| 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 | 34.2 | Very low | 35.3 | Very low | 236 Ų | 236 | 140 Ų | 140 | 100% | 1.163 | 83% | 0.832 | S | S | * | * | 0 | 102.6 | 0 | -77 | 171.6 | 169.9 | 0 | 0 | 106.4 | |||||
| 2 | S | 29.9 | Very low | 35 | Very low | 115 Ų | 115 | 137.8 Ų | 137.8 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | 70.9 | 128.7 | 109.7 | -82.2 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 3 | V | 32.9 | Very low | 34.8 | Very low | 133 Ų | 133 | 142.2 Ų | 142.2 | 81% | 0.806 | 84% | 0.835 | S | S | * | * | cis | -166.1 | 153.5 | 19.6 | 136.8 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 4 | K | 35.2 | Very low | 34.4 | Very low | 192 Ų | 192 | 136.7 Ų | 136.7 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | trans | -83.6 | 178.4 | 174.1 | -116.5 | -166.7 | 176.6 | 174.1 | 0 | 111.3 | ||||
| 5 | P | 44.1 | Very low | 34.9 | Very low | 100 Ų | 100 | 137.6 Ų | 137.6 | 65% | 0.649 | 83% | 0.829 | S | S | * | * | trans | -93 | 162.3 | -140.6 | 40.4 | -34.4 | 0 | 0 | 0 | 114.5 | ||||
| 6 | S | 30.6 | Very low | 34.7 | Very low | 121 Ų | 121 | 136.3 Ų | 136.3 | 85% | 0.846 | 82% | 0.823 | S | S | * | * | trans | -106.3 | 122.2 | 169.3 | 58.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 7 | W | 33.3 | Very low | 35.2 | Very low | 243 Ų | 243 | 134.1 Ų | 134.1 | 92% | 0.92 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 145.3 | 169.1 | -75.6 | 44.4 | 0 | 0 | 0 | 111.1 | ||
| 8 | G | 32.7 | Very low | 35.3 | Very low | 69 Ų | 69 | 132.7 Ų | 132.7 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 171.2 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 9 | P | 35 | Very low | 35.2 | Very low | 131 Ų | 131 | 130.6 Ų | 130.6 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 136 | 159.6 | 31.7 | -20.2 | 0 | 0 | 0 | 111.1 | ||
| 10 | G | 31 | Very low | 35.5 | Very low | 70 Ų | 70 | 130.1 Ų | 130.1 | 72% | 0.722 | 81% | 0.811 | S | S | * | * | trans | -84.5 | -152.5 | 155.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 11 | P | 49.2 | Very low | 35.8 | Very low | 130 Ų | 130 | 128.1 Ų | 128.1 | 84% | 0.844 | 80% | 0.803 | S | S | * | * | -123.7 | 142.5 | -80.1 | 35.6 | -25.1 | 0 | 0 | 0 | 112.2 | |||||
| 12 | S | 32.5 | Very low | 36 | Very low | 113 Ų | 113 | 123.3 Ų | 123.3 | 79% | 0.79 | 78% | 0.781 | S | S | * | * | trans | 179.6 | 122.3 | 162.7 | 41.3 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 13 | E | 32.3 | Very low | 36.8 | Very low | 195 Ų | 195 | 126.7 Ų | 126.7 | 91% | 0.911 | 79% | 0.789 | S | S | * | * | -156.5 | 149 | 60.9 | -73.2 | 174.5 | 139.3 | 0 | 0 | 111.4 | |||||
| 14 | G | 29.2 | Very low | 37.6 | Very low | 66 Ų | 66 | 122.6 Ų | 122.6 | 68% | 0.68 | 77% | 0.774 | S | S | * | * | trans | 80.5 | 79.9 | 140.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | T16 | G14-T16 PolarHBondContact O-N 2.9Š| ||
| 15 | V | 41.1 | Very low | 38.1 | Very low | 150 Ų | 150 | 120 Ų | 120 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | trans | -70.9 | 100.9 | 146 | 174.6 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 16 | T | 31.6 | Very low | 38.4 | Very low | 117 Ų | 117 | 120.7 Ų | 120.7 | 72% | 0.718 | 77% | 0.767 | S | S | * | * | trans | -110.9 | 107.4 | 158.6 | 29.6 | 0 | 0 | 0 | 0 | 107.8 | G14 V18 | G14-T16 PolarHBondContact O-N 2.9Å; T16-V18 PolarHBondContact O-N 2.94Å; T16-V18 VanDerWaalsContact O-N 3.11Å | ||
| 17 | A | 43 | Very low | 39.5 | Very low | 98 Ų | 98 | 123 Ų | 123 | 81% | 0.81 | 76% | 0.763 | S | S | * | * | trans | -58.6 | 110.1 | 161.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 18 | V | 38.1 | Very low | 40.3 | Very low | 109 Ų | 109 | 115.6 Ų | 115.6 | 66% | 0.661 | 74% | 0.742 | S | S | * | * | trans | -83.3 | 137.1 | 176.6 | 177.5 | 0 | 0 | 0 | 0 | 108.7 | T16 | T16-V18 PolarHBondContact O-N 2.94Å; T16-V18 VanDerWaalsContact O-N 3.11Å | ||
| 19 | P | 32.7 | Very low | 41.4 | Very low | 94 Ų | 94 | 122.2 Ų | 122.2 | 61% | 0.61 | 75% | 0.746 | S | S | * | * | trans | -67.8 | 160.5 | -174.9 | -11.4 | 27.8 | 0 | 0 | 0 | 112 | S21 | P19-S21 PolarHBondContact O-N 3.03Š| ||
| 20 | A | 42.3 | Very low | 42.6 | Very low | 119 Ų | 119 | 120 Ų | 120 | 98% | 0.983 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | 45.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 21 | S | 40 | Very low | 43.7 | Very low | 90 Ų | 90 | 122.7 Ų | 122.7 | 63% | 0.629 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.8 | -1.5 | -174.3 | 58.4 | 0 | 0 | 0 | 0 | 116.9 | P19 | P19-S21 PolarHBondContact O-N 3.03Š|
| 22 | D | 38.4 | Very low | 44 | Very low | 134 Ų | 134 | 119.5 Ų | 119.5 | 72% | 0.717 | 70% | 0.699 | S | S | * | * | trans | -117.3 | 70.8 | 174 | -82 | -29.5 | 0 | 0 | 0 | 111.5 | ||||
| 23 | L | 47.7 | Very low | 45.2 | Very low | 186 Ų | 186 | 119.5 Ų | 119.5 | 97% | 0.974 | 69% | 0.69 | S | S | * | * | trans | -95.4 | 57.3 | 156.8 | -167.3 | 79.6 | 0 | 0 | 0 | 108 | ||||
| 24 | G | 49.3 | Very low | 46.5 | Very low | 47 Ų | 47 | 114.7 Ų | 114.7 | 49% | 0.485 | 67% | 0.67 | S | S | . | * | trans | -146.3 | 121.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 25 | D | 46 | Very low | 47.7 | Very low | 139 Ų | 139 | 117.2 Ų | 117.2 | 74% | 0.743 | 67% | 0.667 | S | S | * | * | trans | 81.5 | 62.4 | 168.2 | -53.1 | -30.6 | 0 | 0 | 0 | 118.1 | H27 | D25-H27 VanDerWaalsContact C-N 3.31Å; D25-H27 PolarHBondContact O-N 2.79Å | ||
| 26 | I | 50.2 | Low | 48.3 | Very low | 114 Ų | 114 | 116 Ų | 116 | 59% | 0.585 | 65% | 0.65 | S | S | * | * | trans | -70.8 | 92 | 149.7 | -55.1 | 168.8 | 0 | 0 | 0 | 107.2 | L32 | I26-L32 HydrophobicContact CD1-CD1 4.45Å; I26-L32 HydrophobicContact CG2-CB 4.2Å; I26-L32 HydrophobicContact CG2-CD1 3.99Å; I26-L32 HydrophobicContact CG2-CG 4.47Å | ||
| 27 | H | 54.6 | Low | 49 | Very low | 168 Ų | 168 | 115.8 Ų | 115.8 | 78% | 0.778 | 65% | 0.645 | S | S | * | * | trans | -98.7 | 11.3 | -177.8 | -110.4 | 62.1 | 0 | 0 | 0 | 114.6 | D25 | D25-H27 VanDerWaalsContact C-N 3.31Å; D25-H27 PolarHBondContact O-N 2.79Å | ||
| 28 | N | 50.1 | Low | 49.5 | Very low | 88 Ų | 88 | 118.6 Ų | 118.6 | 47% | 0.471 | 64% | 0.641 | S | S | . | * | trans | -122.5 | 108.9 | 175.9 | -132.8 | -7.4 | 0 | 0 | 0 | 110.6 | T30 E31 L32 | N28-T30 PolarHBondContact ND2-OG1 2.98Å; N28-T30 PolarHBondContact O-N 3Å; N28-T30 VanDerWaalsContact O-N 3.12Å; N28-T30 PolarHBondContact OD1-OG1 3.29Å; N28-T30 VanDerWaalsContact OD1-OG1 3.07Å; N28-E31 HydrophobicContact CB-CB 4.28Å; N28-E31 HydrophobicContact CB-CG 4.27Å; N28-E31 PolarHBondContact O-N 3Å; N28-L32 PolarHBondContact O-N 3.36Å | ||
| 29 | W | 54.5 | Low | 50.1 | Low | 209 Ų | 209 | 118.6 Ų | 118.6 | 79% | 0.792 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -56.4 | -26.4 | 173.5 | -75.1 | 99 | 0 | 0 | 0 | 111.9 | L33 | W29-L33 WeakPolarHBondContact O-CB 3.5Å; W29-L33 WeakPolarHBondContact O-CD1 3.21Å; W29-L33 VanDerWaalsContact O-CG 3.31Å; W29-L33 WeakPolarHBondContact O-CG 3.41Å; W29-L33 PolarHBondContact O-N 3.29Å |
| 30 | T | 60.4 | Low | 51.1 | Low | 85 Ų | 85 | 118.6 Ų | 118.6 | 52% | 0.521 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -70 | -34.2 | 174.2 | 44.1 | 0 | 0 | 0 | 0 | 113.6 | N28 D34 | N28-T30 PolarHBondContact ND2-OG1 2.98Å; N28-T30 PolarHBondContact O-N 3Å; N28-T30 VanDerWaalsContact O-N 3.12Å; N28-T30 PolarHBondContact OD1-OG1 3.29Å; N28-T30 VanDerWaalsContact OD1-OG1 3.07Å; T30-D34 WeakPolarHBondContact O-CB 3.49Å; T30-D34 PolarHBondContact O-N 3.11Å |
| 31 | E | 55.6 | Low | 51.5 | Low | 126 Ų | 126 | 117 Ų | 117 | 59% | 0.589 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -76.5 | -34.6 | 174.7 | -80.6 | -174.8 | 159 | 0 | 0 | 111.9 | N28 D34 L35 | N28-E31 HydrophobicContact CB-CB 4.28Å; N28-E31 HydrophobicContact CB-CG 4.27Å; N28-E31 PolarHBondContact O-N 3Å; E31-D34 PolarHBondContact O-N 2.83Å; E31-L35 VanDerWaalsContact O-CB 3.24Å; E31-L35 WeakPolarHBondContact O-CB 3.29Å; E31-L35 PolarHBondContact O-N 3.43Å |
| 32 | L | 55.3 | Low | 51.9 | Low | 62 Ų | 62 | 120.4 Ų | 120.4 | 33% | 0.325 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -70.3 | -37 | 173.8 | -149.9 | 153.3 | 0 | 0 | 0 | 110.4 | I26 N28 F36 | I26-L32 HydrophobicContact CD1-CD1 4.45Å; I26-L32 HydrophobicContact CG2-CB 4.2Å; I26-L32 HydrophobicContact CG2-CD1 3.99Å; I26-L32 HydrophobicContact CG2-CG 4.47Å; N28-L32 PolarHBondContact O-N 3.36Å; L32-F36 HydrophobicContact CD2-CD2 3.73Å; L32-F36 HydrophobicContact CD2-CE2 3.9Å; L32-F36 WeakPolarHBondContact O-CB 3.09Å; L32-F36 WeakPolarHBondContact O-CD2 3.48Å; L32-F36 PolarHBondContact O-N 2.83Å |
| 33 | L | 57 | Low | 53.1 | Low | 114 Ų | 114 | 115.6 Ų | 115.6 | 60% | 0.597 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.7 | -41.3 | 169.3 | -85.5 | 160 | 0 | 0 | 0 | 111.9 | W29 F36 N37 | W29-L33 WeakPolarHBondContact O-CB 3.5Å; W29-L33 WeakPolarHBondContact O-CD1 3.21Å; W29-L33 VanDerWaalsContact O-CG 3.31Å; W29-L33 WeakPolarHBondContact O-CG 3.41Å; W29-L33 PolarHBondContact O-N 3.29Å; L33-F36 CarbonylContact O-C 3.58Å; L33-F36 PolarHBondContact O-N 3.45Å; L33-N37 WeakPolarHBondContact O-CA 3.39Å; L33-N37 WeakPolarHBondContact O-CB 3.33Å; L33-N37 PolarHBondContact O-N 3.16Å |
| 34 | D | 58.7 | Low | 53.4 | Low | 93 Ų | 93 | 113.6 Ų | 113.6 | 50% | 0.497 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.3 | -35.5 | 176 | -114 | 4.4 | 0 | 0 | 0 | 111.8 | T30 E31 N37 H38 | T30-D34 WeakPolarHBondContact O-CB 3.49Å; T30-D34 PolarHBondContact O-N 3.11Å; E31-D34 PolarHBondContact O-N 2.83Å; D34-N37 PolarHBondContact O-N 2.89Å; D34-H38 VanDerWaalsContact O-CB 3.25Å; D34-H38 WeakPolarHBondContact O-CB 3.33Å; D34-H38 PolarHBondContact O-N 3.43Å |
| 35 | L | 55.6 | Low | 54 | Low | 119 Ų | 119 | 113.5 Ų | 113.5 | 62% | 0.623 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.9 | -42.6 | 173.6 | -159.8 | 84.3 | 0 | 0 | 0 | 110.5 | E31 T39 | E31-L35 VanDerWaalsContact O-CB 3.24Å; E31-L35 WeakPolarHBondContact O-CB 3.29Å; E31-L35 PolarHBondContact O-N 3.43Å; L35-T39 WeakPolarHBondContact O-CB 3.19Å; L35-T39 PolarHBondContact O-N 3.39Å; L35-T39 PolarHBondContact O-OG1 2.67Å |
| 36 | F | 53.6 | Low | 55 | Low | 124 Ų | 124 | 115.6 Ų | 115.6 | 54% | 0.544 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67.6 | -38.7 | 172.5 | -101 | -90 | 0 | 0 | 0 | 112.1 | L32 L33 T39 L40 | L32-F36 HydrophobicContact CD2-CD2 3.73Å; L32-F36 HydrophobicContact CD2-CE2 3.9Å; L32-F36 WeakPolarHBondContact O-CB 3.09Å; L32-F36 WeakPolarHBondContact O-CD2 3.48Å; L32-F36 PolarHBondContact O-N 2.83Å; L33-F36 CarbonylContact O-C 3.58Å; L33-F36 PolarHBondContact O-N 3.45Å; F36-T39 WeakPolarHBondContact CA-OG1 3.39Å; F36-T39 PolarHBondContact O-N 3.01Å; F36-T39 PolarHBondContact O-OG1 2.88Å; F36-L40 HydrophobicContact CD1-CD1 4.12Å; F36-L40 HydrophobicContact CE1-CD1 4.49Å; F36-L40 VanDerWaalsContact O-CB 3.29Å; F36-L40 WeakPolarHBondContact O-CB 3.43Å; F36-L40 PolarHBondContact O-N 3.25Å |
| 37 | N | 46.3 | Very low | 56.3 | Low | 113 Ų | 113 | 112.7 Ų | 112.7 | 60% | 0.604 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -73 | -31.7 | -179.2 | -156.7 | 29.7 | 0 | 0 | 0 | 111.3 | L33 D34 S41 | L33-N37 WeakPolarHBondContact O-CA 3.39Å; L33-N37 WeakPolarHBondContact O-CB 3.33Å; L33-N37 PolarHBondContact O-N 3.16Å; D34-N37 PolarHBondContact O-N 2.89Å; N37-S41 WeakPolarHBondContact O-CB 3.47Å; N37-S41 PolarHBondContact O-N 3.4Å |
| 38 | H | 53.1 | Low | 57.8 | Low | 158 Ų | 158 | 107.2 Ų | 107.2 | 73% | 0.731 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -80.7 | -20.5 | 170.6 | -92.5 | -61.7 | 0 | 0 | 0 | 114.2 | D34 | D34-H38 VanDerWaalsContact O-CB 3.25Å; D34-H38 WeakPolarHBondContact O-CB 3.33Å; D34-H38 PolarHBondContact O-N 3.43Å |
| 39 | T | 50.1 | Low | 59.6 | Low | 108 Ų | 108 | 106.7 Ų | 106.7 | 66% | 0.663 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -92.1 | -17.7 | 170.7 | 37.3 | 0 | 0 | 0 | 0 | 114.3 | L35 F36 | L35-T39 WeakPolarHBondContact O-CB 3.19Å; L35-T39 PolarHBondContact O-N 3.39Å; L35-T39 PolarHBondContact O-OG1 2.67Å; F36-T39 WeakPolarHBondContact CA-OG1 3.39Å; F36-T39 PolarHBondContact O-N 3.01Å; F36-T39 PolarHBondContact O-OG1 2.88Å |
| 40 | L | 53.7 | Low | 61.2 | Low | 95 Ų | 95 | 99.9 Ų | 99.9 | 50% | 0.497 | 53% | 0.525 | S | S | . | . | S | Bend | trans | -111 | 24.3 | 178.6 | -107.8 | 99.5 | 0 | 0 | 0 | 114.3 | F36 | F36-L40 HydrophobicContact CD1-CD1 4.12Å; F36-L40 HydrophobicContact CE1-CD1 4.49Å; F36-L40 VanDerWaalsContact O-CB 3.29Å; F36-L40 WeakPolarHBondContact O-CB 3.43Å; F36-L40 PolarHBondContact O-N 3.25Å |
| 41 | S | 50.5 | Low | 62.7 | Low | 84 Ų | 84 | 99.8 Ų | 99.8 | 59% | 0.587 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -92.8 | 110.9 | 171.4 | 167.9 | 0 | 0 | 0 | 0 | 110 | N37 | N37-S41 WeakPolarHBondContact O-CB 3.47Å; N37-S41 PolarHBondContact O-N 3.4Å |
| 42 | E | 49.8 | Very low | 64.4 | Low | 162 Ų | 162 | 94.8 Ų | 94.8 | 76% | 0.757 | 50% | 0.501 | S | S | * | . | trans | 77.3 | 92.6 | -179.4 | -70.8 | 176.3 | 163 | 0 | 0 | 116.3 | H44 | E42-H44 PolarHBondContact O-N 2.96Š| ||
| 43 | C | 62.1 | Low | 66.1 | Low | 34 Ų | 34 | 95.3 Ų | 95.3 | 23% | 0.23 | 50% | 0.499 | C | S | . | . | trans | -70.3 | 63.4 | 161.7 | -51.9 | 0 | 0 | 0 | 0 | 111 | V45 C292 | C43-V45 PolarHBondContact O-N 2.77Å; C43-C292 HydrophobicContact CB-CB 4.17Å; C43-C292 WeakPolarHBondContact CB-SG 3.46Å; C43-C292 WeakPolarHBondContact SG-CB 3.47Å; C43-C292 CovalentContact SG-SG 2.04Å; C43-C292 PolarHBondContact SG-SG 2.92Å | ||
| 44 | H | 55.5 | Low | 67.9 | Low | 144 Ų | 144 | 94.8 Ų | 94.8 | 67% | 0.667 | 50% | 0.5 | S | S | * | . | trans | -85.2 | 101.8 | 174.7 | -127.5 | -72.9 | 0 | 0 | 0 | 108.9 | E42 | E42-H44 PolarHBondContact O-N 2.96Š| ||
| 45 | V | 62.2 | Low | 69.6 | Low | 45 Ų | 45 | 93.5 Ų | 93.5 | 27% | 0.273 | 50% | 0.495 | S | S | . | . | trans | -97.5 | 102.1 | 167.6 | -168.5 | 0 | 0 | 0 | 0 | 107 | C43 L47 H293 H296 | C43-V45 PolarHBondContact O-N 2.77Å; V45-L47 HydrophobicContact CB-CD1 4.1Å; V45-L47 HydrophobicContact CG1-CD1 3.48Å; V45-L47 VanDerWaalsContact CG1-CD1 3.48Å; V45-L47 HydrophobicContact CG1-CG 3.79Å; V45-L47 PolarHBondContact O-N 3.44Å; V45-H293 WeakPolarHBondContact CG2-ND1 3.31Å; V45-H296 PolarHBondContact O-CE1 2.95Å | ||
| 46 | E | 65.5 | Low | 71.5 | Confident | 183 Ų | 183 | 87.9 Ų | 87.9 | 86% | 0.855 | 47% | 0.466 | S | S | * | . | trans | -70.1 | 92.8 | 174.8 | -69.7 | -168.2 | 163.9 | 0 | 0 | 110 | ||||
| 47 | L | 77.1 | Confident | 73.6 | Confident | 52 Ų | 52 | 85.9 Ų | 85.9 | 27% | 0.272 | 46% | 0.457 | S | S | . | . | trans | -108.6 | 133.2 | 172.5 | -73.5 | 147.8 | 0 | 0 | 0 | 109.2 | V45 E49 F300 F301 | V45-L47 HydrophobicContact CB-CD1 4.1Å; V45-L47 HydrophobicContact CG1-CD1 3.48Å; V45-L47 VanDerWaalsContact CG1-CD1 3.48Å; V45-L47 HydrophobicContact CG1-CG 3.79Å; V45-L47 PolarHBondContact O-N 3.44Å; L47-E49 PolarHBondContact O-N 3.17Å; L47-E49 VanDerWaalsContact O-N 3.12Å; L47-F300 HydrophobicContact CB-CD1 4.13Å; L47-F300 HydrophobicContact CB-CD2 3.61Å; L47-F300 HydrophobicContact CB-CE1 3.87Å; L47-F300 HydrophobicContact CB-CE2 3.31Å; L47-F300 HydrophobicContact CB-CG 4.02Å; L47-F300 HydrophobicContact CB-CZ 3.45Å; L47-F300 VanDerWaalsContact CB-CZ 3.45Å; L47-F300 HydrophobicContact CD1-CB 3.99Å; L47-F300 HydrophobicContact CD1-CD1 3.83Å; L47-F300 HydrophobicContact CD1-CD2 4.02Å; L47-F300 HydrophobicContact CD1-CE1 4.34Å; L47-F300 HydrophobicContact CD1-CG 3.66Å; L47-F300 HydrophobicContact CD2-CD1 4.01Å; L47-F300 HydrophobicContact CD2-CE1 3.79Å; L47-F300 HydrophobicContact CD2-CZ 4.19Å; L47-F300 HydrophobicContact CG-CD1 4.21Å; L47-F300 HydrophobicContact CG-CD2 4.36Å; L47-F300 HydrophobicContact CG-CE1 4.21Å; L47-F300 HydrophobicContact CG-CE2 4.36Å; L47-F300 HydrophobicContact CG-CG 4.29Å; L47-F300 HydrophobicContact CG-CZ 4.29Å; L47-F301 HydrophobicContact CD2-CE2 4.26Å; L47-F301 HydrophobicContact CD2-CZ 4.26Å | ||
| 48 | S | 88.1 | Confident | 75.9 | Confident | 54 Ų | 54 | 83.1 Ų | 83.1 | 38% | 0.378 | 45% | 0.45 | S | S | . | . | trans | -75.8 | 103.1 | -176.6 | 172.6 | 0 | 0 | 0 | 0 | 111 | S50 T51 K52 | S48-S50 VanDerWaalsContact C-N 3.26Å; S48-S50 PolarHBondContact O-N 3.14Å; S48-S50 PolarHBondContact OG-OG 2.77Å; S48-T51 WeakPolarHBondContact CB-OG1 3.34Å; S48-T51 WeakPolarHBondContact O-CB 3.38Å; S48-T51 PolarHBondContact O-N 2.88Å; S48-T51 VanDerWaalsContact O-N 3.12Å; S48-T51 WeakPolarHBondContact OG-CB 3.27Å; S48-T51 PolarHBondContact OG-N 3.45Å; S48-T51 VanDerWaalsContact OG-N 3.16Å; S48-T51 PolarHBondContact OG-OG1 3.23Å; S48-K52 PolarHBondContact O-N 2.86Å | ||
| 49 | E | 87 | Confident | 78 | Confident | 77 Ų | 77 | 78.8 Ų | 78.8 | 36% | 0.36 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -56.6 | -39 | 172.8 | -75.4 | -61.9 | 142.1 | 0 | 0 | 112.3 | L47 T51 K52 R53 F300 | L47-E49 PolarHBondContact O-N 3.17Å; L47-E49 VanDerWaalsContact O-N 3.12Å; E49-T51 VanDerWaalsContact C-N 3.34Å; E49-T51 PolarHBondContact O-N 3.49Å; E49-K52 VanDerWaalsContact CD-NZ 3.32Å; E49-K52 WeakPolarHBondContact O-CB 3.3Å; E49-K52 PolarHBondContact O-N 2.83Å; E49-K52 IonicContact OE1-NZ 3.51Å; E49-K52 PolarHBondContact OE1-NZ 3.12Å; E49-K52 VanDerWaalsContact OE1-NZ 3.12Å; E49-K52 WeakPolarHBondContact OE2-CE 3.3Å; E49-K52 IonicContact OE2-NZ 3.12Å; E49-K52 PolarHBondContact OE2-NZ 3.15Å; E49-R53 WeakPolarHBondContact O-CG 3.23Å; E49-R53 PolarHBondContact O-N 3.22Å; E49-F300 VanDerWaalsContact OE1-CD2 3.25Å; E49-F300 WeakPolarHBondContact OE1-CD2 3.4Å; E49-F300 WeakPolarHBondContact OE1-CE2 3.4Å |
| 50 | S | 88.9 | Confident | 80.3 | Confident | 66 Ų | 66 | 74 Ų | 74 | 46% | 0.462 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.6 | -41 | 175.2 | 53.6 | 0 | 0 | 0 | 0 | 112.5 | S48 V54 | S48-S50 VanDerWaalsContact C-N 3.26Å; S48-S50 PolarHBondContact O-N 3.14Å; S48-S50 PolarHBondContact OG-OG 2.77Å; S50-V54 WeakPolarHBondContact O-CG2 3.34Å; S50-V54 PolarHBondContact O-N 3.32Å; S50-V54 VanDerWaalsContact O-N 3.16Å |
| 51 | T | 90.5 | Very high | 82.4 | Confident | 83 Ų | 83 | 73 Ų | 73 | 51% | 0.509 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -66.2 | -43.8 | 175.5 | -56.8 | 0 | 0 | 0 | 0 | 110.9 | S48 E49 R53 V54 V55 | S48-T51 WeakPolarHBondContact CB-OG1 3.34Å; S48-T51 WeakPolarHBondContact O-CB 3.38Å; S48-T51 PolarHBondContact O-N 2.88Å; S48-T51 VanDerWaalsContact O-N 3.12Å; S48-T51 WeakPolarHBondContact OG-CB 3.27Å; S48-T51 PolarHBondContact OG-N 3.45Å; S48-T51 VanDerWaalsContact OG-N 3.16Å; S48-T51 PolarHBondContact OG-OG1 3.23Å; E49-T51 VanDerWaalsContact C-N 3.34Å; E49-T51 PolarHBondContact O-N 3.49Å; T51-R53 VanDerWaalsContact C-N 3.35Å; T51-R53 PolarHBondContact O-N 3.44Å; T51-V54 PolarHBondContact O-N 2.88Å; T51-V55 HydrophobicContact CG2-CG2 4.33Å; T51-V55 VanDerWaalsContact O-CG2 3.32Å; T51-V55 WeakPolarHBondContact O-CG2 3.31Å; T51-V55 PolarHBondContact O-N 3.26Å |
| 52 | K | 91 | Very high | 84.6 | Confident | 21 Ų | 21 | 71.7 Ų | 71.7 | 9% | 0.091 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -54.5 | -50.1 | 175.9 | -172.3 | -176.9 | 73.4 | -171.8 | 0 | 111.2 | S48 E49 V54 V55 L56 Y117 F300 | S48-K52 PolarHBondContact O-N 2.86Å; E49-K52 VanDerWaalsContact CD-NZ 3.32Å; E49-K52 WeakPolarHBondContact O-CB 3.3Å; E49-K52 PolarHBondContact O-N 2.83Å; E49-K52 IonicContact OE1-NZ 3.51Å; E49-K52 PolarHBondContact OE1-NZ 3.12Å; E49-K52 VanDerWaalsContact OE1-NZ 3.12Å; E49-K52 WeakPolarHBondContact OE2-CE 3.3Å; E49-K52 IonicContact OE2-NZ 3.12Å; E49-K52 PolarHBondContact OE2-NZ 3.15Å; K52-V54 PolarHBondContact O-N 2.94Å; K52-V55 PolarHBondContact O-N 3.12Å; K52-L56 HydrophobicContact CD-CD1 4.44Å; K52-L56 HydrophobicContact CG-CD1 3.91Å; K52-L56 HydrophobicContact CG-CG 4.39Å; K52-L56 WeakPolarHBondContact O-CB 3.34Å; K52-L56 WeakPolarHBondContact O-CG 3.15Å; K52-L56 PolarHBondContact O-N 3.36Å; K52-Y117 VanDerWaalsContact CE-OH 3.32Å; K52-Y117 WeakPolarHBondContact CE-OH 3.13Å; K52-F300 HydrophobicContact CB-CE1 4.35Å; K52-F300 HydrophobicContact CB-CE2 4.23Å; K52-F300 HydrophobicContact CB-CZ 3.71Å; K52-F300 HydrophobicContact CD-CD1 4.47Å; K52-F300 HydrophobicContact CD-CD2 4.2Å; K52-F300 HydrophobicContact CD-CE1 4.2Å; K52-F300 HydrophobicContact CD-CE2 3.91Å; K52-F300 HydrophobicContact CD-CG 4.48Å; K52-F300 HydrophobicContact CD-CZ 3.9Å; K52-F300 VanDerWaalsContact CD-O 3.22Å; K52-F300 WeakPolarHBondContact CD-O 3.45Å; K52-F300 HydrophobicContact CG-CE1 4.38Å; K52-F300 HydrophobicContact CG-CZ 4.11Å |
| 53 | R | 92.8 | Very high | 86.8 | Confident | 73 Ų | 73 | 64.4 Ų | 64.4 | 28% | 0.275 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.8 | -44.3 | 179.3 | -68.8 | -172.9 | -61.1 | -133.3 | 7.6 | 112.6 | E49 T51 L56 F57 V113 D116 | E49-R53 WeakPolarHBondContact O-CG 3.23Å; E49-R53 PolarHBondContact O-N 3.22Å; T51-R53 VanDerWaalsContact C-N 3.35Å; T51-R53 PolarHBondContact O-N 3.44Å; R53-L56 PolarHBondContact O-N 3.04Å; R53-F57 WeakPolarHBondContact O-CB 3.29Å; R53-F57 PolarHBondContact O-N 3.39Å; R53-V113 HydrophobicContact CB-CG1 3.87Å; R53-V113 VanDerWaalsContact CD-O 3.28Å; R53-V113 WeakPolarHBondContact CD-O 3.42Å; R53-V113 HydrophobicContact CG-CG1 3.89Å; R53-D116 IonicContact CZ-OD1 3.67Å; R53-D116 IonicContact NH1-OD1 3.87Å; R53-D116 PolarHBondContact NH1-OD1 3.45Å; R53-D116 IonicContact NH1-OD2 2.7Å; R53-D116 PolarHBondContact NH1-OD2 3.02Å; R53-D116 VanDerWaalsContact NH1-OD2 3.07Å |
| 54 | V | 93.8 | Very high | 88.5 | Confident | 103 Ų | 103 | 65.1 Ų | 65.1 | 62% | 0.624 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -63.3 | -42.8 | 177.5 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | S50 T51 K52 A58 | S50-V54 WeakPolarHBondContact O-CG2 3.34Å; S50-V54 PolarHBondContact O-N 3.32Å; S50-V54 VanDerWaalsContact O-N 3.16Å; T51-V54 PolarHBondContact O-N 2.88Å; K52-V54 PolarHBondContact O-N 2.94Å; V54-A58 WeakPolarHBondContact O-CB 3.3Å; V54-A58 PolarHBondContact O-N 3.37Å |
| 55 | V | 94.8 | Very high | 90.5 | Very high | 66 Ų | 66 | 61.9 Ų | 61.9 | 40% | 0.4 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63.7 | -49.4 | 177.7 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | T51 K52 F57 A58 L59 | T51-V55 HydrophobicContact CG2-CG2 4.33Å; T51-V55 VanDerWaalsContact O-CG2 3.32Å; T51-V55 WeakPolarHBondContact O-CG2 3.31Å; T51-V55 PolarHBondContact O-N 3.26Å; K52-V55 PolarHBondContact O-N 3.12Å; V55-F57 PolarHBondContact O-N 2.97Å; V55-A58 PolarHBondContact O-N 3.05Å; V55-L59 HydrophobicContact CG1-CD1 3.91Å; V55-L59 HydrophobicContact CG1-CG 4.35Å; V55-L59 VanDerWaalsContact O-CG 3.32Å; V55-L59 WeakPolarHBondContact O-CG 3.19Å; V55-L59 PolarHBondContact O-N 3.13Å |
| 56 | L | 95.7 | Very high | 92.1 | Very high | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -59.7 | -46.3 | 178.4 | -73.9 | 172.8 | 0 | 0 | 0 | 111.8 | K52 R53 A58 L59 Y60 V113 D303 V304 | K52-L56 HydrophobicContact CD-CD1 4.44Å; K52-L56 HydrophobicContact CG-CD1 3.91Å; K52-L56 HydrophobicContact CG-CG 4.39Å; K52-L56 WeakPolarHBondContact O-CB 3.34Å; K52-L56 WeakPolarHBondContact O-CG 3.15Å; K52-L56 PolarHBondContact O-N 3.36Å; R53-L56 PolarHBondContact O-N 3.04Å; L56-A58 VanDerWaalsContact C-N 3.33Å; L56-A58 PolarHBondContact O-N 2.83Å; L56-L59 PolarHBondContact O-N 3.21Å; L56-Y60 HydrophobicContact CB-CE2 4.35Å; L56-Y60 WeakPolarHBondContact O-CB 3.2Å; L56-Y60 WeakPolarHBondContact O-CD2 3.28Å; L56-Y60 PolarHBondContact O-N 2.86Å; L56-V113 HydrophobicContact CB-CG1 3.97Å; L56-V113 HydrophobicContact CB-CG2 4.42Å; L56-V113 HydrophobicContact CD1-CG1 4.15Å; L56-V113 HydrophobicContact CD1-CG2 4.11Å; L56-D303 HydrophobicContact CD1-CB 3.69Å; L56-D303 HydrophobicContact CD2-CB 3.68Å; L56-D303 HydrophobicContact CG-CB 4.35Å; L56-V304 HydrophobicContact CD2-CB 4.5Å; L56-V304 HydrophobicContact CD2-CG2 3.78Å; L56-V304 HydrophobicContact CG-CG2 4.32Å |
| 57 | F | 96.2 | Very high | 93.6 | Very high | 83 Ų | 83 | 54 Ų | 54 | 36% | 0.364 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -58 | -46.2 | 176.1 | -176.8 | -88.3 | 0 | 0 | 0 | 111.7 | R53 V55 L59 Y60 L61 M110 T114 | R53-F57 WeakPolarHBondContact O-CB 3.29Å; R53-F57 PolarHBondContact O-N 3.39Å; V55-F57 PolarHBondContact O-N 2.97Å; F57-L59 PolarHBondContact O-N 3.24Å; F57-Y60 PolarHBondContact O-N 2.82Å; F57-L61 HydrophobicContact CE1-CD2 4.18Å; F57-L61 VanDerWaalsContact O-CB 3.28Å; F57-L61 WeakPolarHBondContact O-CB 3.46Å; F57-L61 PolarHBondContact O-N 3.01Å; F57-M110 HydrophobicContact CD2-CB 4.02Å; F57-M110 HydrophobicContact CD2-CG 4.14Å; F57-M110 HydrophobicContact CD2-SD 4.32Å; F57-M110 HydrophobicContact CE2-CB 4.08Å; F57-M110 HydrophobicContact CE2-CG 4.34Å; F57-M110 HydrophobicContact CE2-SD 4.11Å; F57-M110 HydrophobicContact CZ-SD 4.42Å; F57-T114 HydrophobicContact CD2-CG2 3.53Å; F57-T114 HydrophobicContact CE2-CG2 3.92Å; F57-T114 HydrophobicContact CG-CG2 4.45Å |
| 58 | A | 96.6 | Very high | 94.5 | Very high | 55 Ų | 55 | 53.7 Ų | 53.7 | 46% | 0.455 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63.3 | -40.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V54 V55 L56 A62 | V54-A58 WeakPolarHBondContact O-CB 3.3Å; V54-A58 PolarHBondContact O-N 3.37Å; V55-A58 PolarHBondContact O-N 3.05Å; L56-A58 VanDerWaalsContact C-N 3.33Å; L56-A58 PolarHBondContact O-N 2.83Å; A58-A62 WeakPolarHBondContact O-CB 3.32Å; A58-A62 PolarHBondContact O-N 3.45Å |
| 59 | L | 96.7 | Very high | 94.8 | Very high | 66 Ų | 66 | 55.7 Ų | 55.7 | 35% | 0.346 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64 | -49.8 | 176.6 | -72.1 | 173.7 | 0 | 0 | 0 | 111.6 | V55 L56 F57 L61 A62 M63 C307 | V55-L59 HydrophobicContact CG1-CD1 3.91Å; V55-L59 HydrophobicContact CG1-CG 4.35Å; V55-L59 VanDerWaalsContact O-CG 3.32Å; V55-L59 WeakPolarHBondContact O-CG 3.19Å; V55-L59 PolarHBondContact O-N 3.13Å; L56-L59 PolarHBondContact O-N 3.21Å; F57-L59 PolarHBondContact O-N 3.24Å; L59-L61 VanDerWaalsContact C-N 3.35Å; L59-L61 PolarHBondContact O-N 3.44Å; L59-A62 PolarHBondContact O-N 3.48Å; L59-M63 WeakPolarHBondContact O-CG 3.32Å; L59-M63 PolarHBondContact O-N 3.25Å; L59-C307 HydrophobicContact CD1-CB 4.38Å |
| 60 | Y | 97.3 | Very high | 95.1 | Very high | 8 Ų | 8 | 53.3 Ų | 53.3 | 3% | 0.031 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.4 | -41.9 | 177.2 | -66.2 | -28.8 | 0 | 0 | 0 | 112.1 | L56 F57 M63 F64 L106 W109 M110 V113 C307 M310 | L56-Y60 HydrophobicContact CB-CE2 4.35Å; L56-Y60 WeakPolarHBondContact O-CB 3.2Å; L56-Y60 WeakPolarHBondContact O-CD2 3.28Å; L56-Y60 PolarHBondContact O-N 2.86Å; F57-Y60 PolarHBondContact O-N 2.82Å; Y60-M63 HydrophobicContact CD1-CE 3.65Å; Y60-M63 HydrophobicContact CE1-CE 4.25Å; Y60-M63 PolarHBondContact O-N 3.42Å; Y60-F64 VanDerWaalsContact O-CB 3.22Å; Y60-F64 WeakPolarHBondContact O-CB 3.32Å; Y60-F64 PolarHBondContact O-N 2.98Å; Y60-L106 HydrophobicContact CD1-CD2 3.85Å; Y60-L106 HydrophobicContact CE1-CD2 4.45Å; Y60-L106 HydrophobicContact CG-CD2 4.4Å; Y60-W109 HydrophobicContact CD2-CB 4.2Å; Y60-W109 HydrophobicContact CE2-CB 3.86Å; Y60-M110 HydrophobicContact CD2-CG 3.86Å; Y60-M110 HydrophobicContact CG-CG 4.07Å; Y60-V113 HydrophobicContact CE2-CG2 3.86Å; Y60-C307 WeakPolarHBondContact CE1-SG 3.43Å; Y60-M310 HydrophobicContact CD1-SD 4.44Å; Y60-M310 HydrophobicContact CE1-SD 3.99Å |
| 61 | L | 97.6 | Very high | 95.3 | Very high | 74 Ų | 74 | 50.2 Ų | 50.2 | 39% | 0.387 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.8 | -44.5 | 176.7 | 179.6 | 62.3 | 0 | 0 | 0 | 111.6 | F57 L59 F64 V65 M110 | F57-L61 HydrophobicContact CE1-CD2 4.18Å; F57-L61 VanDerWaalsContact O-CB 3.28Å; F57-L61 WeakPolarHBondContact O-CB 3.46Å; F57-L61 PolarHBondContact O-N 3.01Å; L59-L61 VanDerWaalsContact C-N 3.35Å; L59-L61 PolarHBondContact O-N 3.44Å; L61-F64 PolarHBondContact O-N 3.42Å; L61-V65 HydrophobicContact CD1-CG2 4.2Å; L61-V65 WeakPolarHBondContact O-CG2 3.4Å; L61-V65 PolarHBondContact O-N 3.29Å; L61-M110 HydrophobicContact CB-SD 3.9Å; L61-M110 HydrophobicContact CD1-SD 4.48Å |
| 62 | A | 97.1 | Very high | 95.5 | Very high | 56 Ų | 56 | 49.7 Ų | 49.7 | 46% | 0.463 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.4 | -48.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | A58 L59 F64 V65 V66 | A58-A62 WeakPolarHBondContact O-CB 3.32Å; A58-A62 PolarHBondContact O-N 3.45Å; L59-A62 PolarHBondContact O-N 3.48Å; A62-F64 VanDerWaalsContact C-N 3.3Å; A62-F64 PolarHBondContact O-N 2.84Å; A62-V65 PolarHBondContact O-N 2.98Å; A62-V66 WeakPolarHBondContact O-CG2 3.39Å; A62-V66 PolarHBondContact O-N 3.27Å |
| 63 | M | 96.8 | Very high | 95.4 | Very high | 10 Ų | 10 | 51.2 Ų | 51.2 | 5% | 0.049 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.9 | -38.9 | 176.5 | -71.1 | -171 | -67.8 | 0 | 0 | 111.9 | L59 Y60 G67 L106 C307 M310 L311 V314 | L59-M63 WeakPolarHBondContact O-CG 3.32Å; L59-M63 PolarHBondContact O-N 3.25Å; Y60-M63 HydrophobicContact CD1-CE 3.65Å; Y60-M63 HydrophobicContact CE1-CE 4.25Å; Y60-M63 PolarHBondContact O-N 3.42Å; M63-G67 WeakPolarHBondContact O-CA 3.38Å; M63-G67 PolarHBondContact O-N 2.99Å; M63-L106 HydrophobicContact CB-CD1 3.69Å; M63-L106 HydrophobicContact CE-CD2 4.42Å; M63-C307 HydrophobicContact CE-CB 4.09Å; M63-M310 HydrophobicContact CE-CB 4.18Å; M63-M310 HydrophobicContact CE-SD 4.37Å; M63-M310 HydrophobicContact SD-CB 3.92Å; M63-L311 HydrophobicContact CG-CD2 4.12Å; M63-L311 HydrophobicContact SD-CD2 3.85Å; M63-L311 HydrophobicContact SD-CG 4.21Å; M63-V314 HydrophobicContact CB-CG2 4.2Å; M63-V314 HydrophobicContact CG-CG2 4.27Å |
| 64 | F | 98.1 | Very high | 95.2 | Very high | 49 Ų | 49 | 47.9 Ų | 47.9 | 22% | 0.215 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.4 | -53.4 | 177 | 174.6 | -107.1 | 0 | 0 | 0 | 111.6 | Y60 L61 A62 L68 V103 L106 P107 M110 | Y60-F64 VanDerWaalsContact O-CB 3.22Å; Y60-F64 WeakPolarHBondContact O-CB 3.32Å; Y60-F64 PolarHBondContact O-N 2.98Å; L61-F64 PolarHBondContact O-N 3.42Å; A62-F64 VanDerWaalsContact C-N 3.3Å; A62-F64 PolarHBondContact O-N 2.84Å; F64-L68 HydrophobicContact CE1-CD2 4.35Å; F64-L68 HydrophobicContact CE2-CD2 4.42Å; F64-L68 HydrophobicContact CZ-CD2 3.96Å; F64-L68 WeakPolarHBondContact O-CB 3.43Å; F64-L68 PolarHBondContact O-N 3.34Å; F64-V103 HydrophobicContact CD2-CG1 3.89Å; F64-V103 WeakPolarHBondContact CD2-O 3.24Å; F64-V103 HydrophobicContact CE2-CG1 4.42Å; F64-L106 HydrophobicContact CB-CB 4.24Å; F64-L106 HydrophobicContact CB-CD1 4.05Å; F64-P107 HydrophobicContact CD2-CG 3.91Å; F64-P107 HydrophobicContact CE2-CG 3.74Å; F64-P107 HydrophobicContact CZ-CG 4.23Å; F64-M110 HydrophobicContact CB-CE 4.48Å |
| 65 | V | 97.4 | Very high | 95 | Very high | 76 Ų | 76 | 44.6 Ų | 44.6 | 46% | 0.461 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.4 | -50 | -176.9 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | L61 A62 V69 | L61-V65 HydrophobicContact CD1-CG2 4.2Å; L61-V65 WeakPolarHBondContact O-CG2 3.4Å; L61-V65 PolarHBondContact O-N 3.29Å; A62-V65 PolarHBondContact O-N 2.98Å; V65-V69 WeakPolarHBondContact O-CG2 3.48Å; V65-V69 PolarHBondContact O-N 3.05Å |
| 66 | V | 95.8 | Very high | 94.7 | Very high | 61 Ų | 61 | 44.1 Ų | 44.1 | 37% | 0.37 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -68.5 | -49.2 | -177.3 | -176.4 | 0 | 0 | 0 | 0 | 110.3 | A62 L68 V69 E70 V314 | A62-V66 WeakPolarHBondContact O-CG2 3.39Å; A62-V66 PolarHBondContact O-N 3.27Å; V66-L68 VanDerWaalsContact C-N 3.31Å; V66-L68 PolarHBondContact O-N 3.06Å; V66-V69 PolarHBondContact O-N 3.48Å; V66-E70 HydrophobicContact CG1-CG 4.24Å; V66-E70 WeakPolarHBondContact O-CG 3.35Å; V66-E70 PolarHBondContact O-N 3.39Å; V66-V314 HydrophobicContact CB-CG1 3.93Å; V66-V314 HydrophobicContact CG1-CG1 3.42Å; V66-V314 VanDerWaalsContact CG1-CG1 3.42Å |
| 67 | G | 96 | Very high | 93.9 | Very high | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.2 | -38.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | M63 N71 | M63-G67 WeakPolarHBondContact O-CA 3.38Å; M63-G67 PolarHBondContact O-N 2.99Å; G67-N71 VanDerWaalsContact O-CB 3.24Å; G67-N71 WeakPolarHBondContact O-CB 3.06Å; G67-N71 PolarHBondContact O-N 3.22Å; G67-N71 PolarHBondContact O-ND2 3.46Å |
| 68 | L | 96.5 | Very high | 93.1 | Very high | 47 Ų | 47 | 41.1 Ų | 41.1 | 25% | 0.246 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64.2 | -50.1 | 178.1 | -177.5 | 66.6 | 0 | 0 | 0 | 110.8 | F64 V66 L72 L100 V103 L104 | F64-L68 HydrophobicContact CE1-CD2 4.35Å; F64-L68 HydrophobicContact CE2-CD2 4.42Å; F64-L68 HydrophobicContact CZ-CD2 3.96Å; F64-L68 WeakPolarHBondContact O-CB 3.43Å; F64-L68 PolarHBondContact O-N 3.34Å; V66-L68 VanDerWaalsContact C-N 3.31Å; V66-L68 PolarHBondContact O-N 3.06Å; L68-L72 HydrophobicContact CD1-CD1 3.73Å; L68-L72 HydrophobicContact CD1-CG 4.21Å; L68-L72 HydrophobicContact CG-CD1 3.91Å; L68-L72 VanDerWaalsContact O-CB 3.23Å; L68-L72 WeakPolarHBondContact O-CB 3.24Å; L68-L72 WeakPolarHBondContact O-CD1 3.12Å; L68-L72 WeakPolarHBondContact O-CG 3.25Å; L68-L72 PolarHBondContact O-N 3.36Å; L68-L72 VanDerWaalsContact O-N 3.12Å; L68-L100 HydrophobicContact CD1-CD1 3.7Å; L68-V103 HydrophobicContact CB-CG1 4.07Å; L68-L104 HydrophobicContact CD1-CD2 4.4Å |
| 69 | V | 94.9 | Very high | 92.3 | Very high | 96 Ų | 96 | 47.4 Ų | 47.4 | 58% | 0.582 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -62.7 | -48.7 | -178.5 | 172.8 | 0 | 0 | 0 | 0 | 110.9 | V65 V66 L73 | V65-V69 WeakPolarHBondContact O-CG2 3.48Å; V65-V69 PolarHBondContact O-N 3.05Å; V66-V69 PolarHBondContact O-N 3.48Å; V69-L73 VanDerWaalsContact O-CB 3.3Å; V69-L73 WeakPolarHBondContact O-CB 3.28Å; V69-L73 PolarHBondContact O-N 3.37Å |
| 70 | E | 92.4 | Very high | 91 | Very high | 27 Ų | 27 | 51.1 Ų | 51.1 | 13% | 0.126 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -70.4 | -46.1 | -174.8 | -67.4 | -173.1 | 139.5 | 0 | 0 | 112.3 | V66 L73 V74 P317 I318 | V66-E70 HydrophobicContact CG1-CG 4.24Å; V66-E70 WeakPolarHBondContact O-CG 3.35Å; V66-E70 PolarHBondContact O-N 3.39Å; E70-L73 WeakPolarHBondContact O-CB 3.44Å; E70-L73 PolarHBondContact O-N 2.91Å; E70-V74 WeakPolarHBondContact O-CG2 3.2Å; E70-V74 PolarHBondContact O-N 3.17Å; E70-P317 HydrophobicContact CB-CB 3.98Å; E70-P317 HydrophobicContact CB-CG 4.39Å; E70-I318 VanDerWaalsContact OE1-CG1 3.24Å; E70-I318 WeakPolarHBondContact OE1-CG1 3.19Å |
| 71 | N | 94.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.3 | -39 | -179.6 | -73.8 | -68.2 | 0 | 0 | 0 | 112 | G67 L73 V74 I75 D99 L100 C313 P317 | G67-N71 VanDerWaalsContact O-CB 3.24Å; G67-N71 WeakPolarHBondContact O-CB 3.06Å; G67-N71 PolarHBondContact O-N 3.22Å; G67-N71 PolarHBondContact O-ND2 3.46Å; N71-L73 VanDerWaalsContact C-N 3.32Å; N71-L73 PolarHBondContact O-N 2.87Å; N71-V74 PolarHBondContact O-N 3Å; N71-I75 WeakPolarHBondContact O-CG1 3.38Å; N71-I75 PolarHBondContact O-N 2.99Å; N71-D99 WeakPolarHBondContact OD1-CB 3.39Å; N71-L100 HydrophobicContact CB-CB 4.28Å; N71-C313 PolarHBondContact ND2-O 3.46Å; N71-P317 VanDerWaalsContact OD1-CG 3.25Å; N71-P317 WeakPolarHBondContact OD1-CG 3.17Å |
| 72 | L | 94 | Very high | 87.4 | Confident | 73 Ų | 73 | 52.3 Ų | 52.3 | 38% | 0.382 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.8 | -39.6 | 172.7 | -71.9 | 176.2 | 0 | 0 | 0 | 112 | L68 I75 C76 L100 | L68-L72 HydrophobicContact CD1-CD1 3.73Å; L68-L72 HydrophobicContact CD1-CG 4.21Å; L68-L72 HydrophobicContact CG-CD1 3.91Å; L68-L72 VanDerWaalsContact O-CB 3.23Å; L68-L72 WeakPolarHBondContact O-CB 3.24Å; L68-L72 WeakPolarHBondContact O-CD1 3.12Å; L68-L72 WeakPolarHBondContact O-CG 3.25Å; L68-L72 PolarHBondContact O-N 3.36Å; L68-L72 VanDerWaalsContact O-N 3.12Å; L72-I75 PolarHBondContact O-N 2.91Å; L72-C76 VanDerWaalsContact O-CB 3.3Å; L72-C76 WeakPolarHBondContact O-CB 3.48Å; L72-C76 PolarHBondContact O-N 3.17Å; L72-C76 PolarHBondContact O-SG 3.07Å; L72-L100 HydrophobicContact CD2-CD1 4.42Å; L72-L100 HydrophobicContact CD2-CD2 3.87Å; L72-L100 HydrophobicContact CG-CD1 4.41Å |
| 73 | L | 89.8 | Confident | 85 | Confident | 52 Ų | 52 | 53.4 Ų | 53.4 | 27% | 0.272 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.1 | -43.6 | 175 | 179.9 | 66.2 | 0 | 0 | 0 | 111.3 | V69 E70 N71 C76 V77 F322 L331 | V69-L73 VanDerWaalsContact O-CB 3.3Å; V69-L73 WeakPolarHBondContact O-CB 3.28Å; V69-L73 PolarHBondContact O-N 3.37Å; E70-L73 WeakPolarHBondContact O-CB 3.44Å; E70-L73 PolarHBondContact O-N 2.91Å; N71-L73 VanDerWaalsContact C-N 3.32Å; N71-L73 PolarHBondContact O-N 2.87Å; L73-C76 PolarHBondContact O-N 3Å; L73-V77 HydrophobicContact CD1-CG2 3.89Å; L73-V77 HydrophobicContact CG-CG2 4.3Å; L73-V77 WeakPolarHBondContact O-CB 3.23Å; L73-V77 VanDerWaalsContact O-CG2 3.3Å; L73-V77 WeakPolarHBondContact O-CG2 3.44Å; L73-V77 PolarHBondContact O-N 3.09Å; L73-F322 HydrophobicContact CD2-CZ 4.14Å; L73-L331 HydrophobicContact CD1-CD1 3.75Å; L73-L331 HydrophobicContact CD2-CD1 3.77Å; L73-L331 HydrophobicContact CG-CD1 4.15Å |
| 74 | V | 87.9 | Confident | 82.3 | Confident | 4 Ų | 4 | 64 Ų | 64 | 2% | 0.024 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.5 | -48.2 | 176.2 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | E70 N71 N78 I92 A96 P317 N321 | E70-V74 WeakPolarHBondContact O-CG2 3.2Å; E70-V74 PolarHBondContact O-N 3.17Å; N71-V74 PolarHBondContact O-N 3Å; V74-N78 VanDerWaalsContact O-CB 3.32Å; V74-N78 WeakPolarHBondContact O-CB 3.34Å; V74-N78 PolarHBondContact O-N 3.05Å; V74-N78 PolarHBondContact O-ND2 3.45Å; V74-I92 HydrophobicContact CG1-CG2 3.78Å; V74-A96 HydrophobicContact CB-CB 4.05Å; V74-A96 HydrophobicContact CG1-CB 3.64Å; V74-P317 HydrophobicContact CG2-CB 3.97Å; V74-P317 HydrophobicContact CG2-CG 4.47Å; V74-N321 WeakPolarHBondContact CG2-ND2 3.39Å |
| 75 | I | 90.1 | Very high | 79.7 | Confident | 34 Ų | 34 | 67.3 Ų | 67.3 | 17% | 0.174 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -59.9 | -50.5 | 177.2 | -66.9 | 165.2 | 0 | 0 | 0 | 110.1 | N71 L72 V77 N78 W79 L93 A96 I97 L100 | N71-I75 WeakPolarHBondContact O-CG1 3.38Å; N71-I75 PolarHBondContact O-N 2.99Å; L72-I75 PolarHBondContact O-N 2.91Å; I75-V77 PolarHBondContact O-N 2.98Å; I75-N78 PolarHBondContact O-N 3.23Å; I75-W79 VanDerWaalsContact O-CB 3.27Å; I75-W79 WeakPolarHBondContact O-CB 3.41Å; I75-W79 PolarHBondContact O-N 2.98Å; I75-L93 HydrophobicContact CB-CD1 4.26Å; I75-L93 HydrophobicContact CG1-CD1 4.1Å; I75-L93 HydrophobicContact CG2-CD1 4.13Å; I75-A96 HydrophobicContact CG1-CB 3.97Å; I75-I97 HydrophobicContact CD1-CG1 4.06Å; I75-I97 HydrophobicContact CG1-CG1 4.33Å; I75-L100 HydrophobicContact CD1-CD2 3.87Å |
| 76 | C | 86.9 | Confident | 77.3 | Confident | 55 Ų | 55 | 65.6 Ų | 65.6 | 37% | 0.372 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -59.8 | -47.1 | -178.9 | -73.3 | 0 | 0 | 0 | 0 | 112.9 | L72 L73 R80 | L72-C76 VanDerWaalsContact O-CB 3.3Å; L72-C76 WeakPolarHBondContact O-CB 3.48Å; L72-C76 PolarHBondContact O-N 3.17Å; L72-C76 PolarHBondContact O-SG 3.07Å; L73-C76 PolarHBondContact O-N 3Å; C76-R80 VanDerWaalsContact O-CG 3.31Å; C76-R80 WeakPolarHBondContact O-CG 3.49Å; C76-R80 PolarHBondContact O-N 3.43Å; C76-R80 VanDerWaalsContact O-N 3.14Å |
| 77 | V | 80.5 | Confident | 75.2 | Confident | 9 Ų | 9 | 67.1 Ų | 67.1 | 6% | 0.055 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -69.2 | -38.1 | -178 | 171.9 | 0 | 0 | 0 | 0 | 111 | L73 I75 G81 F327 R330 | L73-V77 HydrophobicContact CD1-CG2 3.89Å; L73-V77 HydrophobicContact CG-CG2 4.3Å; L73-V77 WeakPolarHBondContact O-CB 3.23Å; L73-V77 VanDerWaalsContact O-CG2 3.3Å; L73-V77 WeakPolarHBondContact O-CG2 3.44Å; L73-V77 PolarHBondContact O-N 3.09Å; I75-V77 PolarHBondContact O-N 2.98Å; V77-G81 PolarHBondContact O-N 3.33Å; V77-F327 HydrophobicContact CB-CE2 3.91Å; V77-F327 HydrophobicContact CB-CZ 4.11Å; V77-F327 HydrophobicContact CG1-CD2 4.16Å; V77-F327 HydrophobicContact CG1-CE2 3.4Å; V77-F327 VanDerWaalsContact CG1-CE2 3.4Å; V77-F327 HydrophobicContact CG1-CZ 3.92Å; V77-F327 HydrophobicContact CG2-CE2 4.39Å; V77-F327 HydrophobicContact CG2-CZ 4.1Å; V77-R330 HydrophobicContact CG1-CB 4.45Å; V77-R330 PolarHBondContact O-NH2 2.97Å |
| 78 | N | 77.8 | Confident | 73.3 | Confident | 12 Ų | 12 | 69.3 Ų | 69.3 | 6% | 0.064 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -72.6 | -36.4 | 177.7 | -78.2 | -76.2 | 0 | 0 | 0 | 112.6 | V74 I75 L93 | V74-N78 VanDerWaalsContact O-CB 3.32Å; V74-N78 WeakPolarHBondContact O-CB 3.34Å; V74-N78 PolarHBondContact O-N 3.05Å; V74-N78 PolarHBondContact O-ND2 3.45Å; I75-N78 PolarHBondContact O-N 3.23Å; N78-L93 HydrophobicContact CB-CD1 4.43Å |
| 79 | W | 79.7 | Confident | 72.4 | Confident | 187 Ų | 187 | 69.3 Ų | 69.3 | 71% | 0.708 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -65.2 | -45.1 | 176.6 | -167.3 | -92.7 | 0 | 0 | 0 | 112.5 | I75 G81 S82 | I75-W79 VanDerWaalsContact O-CB 3.27Å; I75-W79 WeakPolarHBondContact O-CB 3.41Å; I75-W79 PolarHBondContact O-N 2.98Å; W79-G81 PolarHBondContact O-N 3.14Å; W79-S82 VanDerWaalsContact O-CB 3.31Å; W79-S82 WeakPolarHBondContact O-CB 3.5Å; W79-S82 PolarHBondContact O-N 3.47Å |
| 80 | R | 70.6 | Confident | 72 | Confident | 144 Ų | 144 | 66.3 Ų | 66.3 | 54% | 0.543 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -73.8 | -25.7 | -177.3 | -68.6 | 173.9 | -177.5 | -155.7 | -3 | 114.5 | C76 S82 Y338 | C76-R80 VanDerWaalsContact O-CG 3.31Å; C76-R80 WeakPolarHBondContact O-CG 3.49Å; C76-R80 PolarHBondContact O-N 3.43Å; C76-R80 VanDerWaalsContact O-N 3.14Å; R80-S82 PolarHBondContact O-N 3.36Å; R80-Y338 PolarHBondContact NH1-OH 2.77Å; R80-Y338 PolarHBondContact NH2-OH 2.87Å |
| 81 | G | 61.4 | Low | 71.8 | Confident | 31 Ų | 31 | 65.5 Ų | 65.5 | 32% | 0.32 | 37% | 0.368 | S | S | . | . | G | 310 helix | trans | -71.5 | -5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | V77 W79 G83 | V77-G81 PolarHBondContact O-N 3.33Å; W79-G81 PolarHBondContact O-N 3.14Å; G81-G83 VanDerWaalsContact C-N 3.28Å; G81-G83 PolarHBondContact O-N 2.89Å |
| 82 | S | 57.8 | Low | 71.6 | Confident | 75 Ų | 75 | 66.1 Ų | 66.1 | 52% | 0.524 | 37% | 0.371 | S | S | . | . | G | 310 helix | trans | -68.9 | -15.9 | -169.1 | -168 | 0 | 0 | 0 | 0 | 115.4 | W79 R80 | W79-S82 VanDerWaalsContact O-CB 3.31Å; W79-S82 WeakPolarHBondContact O-CB 3.5Å; W79-S82 PolarHBondContact O-N 3.47Å; R80-S82 PolarHBondContact O-N 3.36Å |
| 83 | G | 46.6 | Very low | 71.4 | Confident | 79 Ų | 79 | 63.4 Ų | 63.4 | 81% | 0.814 | 36% | 0.357 | S | S | * | . | G | 310 helix | trans | -89.6 | -9.4 | -170 | 0 | 0 | 0 | 0 | 0 | 116.7 | G81 | G81-G83 VanDerWaalsContact C-N 3.28Å; G81-G83 PolarHBondContact O-N 2.89Å |
| 84 | R | 39.4 | Very low | 71.7 | Confident | 232 Ų | 232 | 62 Ų | 62 | 88% | 0.875 | 35% | 0.349 | S | S | * | . | S | Bend | trans | -138.5 | 76.7 | -166.3 | -146.8 | 157.2 | 162.6 | 150 | -7.3 | 111 | G86 | R84-G86 PolarHBondContact O-N 3.11Š|
| 85 | A | 44.6 | Very low | 71.9 | Confident | 119 Ų | 119 | 62 Ų | 62 | 98% | 0.983 | 35% | 0.349 | S | S | * | . | S | Bend | trans | 51 | 24.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||
| 86 | G | 46.3 | Very low | 72.1 | Confident | 41 Ų | 41 | 60.5 Ų | 60.5 | 42% | 0.423 | 34% | 0.342 | S | S | . | . | trans | -105 | 111.3 | -176 | 0 | 0 | 0 | 0 | 0 | 111.4 | R84 L88 | R84-G86 PolarHBondContact O-N 3.11Å; G86-L88 PolarHBondContact O-N 3.47Å | ||
| 87 | L | 52 | Low | 72.6 | Confident | 93 Ų | 93 | 61.3 Ų | 61.3 | 49% | 0.487 | 34% | 0.342 | S | S | . | . | trans | -37.9 | 99.2 | 167.6 | -157.3 | 82.7 | 0 | 0 | 0 | 110.7 | N89 H167 | L87-N89 PolarHBondContact O-N 2.89Å; L87-H167 VanDerWaalsContact CD1-CE1 3.43Å; L87-H167 WeakPolarHBondContact CD1-CE1 3.43Å; L87-H167 WeakPolarHBondContact CD1-NE2 3.38Å | ||
| 88 | L | 56.6 | Low | 73.4 | Confident | 46 Ų | 46 | 60.9 Ų | 60.9 | 24% | 0.241 | 34% | 0.339 | C | S | . | . | trans | -59.8 | 115.5 | 174.8 | -158.4 | 164 | 0 | 0 | 0 | 106.3 | G86 L90 L93 | G86-L88 PolarHBondContact O-N 3.47Å; L88-L90 HydrophobicContact CD2-CB 4.41Å; L88-L90 HydrophobicContact CD2-CD2 3.67Å; L88-L90 HydrophobicContact CD2-CG 3.86Å; L88-L90 PolarHBondContact O-N 3.47Å; L88-L93 HydrophobicContact CD2-CB 4.43Å; L88-L93 HydrophobicContact CD2-CD2 4.07Å | ||
| 89 | N | 76.4 | Confident | 74.3 | Confident | 47 Ų | 47 | 60.3 Ų | 60.3 | 25% | 0.251 | 34% | 0.336 | S | S | . | . | trans | -79.4 | 73.7 | 180 | -145.8 | -22.6 | 0 | 0 | 0 | 107.8 | L87 Y91 I92 L93 | L87-N89 PolarHBondContact O-N 2.89Å; N89-Y91 PolarHBondContact O-N 2.8Å; N89-Y91 VanDerWaalsContact O-N 3.11Å; N89-I92 HydrophobicContact CB-CB 4.2Å; N89-I92 HydrophobicContact CB-CD1 3.87Å; N89-I92 HydrophobicContact CB-CG1 4.04Å; N89-I92 VanDerWaalsContact ND2-CD1 3.28Å; N89-I92 WeakPolarHBondContact ND2-CD1 3.32Å; N89-I92 WeakPolarHBondContact O-CA 3.47Å; N89-I92 WeakPolarHBondContact O-CB 3.28Å; N89-I92 PolarHBondContact O-N 2.9Å; N89-L93 PolarHBondContact O-N 2.98Å; N89-L93 VanDerWaalsContact O-N 3.14Å | ||
| 90 | L | 86 | Confident | 75.2 | Confident | 32 Ų | 32 | 52.7 Ų | 52.7 | 17% | 0.168 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -48.7 | -39.9 | -171.1 | -78.8 | 164.4 | 0 | 0 | 0 | 112.1 | L88 L93 N94 R170 R171 | L88-L90 HydrophobicContact CD2-CB 4.41Å; L88-L90 HydrophobicContact CD2-CD2 3.67Å; L88-L90 HydrophobicContact CD2-CG 3.86Å; L88-L90 PolarHBondContact O-N 3.47Å; L90-L93 PolarHBondContact O-N 2.75Å; L90-N94 PolarHBondContact O-N 3.48Å; L90-N94 PolarHBondContact O-ND2 3.26Å; L90-R170 HydrophobicContact CD1-CB 3.97Å; L90-R171 HydrophobicContact CD1-CG 3.74Å |
| 91 | Y | 89.6 | Confident | 76.4 | Confident | 11 Ų | 11 | 46 Ų | 46 | 4% | 0.043 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.7 | -41.2 | 177.3 | -59.7 | -50.5 | 0 | 0 | 0 | 112.7 | N89 L93 N94 M95 F143 C146 D150 R170 M173 | N89-Y91 PolarHBondContact O-N 2.8Å; N89-Y91 VanDerWaalsContact O-N 3.11Å; Y91-L93 VanDerWaalsContact C-N 3.33Å; Y91-L93 PolarHBondContact O-N 3.21Å; Y91-N94 PolarHBondContact O-N 3.1Å; Y91-M95 WeakPolarHBondContact O-CB 3.28Å; Y91-M95 PolarHBondContact O-N 3.12Å; Y91-F143 AromaticContact CD1-CD1 3.91Å; Y91-F143 HydrophobicContact CD1-CD1 3.91Å; Y91-F143 HydrophobicContact CD1-CE1 4.3Å; Y91-C146 HydrophobicContact CD1-CB 4.09Å; Y91-C146 HydrophobicContact CE1-CB 3.88Å; Y91-C146 HydrophobicContact CE2-CB 4.45Å; Y91-C146 HydrophobicContact CG-CB 4.45Å; Y91-D150 HydrophobicContact CD2-CB 3.96Å; Y91-D150 HydrophobicContact CE2-CB 3.59Å; Y91-R170 HydrophobicContact CE2-CG 3.82Å; Y91-M173 HydrophobicContact CE1-CB 4.16Å |
| 92 | I | 89.7 | Confident | 78.2 | Confident | 13 Ų | 13 | 44.6 Ų | 44.6 | 7% | 0.067 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64 | -41.2 | 176.3 | -61.3 | -177.2 | 0 | 0 | 0 | 110.7 | V74 N89 A96 L147 | V74-I92 HydrophobicContact CG1-CG2 3.78Å; N89-I92 HydrophobicContact CB-CB 4.2Å; N89-I92 HydrophobicContact CB-CD1 3.87Å; N89-I92 HydrophobicContact CB-CG1 4.04Å; N89-I92 VanDerWaalsContact ND2-CD1 3.28Å; N89-I92 WeakPolarHBondContact ND2-CD1 3.32Å; N89-I92 WeakPolarHBondContact O-CA 3.47Å; N89-I92 WeakPolarHBondContact O-CB 3.28Å; N89-I92 PolarHBondContact O-N 2.9Å; I92-A96 WeakPolarHBondContact O-CB 3.4Å; I92-A96 PolarHBondContact O-N 3.38Å; I92-L147 HydrophobicContact CD1-CD1 4.44Å; I92-L147 HydrophobicContact CG1-CD1 3.97Å; I92-L147 HydrophobicContact CG1-CD2 4Å |
| 93 | L | 90.6 | Very high | 80.1 | Confident | 15 Ų | 15 | 41 Ų | 41 | 8% | 0.079 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.4 | -48.6 | 178.3 | 178.9 | 64.5 | 0 | 0 | 0 | 111.5 | I75 N78 L88 N89 L90 Y91 A96 I97 | I75-L93 HydrophobicContact CB-CD1 4.26Å; I75-L93 HydrophobicContact CG1-CD1 4.1Å; I75-L93 HydrophobicContact CG2-CD1 4.13Å; N78-L93 HydrophobicContact CB-CD1 4.43Å; L88-L93 HydrophobicContact CD2-CB 4.43Å; L88-L93 HydrophobicContact CD2-CD2 4.07Å; N89-L93 PolarHBondContact O-N 2.98Å; N89-L93 VanDerWaalsContact O-N 3.14Å; L90-L93 PolarHBondContact O-N 2.75Å; Y91-L93 VanDerWaalsContact C-N 3.33Å; Y91-L93 PolarHBondContact O-N 3.21Å; L93-A96 PolarHBondContact O-N 2.82Å; L93-I97 HydrophobicContact CD1-CD1 4.47Å; L93-I97 HydrophobicContact CG-CD1 4.21Å; L93-I97 WeakPolarHBondContact O-CG1 3.33Å; L93-I97 PolarHBondContact O-N 3.49Å |
| 94 | N | 94.2 | Very high | 82.5 | Confident | 23 Ų | 23 | 41.7 Ų | 41.7 | 12% | 0.123 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -68.6 | -36.8 | -179.4 | -74.9 | -89.3 | 0 | 0 | 0 | 112.3 | L90 Y91 I97 A98 F143 W178 | L90-N94 PolarHBondContact O-N 3.48Å; L90-N94 PolarHBondContact O-ND2 3.26Å; Y91-N94 PolarHBondContact O-N 3.1Å; N94-I97 WeakPolarHBondContact O-CB 3.22Å; N94-I97 PolarHBondContact O-N 3.32Å; N94-A98 PolarHBondContact O-N 3.2Å; N94-F143 HydrophobicContact CB-CD1 3.98Å; N94-F143 HydrophobicContact CB-CD2 3.94Å; N94-F143 HydrophobicContact CB-CE1 3.52Å; N94-F143 HydrophobicContact CB-CE2 3.53Å; N94-F143 HydrophobicContact CB-CG 4.2Å; N94-F143 HydrophobicContact CB-CZ 3.31Å; N94-W178 PolarHBondContact OD1-NE1 3.37Å |
| 95 | M | 93.7 | Very high | 85.2 | Confident | 4 Ų | 4 | 30.8 Ų | 30.8 | 2% | 0.02 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.5 | -45 | 171.9 | -174.4 | 176.9 | 68.1 | 0 | 0 | 111.3 | Y91 I97 A98 D99 F143 L144 L147 Y320 | Y91-M95 WeakPolarHBondContact O-CB 3.28Å; Y91-M95 PolarHBondContact O-N 3.12Å; M95-I97 VanDerWaalsContact C-N 3.27Å; M95-I97 PolarHBondContact O-N 3.34Å; M95-A98 WeakPolarHBondContact O-CB 3.34Å; M95-A98 PolarHBondContact O-N 2.82Å; M95-A98 VanDerWaalsContact O-N 3.13Å; M95-D99 WeakPolarHBondContact O-CB 3.41Å; M95-D99 VanDerWaalsContact O-CG 3.32Å; M95-D99 PolarHBondContact O-N 3.08Å; M95-F143 HydrophobicContact CB-CB 3.81Å; M95-F143 HydrophobicContact CB-CG 4.44Å; M95-F143 HydrophobicContact CG-CB 4.31Å; M95-L144 HydrophobicContact SD-CB 4.31Å; M95-L147 HydrophobicContact CE-CD2 4.32Å; M95-Y320 HydrophobicContact CE-CD2 3.37Å; M95-Y320 HydrophobicContact CE-CE2 3.12Å; M95-Y320 HydrophobicContact CE-CG 4.36Å; M95-Y320 HydrophobicContact SD-CE2 4.01Å |
| 96 | A | 94.7 | Very high | 87.6 | Confident | 2 Ų | 2 | 25.1 Ų | 25.1 | 2% | 0.017 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.4 | -30.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113 | V74 I75 I92 L93 L100 | V74-A96 HydrophobicContact CB-CB 4.05Å; V74-A96 HydrophobicContact CG1-CB 3.64Å; I75-A96 HydrophobicContact CG1-CB 3.97Å; I92-A96 WeakPolarHBondContact O-CB 3.4Å; I92-A96 PolarHBondContact O-N 3.38Å; L93-A96 PolarHBondContact O-N 2.82Å; A96-L100 WeakPolarHBondContact O-CB 3.45Å; A96-L100 PolarHBondContact O-N 3.39Å |
| 97 | I | 96.5 | Very high | 90 | Very high | 72 Ų | 72 | 25.3 Ų | 25.3 | 37% | 0.369 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -68.1 | -43.1 | 172.3 | -68.3 | 165.4 | 0 | 0 | 0 | 110.4 | I75 L93 N94 M95 L100 G101 W178 | I75-I97 HydrophobicContact CD1-CG1 4.06Å; I75-I97 HydrophobicContact CG1-CG1 4.33Å; L93-I97 HydrophobicContact CD1-CD1 4.47Å; L93-I97 HydrophobicContact CG-CD1 4.21Å; L93-I97 WeakPolarHBondContact O-CG1 3.33Å; L93-I97 PolarHBondContact O-N 3.49Å; N94-I97 WeakPolarHBondContact O-CB 3.22Å; N94-I97 PolarHBondContact O-N 3.32Å; M95-I97 VanDerWaalsContact C-N 3.27Å; M95-I97 PolarHBondContact O-N 3.34Å; I97-L100 PolarHBondContact O-N 2.97Å; I97-G101 PolarHBondContact O-N 3.35Å; I97-W178 HydrophobicContact CB-CZ2 4.41Å; I97-W178 HydrophobicContact CG2-CH2 4.16Å; I97-W178 HydrophobicContact CG2-CZ2 3.99Å |
| 98 | A | 97.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -65.1 | -48.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | N94 M95 L100 G101 I102 N136 W178 | N94-A98 PolarHBondContact O-N 3.2Å; M95-A98 WeakPolarHBondContact O-CB 3.34Å; M95-A98 PolarHBondContact O-N 2.82Å; M95-A98 VanDerWaalsContact O-N 3.13Å; A98-L100 VanDerWaalsContact C-N 3.28Å; A98-L100 PolarHBondContact O-N 3.3Å; A98-G101 WeakPolarHBondContact O-CA 3.44Å; A98-G101 PolarHBondContact O-N 2.82Å; A98-I102 PolarHBondContact O-N 3.44Å; A98-I102 VanDerWaalsContact O-N 3.11Å; A98-N136 WeakPolarHBondContact O-CB 3.37Å; A98-N136 PolarHBondContact O-OD1 3.25Å; A98-W178 HydrophobicContact CB-CH2 4.02Å |
| 99 | D | 97.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -57.7 | -41.2 | 176 | -72.2 | -19 | 0 | 0 | 0 | 111 | N71 M95 G101 I102 V103 S140 H312 C313 | N71-D99 WeakPolarHBondContact OD1-CB 3.39Å; M95-D99 WeakPolarHBondContact O-CB 3.41Å; M95-D99 VanDerWaalsContact O-CG 3.32Å; M95-D99 PolarHBondContact O-N 3.08Å; D99-G101 VanDerWaalsContact C-N 3.31Å; D99-G101 PolarHBondContact O-N 3.43Å; D99-I102 PolarHBondContact O-N 2.92Å; D99-V103 VanDerWaalsContact O-CG2 3.31Å; D99-V103 WeakPolarHBondContact O-CG2 3.49Å; D99-V103 PolarHBondContact O-N 3.4Å; D99-S140 VanDerWaalsContact OD1-CB 3.31Å; D99-S140 WeakPolarHBondContact OD1-CB 3.5Å; D99-S140 PolarHBondContact OD1-OG 3.33Å; D99-H312 IonicContact OD1-CD2 3.55Å; D99-H312 IonicContact OD1-NE2 2.86Å; D99-C313 HydrophobicContact CB-CB 3.87Å |
| 100 | L | 97.2 | Very high | 94.8 | Very high | 27 Ų | 27 | 20.4 Ų | 20.4 | 14% | 0.141 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62 | -38.1 | 173.5 | -177.5 | 63.5 | 0 | 0 | 0 | 112 | L68 N71 L72 I75 A96 I97 A98 V103 L104 | L68-L100 HydrophobicContact CD1-CD1 3.7Å; N71-L100 HydrophobicContact CB-CB 4.28Å; L72-L100 HydrophobicContact CD2-CD1 4.42Å; L72-L100 HydrophobicContact CD2-CD2 3.87Å; L72-L100 HydrophobicContact CG-CD1 4.41Å; I75-L100 HydrophobicContact CD1-CD2 3.87Å; A96-L100 WeakPolarHBondContact O-CB 3.45Å; A96-L100 PolarHBondContact O-N 3.39Å; I97-L100 PolarHBondContact O-N 2.97Å; A98-L100 VanDerWaalsContact C-N 3.28Å; A98-L100 PolarHBondContact O-N 3.3Å; L100-V103 PolarHBondContact O-N 3.43Å; L100-L104 HydrophobicContact CD1-CD1 4.41Å; L100-L104 HydrophobicContact CD1-CG 4.22Å; L100-L104 HydrophobicContact CG-CD1 4.03Å; L100-L104 HydrophobicContact CG-CG 4.28Å; L100-L104 WeakPolarHBondContact O-CB 3.41Å; L100-L104 WeakPolarHBondContact O-CG 3.32Å; L100-L104 PolarHBondContact O-N 3.03Å |
| 101 | G | 97.5 | Very high | 95.2 | Very high | 4 Ų | 4 | 22.9 Ų | 22.9 | 4% | 0.041 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -58.5 | -46.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | I97 A98 D99 V103 L104 S105 F132 | I97-G101 PolarHBondContact O-N 3.35Å; A98-G101 WeakPolarHBondContact O-CA 3.44Å; A98-G101 PolarHBondContact O-N 2.82Å; D99-G101 VanDerWaalsContact C-N 3.31Å; D99-G101 PolarHBondContact O-N 3.43Å; G101-V103 PolarHBondContact O-N 3.46Å; G101-L104 PolarHBondContact O-N 3.1Å; G101-S105 PolarHBondContact O-N 3.07Å; G101-F132 WeakPolarHBondContact O-CE1 3.23Å |
| 102 | I | 97.3 | Very high | 95.3 | Very high | 1 Ų | 1 | 23.1 Ų | 23.1 | 1% | 0.005 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -60 | -49.2 | 175.4 | -58.9 | 174.2 | 0 | 0 | 0 | 110.3 | A98 D99 L104 S105 L106 Y133 N136 | A98-I102 PolarHBondContact O-N 3.44Å; A98-I102 VanDerWaalsContact O-N 3.11Å; D99-I102 PolarHBondContact O-N 2.92Å; I102-L104 VanDerWaalsContact C-N 3.29Å; I102-L104 PolarHBondContact O-N 3.23Å; I102-S105 WeakPolarHBondContact O-CB 3.43Å; I102-S105 PolarHBondContact O-N 3.37Å; I102-S105 PolarHBondContact O-OG 3Å; I102-L106 PolarHBondContact O-N 3.22Å; I102-Y133 HydrophobicContact CG2-CD2 4.23Å; I102-Y133 HydrophobicContact CG2-CE2 3.98Å; I102-N136 HydrophobicContact CG1-CB 3.74Å |
| 103 | V | 97.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -56.7 | -42.7 | 178.6 | 166.8 | 0 | 0 | 0 | 0 | 111.6 | F64 L68 D99 L100 G101 S105 L106 | F64-V103 HydrophobicContact CD2-CG1 3.89Å; F64-V103 WeakPolarHBondContact CD2-O 3.24Å; F64-V103 HydrophobicContact CE2-CG1 4.42Å; L68-V103 HydrophobicContact CB-CG1 4.07Å; D99-V103 VanDerWaalsContact O-CG2 3.31Å; D99-V103 WeakPolarHBondContact O-CG2 3.49Å; D99-V103 PolarHBondContact O-N 3.4Å; L100-V103 PolarHBondContact O-N 3.43Å; G101-V103 PolarHBondContact O-N 3.46Å; V103-S105 PolarHBondContact O-N 3.16Å; V103-L106 VanDerWaalsContact O-CB 3.32Å; V103-L106 WeakPolarHBondContact O-CB 3.4Å; V103-L106 PolarHBondContact O-N 3.02Å; V103-L106 VanDerWaalsContact O-N 3.16Å |
| 104 | L | 97 | Very high | 95.5 | Very high | 93 Ų | 93 | 25.4 Ų | 25.4 | 49% | 0.487 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -68.7 | -16.4 | 178.6 | -70.8 | 173.7 | 0 | 0 | 0 | 113.5 | L68 L100 G101 I102 P107 | L68-L104 HydrophobicContact CD1-CD2 4.4Å; L100-L104 HydrophobicContact CD1-CD1 4.41Å; L100-L104 HydrophobicContact CD1-CG 4.22Å; L100-L104 HydrophobicContact CG-CD1 4.03Å; L100-L104 HydrophobicContact CG-CG 4.28Å; L100-L104 WeakPolarHBondContact O-CB 3.41Å; L100-L104 WeakPolarHBondContact O-CG 3.32Å; L100-L104 PolarHBondContact O-N 3.03Å; G101-L104 PolarHBondContact O-N 3.1Å; I102-L104 VanDerWaalsContact C-N 3.29Å; I102-L104 PolarHBondContact O-N 3.23Å; L104-P107 WeakPolarHBondContact O-CD 3.32Å |
| 105 | S | 96.1 | Very high | 95.4 | Very high | 4 Ų | 4 | 27.6 Ų | 27.6 | 3% | 0.028 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -81.3 | -24.4 | 172.3 | 77 | 0 | 0 | 0 | 0 | 113.3 | G101 I102 V103 P107 V108 W109 | G101-S105 PolarHBondContact O-N 3.07Å; I102-S105 WeakPolarHBondContact O-CB 3.43Å; I102-S105 PolarHBondContact O-N 3.37Å; I102-S105 PolarHBondContact O-OG 3Å; V103-S105 PolarHBondContact O-N 3.16Å; S105-P107 VanDerWaalsContact C-CD 3.43Å; S105-P107 VanDerWaalsContact C-N 3.34Å; S105-V108 WeakPolarHBondContact O-CB 3.31Å; S105-V108 PolarHBondContact O-N 2.98Å; S105-W109 VanDerWaalsContact C-CD1 3.49Å; S105-W109 PolarHBondContact O-N 3.05Å; S105-W109 PolarHBondContact OG-NE1 3.18Å; S105-W109 VanDerWaalsContact OG-NE1 3.11Å |
| 106 | L | 96.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -51.7 | -39.1 | -178.7 | -65.4 | 174.1 | 0 | 0 | 0 | 114.8 | Y60 M63 F64 I102 V103 V108 W109 M110 M310 | Y60-L106 HydrophobicContact CD1-CD2 3.85Å; Y60-L106 HydrophobicContact CE1-CD2 4.45Å; Y60-L106 HydrophobicContact CG-CD2 4.4Å; M63-L106 HydrophobicContact CB-CD1 3.69Å; M63-L106 HydrophobicContact CE-CD2 4.42Å; F64-L106 HydrophobicContact CB-CB 4.24Å; F64-L106 HydrophobicContact CB-CD1 4.05Å; I102-L106 PolarHBondContact O-N 3.22Å; V103-L106 VanDerWaalsContact O-CB 3.32Å; V103-L106 WeakPolarHBondContact O-CB 3.4Å; V103-L106 PolarHBondContact O-N 3.02Å; V103-L106 VanDerWaalsContact O-N 3.16Å; L106-V108 PolarHBondContact O-N 3.5Å; L106-W109 PolarHBondContact O-N 3.48Å; L106-M110 WeakPolarHBondContact O-CG 3.49Å; L106-M110 PolarHBondContact O-N 3.37Å; L106-M310 HydrophobicContact CD2-CE 4.48Å; L106-M310 HydrophobicContact CD2-SD 3.55Å; L106-M310 VanDerWaalsContact CD2-SD 3.55Å |
| 107 | P | 96.4 | Very high | 94.9 | Very high | 44 Ų | 44 | 33.2 Ų | 33.2 | 29% | 0.286 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -59.2 | -32.4 | 174.3 | -25.9 | 36.5 | 0 | 0 | 0 | 114.6 | F64 L104 S105 M110 L111 | F64-P107 HydrophobicContact CD2-CG 3.91Å; F64-P107 HydrophobicContact CE2-CG 3.74Å; F64-P107 HydrophobicContact CZ-CG 4.23Å; L104-P107 WeakPolarHBondContact O-CD 3.32Å; S105-P107 VanDerWaalsContact C-CD 3.43Å; S105-P107 VanDerWaalsContact C-N 3.34Å; P107-M110 VanDerWaalsContact CA-CE 3.49Å; P107-M110 HydrophobicContact CB-CE 4.13Å; P107-M110 HydrophobicContact CG-CE 4.13Å; P107-L111 WeakPolarHBondContact O-CG 2.81Å; P107-L111 PolarHBondContact O-N 3.45Å; P107-L111 VanDerWaalsContact O-N 3.13Å |
| 108 | V | 95.4 | Very high | 94.6 | Very high | 40 Ų | 40 | 30.7 Ų | 30.7 | 24% | 0.242 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -70.9 | -46.1 | 177.1 | -175.8 | 0 | 0 | 0 | 0 | 110 | S105 L106 M110 L111 E112 W119 T129 | S105-V108 WeakPolarHBondContact O-CB 3.31Å; S105-V108 PolarHBondContact O-N 2.98Å; L106-V108 PolarHBondContact O-N 3.5Å; V108-M110 VanDerWaalsContact C-N 3.33Å; V108-M110 PolarHBondContact O-N 3.31Å; V108-L111 WeakPolarHBondContact O-CB 3.12Å; V108-L111 PolarHBondContact O-N 3.46Å; V108-L111 VanDerWaalsContact O-N 3.13Å; V108-E112 PolarHBondContact O-N 2.87Å; V108-W119 HydrophobicContact CG1-CH2 3.59Å; V108-W119 HydrophobicContact CG1-CZ3 3.95Å; V108-T129 HydrophobicContact CB-CG2 4.26Å; V108-T129 HydrophobicContact CG1-CG2 3.9Å |
| 109 | W | 94.5 | Very high | 94.4 | Very high | 27 Ų | 27 | 30.9 Ų | 30.9 | 10% | 0.102 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -62.7 | -37.1 | 175.9 | -55 | 116.4 | 0 | 0 | 0 | 112.5 | Y60 S105 L106 E112 V113 T129 H130 Y133 | Y60-W109 HydrophobicContact CD2-CB 4.2Å; Y60-W109 HydrophobicContact CE2-CB 3.86Å; S105-W109 VanDerWaalsContact C-CD1 3.49Å; S105-W109 PolarHBondContact O-N 3.05Å; S105-W109 PolarHBondContact OG-NE1 3.18Å; S105-W109 VanDerWaalsContact OG-NE1 3.11Å; L106-W109 PolarHBondContact O-N 3.48Å; W109-E112 VanDerWaalsContact CZ3-OE2 3.3Å; W109-E112 WeakPolarHBondContact CZ3-OE2 3.38Å; W109-E112 PolarHBondContact O-N 3.18Å; W109-V113 WeakPolarHBondContact O-CG2 3.4Å; W109-V113 PolarHBondContact O-N 3.13Å; W109-T129 HydrophobicContact CH2-CG2 4.39Å; W109-T129 HydrophobicContact CZ2-CG2 3.98Å; W109-H130 AromaticContact CH2-CD2 3.97Å; W109-H130 AromaticContact CH2-CE1 3.65Å; W109-H130 AromaticContact CH2-NE2 3.64Å; W109-H130 AromaticContact CZ3-CE1 3.91Å; W109-Y133 HydrophobicContact CZ2-CG 4.23Å |
| 110 | M | 95.5 | Very high | 94.1 | Very high | 17 Ų | 17 | 36.3 Ų | 36.3 | 8% | 0.084 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.2 | -47.3 | 171.6 | -77 | -170.7 | -71.9 | 0 | 0 | 111.6 | F57 Y60 L61 F64 L106 P107 V108 V113 T114 | F57-M110 HydrophobicContact CD2-CB 4.02Å; F57-M110 HydrophobicContact CD2-CG 4.14Å; F57-M110 HydrophobicContact CD2-SD 4.32Å; F57-M110 HydrophobicContact CE2-CB 4.08Å; F57-M110 HydrophobicContact CE2-CG 4.34Å; F57-M110 HydrophobicContact CE2-SD 4.11Å; F57-M110 HydrophobicContact CZ-SD 4.42Å; Y60-M110 HydrophobicContact CD2-CG 3.86Å; Y60-M110 HydrophobicContact CG-CG 4.07Å; L61-M110 HydrophobicContact CB-SD 3.9Å; L61-M110 HydrophobicContact CD1-SD 4.48Å; F64-M110 HydrophobicContact CB-CE 4.48Å; L106-M110 WeakPolarHBondContact O-CG 3.49Å; L106-M110 PolarHBondContact O-N 3.37Å; P107-M110 VanDerWaalsContact CA-CE 3.49Å; P107-M110 HydrophobicContact CB-CE 4.13Å; P107-M110 HydrophobicContact CG-CE 4.13Å; V108-M110 VanDerWaalsContact C-N 3.33Å; V108-M110 PolarHBondContact O-N 3.31Å; M110-V113 PolarHBondContact O-N 3.46Å; M110-T114 VanDerWaalsContact O-CG2 3.29Å; M110-T114 WeakPolarHBondContact O-CG2 3.41Å; M110-T114 PolarHBondContact O-N 3.16Å; M110-T114 PolarHBondContact O-OG1 3Å |
| 111 | L | 94.3 | Very high | 93.9 | Very high | 84 Ų | 84 | 39.2 Ų | 39.2 | 44% | 0.44 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -63.7 | -44.4 | 179 | -72 | 169.5 | 0 | 0 | 0 | 111.3 | P107 V108 V113 T114 L115 W121 | P107-L111 WeakPolarHBondContact O-CG 2.81Å; P107-L111 PolarHBondContact O-N 3.45Å; P107-L111 VanDerWaalsContact O-N 3.13Å; V108-L111 WeakPolarHBondContact O-CB 3.12Å; V108-L111 PolarHBondContact O-N 3.46Å; V108-L111 VanDerWaalsContact O-N 3.13Å; L111-V113 PolarHBondContact O-N 3.47Å; L111-T114 WeakPolarHBondContact CA-OG1 3.14Å; L111-T114 PolarHBondContact O-N 3.45Å; L111-T114 PolarHBondContact O-OG1 3.24Å; L111-L115 WeakPolarHBondContact O-CB 3.17Å; L111-L115 VanDerWaalsContact O-CG 3.31Å; L111-L115 WeakPolarHBondContact O-CG 3.39Å; L111-L115 PolarHBondContact O-N 2.89Å; L111-W121 HydrophobicContact CB-CH2 3.79Å; L111-W121 HydrophobicContact CB-CZ2 3.63Å; L111-W121 HydrophobicContact CD1-CZ2 4Å; L111-W121 HydrophobicContact CG-CZ2 4.42Å |
| 112 | E | 91.8 | Very high | 93.6 | Very high | 15 Ų | 15 | 40.5 Ų | 40.5 | 7% | 0.07 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -56.1 | -50.4 | 176.6 | -177.4 | 169.5 | -157 | 0 | 0 | 111.7 | V108 W109 T114 L115 D116 Y117 | V108-E112 PolarHBondContact O-N 2.87Å; W109-E112 VanDerWaalsContact CZ3-OE2 3.3Å; W109-E112 WeakPolarHBondContact CZ3-OE2 3.38Å; W109-E112 PolarHBondContact O-N 3.18Å; E112-T114 VanDerWaalsContact C-N 3.33Å; E112-T114 PolarHBondContact O-N 3.27Å; E112-L115 CarbonylContact O-C 3.54Å; E112-L115 PolarHBondContact O-N 3.32Å; E112-D116 PolarHBondContact O-N 2.94Å; E112-Y117 HydrophobicContact CG-CD1 4.28Å; E112-Y117 WeakPolarHBondContact O-CA 3.13Å; E112-Y117 PolarHBondContact O-N 2.98Å |
| 113 | V | 92.3 | Very high | 93.4 | Very high | 4 Ų | 4 | 42.8 Ų | 42.8 | 2% | 0.024 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.4 | -38.6 | 176.8 | 170.4 | 0 | 0 | 0 | 0 | 112.1 | R53 L56 Y60 W109 M110 L111 L115 D116 Y117 | R53-V113 HydrophobicContact CB-CG1 3.87Å; R53-V113 VanDerWaalsContact CD-O 3.28Å; R53-V113 WeakPolarHBondContact CD-O 3.42Å; R53-V113 HydrophobicContact CG-CG1 3.89Å; L56-V113 HydrophobicContact CB-CG1 3.97Å; L56-V113 HydrophobicContact CB-CG2 4.42Å; L56-V113 HydrophobicContact CD1-CG1 4.15Å; L56-V113 HydrophobicContact CD1-CG2 4.11Å; Y60-V113 HydrophobicContact CE2-CG2 3.86Å; W109-V113 WeakPolarHBondContact O-CG2 3.4Å; W109-V113 PolarHBondContact O-N 3.13Å; M110-V113 PolarHBondContact O-N 3.46Å; L111-V113 PolarHBondContact O-N 3.47Å; V113-L115 VanDerWaalsContact C-N 3.29Å; V113-L115 PolarHBondContact O-N 2.95Å; V113-D116 PolarHBondContact O-N 3Å; V113-Y117 HydrophobicContact CG2-CE1 4.1Å |
| 114 | T | 92.6 | Very high | 93.2 | Very high | 73 Ų | 73 | 50.3 Ų | 50.3 | 45% | 0.448 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -70.7 | -25.2 | 178.5 | 56.6 | 0 | 0 | 0 | 0 | 113.8 | F57 M110 L111 E112 D116 | F57-T114 HydrophobicContact CD2-CG2 3.53Å; F57-T114 HydrophobicContact CE2-CG2 3.92Å; F57-T114 HydrophobicContact CG-CG2 4.45Å; M110-T114 VanDerWaalsContact O-CG2 3.29Å; M110-T114 WeakPolarHBondContact O-CG2 3.41Å; M110-T114 PolarHBondContact O-N 3.16Å; M110-T114 PolarHBondContact O-OG1 3Å; L111-T114 WeakPolarHBondContact CA-OG1 3.14Å; L111-T114 PolarHBondContact O-N 3.45Å; L111-T114 PolarHBondContact O-OG1 3.24Å; E112-T114 VanDerWaalsContact C-N 3.33Å; E112-T114 PolarHBondContact O-N 3.27Å; T114-D116 VanDerWaalsContact C-N 3.3Å |
| 115 | L | 92.2 | Very high | 93 | Very high | 69 Ų | 69 | 47.8 Ų | 47.8 | 36% | 0.361 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | 22.5 | 178.4 | -65.1 | 175.7 | 0 | 0 | 0 | 112.1 | L111 E112 V113 Y117 T118 L120 W121 | L111-L115 WeakPolarHBondContact O-CB 3.17Å; L111-L115 VanDerWaalsContact O-CG 3.31Å; L111-L115 WeakPolarHBondContact O-CG 3.39Å; L111-L115 PolarHBondContact O-N 2.89Å; E112-L115 CarbonylContact O-C 3.54Å; E112-L115 PolarHBondContact O-N 3.32Å; V113-L115 VanDerWaalsContact C-N 3.29Å; V113-L115 PolarHBondContact O-N 2.95Å; L115-Y117 VanDerWaalsContact C-N 3.28Å; L115-Y117 PolarHBondContact O-N 3.37Å; L115-T118 WeakPolarHBondContact O-CB 3.42Å; L115-T118 PolarHBondContact O-N 3.19Å; L115-T118 PolarHBondContact O-OG1 2.99Å; L115-L120 HydrophobicContact CD1-CD1 4.22Å; L115-W121 HydrophobicContact CD1-CH2 3.9Å; L115-W121 HydrophobicContact CD1-CZ2 4.09Å |
| 116 | D | 89.5 | Confident | 92.9 | Very high | 74 Ų | 74 | 47.6 Ų | 47.6 | 40% | 0.396 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 55.3 | 43.4 | 179.7 | -139.6 | 8.7 | 0 | 0 | 0 | 112.9 | R53 E112 V113 T114 T118 | R53-D116 IonicContact CZ-OD1 3.67Å; R53-D116 IonicContact NH1-OD1 3.87Å; R53-D116 PolarHBondContact NH1-OD1 3.45Å; R53-D116 IonicContact NH1-OD2 2.7Å; R53-D116 PolarHBondContact NH1-OD2 3.02Å; R53-D116 VanDerWaalsContact NH1-OD2 3.07Å; E112-D116 PolarHBondContact O-N 2.94Å; V113-D116 PolarHBondContact O-N 3Å; T114-D116 VanDerWaalsContact C-N 3.3Å; D116-T118 PolarHBondContact O-N 3.27Å; D116-T118 VanDerWaalsContact O-N 3.14Å |
| 117 | Y | 88.6 | Confident | 92.8 | Very high | 50 Ų | 50 | 52.4 Ų | 52.4 | 20% | 0.196 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 62.3 | 16.5 | -176.9 | -51.5 | -92.1 | 0 | 0 | 0 | 114.1 | K52 E112 V113 L115 W119 D303 | K52-Y117 VanDerWaalsContact CE-OH 3.32Å; K52-Y117 WeakPolarHBondContact CE-OH 3.13Å; E112-Y117 HydrophobicContact CG-CD1 4.28Å; E112-Y117 WeakPolarHBondContact O-CA 3.13Å; E112-Y117 PolarHBondContact O-N 2.98Å; V113-Y117 HydrophobicContact CG2-CE1 4.1Å; L115-Y117 VanDerWaalsContact C-N 3.28Å; L115-Y117 PolarHBondContact O-N 3.37Å; Y117-W119 PolarHBondContact O-N 3.24Å; Y117-D303 WeakPolarHBondContact CE1-OD2 3.44Å; Y117-D303 PolarHBondContact OH-OD2 3.5Å |
| 118 | T | 90.1 | Very high | 92.8 | Very high | 19 Ų | 19 | 55 Ų | 55 | 12% | 0.117 | 28% | 0.279 | C | S | . | . | trans | -76.3 | 119.3 | 175.3 | -55.2 | 0 | 0 | 0 | 0 | 110.7 | L115 D116 L120 P200 | L115-T118 WeakPolarHBondContact O-CB 3.42Å; L115-T118 PolarHBondContact O-N 3.19Å; L115-T118 PolarHBondContact O-OG1 2.99Å; D116-T118 PolarHBondContact O-N 3.27Å; D116-T118 VanDerWaalsContact O-N 3.14Å; T118-L120 HydrophobicContact CG2-CD2 3.73Å; T118-L120 HydrophobicContact CG2-CG 4.08Å; T118-P200 CarbonylContact C-O 3.6Å; T118-P200 WeakPolarHBondContact CA-O 3.31Å; T118-P200 HydrophobicContact CG2-CG 3.91Å | ||
| 119 | W | 92.6 | Very high | 92.8 | Very high | 3 Ų | 3 | 53.8 Ų | 53.8 | 1% | 0.011 | 27% | 0.272 | C | S | . | . | trans | -95.3 | 101.8 | -179 | -169 | -83.6 | 0 | 0 | 0 | 112.7 | V108 Y117 W121 G122 S125 C126 T129 L194 P200 C202 | V108-W119 HydrophobicContact CG1-CH2 3.59Å; V108-W119 HydrophobicContact CG1-CZ3 3.95Å; Y117-W119 PolarHBondContact O-N 3.24Å; W119-W121 AromaticContact CD2-CE3 3.47Å; W119-W121 HydrophobicContact CD2-CE3 3.47Å; W119-W121 VanDerWaalsContact CD2-CE3 3.47Å; W119-W121 AromaticContact CD2-CZ3 3.88Å; W119-W121 HydrophobicContact CD2-CZ3 3.88Å; W119-W121 AromaticContact CE2-CE3 3.54Å; W119-W121 AromaticContact CE3-CE3 3.69Å; W119-W121 HydrophobicContact CE3-CE3 3.69Å; W119-W121 AromaticContact CE3-CZ3 3.68Å; W119-W121 HydrophobicContact CE3-CZ3 3.68Å; W119-W121 AromaticContact CG-CE3 3.9Å; W119-W121 HydrophobicContact CG-CE3 3.9Å; W119-W121 HydrophobicContact CG-CZ3 4.33Å; W119-W121 HydrophobicContact CH2-CE3 4.05Å; W119-W121 HydrophobicContact CH2-CZ3 4.48Å; W119-W121 HydrophobicContact CZ2-CB 4.11Å; W119-W121 HydrophobicContact CZ2-CD2 4.4Å; W119-W121 AromaticContact CZ2-CE3 3.82Å; W119-W121 HydrophobicContact CZ2-CE3 3.82Å; W119-W121 AromaticContact CZ3-CE3 3.99Å; W119-W121 HydrophobicContact CZ3-CE3 3.99Å; W119-W121 HydrophobicContact CZ3-CZ3 4.01Å; W119-G122 PolarHBondContact NE1-O 3.3Å; W119-S125 WeakPolarHBondContact CZ2-O 3.48Å; W119-C126 HydrophobicContact CD2-CB 4.14Å; W119-C126 VanDerWaalsContact CE2-CA 3.41Å; W119-C126 HydrophobicContact CG-CB 4.3Å; W119-C126 HydrophobicContact CZ2-CB 4.17Å; W119-C126 VanDerWaalsContact CZ2-N 3.3Å; W119-T129 HydrophobicContact CH2-CG2 4.16Å; W119-L194 HydrophobicContact CB-CD1 3.82Å; W119-L194 HydrophobicContact CG-CD1 3.97Å; W119-P200 PolarHBondContact N-O 3.32Å; W119-P200 WeakPolarHBondContact O-CG 3.42Å; W119-C202 HydrophobicContact CB-CB 4.1Å; W119-C202 HydrophobicContact CD2-CB 3.91Å; W119-C202 HydrophobicContact CE3-CB 3.96Å; W119-C202 HydrophobicContact CG-CB 3.95Å | ||
| 120 | L | 91.8 | Very high | 92.8 | Very high | 114 Ų | 114 | 53.8 Ų | 53.8 | 60% | 0.597 | 27% | 0.273 | S | S | * | . | trans | -99.3 | -3.6 | -176 | -59.3 | 178.3 | 0 | 0 | 0 | 114.6 | L115 T118 G122 P200 | L115-L120 HydrophobicContact CD1-CD1 4.22Å; T118-L120 HydrophobicContact CG2-CD2 3.73Å; T118-L120 HydrophobicContact CG2-CG 4.08Å; L120-G122 VanDerWaalsContact C-N 3.31Å; L120-G122 PolarHBondContact O-N 2.86Å; L120-P200 HydrophobicContact CD2-CG 4.05Å | ||
| 121 | W | 91.2 | Very high | 92.8 | Very high | 88 Ų | 88 | 55.9 Ų | 55.9 | 33% | 0.333 | 28% | 0.281 | S | S | . | . | S | Bend | trans | -89.6 | 9.4 | -171.3 | -52.9 | -88.1 | 0 | 0 | 0 | 114.5 | L111 L115 W119 S125 | L111-W121 HydrophobicContact CB-CH2 3.79Å; L111-W121 HydrophobicContact CB-CZ2 3.63Å; L111-W121 HydrophobicContact CD1-CZ2 4Å; L111-W121 HydrophobicContact CG-CZ2 4.42Å; L115-W121 HydrophobicContact CD1-CH2 3.9Å; L115-W121 HydrophobicContact CD1-CZ2 4.09Å; W119-W121 AromaticContact CD2-CE3 3.47Å; W119-W121 HydrophobicContact CD2-CE3 3.47Å; W119-W121 VanDerWaalsContact CD2-CE3 3.47Å; W119-W121 AromaticContact CD2-CZ3 3.88Å; W119-W121 HydrophobicContact CD2-CZ3 3.88Å; W119-W121 AromaticContact CE2-CE3 3.54Å; W119-W121 AromaticContact CE3-CE3 3.69Å; W119-W121 HydrophobicContact CE3-CE3 3.69Å; W119-W121 AromaticContact CE3-CZ3 3.68Å; W119-W121 HydrophobicContact CE3-CZ3 3.68Å; W119-W121 AromaticContact CG-CE3 3.9Å; W119-W121 HydrophobicContact CG-CE3 3.9Å; W119-W121 HydrophobicContact CG-CZ3 4.33Å; W119-W121 HydrophobicContact CH2-CE3 4.05Å; W119-W121 HydrophobicContact CH2-CZ3 4.48Å; W119-W121 HydrophobicContact CZ2-CB 4.11Å; W119-W121 HydrophobicContact CZ2-CD2 4.4Å; W119-W121 AromaticContact CZ2-CE3 3.82Å; W119-W121 HydrophobicContact CZ2-CE3 3.82Å; W119-W121 AromaticContact CZ3-CE3 3.99Å; W119-W121 HydrophobicContact CZ3-CE3 3.99Å; W119-W121 HydrophobicContact CZ3-CZ3 4.01Å; W121-S125 WeakPolarHBondContact O-CB 2.9Å; W121-S125 PolarHBondContact O-OG 2.64Å |
| 122 | G | 92.4 | Very high | 93 | Very high | 31 Ų | 31 | 55.1 Ų | 55.1 | 32% | 0.32 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | 77.8 | 169.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | W119 L120 F124 S125 C126 | W119-G122 PolarHBondContact NE1-O 3.3Å; L120-G122 VanDerWaalsContact C-N 3.31Å; L120-G122 PolarHBondContact O-N 2.86Å; G122-F124 PolarHBondContact O-N 3.49Å; G122-S125 PolarHBondContact O-N 3.34Å; G122-C126 PolarHBondContact O-N 2.96Å; G122-C126 VanDerWaalsContact O-N 3.14Å |
| 123 | S | 92.1 | Very high | 93.2 | Very high | 50 Ų | 50 | 54.9 Ų | 54.9 | 35% | 0.35 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64.3 | -39 | -171.6 | -178.3 | 0 | 0 | 0 | 0 | 113.7 | C126 R127 | S123-C126 PolarHBondContact O-N 3.11Å; S123-R127 PolarHBondContact O-N 2.96Å |
| 124 | F | 93.4 | Very high | 93.3 | Very high | 158 Ų | 158 | 55.8 Ų | 55.8 | 69% | 0.693 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -60.2 | -49.6 | 176.4 | 173.1 | -97.7 | 0 | 0 | 0 | 111.4 | G122 C126 R127 F128 | G122-F124 PolarHBondContact O-N 3.49Å; F124-C126 VanDerWaalsContact C-N 3.32Å; F124-C126 PolarHBondContact O-N 3.44Å; F124-R127 PolarHBondContact O-N 3.06Å; F124-F128 HydrophobicContact CD1-CB 4.49Å; F124-F128 HydrophobicContact CE1-CB 4.1Å; F124-F128 HydrophobicContact CE1-CG 4.28Å; F124-F128 HydrophobicContact CZ-CB 4.14Å; F124-F128 HydrophobicContact CZ-CD2 4.25Å; F124-F128 HydrophobicContact CZ-CG 4.25Å; F124-F128 VanDerWaalsContact O-CB 3.26Å; F124-F128 WeakPolarHBondContact O-CB 3.11Å; F124-F128 PolarHBondContact O-N 3.5Å |
| 125 | S | 94.3 | Very high | 93.6 | Very high | 39 Ų | 39 | 53 Ų | 53 | 27% | 0.273 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.8 | -38 | -179.3 | -50.8 | 0 | 0 | 0 | 0 | 111.7 | W119 W121 G122 R127 F128 T129 | W119-S125 WeakPolarHBondContact CZ2-O 3.48Å; W121-S125 WeakPolarHBondContact O-CB 2.9Å; W121-S125 PolarHBondContact O-OG 2.64Å; G122-S125 PolarHBondContact O-N 3.34Å; S125-R127 PolarHBondContact O-N 3.34Å; S125-F128 PolarHBondContact O-N 3.25Å; S125-T129 WeakPolarHBondContact O-CB 3.3Å; S125-T129 PolarHBondContact O-N 3.13Å; S125-T129 PolarHBondContact O-OG1 3.35Å |
| 126 | C | 93.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -55.8 | -50.8 | 176.1 | 160.1 | 0 | 0 | 0 | 0 | 111.3 | W119 G122 S123 F124 H130 C202 | W119-C126 HydrophobicContact CD2-CB 4.14Å; W119-C126 VanDerWaalsContact CE2-CA 3.41Å; W119-C126 HydrophobicContact CG-CB 4.3Å; W119-C126 HydrophobicContact CZ2-CB 4.17Å; W119-C126 VanDerWaalsContact CZ2-N 3.3Å; G122-C126 PolarHBondContact O-N 2.96Å; G122-C126 VanDerWaalsContact O-N 3.14Å; S123-C126 PolarHBondContact O-N 3.11Å; F124-C126 VanDerWaalsContact C-N 3.32Å; F124-C126 PolarHBondContact O-N 3.44Å; C126-H130 PolarHBondContact O-N 3.22Å; C126-H130 PolarHBondContact O-ND1 3.08Å; C126-C202 VanDerWaalsContact CA-SG 3.53Å; C126-C202 HydrophobicContact CB-CB 3.9Å; C126-C202 WeakPolarHBondContact CB-SG 3.36Å; C126-C202 WeakPolarHBondContact SG-CB 3.38Å; C126-C202 CovalentContact SG-SG 2.03Å; C126-C202 PolarHBondContact SG-SG 2.95Å |
| 127 | R | 94.9 | Very high | 94.1 | Very high | 102 Ų | 102 | 46.7 Ų | 46.7 | 39% | 0.385 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -68.8 | -44.4 | 177.5 | -67.8 | 178.3 | -179.2 | 165.2 | 5.9 | 112.5 | S123 F124 S125 H130 Y131 V189 I192 | S123-R127 PolarHBondContact O-N 2.96Å; F124-R127 PolarHBondContact O-N 3.06Å; S125-R127 PolarHBondContact O-N 3.34Å; R127-H130 PolarHBondContact O-N 2.95Å; R127-Y131 VanDerWaalsContact O-CB 3.31Å; R127-Y131 WeakPolarHBondContact O-CB 3.25Å; R127-Y131 PolarHBondContact O-N 3.47Å; R127-V189 HydrophobicContact CB-CG1 4.03Å; R127-V189 WeakPolarHBondContact O-CG1 3.28Å; R127-I192 WeakPolarHBondContact CG-O 3.43Å; R127-I192 PolarHBondContact NE-O 2.9Å |
| 128 | F | 95.5 | Very high | 94.5 | Very high | 97 Ų | 97 | 44.3 Ų | 44.3 | 43% | 0.425 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -65 | -41.7 | -176.6 | 177 | -100 | 0 | 0 | 0 | 112 | F124 S125 Y131 F132 | F124-F128 HydrophobicContact CD1-CB 4.49Å; F124-F128 HydrophobicContact CE1-CB 4.1Å; F124-F128 HydrophobicContact CE1-CG 4.28Å; F124-F128 HydrophobicContact CZ-CB 4.14Å; F124-F128 HydrophobicContact CZ-CD2 4.25Å; F124-F128 HydrophobicContact CZ-CG 4.25Å; F124-F128 VanDerWaalsContact O-CB 3.26Å; F124-F128 WeakPolarHBondContact O-CB 3.11Å; F124-F128 PolarHBondContact O-N 3.5Å; S125-F128 PolarHBondContact O-N 3.25Å; F128-Y131 PolarHBondContact O-N 2.58Å; F128-F132 HydrophobicContact CE1-CB 4.37Å; F128-F132 HydrophobicContact CZ-CB 4.38Å; F128-F132 HydrophobicContact CZ-CD2 4.33Å; F128-F132 WeakPolarHBondContact O-CB 3.43Å; F128-F132 PolarHBondContact O-N 2.79Å |
| 129 | T | 95.4 | Very high | 94.9 | Very high | 15 Ų | 15 | 43.4 Ų | 43.4 | 9% | 0.092 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.1 | -46.5 | 178.7 | -62.5 | 0 | 0 | 0 | 0 | 111.3 | V108 W109 W119 S125 F132 Y133 | V108-T129 HydrophobicContact CB-CG2 4.26Å; V108-T129 HydrophobicContact CG1-CG2 3.9Å; W109-T129 HydrophobicContact CH2-CG2 4.39Å; W109-T129 HydrophobicContact CZ2-CG2 3.98Å; W119-T129 HydrophobicContact CH2-CG2 4.16Å; S125-T129 WeakPolarHBondContact O-CB 3.3Å; S125-T129 PolarHBondContact O-N 3.13Å; S125-T129 PolarHBondContact O-OG1 3.35Å; T129-F132 PolarHBondContact O-N 3.19Å; T129-Y133 WeakPolarHBondContact O-CB 3.5Å; T129-Y133 PolarHBondContact O-N 2.87Å |
| 130 | H | 94.3 | Very high | 95.1 | Very high | 27 Ų | 27 | 43.2 Ų | 43.2 | 13% | 0.125 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.3 | -45.5 | 174.9 | -79.9 | 81.5 | 0 | 0 | 0 | 111.8 | W109 C126 R127 F132 Y133 F134 I192 C202 | W109-H130 AromaticContact CH2-CD2 3.97Å; W109-H130 AromaticContact CH2-CE1 3.65Å; W109-H130 AromaticContact CH2-NE2 3.64Å; W109-H130 AromaticContact CZ3-CE1 3.91Å; C126-H130 PolarHBondContact O-N 3.22Å; C126-H130 PolarHBondContact O-ND1 3.08Å; R127-H130 PolarHBondContact O-N 2.95Å; H130-F132 PolarHBondContact O-N 3.22Å; H130-Y133 PolarHBondContact O-N 3.42Å; H130-F134 HydrophobicContact CB-CE2 4.43Å; H130-F134 WeakPolarHBondContact O-CD2 2.98Å; H130-F134 PolarHBondContact O-N 2.88Å; H130-I192 HydrophobicContact CB-CG1 4.45Å; H130-I192 HydrophobicContact CB-CG2 4.49Å; H130-C202 VanDerWaalsContact CE1-SG 3.54Å |
| 131 | Y | 96.8 | Very high | 95.3 | Very high | 62 Ų | 62 | 37.9 Ų | 37.9 | 24% | 0.243 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -57.4 | -51.4 | 175 | 178.2 | -107.3 | 0 | 0 | 0 | 112 | R127 F128 Y133 F134 V135 A182 P185 L186 V189 | R127-Y131 VanDerWaalsContact O-CB 3.31Å; R127-Y131 WeakPolarHBondContact O-CB 3.25Å; R127-Y131 PolarHBondContact O-N 3.47Å; F128-Y131 PolarHBondContact O-N 2.58Å; Y131-Y133 VanDerWaalsContact C-N 3.29Å; Y131-Y133 PolarHBondContact O-N 2.94Å; Y131-F134 PolarHBondContact O-N 3.34Å; Y131-V135 HydrophobicContact CD1-CG2 4.1Å; Y131-V135 HydrophobicContact CD2-CG2 3.94Å; Y131-V135 HydrophobicContact CE1-CG2 3.72Å; Y131-V135 HydrophobicContact CE2-CG2 3.52Å; Y131-V135 HydrophobicContact CG-CG2 4.2Å; Y131-V135 VanDerWaalsContact CZ-CG2 3.41Å; Y131-V135 VanDerWaalsContact O-CG2 3.25Å; Y131-V135 WeakPolarHBondContact O-CG2 3.45Å; Y131-V135 PolarHBondContact O-N 2.86Å; Y131-A182 WeakPolarHBondContact CE2-O 3.42Å; Y131-A182 PolarHBondContact OH-O 3.49Å; Y131-P185 HydrophobicContact CD2-CB 4.07Å; Y131-P185 HydrophobicContact CE2-CB 4.29Å; Y131-L186 HydrophobicContact CD2-CD2 4.25Å; Y131-L186 HydrophobicContact CE2-CD2 3.62Å; Y131-L186 HydrophobicContact CE2-CG 4.3Å; Y131-V189 HydrophobicContact CD2-CG2 4.3Å |
| 132 | F | 97.4 | Very high | 95.6 | Very high | 68 Ų | 68 | 34.7 Ų | 34.7 | 30% | 0.298 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -59.5 | -41.8 | -179.6 | -177 | -106.9 | 0 | 0 | 0 | 111.3 | G101 F128 T129 H130 N136 | G101-F132 WeakPolarHBondContact O-CE1 3.23Å; F128-F132 HydrophobicContact CE1-CB 4.37Å; F128-F132 HydrophobicContact CZ-CB 4.38Å; F128-F132 HydrophobicContact CZ-CD2 4.33Å; F128-F132 WeakPolarHBondContact O-CB 3.43Å; F128-F132 PolarHBondContact O-N 2.79Å; T129-F132 PolarHBondContact O-N 3.19Å; H130-F132 PolarHBondContact O-N 3.22Å; F132-N136 WeakPolarHBondContact CD2-ND2 3.16Å; F132-N136 VanDerWaalsContact CE2-ND2 3.3Å; F132-N136 WeakPolarHBondContact CE2-ND2 3.23Å; F132-N136 WeakPolarHBondContact CZ-ND2 3.18Å; F132-N136 PolarHBondContact O-N 3.38Å; F132-N136 PolarHBondContact O-ND2 3.39Å |
| 133 | Y | 95.7 | Very high | 95.8 | Very high | 9 Ų | 9 | 33.2 Ų | 33.2 | 4% | 0.035 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -58.1 | -56.9 | 173.1 | 174.8 | -109.1 | 0 | 0 | 0 | 111.6 | I102 W109 T129 H130 Y131 V135 N136 M137 D306 S309 M310 | I102-Y133 HydrophobicContact CG2-CD2 4.23Å; I102-Y133 HydrophobicContact CG2-CE2 3.98Å; W109-Y133 HydrophobicContact CZ2-CG 4.23Å; T129-Y133 WeakPolarHBondContact O-CB 3.5Å; T129-Y133 PolarHBondContact O-N 2.87Å; H130-Y133 PolarHBondContact O-N 3.42Å; Y131-Y133 VanDerWaalsContact C-N 3.29Å; Y131-Y133 PolarHBondContact O-N 2.94Å; Y133-V135 PolarHBondContact O-N 3.45Å; Y133-N136 PolarHBondContact O-N 3.48Å; Y133-M137 HydrophobicContact CE1-SD 4.31Å; Y133-M137 VanDerWaalsContact O-CB 3.28Å; Y133-M137 WeakPolarHBondContact O-CB 3.36Å; Y133-M137 PolarHBondContact O-N 3.16Å; Y133-D306 PolarHBondContact OH-OD1 3.31Å; Y133-S309 PolarHBondContact OH-OG 3.3Å; Y133-M310 HydrophobicContact CD2-CE 4.33Å; Y133-M310 HydrophobicContact CE2-CE 3.55Å; Y133-M310 HydrophobicContact CE2-CG 4.29Å |
| 134 | F | 95.4 | Very high | 95.8 | Very high | 23 Ų | 23 | 31.2 Ų | 31.2 | 10% | 0.101 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.9 | -39.1 | -177.1 | -72.7 | -57.2 | 0 | 0 | 0 | 113.7 | H130 Y131 N136 M137 Y138 P185 V189 | H130-F134 HydrophobicContact CB-CE2 4.43Å; H130-F134 WeakPolarHBondContact O-CD2 2.98Å; H130-F134 PolarHBondContact O-N 2.88Å; Y131-F134 PolarHBondContact O-N 3.34Å; F134-N136 VanDerWaalsContact C-N 3.34Å; F134-N136 PolarHBondContact O-N 2.75Å; F134-M137 HydrophobicContact CD1-CE 3.93Å; F134-M137 HydrophobicContact CD1-SD 4.13Å; F134-M137 WeakPolarHBondContact O-CB 3.29Å; F134-M137 PolarHBondContact O-N 3.1Å; F134-Y138 HydrophobicContact CB-CD2 4.48Å; F134-Y138 HydrophobicContact CB-CE2 4.35Å; F134-Y138 WeakPolarHBondContact O-CD2 3.25Å; F134-Y138 PolarHBondContact O-N 3.21Å; F134-P185 HydrophobicContact CB-CB 3.64Å; F134-P185 HydrophobicContact CB-CG 3.68Å; F134-P185 HydrophobicContact CG-CB 4.5Å; F134-V189 HydrophobicContact CD2-CG2 4.1Å |
| 135 | V | 97.7 | Very high | 95.9 | Very high | 15 Ų | 15 | 24.5 Ų | 24.5 | 9% | 0.091 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -59.7 | -47.1 | 177 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | Y131 Y133 S139 S181 P185 | Y131-V135 HydrophobicContact CD1-CG2 4.1Å; Y131-V135 HydrophobicContact CD2-CG2 3.94Å; Y131-V135 HydrophobicContact CE1-CG2 3.72Å; Y131-V135 HydrophobicContact CE2-CG2 3.52Å; Y131-V135 HydrophobicContact CG-CG2 4.2Å; Y131-V135 VanDerWaalsContact CZ-CG2 3.41Å; Y131-V135 VanDerWaalsContact O-CG2 3.25Å; Y131-V135 WeakPolarHBondContact O-CG2 3.45Å; Y131-V135 PolarHBondContact O-N 2.86Å; Y133-V135 PolarHBondContact O-N 3.45Å; V135-S139 VanDerWaalsContact O-CB 3.27Å; V135-S139 WeakPolarHBondContact O-CB 3.38Å; V135-S139 PolarHBondContact O-N 3.5Å; V135-S139 PolarHBondContact O-OG 3.12Å; V135-S181 WeakPolarHBondContact CG2-O 3.2Å; V135-P185 HydrophobicContact CG2-CG 3.94Å |
| 136 | N | 97.8 | Very high | 95.9 | Very high | 10 Ų | 10 | 23.5 Ų | 23.5 | 5% | 0.053 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -71 | -37.4 | -180 | -74.4 | -68.2 | 0 | 0 | 0 | 111.7 | A98 I102 F132 Y133 F134 S139 S140 | A98-N136 WeakPolarHBondContact O-CB 3.37Å; A98-N136 PolarHBondContact O-OD1 3.25Å; I102-N136 HydrophobicContact CG1-CB 3.74Å; F132-N136 WeakPolarHBondContact CD2-ND2 3.16Å; F132-N136 VanDerWaalsContact CE2-ND2 3.3Å; F132-N136 WeakPolarHBondContact CE2-ND2 3.23Å; F132-N136 WeakPolarHBondContact CZ-ND2 3.18Å; F132-N136 PolarHBondContact O-N 3.38Å; F132-N136 PolarHBondContact O-ND2 3.39Å; Y133-N136 PolarHBondContact O-N 3.48Å; F134-N136 VanDerWaalsContact C-N 3.34Å; F134-N136 PolarHBondContact O-N 2.75Å; N136-S139 PolarHBondContact O-N 3.11Å; N136-S140 PolarHBondContact O-N 3.34Å |
| 137 | M | 96 | Very high | 95.8 | Very high | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -54.9 | -58.4 | 173.1 | -169.1 | -161.5 | 72.4 | 0 | 0 | 111.6 | Y133 F134 S139 S140 I141 W271 | Y133-M137 HydrophobicContact CE1-SD 4.31Å; Y133-M137 VanDerWaalsContact O-CB 3.28Å; Y133-M137 WeakPolarHBondContact O-CB 3.36Å; Y133-M137 PolarHBondContact O-N 3.16Å; F134-M137 HydrophobicContact CD1-CE 3.93Å; F134-M137 HydrophobicContact CD1-SD 4.13Å; F134-M137 WeakPolarHBondContact O-CB 3.29Å; F134-M137 PolarHBondContact O-N 3.1Å; M137-S139 VanDerWaalsContact C-N 3.3Å; M137-S139 PolarHBondContact O-N 2.86Å; M137-S140 PolarHBondContact O-N 3.06Å; M137-I141 HydrophobicContact CG-CD1 4.34Å; M137-I141 WeakPolarHBondContact O-CG1 3.32Å; M137-I141 PolarHBondContact O-N 2.78Å; M137-I141 VanDerWaalsContact O-N 3.16Å; M137-W271 HydrophobicContact CG-CH2 3.41Å; M137-W271 VanDerWaalsContact CG-CH2 3.41Å; M137-W271 HydrophobicContact CG-CZ2 4.39Å; M137-W271 HydrophobicContact CG-CZ3 4.07Å; M137-W271 HydrophobicContact SD-CH2 3.85Å; M137-W271 HydrophobicContact SD-CZ3 3.86Å |
| 138 | Y | 97.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -62.6 | -38.4 | 178.2 | -72.2 | -57.5 | 0 | 0 | 0 | 112.2 | F134 I141 F142 I184 P185 E188 T222 L225 | F134-Y138 HydrophobicContact CB-CD2 4.48Å; F134-Y138 HydrophobicContact CB-CE2 4.35Å; F134-Y138 WeakPolarHBondContact O-CD2 3.25Å; F134-Y138 PolarHBondContact O-N 3.21Å; Y138-I141 PolarHBondContact O-N 3.46Å; Y138-F142 HydrophobicContact CD1-CZ 4.22Å; Y138-F142 WeakPolarHBondContact O-CB 3.5Å; Y138-F142 WeakPolarHBondContact O-CD2 3.46Å; Y138-F142 WeakPolarHBondContact O-CG 3.47Å; Y138-F142 PolarHBondContact O-N 2.93Å; Y138-I184 HydrophobicContact CD2-CB 4.37Å; Y138-I184 HydrophobicContact CD2-CG2 3.89Å; Y138-I184 HydrophobicContact CE1-CG2 4.28Å; Y138-I184 HydrophobicContact CE2-CB 4.37Å; Y138-I184 HydrophobicContact CE2-CG2 3.47Å; Y138-I184 VanDerWaalsContact CE2-CG2 3.47Å; Y138-I184 HydrophobicContact CG-CG2 4.45Å; Y138-P185 HydrophobicContact CD2-CG 3.72Å; Y138-P185 HydrophobicContact CE2-CG 3.9Å; Y138-E188 WeakPolarHBondContact CE2-OE1 3.27Å; Y138-E188 PolarHBondContact OH-OE1 2.89Å; Y138-E188 PolarHBondContact OH-OE2 3.38Å; Y138-T222 WeakPolarHBondContact OH-CA 3.36Å; Y138-L225 HydrophobicContact CD1-CB 4.46Å; Y138-L225 HydrophobicContact CE1-CB 3.88Å |
| 139 | S | 97.9 | Very high | 95.5 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -59 | -49.3 | 176.9 | -63 | 0 | 0 | 0 | 0 | 111 | V135 N136 M137 I141 F142 F143 W178 S181 | V135-S139 VanDerWaalsContact O-CB 3.27Å; V135-S139 WeakPolarHBondContact O-CB 3.38Å; V135-S139 PolarHBondContact O-N 3.5Å; V135-S139 PolarHBondContact O-OG 3.12Å; N136-S139 PolarHBondContact O-N 3.11Å; M137-S139 VanDerWaalsContact C-N 3.3Å; M137-S139 PolarHBondContact O-N 2.86Å; S139-I141 PolarHBondContact O-N 3.42Å; S139-F142 PolarHBondContact O-N 2.87Å; S139-F143 WeakPolarHBondContact O-CB 3.31Å; S139-F143 WeakPolarHBondContact O-CD2 3.29Å; S139-F143 WeakPolarHBondContact O-CG 3.34Å; S139-F143 PolarHBondContact O-N 3.31Å; S139-W178 WeakPolarHBondContact OG-CZ3 3.47Å; S139-S181 WeakPolarHBondContact CA-OG 3.33Å; S139-S181 PolarHBondContact N-OG 2.99Å; S139-S181 WeakPolarHBondContact OG-CB 3.45Å; S139-S181 PolarHBondContact OG-OG 3.25Å |
| 140 | S | 96.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -58.7 | -47.5 | 179.5 | -174 | 0 | 0 | 0 | 0 | 111.9 | D99 N136 M137 F142 F143 L144 H312 | D99-S140 VanDerWaalsContact OD1-CB 3.31Å; D99-S140 WeakPolarHBondContact OD1-CB 3.5Å; D99-S140 PolarHBondContact OD1-OG 3.33Å; N136-S140 PolarHBondContact O-N 3.34Å; M137-S140 PolarHBondContact O-N 3.06Å; S140-F142 PolarHBondContact O-N 3.46Å; S140-F143 PolarHBondContact O-N 3.31Å; S140-L144 WeakPolarHBondContact O-CB 3.4Å; S140-L144 PolarHBondContact O-N 2.95Å; S140-H312 PolarHBondContact OG-NE2 2.83Å |
| 141 | I | 96.2 | Very high | 94.8 | Very high | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.005 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -60.2 | -48.2 | 178.1 | -63 | 168.3 | 0 | 0 | 0 | 111.4 | M137 Y138 S139 F143 L144 V145 P230 F267 W271 | M137-I141 HydrophobicContact CG-CD1 4.34Å; M137-I141 WeakPolarHBondContact O-CG1 3.32Å; M137-I141 PolarHBondContact O-N 2.78Å; M137-I141 VanDerWaalsContact O-N 3.16Å; Y138-I141 PolarHBondContact O-N 3.46Å; S139-I141 PolarHBondContact O-N 3.42Å; I141-F143 PolarHBondContact O-N 3.06Å; I141-L144 WeakPolarHBondContact O-CB 3.38Å; I141-L144 PolarHBondContact O-N 3.23Å; I141-V145 WeakPolarHBondContact O-CG2 3.4Å; I141-V145 PolarHBondContact O-N 3.34Å; I141-P230 HydrophobicContact CG2-CB 3.56Å; I141-P230 HydrophobicContact CG2-CG 3.36Å; I141-F267 HydrophobicContact CG2-CE2 4.35Å; I141-F267 HydrophobicContact CG2-CZ 4.45Å; I141-W271 HydrophobicContact CD1-CD2 4.5Å; I141-W271 HydrophobicContact CD1-CE3 4.41Å; I141-W271 HydrophobicContact CD1-CH2 3.56Å; I141-W271 HydrophobicContact CD1-CZ2 3.56Å; I141-W271 HydrophobicContact CD1-CZ3 3.96Å; I141-W271 HydrophobicContact CG1-CH2 4.11Å; I141-W271 HydrophobicContact CG1-CZ2 3.61Å |
| 142 | F | 97.3 | Very high | 94.4 | Very high | 22 Ų | 22 | 17.1 Ų | 17.1 | 10% | 0.096 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -69.5 | -34.7 | -178.4 | -63.6 | -21.6 | 0 | 0 | 0 | 112.7 | Y138 S139 S140 L144 V145 C146 I177 L180 S181 I184 | Y138-F142 HydrophobicContact CD1-CZ 4.22Å; Y138-F142 WeakPolarHBondContact O-CB 3.5Å; Y138-F142 WeakPolarHBondContact O-CD2 3.46Å; Y138-F142 WeakPolarHBondContact O-CG 3.47Å; Y138-F142 PolarHBondContact O-N 2.93Å; S139-F142 PolarHBondContact O-N 2.87Å; S140-F142 PolarHBondContact O-N 3.46Å; F142-L144 VanDerWaalsContact C-N 3.31Å; F142-V145 PolarHBondContact O-N 2.82Å; F142-C146 WeakPolarHBondContact O-CB 3.42Å; F142-C146 PolarHBondContact O-N 3.17Å; F142-C146 PolarHBondContact O-SG 3.04Å; F142-I177 HydrophobicContact CB-CG1 4.26Å; F142-I177 HydrophobicContact CB-CG2 3.81Å; F142-I177 HydrophobicContact CD2-CG2 4.41Å; F142-L180 HydrophobicContact CD2-CD2 4.32Å; F142-L180 HydrophobicContact CE2-CD2 4Å; F142-L180 HydrophobicContact CE2-CG 4.21Å; F142-S181 WeakPolarHBondContact CD2-OG 3.43Å; F142-I184 HydrophobicContact CE2-CD1 3.66Å; F142-I184 HydrophobicContact CZ-CD1 3.82Å |
| 143 | F | 95.8 | Very high | 94 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -64.6 | -37.1 | 171.3 | -77.2 | -56.1 | 0 | 0 | 0 | 112.1 | Y91 N94 M95 S139 S140 I141 C146 L147 C174 I177 W178 | Y91-F143 AromaticContact CD1-CD1 3.91Å; Y91-F143 HydrophobicContact CD1-CD1 3.91Å; Y91-F143 HydrophobicContact CD1-CE1 4.3Å; N94-F143 HydrophobicContact CB-CD1 3.98Å; N94-F143 HydrophobicContact CB-CD2 3.94Å; N94-F143 HydrophobicContact CB-CE1 3.52Å; N94-F143 HydrophobicContact CB-CE2 3.53Å; N94-F143 HydrophobicContact CB-CG 4.2Å; N94-F143 HydrophobicContact CB-CZ 3.31Å; M95-F143 HydrophobicContact CB-CB 3.81Å; M95-F143 HydrophobicContact CB-CG 4.44Å; M95-F143 HydrophobicContact CG-CB 4.31Å; S139-F143 WeakPolarHBondContact O-CB 3.31Å; S139-F143 WeakPolarHBondContact O-CD2 3.29Å; S139-F143 WeakPolarHBondContact O-CG 3.34Å; S139-F143 PolarHBondContact O-N 3.31Å; S140-F143 PolarHBondContact O-N 3.31Å; I141-F143 PolarHBondContact O-N 3.06Å; F143-C146 PolarHBondContact O-N 3.48Å; F143-L147 VanDerWaalsContact O-CB 3.23Å; F143-L147 WeakPolarHBondContact O-CB 3.39Å; F143-L147 PolarHBondContact O-N 2.93Å; F143-C174 HydrophobicContact CE1-CB 3.97Å; F143-C174 HydrophobicContact CZ-CB 4.37Å; F143-I177 HydrophobicContact CD1-CD1 3.61Å; F143-I177 HydrophobicContact CD1-CG2 4.33Å; F143-I177 HydrophobicContact CD2-CG2 4.07Å; F143-I177 HydrophobicContact CE1-CB 4.07Å; F143-I177 HydrophobicContact CE1-CD1 3.55Å; F143-I177 HydrophobicContact CE1-CG1 4.44Å; F143-I177 HydrophobicContact CE1-CG2 4.01Å; F143-I177 HydrophobicContact CE2-CB 4.46Å; F143-I177 HydrophobicContact CE2-CG2 3.67Å; F143-I177 HydrophobicContact CG-CD1 4.39Å; F143-I177 HydrophobicContact CG-CG2 4.34Å; F143-I177 HydrophobicContact CZ-CB 3.91Å; F143-I177 HydrophobicContact CZ-CD1 4.27Å; F143-I177 HydrophobicContact CZ-CG2 3.62Å; F143-W178 HydrophobicContact CE2-CD2 4.42Å; F143-W178 AromaticContact CE2-CE2 3.88Å; F143-W178 HydrophobicContact CE2-CZ2 4.09Å; F143-W178 AromaticContact CE2-NE1 3.9Å; F143-W178 AromaticContact CZ-CD1 3.93Å; F143-W178 AromaticContact CZ-NE1 3.65Å |
| 144 | L | 93.5 | Very high | 93.4 | Very high | 8 Ų | 8 | 18 Ų | 18 | 4% | 0.042 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -64.5 | -43.2 | 175.1 | 178.6 | 54.8 | 0 | 0 | 0 | 112.6 | M95 S140 I141 F142 L147 S148 I234 F267 Y320 | M95-L144 HydrophobicContact SD-CB 4.31Å; S140-L144 WeakPolarHBondContact O-CB 3.4Å; S140-L144 PolarHBondContact O-N 2.95Å; I141-L144 WeakPolarHBondContact O-CB 3.38Å; I141-L144 PolarHBondContact O-N 3.23Å; F142-L144 VanDerWaalsContact C-N 3.31Å; L144-L147 PolarHBondContact O-N 3.02Å; L144-S148 PolarHBondContact O-N 3.4Å; L144-S148 PolarHBondContact O-OG 3.24Å; L144-I234 HydrophobicContact CD2-CD1 3.83Å; L144-I234 HydrophobicContact CG-CD1 3.79Å; L144-I234 HydrophobicContact CG-CG1 4.35Å; L144-F267 HydrophobicContact CD2-CD2 3.76Å; L144-F267 HydrophobicContact CD2-CE2 4.27Å; L144-Y320 WeakPolarHBondContact CD1-OH 2.92Å |
| 145 | V | 95.6 | Very high | 92.8 | Very high | 16 Ų | 16 | 21.3 Ų | 21.3 | 10% | 0.097 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -59.3 | -51.8 | 172.9 | 173.5 | 0 | 0 | 0 | 0 | 110.1 | I141 F142 L147 S148 V149 P230 L233 I234 | I141-V145 WeakPolarHBondContact O-CG2 3.4Å; I141-V145 PolarHBondContact O-N 3.34Å; F142-V145 PolarHBondContact O-N 2.82Å; V145-L147 VanDerWaalsContact C-N 3.31Å; V145-L147 PolarHBondContact O-N 3.47Å; V145-S148 WeakPolarHBondContact O-CB 3.46Å; V145-S148 PolarHBondContact O-N 3.48Å; V145-S148 VanDerWaalsContact O-N 3.08Å; V145-V149 WeakPolarHBondContact O-CG2 3.35Å; V145-V149 PolarHBondContact O-N 2.91Å; V145-P230 HydrophobicContact CG2-CB 3.69Å; V145-P230 HydrophobicContact CG2-CG 4.47Å; V145-L233 HydrophobicContact CG1-CB 3.94Å; V145-L233 HydrophobicContact CG1-CD1 3.79Å; V145-I234 HydrophobicContact CG2-CD1 4.01Å; V145-I234 HydrophobicContact CG2-CG1 3.89Å |
| 146 | C | 94.3 | Very high | 92.2 | Very high | 19 Ų | 19 | 24 Ų | 24 | 13% | 0.128 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.6 | -37.7 | -179 | -71.4 | 0 | 0 | 0 | 0 | 112.6 | Y91 F142 F143 S148 V149 D150 I177 | Y91-C146 HydrophobicContact CD1-CB 4.09Å; Y91-C146 HydrophobicContact CE1-CB 3.88Å; Y91-C146 HydrophobicContact CE2-CB 4.45Å; Y91-C146 HydrophobicContact CG-CB 4.45Å; F142-C146 WeakPolarHBondContact O-CB 3.42Å; F142-C146 PolarHBondContact O-N 3.17Å; F142-C146 PolarHBondContact O-SG 3.04Å; F143-C146 PolarHBondContact O-N 3.48Å; C146-S148 VanDerWaalsContact C-N 3.33Å; C146-S148 PolarHBondContact O-N 3.22Å; C146-V149 PolarHBondContact O-N 2.91Å; C146-D150 WeakPolarHBondContact O-CB 3.35Å; C146-D150 PolarHBondContact O-N 2.88Å; C146-I177 HydrophobicContact CB-CD1 4.23Å; C146-I177 VanDerWaalsContact SG-CD1 3.59Å |
| 147 | L | 90.9 | Very high | 91.3 | Very high | 2 Ų | 2 | 24.9 Ų | 24.9 | 1% | 0.01 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -61.9 | -41.5 | 173.7 | 178.9 | 63.2 | 0 | 0 | 0 | 111.6 | I92 M95 F143 L144 V145 D150 R151 Y320 | I92-L147 HydrophobicContact CD1-CD1 4.44Å; I92-L147 HydrophobicContact CG1-CD1 3.97Å; I92-L147 HydrophobicContact CG1-CD2 4Å; M95-L147 HydrophobicContact CE-CD2 4.32Å; F143-L147 VanDerWaalsContact O-CB 3.23Å; F143-L147 WeakPolarHBondContact O-CB 3.39Å; F143-L147 PolarHBondContact O-N 2.93Å; L144-L147 PolarHBondContact O-N 3.02Å; V145-L147 VanDerWaalsContact C-N 3.31Å; V145-L147 PolarHBondContact O-N 3.47Å; L147-D150 PolarHBondContact O-N 3.47Å; L147-R151 VanDerWaalsContact O-CG 3.25Å; L147-R151 WeakPolarHBondContact O-CG 3.42Å; L147-R151 PolarHBondContact O-N 3.18Å; L147-R151 VanDerWaalsContact O-N 3.08Å; L147-Y320 HydrophobicContact CD2-CD1 3.98Å; L147-Y320 HydrophobicContact CD2-CE1 3.59Å |
| 148 | S | 91.4 | Very high | 89.8 | Confident | 3 Ų | 3 | 29.6 Ų | 29.6 | 2% | 0.021 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.4 | -44.5 | 178.2 | -59.2 | 0 | 0 | 0 | 0 | 111.5 | L144 V145 C146 Y152 N238 | L144-S148 PolarHBondContact O-N 3.4Å; L144-S148 PolarHBondContact O-OG 3.24Å; V145-S148 WeakPolarHBondContact O-CB 3.46Å; V145-S148 PolarHBondContact O-N 3.48Å; V145-S148 VanDerWaalsContact O-N 3.08Å; C146-S148 VanDerWaalsContact C-N 3.33Å; C146-S148 PolarHBondContact O-N 3.22Å; S148-Y152 PolarHBondContact O-N 3.38Å; S148-N238 WeakPolarHBondContact CB-ND2 3.25Å; S148-N238 PolarHBondContact OG-ND2 3.33Å |
| 149 | V | 92.5 | Very high | 88.8 | Confident | 44 Ų | 44 | 32.2 Ų | 32.2 | 27% | 0.267 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -63.2 | -48.9 | 175.2 | 178 | 0 | 0 | 0 | 0 | 111.1 | V145 C146 R151 Y152 V153 F237 | V145-V149 WeakPolarHBondContact O-CG2 3.35Å; V145-V149 PolarHBondContact O-N 2.91Å; C146-V149 PolarHBondContact O-N 2.91Å; V149-R151 VanDerWaalsContact C-N 3.3Å; V149-R151 PolarHBondContact O-N 3.01Å; V149-Y152 WeakPolarHBondContact O-CB 3.41Å; V149-Y152 PolarHBondContact O-N 3.48Å; V149-Y152 VanDerWaalsContact O-N 3.12Å; V149-V153 HydrophobicContact CG1-CG2 4.09Å; V149-V153 WeakPolarHBondContact O-CG2 3.49Å; V149-V153 PolarHBondContact O-N 3.13Å; V149-F237 HydrophobicContact CB-CD2 4.47Å; V149-F237 HydrophobicContact CB-CG 4.47Å; V149-F237 HydrophobicContact CG1-CE1 4.21Å; V149-F237 HydrophobicContact CG1-CZ 4.25Å; V149-F237 HydrophobicContact CG2-CD1 4.37Å; V149-F237 HydrophobicContact CG2-CD2 3.53Å; V149-F237 HydrophobicContact CG2-CE1 4.36Å; V149-F237 HydrophobicContact CG2-CE2 3.57Å; V149-F237 HydrophobicContact CG2-CG 3.98Å; V149-F237 HydrophobicContact CG2-CZ 3.99Å |
| 150 | D | 88.3 | Confident | 87.5 | Confident | 20 Ų | 20 | 37 Ų | 37 | 11% | 0.107 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.6 | -38.2 | -175.7 | -177.1 | 82 | 0 | 0 | 0 | 112.6 | Y91 C146 L147 Y152 V153 T154 R170 | Y91-D150 HydrophobicContact CD2-CB 3.96Å; Y91-D150 HydrophobicContact CE2-CB 3.59Å; C146-D150 WeakPolarHBondContact O-CB 3.35Å; C146-D150 PolarHBondContact O-N 2.88Å; L147-D150 PolarHBondContact O-N 3.47Å; D150-Y152 PolarHBondContact O-N 2.94Å; D150-V153 PolarHBondContact O-N 3.31Å; D150-T154 VanDerWaalsContact O-CB 3.23Å; D150-T154 WeakPolarHBondContact O-CB 3.41Å; D150-T154 PolarHBondContact O-N 3.35Å; D150-T154 PolarHBondContact O-OG1 2.77Å; D150-R170 VanDerWaalsContact CG-NH2 3.27Å; D150-R170 IonicContact OD1-CZ 3.26Å; D150-R170 VanDerWaalsContact OD1-CZ 3.26Å; D150-R170 IonicContact OD1-NE 2.75Å; D150-R170 PolarHBondContact OD1-NE 2.85Å; D150-R170 IonicContact OD1-NH2 2.9Å; D150-R170 PolarHBondContact OD1-NH2 3.42Å; D150-R170 IonicContact OD2-CZ 3.88Å; D150-R170 IonicContact OD2-NE 2.74Å; D150-R170 IonicContact OD2-NH2 3.07Å; D150-R170 PolarHBondContact OD2-NH2 3.19Å |
| 151 | R | 87 | Confident | 86.4 | Confident | 54 Ų | 54 | 41.3 Ų | 41.3 | 20% | 0.204 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -57.4 | -49.1 | 173.5 | -77.4 | 171.5 | 176.8 | -151.9 | -4.7 | 111.2 | L147 V149 L155 Y263 Y320 | L147-R151 VanDerWaalsContact O-CG 3.25Å; L147-R151 WeakPolarHBondContact O-CG 3.42Å; L147-R151 PolarHBondContact O-N 3.18Å; L147-R151 VanDerWaalsContact O-N 3.08Å; V149-R151 VanDerWaalsContact C-N 3.3Å; V149-R151 PolarHBondContact O-N 3.01Å; R151-L155 VanDerWaalsContact O-CD1 3.28Å; R151-L155 WeakPolarHBondContact O-CD1 3.45Å; R151-L155 VanDerWaalsContact O-CG 3.25Å; R151-L155 WeakPolarHBondContact O-CG 3.3Å; R151-L155 PolarHBondContact O-N 3.44Å; R151-Y263 PolarHBondContact NH1-OH 3.29Å; R151-Y320 VanDerWaalsContact NH2-CD1 3.35Å |
| 152 | Y | 88.3 | Confident | 85.4 | Confident | 46 Ų | 46 | 46.2 Ų | 46.2 | 18% | 0.18 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -63.2 | -49.8 | 177.9 | 178.4 | -105 | 0 | 0 | 0 | 112 | S148 V149 D150 T154 L155 T156 F237 L240 R244 | S148-Y152 PolarHBondContact O-N 3.38Å; V149-Y152 WeakPolarHBondContact O-CB 3.41Å; V149-Y152 PolarHBondContact O-N 3.48Å; V149-Y152 VanDerWaalsContact O-N 3.12Å; D150-Y152 PolarHBondContact O-N 2.94Å; Y152-T154 VanDerWaalsContact C-N 3.34Å; Y152-T154 PolarHBondContact O-N 3.49Å; Y152-L155 WeakPolarHBondContact O-CB 3.5Å; Y152-L155 PolarHBondContact O-N 2.88Å; Y152-T156 HydrophobicContact CE1-CG2 4.21Å; Y152-T156 HydrophobicContact CE2-CG2 4.06Å; Y152-T156 PolarHBondContact O-N 3.48Å; Y152-T156 PolarHBondContact O-OG1 3.24Å; Y152-F237 AromaticContact CD1-CD1 3.91Å; Y152-F237 HydrophobicContact CD1-CD1 3.91Å; Y152-F237 AromaticContact CD1-CE1 3.94Å; Y152-F237 HydrophobicContact CD1-CE1 3.94Å; Y152-F237 HydrophobicContact CG-CD1 4.03Å; Y152-L240 HydrophobicContact CD2-CB 3.71Å; Y152-L240 HydrophobicContact CE2-CB 3.66Å; Y152-L240 HydrophobicContact CE2-CD1 4.33Å; Y152-L240 HydrophobicContact CG-CB 4.49Å; Y152-R244 HydrophobicContact CE2-CG 4.22Å |
| 153 | V | 88 | Confident | 84.1 | Confident | 45 Ų | 45 | 49.8 Ų | 49.8 | 27% | 0.273 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61 | -43.8 | -178.2 | 175 | 0 | 0 | 0 | 0 | 111.1 | V149 D150 L155 T156 S157 | V149-V153 HydrophobicContact CG1-CG2 4.09Å; V149-V153 WeakPolarHBondContact O-CG2 3.49Å; V149-V153 PolarHBondContact O-N 3.13Å; D150-V153 PolarHBondContact O-N 3.31Å; V153-L155 VanDerWaalsContact C-N 3.3Å; V153-L155 PolarHBondContact O-N 3.47Å; V153-T156 PolarHBondContact O-N 2.93Å; V153-T156 VanDerWaalsContact O-N 3.16Å; V153-T156 PolarHBondContact O-OG1 3.36Å; V153-S157 WeakPolarHBondContact O-CB 3.49Å; V153-S157 PolarHBondContact O-N 3.03Å; V153-S157 VanDerWaalsContact O-N 3.11Å; V153-S157 PolarHBondContact O-OG 3.12Å |
| 154 | T | 84.3 | Confident | 83.1 | Confident | 51 Ų | 51 | 55.5 Ų | 55.5 | 31% | 0.313 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -61.5 | -37.7 | 178.7 | -58.5 | 0 | 0 | 0 | 0 | 112 | D150 Y152 T156 S157 R170 | D150-T154 VanDerWaalsContact O-CB 3.23Å; D150-T154 WeakPolarHBondContact O-CB 3.41Å; D150-T154 PolarHBondContact O-N 3.35Å; D150-T154 PolarHBondContact O-OG1 2.77Å; Y152-T154 VanDerWaalsContact C-N 3.34Å; Y152-T154 PolarHBondContact O-N 3.49Å; T154-T156 VanDerWaalsContact C-N 3.32Å; T154-T156 PolarHBondContact O-N 2.9Å; T154-S157 PolarHBondContact O-N 3.39Å; T154-R170 PolarHBondContact OG1-NH2 3.44Å |
| 155 | L | 82.9 | Confident | 82.4 | Confident | 91 Ų | 91 | 60.8 Ų | 60.8 | 48% | 0.476 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -67.4 | -32.8 | 176.8 | -71.9 | 160.1 | 0 | 0 | 0 | 113.1 | R151 Y152 V153 T241 L245 | R151-L155 VanDerWaalsContact O-CD1 3.28Å; R151-L155 WeakPolarHBondContact O-CD1 3.45Å; R151-L155 VanDerWaalsContact O-CG 3.25Å; R151-L155 WeakPolarHBondContact O-CG 3.3Å; R151-L155 PolarHBondContact O-N 3.44Å; Y152-L155 WeakPolarHBondContact O-CB 3.5Å; Y152-L155 PolarHBondContact O-N 2.88Å; V153-L155 VanDerWaalsContact C-N 3.3Å; V153-L155 PolarHBondContact O-N 3.47Å; L155-T241 HydrophobicContact CD1-CG2 3.71Å; L155-L245 HydrophobicContact CD1-CD1 3.31Å; L155-L245 HydrophobicContact CD2-CD1 3.86Å; L155-L245 HydrophobicContact CG-CD1 4.23Å |
| 156 | T | 84.4 | Confident | 81.6 | Confident | 73 Ų | 73 | 60.7 Ų | 60.7 | 45% | 0.448 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -84.8 | -15.1 | -178.8 | 59.1 | 0 | 0 | 0 | 0 | 113.6 | Y152 V153 T154 | Y152-T156 HydrophobicContact CE1-CG2 4.21Å; Y152-T156 HydrophobicContact CE2-CG2 4.06Å; Y152-T156 PolarHBondContact O-N 3.48Å; Y152-T156 PolarHBondContact O-OG1 3.24Å; V153-T156 PolarHBondContact O-N 2.93Å; V153-T156 VanDerWaalsContact O-N 3.16Å; V153-T156 PolarHBondContact O-OG1 3.36Å; T154-T156 VanDerWaalsContact C-N 3.32Å; T154-T156 PolarHBondContact O-N 2.9Å |
| 157 | S | 78.4 | Confident | 81 | Confident | 27 Ų | 27 | 62.7 Ų | 62.7 | 19% | 0.189 | 34% | 0.343 | C | S | . | . | trans | -106.6 | 108.8 | -170.6 | -54.9 | 0 | 0 | 0 | 0 | 111.7 | V153 T154 W162 | V153-S157 WeakPolarHBondContact O-CB 3.49Å; V153-S157 PolarHBondContact O-N 3.03Å; V153-S157 VanDerWaalsContact O-N 3.11Å; V153-S157 PolarHBondContact O-OG 3.12Å; T154-S157 PolarHBondContact O-N 3.39Å; S157-W162 VanDerWaalsContact CB-NE1 3.26Å; S157-W162 PolarHBondContact OG-NE1 3.31Å | ||
| 158 | A | 65.5 | Low | 80.8 | Confident | 100 Ų | 100 | 70 Ų | 70 | 83% | 0.826 | 37% | 0.37 | S | S | * | . | trans | -94.8 | -7.6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 159 | S | 75.9 | Confident | 80.6 | Confident | 55 Ų | 55 | 72.5 Ų | 72.5 | 39% | 0.385 | 39% | 0.385 | S | S | . | . | trans | -87.9 | 132.5 | -171.3 | -178.4 | 0 | 0 | 0 | 0 | 113.8 | S161 W162 Q163 | S159-S161 PolarHBondContact O-N 3.13Å; S159-S161 PolarHBondContact OG-OG 3.37Å; S159-S161 VanDerWaalsContact OG-OG 3.08Å; S159-W162 VanDerWaalsContact O-CB 3.32Å; S159-W162 WeakPolarHBondContact O-CB 3.24Å; S159-W162 PolarHBondContact O-N 2.92Å; S159-Q163 PolarHBondContact O-N 3.13Å | ||
| 160 | P | 70.8 | Confident | 80.5 | Confident | 99 Ų | 99 | 70.8 Ų | 70.8 | 64% | 0.643 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -62.8 | -35.2 | 175.7 | -23 | 33.1 | 0 | 0 | 0 | 114.6 | W162 Q163 | P160-W162 VanDerWaalsContact C-N 3.26Å; P160-W162 PolarHBondContact O-N 2.96Å; P160-Q163 WeakPolarHBondContact O-CB 3.37Å; P160-Q163 PolarHBondContact O-N 3.42Å |
| 161 | S | 72.5 | Confident | 80.6 | Confident | 91 Ų | 91 | 78.5 Ų | 78.5 | 64% | 0.636 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -66.2 | -33.4 | 177.1 | 59.9 | 0 | 0 | 0 | 0 | 111.8 | S159 H164 Y165 | S159-S161 PolarHBondContact O-N 3.13Å; S159-S161 PolarHBondContact OG-OG 3.37Å; S159-S161 VanDerWaalsContact OG-OG 3.08Å; S161-H164 PolarHBondContact O-N 3.42Å; S161-Y165 PolarHBondContact O-N 3.26Å |
| 162 | W | 74.9 | Confident | 80.9 | Confident | 104 Ų | 104 | 79.1 Ų | 79.1 | 39% | 0.394 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -65.7 | -37.1 | 174.3 | -177.2 | -103 | 0 | 0 | 0 | 111.9 | S157 S159 P160 H164 Y165 Q166 | S157-W162 VanDerWaalsContact CB-NE1 3.26Å; S157-W162 PolarHBondContact OG-NE1 3.31Å; S159-W162 VanDerWaalsContact O-CB 3.32Å; S159-W162 WeakPolarHBondContact O-CB 3.24Å; S159-W162 PolarHBondContact O-N 2.92Å; P160-W162 VanDerWaalsContact C-N 3.26Å; P160-W162 PolarHBondContact O-N 2.96Å; W162-H164 PolarHBondContact O-N 2.86Å; W162-Y165 HydrophobicContact CE3-CD1 4.02Å; W162-Y165 HydrophobicContact CH2-CD1 4.29Å; W162-Y165 HydrophobicContact CH2-CE1 4.26Å; W162-Y165 AromaticContact CZ3-CD1 3.82Å; W162-Y165 HydrophobicContact CZ3-CD1 3.82Å; W162-Y165 HydrophobicContact CZ3-CE1 4.01Å; W162-Y165 PolarHBondContact O-N 3.41Å; W162-Q166 VanDerWaalsContact CD1-OE1 3.25Å; W162-Q166 HydrophobicContact CD2-CG 4.42Å; W162-Q166 HydrophobicContact CG-CG 4.29Å; W162-Q166 WeakPolarHBondContact O-CB 3.45Å; W162-Q166 VanDerWaalsContact O-CG 3.28Å; W162-Q166 WeakPolarHBondContact O-CG 3.33Å; W162-Q166 PolarHBondContact O-N 3.4Å |
| 163 | Q | 70.7 | Confident | 81.2 | Confident | 97 Ų | 97 | 80.8 Ų | 80.8 | 45% | 0.453 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -61.4 | -41.3 | 178.1 | -65.1 | 176.7 | -3.3 | 0 | 0 | 112.6 | S159 P160 Q166 H167 | S159-Q163 PolarHBondContact O-N 3.13Å; P160-Q163 WeakPolarHBondContact O-CB 3.37Å; P160-Q163 PolarHBondContact O-N 3.42Å; Q163-Q166 WeakPolarHBondContact O-CB 3.39Å; Q163-Q166 PolarHBondContact O-N 3.3Å; Q163-H167 PolarHBondContact O-CD2 3.08Å; Q163-H167 PolarHBondContact O-N 2.67Å; Q163-H167 VanDerWaalsContact O-N 3.12Å |
| 164 | H | 73.9 | Confident | 81.5 | Confident | 121 Ų | 121 | 79 Ų | 79 | 56% | 0.56 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -66.8 | -39.7 | 176.2 | -175.2 | 78.6 | 0 | 0 | 0 | 112.2 | S161 W162 H167 | S161-H164 PolarHBondContact O-N 3.42Å; W162-H164 PolarHBondContact O-N 2.86Å; H164-H167 PolarHBondContact O-N 2.98Å |
| 165 | Y | 79.9 | Confident | 82.1 | Confident | 119 Ų | 119 | 79.4 Ų | 79.4 | 47% | 0.467 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.7 | -44.6 | 173.3 | 179.6 | -104 | 0 | 0 | 0 | 111.6 | S161 W162 H167 R168 V169 | S161-Y165 PolarHBondContact O-N 3.26Å; W162-Y165 HydrophobicContact CE3-CD1 4.02Å; W162-Y165 HydrophobicContact CH2-CD1 4.29Å; W162-Y165 HydrophobicContact CH2-CE1 4.26Å; W162-Y165 AromaticContact CZ3-CD1 3.82Å; W162-Y165 HydrophobicContact CZ3-CD1 3.82Å; W162-Y165 HydrophobicContact CZ3-CE1 4.01Å; W162-Y165 PolarHBondContact O-N 3.41Å; Y165-H167 VanDerWaalsContact C-N 3.27Å; Y165-H167 PolarHBondContact O-N 3.27Å; Y165-R168 PolarHBondContact O-N 2.85Å; Y165-R168 VanDerWaalsContact O-N 3.1Å; Y165-V169 HydrophobicContact CD1-CG2 4.03Å; Y165-V169 HydrophobicContact CE1-CG2 3.64Å; Y165-V169 HydrophobicContact CE2-CG2 4.34Å; Y165-V169 WeakPolarHBondContact O-CG2 3.4Å; Y165-V169 PolarHBondContact O-N 3.46Å |
| 166 | Q | 79.7 | Confident | 82.8 | Confident | 14 Ų | 14 | 76.9 Ų | 76.9 | 7% | 0.065 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -56.5 | -37.5 | 175.5 | -75 | 178.7 | -58.5 | 0 | 0 | 112.5 | W162 Q163 R168 V169 R170 | W162-Q166 VanDerWaalsContact CD1-OE1 3.25Å; W162-Q166 HydrophobicContact CD2-CG 4.42Å; W162-Q166 HydrophobicContact CG-CG 4.29Å; W162-Q166 WeakPolarHBondContact O-CB 3.45Å; W162-Q166 VanDerWaalsContact O-CG 3.28Å; W162-Q166 WeakPolarHBondContact O-CG 3.33Å; W162-Q166 PolarHBondContact O-N 3.4Å; Q163-Q166 WeakPolarHBondContact O-CB 3.39Å; Q163-Q166 PolarHBondContact O-N 3.3Å; Q166-R168 PolarHBondContact O-N 3.19Å; Q166-V169 PolarHBondContact O-N 2.92Å; Q166-R170 WeakPolarHBondContact O-CB 3.4Å; Q166-R170 WeakPolarHBondContact O-CG 3.23Å; Q166-R170 PolarHBondContact O-N 3.06Å |
| 167 | H | 81.2 | Confident | 83.5 | Confident | 60 Ų | 60 | 73.9 Ų | 73.9 | 28% | 0.278 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.6 | -41 | 176.3 | -83.3 | -70.9 | 0 | 0 | 0 | 113.5 | L87 Q163 H164 Y165 R171 | L87-H167 VanDerWaalsContact CD1-CE1 3.43Å; L87-H167 WeakPolarHBondContact CD1-CE1 3.43Å; L87-H167 WeakPolarHBondContact CD1-NE2 3.38Å; Q163-H167 PolarHBondContact O-CD2 3.08Å; Q163-H167 PolarHBondContact O-N 2.67Å; Q163-H167 VanDerWaalsContact O-N 3.12Å; H164-H167 PolarHBondContact O-N 2.98Å; Y165-H167 VanDerWaalsContact C-N 3.27Å; Y165-H167 PolarHBondContact O-N 3.27Å; H167-R171 WeakPolarHBondContact O-CG 3.32Å; H167-R171 PolarHBondContact O-N 3.41Å |
| 168 | R | 85.3 | Confident | 84.4 | Confident | 156 Ų | 156 | 76 Ų | 76 | 59% | 0.589 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -66.5 | -43.5 | 175.4 | -74.1 | -172.5 | -80.6 | 171 | -4.2 | 111 | Y165 Q166 R171 A172 | Y165-R168 PolarHBondContact O-N 2.85Å; Y165-R168 VanDerWaalsContact O-N 3.1Å; Q166-R168 PolarHBondContact O-N 3.19Å; R168-R171 PolarHBondContact O-N 3.38Å; R168-A172 PolarHBondContact O-N 3.4Å |
| 169 | V | 88.4 | Confident | 86 | Confident | 56 Ų | 56 | 75.5 Ų | 75.5 | 34% | 0.339 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.3 | -47.9 | 175.8 | 174.8 | 0 | 0 | 0 | 0 | 111 | Y165 Q166 R171 A172 M173 | Y165-V169 HydrophobicContact CD1-CG2 4.03Å; Y165-V169 HydrophobicContact CE1-CG2 3.64Å; Y165-V169 HydrophobicContact CE2-CG2 4.34Å; Y165-V169 WeakPolarHBondContact O-CG2 3.4Å; Y165-V169 PolarHBondContact O-N 3.46Å; Q166-V169 PolarHBondContact O-N 2.92Å; V169-R171 VanDerWaalsContact C-N 3.32Å; V169-R171 PolarHBondContact O-N 3.3Å; V169-A172 PolarHBondContact O-N 3.38Å; V169-A172 VanDerWaalsContact O-N 3.17Å; V169-M173 HydrophobicContact CG1-CG 4.11Å; V169-M173 WeakPolarHBondContact O-CB 3.43Å; V169-M173 VanDerWaalsContact O-CG 3.29Å; V169-M173 WeakPolarHBondContact O-CG 3.44Å; V169-M173 PolarHBondContact O-N 3.31Å |
| 170 | R | 89.8 | Confident | 87 | Confident | 7 Ų | 7 | 77 Ų | 77 | 3% | 0.026 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -56.3 | -42.9 | 177.7 | -74.2 | 167.7 | 177.3 | 165.4 | -1.6 | 112.7 | L90 Y91 D150 T154 Q166 M173 C174 | L90-R170 HydrophobicContact CD1-CB 3.97Å; Y91-R170 HydrophobicContact CE2-CG 3.82Å; D150-R170 VanDerWaalsContact CG-NH2 3.27Å; D150-R170 IonicContact OD1-CZ 3.26Å; D150-R170 VanDerWaalsContact OD1-CZ 3.26Å; D150-R170 IonicContact OD1-NE 2.75Å; D150-R170 PolarHBondContact OD1-NE 2.85Å; D150-R170 IonicContact OD1-NH2 2.9Å; D150-R170 PolarHBondContact OD1-NH2 3.42Å; D150-R170 IonicContact OD2-CZ 3.88Å; D150-R170 IonicContact OD2-NE 2.74Å; D150-R170 IonicContact OD2-NH2 3.07Å; D150-R170 PolarHBondContact OD2-NH2 3.19Å; T154-R170 PolarHBondContact OG1-NH2 3.44Å; Q166-R170 WeakPolarHBondContact O-CB 3.4Å; Q166-R170 WeakPolarHBondContact O-CG 3.23Å; Q166-R170 PolarHBondContact O-N 3.06Å; R170-M173 PolarHBondContact O-N 3.45Å; R170-C174 PolarHBondContact O-N 3.02Å; R170-C174 PolarHBondContact O-SG 2.78Å |
| 171 | R | 90.8 | Very high | 88.3 | Confident | 183 Ų | 183 | 72.2 Ų | 72.2 | 69% | 0.691 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -65.4 | -44.7 | 177.4 | -70.6 | 177.4 | 71.1 | 175.4 | 2.5 | 111.7 | L90 H167 R168 V169 C174 A175 | L90-R171 HydrophobicContact CD1-CG 3.74Å; H167-R171 WeakPolarHBondContact O-CG 3.32Å; H167-R171 PolarHBondContact O-N 3.41Å; R168-R171 PolarHBondContact O-N 3.38Å; V169-R171 VanDerWaalsContact C-N 3.32Å; V169-R171 PolarHBondContact O-N 3.3Å; R171-C174 PolarHBondContact O-N 2.9Å; R171-A175 PolarHBondContact O-N 2.74Å |
| 172 | A | 93 | Very high | 89.4 | Confident | 66 Ų | 66 | 69.2 Ų | 69.2 | 55% | 0.545 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | R168 V169 A175 G176 | R168-A172 PolarHBondContact O-N 3.4Å; V169-A172 PolarHBondContact O-N 3.38Å; V169-A172 VanDerWaalsContact O-N 3.17Å; A172-A175 PolarHBondContact O-N 2.94Å; A172-G176 PolarHBondContact O-N 3.11Å |
| 173 | M | 94.3 | Very high | 90.5 | Very high | 82 Ų | 82 | 68.9 Ų | 68.9 | 40% | 0.404 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 175 | -70.9 | -59.8 | -62.4 | 0 | 0 | 111.9 | Y91 V169 R170 A175 G176 I177 | Y91-M173 HydrophobicContact CE1-CB 4.16Å; V169-M173 HydrophobicContact CG1-CG 4.11Å; V169-M173 WeakPolarHBondContact O-CB 3.43Å; V169-M173 VanDerWaalsContact O-CG 3.29Å; V169-M173 WeakPolarHBondContact O-CG 3.44Å; V169-M173 PolarHBondContact O-N 3.31Å; R170-M173 PolarHBondContact O-N 3.45Å; M173-A175 PolarHBondContact O-N 3.46Å; M173-G176 PolarHBondContact O-N 2.97Å; M173-I177 WeakPolarHBondContact O-CD1 3.18Å; M173-I177 VanDerWaalsContact O-CG1 3.24Å; M173-I177 WeakPolarHBondContact O-CG1 3.33Å; M173-I177 PolarHBondContact O-N 2.76Å |
| 174 | C | 95.3 | Very high | 91.7 | Very high | 8 Ų | 8 | 65.4 Ų | 65.4 | 5% | 0.054 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.3 | -44.3 | 177.4 | -64.8 | 0 | 0 | 0 | 0 | 112.2 | F143 R170 R171 G176 I177 W178 | F143-C174 HydrophobicContact CE1-CB 3.97Å; F143-C174 HydrophobicContact CZ-CB 4.37Å; R170-C174 PolarHBondContact O-N 3.02Å; R170-C174 PolarHBondContact O-SG 2.78Å; R171-C174 PolarHBondContact O-N 2.9Å; C174-G176 VanDerWaalsContact C-N 3.35Å; C174-I177 PolarHBondContact O-N 2.99Å; C174-W178 PolarHBondContact O-N 2.78Å; C174-W178 VanDerWaalsContact O-N 3.14Å |
| 175 | A | 96.3 | Very high | 92.6 | Very high | 58 Ų | 58 | 59.7 Ų | 59.7 | 48% | 0.479 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | R171 A172 M173 I177 W178 V179 | R171-A175 PolarHBondContact O-N 2.74Å; A172-A175 PolarHBondContact O-N 2.94Å; M173-A175 PolarHBondContact O-N 3.46Å; A175-I177 PolarHBondContact O-N 3.46Å; A175-W178 PolarHBondContact O-N 2.92Å; A175-V179 WeakPolarHBondContact O-CG2 3.27Å; A175-V179 PolarHBondContact O-N 3.37Å |
| 176 | G | 97.9 | Very high | 93.2 | Very high | 39 Ų | 39 | 58.3 Ų | 58.3 | 40% | 0.402 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.2 | -41.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | A172 M173 C174 V179 L180 | A172-G176 PolarHBondContact O-N 3.11Å; M173-G176 PolarHBondContact O-N 2.97Å; C174-G176 VanDerWaalsContact C-N 3.35Å; G176-V179 PolarHBondContact O-N 3.33Å; G176-L180 VanDerWaalsContact O-CB 3.22Å; G176-L180 WeakPolarHBondContact O-CB 3.2Å; G176-L180 PolarHBondContact O-N 3.06Å |
| 177 | I | 98.1 | Very high | 93.6 | Very high | 9 Ų | 9 | 60.9 Ų | 60.9 | 5% | 0.046 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.4 | -50 | 175.9 | -70.2 | 161.8 | 0 | 0 | 0 | 110.4 | F142 F143 C146 M173 C174 A175 V179 L180 S181 | F142-I177 HydrophobicContact CB-CG1 4.26Å; F142-I177 HydrophobicContact CB-CG2 3.81Å; F142-I177 HydrophobicContact CD2-CG2 4.41Å; F143-I177 HydrophobicContact CD1-CD1 3.61Å; F143-I177 HydrophobicContact CD1-CG2 4.33Å; F143-I177 HydrophobicContact CD2-CG2 4.07Å; F143-I177 HydrophobicContact CE1-CB 4.07Å; F143-I177 HydrophobicContact CE1-CD1 3.55Å; F143-I177 HydrophobicContact CE1-CG1 4.44Å; F143-I177 HydrophobicContact CE1-CG2 4.01Å; F143-I177 HydrophobicContact CE2-CB 4.46Å; F143-I177 HydrophobicContact CE2-CG2 3.67Å; F143-I177 HydrophobicContact CG-CD1 4.39Å; F143-I177 HydrophobicContact CG-CG2 4.34Å; F143-I177 HydrophobicContact CZ-CB 3.91Å; F143-I177 HydrophobicContact CZ-CD1 4.27Å; F143-I177 HydrophobicContact CZ-CG2 3.62Å; C146-I177 HydrophobicContact CB-CD1 4.23Å; C146-I177 VanDerWaalsContact SG-CD1 3.59Å; M173-I177 WeakPolarHBondContact O-CD1 3.18Å; M173-I177 VanDerWaalsContact O-CG1 3.24Å; M173-I177 WeakPolarHBondContact O-CG1 3.33Å; M173-I177 PolarHBondContact O-N 2.76Å; C174-I177 PolarHBondContact O-N 2.99Å; A175-I177 PolarHBondContact O-N 3.46Å; I177-V179 VanDerWaalsContact C-N 3.32Å; I177-V179 PolarHBondContact O-N 2.96Å; I177-L180 PolarHBondContact O-N 2.87Å; I177-S181 VanDerWaalsContact O-CB 3.29Å; I177-S181 WeakPolarHBondContact O-CB 3.44Å; I177-S181 PolarHBondContact O-N 3.36Å; I177-S181 PolarHBondContact O-OG 3.4Å; I177-S181 VanDerWaalsContact O-OG 3.05Å |
| 178 | W | 98.2 | Very high | 93.7 | Very high | 72 Ų | 72 | 58.5 Ų | 58.5 | 27% | 0.273 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -58.5 | -43.3 | 178.7 | -79.9 | 117.7 | 0 | 0 | 0 | 112.7 | N94 I97 A98 S139 F143 C174 A175 A182 | N94-W178 PolarHBondContact OD1-NE1 3.37Å; I97-W178 HydrophobicContact CB-CZ2 4.41Å; I97-W178 HydrophobicContact CG2-CH2 4.16Å; I97-W178 HydrophobicContact CG2-CZ2 3.99Å; A98-W178 HydrophobicContact CB-CH2 4.02Å; S139-W178 WeakPolarHBondContact OG-CZ3 3.47Å; F143-W178 HydrophobicContact CE2-CD2 4.42Å; F143-W178 AromaticContact CE2-CE2 3.88Å; F143-W178 HydrophobicContact CE2-CZ2 4.09Å; F143-W178 AromaticContact CE2-NE1 3.9Å; F143-W178 AromaticContact CZ-CD1 3.93Å; F143-W178 AromaticContact CZ-NE1 3.65Å; C174-W178 PolarHBondContact O-N 2.78Å; C174-W178 VanDerWaalsContact O-N 3.14Å; A175-W178 PolarHBondContact O-N 2.92Å; W178-A182 VanDerWaalsContact O-CB 3.27Å; W178-A182 WeakPolarHBondContact O-CB 3.38Å; W178-A182 PolarHBondContact O-N 3.49Å |
| 179 | V | 98.3 | Very high | 94 | Very high | 89 Ų | 89 | 51.6 Ų | 51.6 | 54% | 0.539 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64 | -46.9 | 176.5 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | A175 G176 I177 A182 I183 | A175-V179 WeakPolarHBondContact O-CG2 3.27Å; A175-V179 PolarHBondContact O-N 3.37Å; G176-V179 PolarHBondContact O-N 3.33Å; I177-V179 VanDerWaalsContact C-N 3.32Å; I177-V179 PolarHBondContact O-N 2.96Å; V179-A182 PolarHBondContact O-N 2.86Å; V179-I183 HydrophobicContact CG1-CD1 3.84Å; V179-I183 WeakPolarHBondContact O-CG1 3.49Å; V179-I183 PolarHBondContact O-N 3.26Å |
| 180 | L | 97.4 | Very high | 94.1 | Very high | 86 Ų | 86 | 53.2 Ų | 53.2 | 45% | 0.45 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.5 | -47.7 | -179.3 | -179.6 | 61.6 | 0 | 0 | 0 | 111.4 | F142 G176 I177 A182 I183 I184 | F142-L180 HydrophobicContact CD2-CD2 4.32Å; F142-L180 HydrophobicContact CE2-CD2 4Å; F142-L180 HydrophobicContact CE2-CG 4.21Å; G176-L180 VanDerWaalsContact O-CB 3.22Å; G176-L180 WeakPolarHBondContact O-CB 3.2Å; G176-L180 PolarHBondContact O-N 3.06Å; I177-L180 PolarHBondContact O-N 2.87Å; L180-A182 PolarHBondContact O-N 3.35Å; L180-I183 PolarHBondContact O-N 2.75Å; L180-I183 VanDerWaalsContact O-N 3.1Å; L180-I184 HydrophobicContact CD1-CD1 3.78Å; L180-I184 HydrophobicContact CD1-CG1 4.06Å; L180-I184 HydrophobicContact CD2-CD1 4.34Å; L180-I184 HydrophobicContact CG-CD1 3.64Å; L180-I184 HydrophobicContact CG-CG1 4.36Å; L180-I184 WeakPolarHBondContact O-CG1 3.41Å; L180-I184 PolarHBondContact O-N 3.45Å |
| 181 | S | 97.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.7 | -24.4 | 178.1 | -61.5 | 0 | 0 | 0 | 0 | 113 | V135 S139 F142 I177 P185 | V135-S181 WeakPolarHBondContact CG2-O 3.2Å; S139-S181 WeakPolarHBondContact CA-OG 3.33Å; S139-S181 PolarHBondContact N-OG 2.99Å; S139-S181 WeakPolarHBondContact OG-CB 3.45Å; S139-S181 PolarHBondContact OG-OG 3.25Å; F142-S181 WeakPolarHBondContact CD2-OG 3.43Å; I177-S181 VanDerWaalsContact O-CB 3.29Å; I177-S181 WeakPolarHBondContact O-CB 3.44Å; I177-S181 PolarHBondContact O-N 3.36Å; I177-S181 PolarHBondContact O-OG 3.4Å; I177-S181 VanDerWaalsContact O-OG 3.05Å; S181-P185 WeakPolarHBondContact O-CD 3.46Å; S181-P185 WeakPolarHBondContact O-CG 3.26Å |
| 182 | A | 97.3 | Very high | 93.8 | Very high | 28 Ų | 28 | 45.7 Ų | 45.7 | 23% | 0.231 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -75.2 | -27.8 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y131 W178 V179 L180 | Y131-A182 WeakPolarHBondContact CE2-O 3.42Å; Y131-A182 PolarHBondContact OH-O 3.49Å; W178-A182 VanDerWaalsContact O-CB 3.27Å; W178-A182 WeakPolarHBondContact O-CB 3.38Å; W178-A182 PolarHBondContact O-N 3.49Å; V179-A182 PolarHBondContact O-N 2.86Å; L180-A182 PolarHBondContact O-N 3.35Å |
| 183 | I | 96.9 | Very high | 93.6 | Very high | 96 Ų | 96 | 46.4 Ų | 46.4 | 49% | 0.492 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -88.2 | -44.5 | -176.5 | -67.7 | 167.3 | 0 | 0 | 0 | 111.7 | V179 L180 L186 | V179-I183 HydrophobicContact CG1-CD1 3.84Å; V179-I183 WeakPolarHBondContact O-CG1 3.49Å; V179-I183 PolarHBondContact O-N 3.26Å; L180-I183 PolarHBondContact O-N 2.75Å; L180-I183 VanDerWaalsContact O-N 3.1Å; I183-L186 WeakPolarHBondContact O-CB 3.37Å; I183-L186 WeakPolarHBondContact O-CG 3.29Å; I183-L186 PolarHBondContact O-N 2.69Å; I183-L186 VanDerWaalsContact O-N 3.12Å |
| 184 | I | 95.3 | Very high | 93.5 | Very high | 25 Ų | 25 | 44.1 Ų | 44.1 | 13% | 0.128 | 26% | 0.256 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53 | -44.9 | -173.9 | -72.5 | 163.2 | 0 | 0 | 0 | 113.3 | Y138 F142 L180 L186 P187 L225 | Y138-I184 HydrophobicContact CD2-CB 4.37Å; Y138-I184 HydrophobicContact CD2-CG2 3.89Å; Y138-I184 HydrophobicContact CE1-CG2 4.28Å; Y138-I184 HydrophobicContact CE2-CB 4.37Å; Y138-I184 HydrophobicContact CE2-CG2 3.47Å; Y138-I184 VanDerWaalsContact CE2-CG2 3.47Å; Y138-I184 HydrophobicContact CG-CG2 4.45Å; F142-I184 HydrophobicContact CE2-CD1 3.66Å; F142-I184 HydrophobicContact CZ-CD1 3.82Å; L180-I184 HydrophobicContact CD1-CD1 3.78Å; L180-I184 HydrophobicContact CD1-CG1 4.06Å; L180-I184 HydrophobicContact CD2-CD1 4.34Å; L180-I184 HydrophobicContact CG-CD1 3.64Å; L180-I184 HydrophobicContact CG-CG1 4.36Å; L180-I184 WeakPolarHBondContact O-CG1 3.41Å; L180-I184 PolarHBondContact O-N 3.45Å; I184-L186 VanDerWaalsContact C-N 3.26Å; I184-L186 PolarHBondContact O-N 3Å; I184-P187 VanDerWaalsContact O-CD 3.22Å; I184-P187 WeakPolarHBondContact O-CD 3.1Å; I184-P187 WeakPolarHBondContact O-CG 3.43Å; I184-L225 HydrophobicContact CD1-CD1 4.14Å; I184-L225 HydrophobicContact CG1-CD1 4.32Å; I184-L225 HydrophobicContact CG2-CD1 3.69Å |
| 185 | P | 94.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -13.7 | -177.6 | -23.5 | 36 | 0 | 0 | 0 | 115.3 | Y131 F134 V135 Y138 S181 E188 V189 | Y131-P185 HydrophobicContact CD2-CB 4.07Å; Y131-P185 HydrophobicContact CE2-CB 4.29Å; F134-P185 HydrophobicContact CB-CB 3.64Å; F134-P185 HydrophobicContact CB-CG 3.68Å; F134-P185 HydrophobicContact CG-CB 4.5Å; V135-P185 HydrophobicContact CG2-CG 3.94Å; Y138-P185 HydrophobicContact CD2-CG 3.72Å; Y138-P185 HydrophobicContact CE2-CG 3.9Å; S181-P185 WeakPolarHBondContact O-CD 3.46Å; S181-P185 WeakPolarHBondContact O-CG 3.26Å; P185-E188 WeakPolarHBondContact O-CA 3.49Å; P185-E188 WeakPolarHBondContact O-CB 3.24Å; P185-E188 PolarHBondContact O-N 3.39Å; P185-V189 HydrophobicContact CB-CG2 4.35Å; P185-V189 WeakPolarHBondContact O-CG2 3.38Å; P185-V189 PolarHBondContact O-N 3.26Å |
| 186 | L | 92.8 | Very high | 92.8 | Very high | 91 Ų | 91 | 52 Ų | 52 | 48% | 0.476 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -56 | -50.3 | -175.1 | -64.9 | 174.7 | 0 | 0 | 0 | 113.3 | Y131 I183 I184 E188 V189 V190 | Y131-L186 HydrophobicContact CD2-CD2 4.25Å; Y131-L186 HydrophobicContact CE2-CD2 3.62Å; Y131-L186 HydrophobicContact CE2-CG 4.3Å; I183-L186 WeakPolarHBondContact O-CB 3.37Å; I183-L186 WeakPolarHBondContact O-CG 3.29Å; I183-L186 PolarHBondContact O-N 2.69Å; I183-L186 VanDerWaalsContact O-N 3.12Å; I184-L186 VanDerWaalsContact C-N 3.26Å; I184-L186 PolarHBondContact O-N 3Å; L186-E188 PolarHBondContact O-N 3.29Å; L186-V189 PolarHBondContact O-N 3.16Å; L186-V190 PolarHBondContact O-N 2.95Å |
| 187 | P | 87.2 | Confident | 92.2 | Very high | 68 Ų | 68 | 52.3 Ų | 52.3 | 44% | 0.442 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -65 | -23.5 | 173.6 | 25.6 | -37.5 | 0 | 0 | 0 | 114.1 | I184 V190 H191 | I184-P187 VanDerWaalsContact O-CD 3.22Å; I184-P187 WeakPolarHBondContact O-CD 3.1Å; I184-P187 WeakPolarHBondContact O-CG 3.43Å; P187-V190 WeakPolarHBondContact O-CG1 3.22Å; P187-H191 PolarHBondContact O-CD2 3.5Å |
| 188 | E | 84.4 | Confident | 91.6 | Very high | 9 Ų | 9 | 58.5 Ų | 58.5 | 4% | 0.042 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -75.3 | -44.1 | 176.3 | -53.1 | -177.2 | -137.6 | 0 | 0 | 110.1 | Y138 P185 L186 V218 T222 | Y138-E188 WeakPolarHBondContact CE2-OE1 3.27Å; Y138-E188 PolarHBondContact OH-OE1 2.89Å; Y138-E188 PolarHBondContact OH-OE2 3.38Å; P185-E188 WeakPolarHBondContact O-CA 3.49Å; P185-E188 WeakPolarHBondContact O-CB 3.24Å; P185-E188 PolarHBondContact O-N 3.39Å; L186-E188 PolarHBondContact O-N 3.29Å; E188-V218 HydrophobicContact CB-CG1 4.23Å; E188-V218 HydrophobicContact CG-CG1 3.92Å; E188-T222 PolarHBondContact OE2-OG1 3.33Å |
| 189 | V | 90.8 | Very high | 91.2 | Very high | 12 Ų | 12 | 60.6 Ų | 60.6 | 7% | 0.073 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -81.1 | -24.3 | -174.2 | 177.7 | 0 | 0 | 0 | 0 | 113.2 | R127 Y131 F134 P185 L186 H191 I192 | R127-V189 HydrophobicContact CB-CG1 4.03Å; R127-V189 WeakPolarHBondContact O-CG1 3.28Å; Y131-V189 HydrophobicContact CD2-CG2 4.3Å; F134-V189 HydrophobicContact CD2-CG2 4.1Å; P185-V189 HydrophobicContact CB-CG2 4.35Å; P185-V189 WeakPolarHBondContact O-CG2 3.38Å; P185-V189 PolarHBondContact O-N 3.26Å; L186-V189 PolarHBondContact O-N 3.16Å; V189-H191 PolarHBondContact O-N 3.2Å; V189-H191 VanDerWaalsContact O-N 3.12Å; V189-I192 HydrophobicContact CG1-CB 4.48Å; V189-I192 WeakPolarHBondContact O-CB 3.48Å; V189-I192 PolarHBondContact O-N 3.37Å |
| 190 | V | 89.4 | Confident | 90.6 | Very high | 89 Ų | 89 | 57.4 Ų | 57.4 | 54% | 0.539 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -28.2 | 178.6 | 73.1 | 0 | 0 | 0 | 0 | 112.4 | L186 P187 | L186-V190 PolarHBondContact O-N 2.95Å; P187-V190 WeakPolarHBondContact O-CG1 3.22Å |
| 191 | H | 86.8 | Confident | 90.2 | Very high | 22 Ų | 22 | 56.7 Ų | 56.7 | 10% | 0.102 | 32% | 0.319 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.1 | -8 | 176.5 | -65.3 | -62.7 | 0 | 0 | 0 | 113.2 | P187 V189 Q193 F204 M205 W214 | P187-H191 PolarHBondContact O-CD2 3.5Å; V189-H191 PolarHBondContact O-N 3.2Å; V189-H191 VanDerWaalsContact O-N 3.12Å; H191-Q193 PolarHBondContact O-N 3.32Å; H191-F204 HydrophobicContact CB-CD2 3.69Å; H191-F204 HydrophobicContact CB-CE2 3.34Å; H191-F204 HydrophobicContact CB-CG 4.49Å; H191-F204 HydrophobicContact CB-CZ 3.87Å; H191-M205 CarbonylContact O-C 3.53Å; H191-M205 WeakPolarHBondContact O-CA 3.36Å; H191-M205 PolarHBondContact O-N 3.45Å; H191-W214 AromaticContact NE2-CD2 3.72Å; H191-W214 AromaticContact NE2-CE3 3.66Å |
| 192 | I | 89.4 | Confident | 89.8 | Confident | 11 Ų | 11 | 57.1 Ų | 57.1 | 6% | 0.056 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 122 | 173.4 | -60.2 | -67.6 | 0 | 0 | 0 | 109.3 | R127 H130 V189 L203 F204 | R127-I192 WeakPolarHBondContact CG-O 3.43Å; R127-I192 PolarHBondContact NE-O 2.9Å; H130-I192 HydrophobicContact CB-CG1 4.45Å; H130-I192 HydrophobicContact CB-CG2 4.49Å; V189-I192 HydrophobicContact CG1-CB 4.48Å; V189-I192 WeakPolarHBondContact O-CB 3.48Å; V189-I192 PolarHBondContact O-N 3.37Å; I192-L203 WeakPolarHBondContact CA-O 3.32Å; I192-F204 HydrophobicContact CD1-CB 3.98Å; I192-F204 HydrophobicContact CD1-CD2 4.24Å |
| 193 | Q | 88.6 | Confident | 89.2 | Confident | 81 Ų | 81 | 59.3 Ų | 59.3 | 38% | 0.379 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.3 | 146.6 | -176.5 | -59 | -170.2 | 4.3 | 0 | 0 | 111.3 | H191 L203 M205 | H191-Q193 PolarHBondContact O-N 3.32Å; Q193-L203 PolarHBondContact N-O 2.95Å; Q193-L203 PolarHBondContact O-N 3.01Å; Q193-M205 HydrophobicContact CB-CB 4.22Å; Q193-M205 HydrophobicContact CB-CG 4.4Å; Q193-M205 HydrophobicContact CG-CB 4.25Å |
| 194 | L | 91.2 | Very high | 88.5 | Confident | 33 Ų | 33 | 57 Ų | 57 | 17% | 0.173 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 117.5 | 167.6 | -177 | 64.7 | 0 | 0 | 0 | 108.2 | W119 P200 | W119-L194 HydrophobicContact CB-CD1 3.82Å; W119-L194 HydrophobicContact CG-CD1 3.97Å; L194-P200 HydrophobicContact CD1-CB 4.06Å |
| 195 | V | 89.6 | Confident | 87.8 | Confident | 59 Ų | 59 | 58.8 Ų | 58.8 | 36% | 0.358 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | 113.5 | 173 | -175.8 | 0 | 0 | 0 | 0 | 107.3 | P200 M201 L203 M205 | V195-P200 VanDerWaalsContact O-CA 3.24Å; V195-P200 WeakPolarHBondContact O-CA 3.28Å; V195-M201 PolarHBondContact N-O 3.34Å; V195-M201 PolarHBondContact O-N 3.48Å; V195-M201 VanDerWaalsContact O-N 3.13Å; V195-L203 HydrophobicContact CG2-CB 4.36Å; V195-L203 HydrophobicContact CG2-CD1 4.29Å; V195-M205 HydrophobicContact CG2-CE 3.46Å; V195-M205 VanDerWaalsContact CG2-CE 3.46Å; V195-M205 HydrophobicContact CG2-CG 4.16Å |
| 196 | E | 87.5 | Confident | 87 | Confident | 174 Ų | 174 | 59.1 Ų | 59.1 | 81% | 0.813 | 33% | 0.327 | S | S | * | . | trans | -76.3 | 139.3 | -179.8 | -64.4 | -175.8 | 179.6 | 0 | 0 | 111.2 | ||||
| 197 | G | 85.7 | Confident | 86.3 | Confident | 44 Ų | 44 | 58 Ų | 58 | 45% | 0.454 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -176.8 | -176.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | E199 | G197-E199 PolarHBondContact O-N 3.42Š|
| 198 | P | 85.8 | Confident | 85.6 | Confident | 139 Ų | 139 | 63.8 Ų | 63.8 | 90% | 0.903 | 34% | 0.343 | S | S | * | . | S | Bend | trans | -59.7 | -33.2 | 170.9 | 24.8 | -32.5 | 0 | 0 | 0 | 111.7 | ||
| 199 | E | 88.2 | Confident | 85.2 | Confident | 117 Ų | 117 | 72.1 Ų | 72.1 | 55% | 0.547 | 38% | 0.382 | S | S | . | . | S | Bend | trans | -121.7 | 85.5 | 173.3 | -67.9 | 171.9 | 177.5 | 0 | 0 | 107.3 | G197 | G197-E199 PolarHBondContact O-N 3.42Š|
| 200 | P | 86.9 | Confident | 84.8 | Confident | 22 Ų | 22 | 74 Ų | 74 | 14% | 0.143 | 39% | 0.394 | C | S | . | . | trans | -64.1 | 138.4 | -178 | 25.5 | -36 | 0 | 0 | 0 | 111.2 | T118 W119 L120 L194 V195 | T118-P200 CarbonylContact C-O 3.6Å; T118-P200 WeakPolarHBondContact CA-O 3.31Å; T118-P200 HydrophobicContact CG2-CG 3.91Å; W119-P200 PolarHBondContact N-O 3.32Å; W119-P200 WeakPolarHBondContact O-CG 3.42Å; L120-P200 HydrophobicContact CD2-CG 4.05Å; L194-P200 HydrophobicContact CD1-CB 4.06Å; V195-P200 VanDerWaalsContact O-CA 3.24Å; V195-P200 WeakPolarHBondContact O-CA 3.28Å | ||
| 201 | M | 88 | Confident | 84.6 | Confident | 70 Ų | 70 | 74.9 Ų | 74.9 | 35% | 0.345 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.6 | 145.9 | -177.4 | -63.7 | 177.2 | -174.3 | 0 | 0 | 111.6 | V195 L203 | V195-M201 PolarHBondContact N-O 3.34Å; V195-M201 PolarHBondContact O-N 3.48Å; V195-M201 VanDerWaalsContact O-N 3.13Å; M201-L203 HydrophobicContact CB-CD1 4.04Å; M201-L203 HydrophobicContact CB-CG 3.96Å; M201-L203 HydrophobicContact SD-CD1 4.44Å |
| 202 | C | 89.2 | Confident | 84.5 | Confident | 9 Ų | 9 | 76.7 Ų | 76.7 | 6% | 0.061 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 104.6 | 175.4 | -175.3 | 0 | 0 | 0 | 0 | 109.4 | W119 C126 H130 | W119-C202 HydrophobicContact CB-CB 4.1Å; W119-C202 HydrophobicContact CD2-CB 3.91Å; W119-C202 HydrophobicContact CE3-CB 3.96Å; W119-C202 HydrophobicContact CG-CB 3.95Å; C126-C202 VanDerWaalsContact CA-SG 3.53Å; C126-C202 HydrophobicContact CB-CB 3.9Å; C126-C202 WeakPolarHBondContact CB-SG 3.36Å; C126-C202 WeakPolarHBondContact SG-CB 3.38Å; C126-C202 CovalentContact SG-SG 2.03Å; C126-C202 PolarHBondContact SG-SG 2.95Å; H130-C202 VanDerWaalsContact CE1-SG 3.54Å |
| 203 | L | 84.8 | Confident | 84.5 | Confident | 74 Ų | 74 | 80.1 Ų | 80.1 | 39% | 0.387 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 156.5 | -169.6 | -64.3 | 176.2 | 0 | 0 | 0 | 112.6 | I192 Q193 V195 M201 M205 | I192-L203 WeakPolarHBondContact CA-O 3.32Å; Q193-L203 PolarHBondContact N-O 2.95Å; Q193-L203 PolarHBondContact O-N 3.01Å; V195-L203 HydrophobicContact CG2-CB 4.36Å; V195-L203 HydrophobicContact CG2-CD1 4.29Å; M201-L203 HydrophobicContact CB-CD1 4.04Å; M201-L203 HydrophobicContact CB-CG 3.96Å; M201-L203 HydrophobicContact SD-CD1 4.44Å; L203-M205 HydrophobicContact CB-CE 3.96Å; L203-M205 HydrophobicContact CD1-CE 3.87Å; L203-M205 PolarHBondContact O-N 3.44Å |
| 204 | F | 82.6 | Confident | 84.5 | Confident | 48 Ų | 48 | 81.1 Ų | 81.1 | 21% | 0.211 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.2 | 114 | 168.5 | -179.1 | -93.2 | 0 | 0 | 0 | 110.5 | H191 I192 A206 Y211 A215 V218 | H191-F204 HydrophobicContact CB-CD2 3.69Å; H191-F204 HydrophobicContact CB-CE2 3.34Å; H191-F204 HydrophobicContact CB-CG 4.49Å; H191-F204 HydrophobicContact CB-CZ 3.87Å; I192-F204 HydrophobicContact CD1-CB 3.98Å; I192-F204 HydrophobicContact CD1-CD2 4.24Å; F204-A206 HydrophobicContact CD1-CB 4.46Å; F204-A206 HydrophobicContact CE1-CB 3.57Å; F204-A206 HydrophobicContact CZ-CB 3.83Å; F204-Y211 AromaticContact CD1-CE2 3.93Å; F204-Y211 HydrophobicContact CD1-CE2 3.93Å; F204-Y211 HydrophobicContact CE1-CE2 4.11Å; F204-A215 HydrophobicContact CE1-CB 4.2Å; F204-V218 HydrophobicContact CE2-CG2 4.33Å; F204-V218 HydrophobicContact CZ-CG2 4.37Å |
| 205 | M | 80.1 | Confident | 84.3 | Confident | 63 Ų | 63 | 80.1 Ų | 80.1 | 31% | 0.31 | 42% | 0.422 | S | S | . | . | trans | -124 | 80.8 | -177.5 | -68.3 | -60.8 | 179.3 | 0 | 0 | 110.5 | H191 Q193 V195 L203 | H191-M205 CarbonylContact O-C 3.53Å; H191-M205 WeakPolarHBondContact O-CA 3.36Å; H191-M205 PolarHBondContact O-N 3.45Å; Q193-M205 HydrophobicContact CB-CB 4.22Å; Q193-M205 HydrophobicContact CB-CG 4.4Å; Q193-M205 HydrophobicContact CG-CB 4.25Å; V195-M205 HydrophobicContact CG2-CE 3.46Å; V195-M205 VanDerWaalsContact CG2-CE 3.46Å; V195-M205 HydrophobicContact CG2-CG 4.16Å; L203-M205 HydrophobicContact CB-CE 3.96Å; L203-M205 HydrophobicContact CD1-CE 3.87Å; L203-M205 PolarHBondContact O-N 3.44Å | ||
| 206 | A | 78 | Confident | 84.4 | Confident | 6 Ų | 6 | 79 Ų | 79 | 5% | 0.05 | 41% | 0.414 | C | S | . | . | trans | -75.8 | 157 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | F204 F208 Y211 W214 | F204-A206 HydrophobicContact CD1-CB 4.46Å; F204-A206 HydrophobicContact CE1-CB 3.57Å; F204-A206 HydrophobicContact CZ-CB 3.83Å; A206-F208 PolarHBondContact O-N 3.36Å; A206-Y211 HydrophobicContact CB-CD2 3.82Å; A206-Y211 HydrophobicContact CB-CE2 4.43Å; A206-W214 HydrophobicContact CB-CB 3.77Å; A206-W214 HydrophobicContact CB-CG 4.36Å | ||
| 207 | P | 78.4 | Confident | 84.7 | Confident | 67 Ų | 67 | 73 Ų | 73 | 44% | 0.435 | 39% | 0.393 | S | S | . | . | trans | -59 | 130.5 | -179.6 | -19.8 | 30.5 | 0 | 0 | 0 | 111.4 | E209 T210 Y211 | P207-E209 VanDerWaalsContact C-N 3.33Å; P207-E209 PolarHBondContact O-N 3.4Å; P207-E209 VanDerWaalsContact O-N 3.16Å; P207-T210 CarbonylContact O-C 3.29Å; P207-T210 VanDerWaalsContact O-C 3.29Å; P207-T210 PolarHBondContact O-N 3.01Å; P207-T210 PolarHBondContact O-OG1 2.84Å; P207-Y211 WeakPolarHBondContact O-CA 3.47Å; P207-Y211 PolarHBondContact O-N 3.42Å | ||
| 208 | F | 71.4 | Confident | 84.9 | Confident | 190 Ų | 190 | 71.9 Ų | 71.9 | 83% | 0.833 | 38% | 0.378 | S | S | * | . | G | 310 helix | trans | -47.8 | -48.4 | -171.6 | -67.8 | -74.4 | 0 | 0 | 0 | 114.3 | A206 T210 Y211 | A206-F208 PolarHBondContact O-N 3.36Å; F208-T210 PolarHBondContact O-N 2.83Å; F208-T210 VanDerWaalsContact O-N 3.16Å; F208-Y211 PolarHBondContact O-N 3.5Å |
| 209 | E | 76.3 | Confident | 85.3 | Confident | 184 Ų | 184 | 65.7 Ų | 65.7 | 86% | 0.86 | 34% | 0.338 | S | S | * | . | G | 310 helix | trans | -61.1 | -25.3 | -179.7 | -62.4 | -59 | 143.2 | 0 | 0 | 114 | P207 | P207-E209 VanDerWaalsContact C-N 3.33Å; P207-E209 PolarHBondContact O-N 3.4Å; P207-E209 VanDerWaalsContact O-N 3.16Å |
| 210 | T | 83.3 | Confident | 85.6 | Confident | 51 Ų | 51 | 63.6 Ų | 63.6 | 31% | 0.313 | 33% | 0.33 | S | S | . | . | G | 310 helix | trans | -124.5 | 17.5 | -175.6 | 54.3 | 0 | 0 | 0 | 0 | 111.8 | P207 F208 S212 T213 W214 | P207-T210 CarbonylContact O-C 3.29Å; P207-T210 VanDerWaalsContact O-C 3.29Å; P207-T210 PolarHBondContact O-N 3.01Å; P207-T210 PolarHBondContact O-OG1 2.84Å; F208-T210 PolarHBondContact O-N 2.83Å; F208-T210 VanDerWaalsContact O-N 3.16Å; T210-S212 PolarHBondContact O-N 3.05Å; T210-T213 WeakPolarHBondContact CB-OG1 3.05Å; T210-T213 PolarHBondContact O-N 3.36Å; T210-T213 PolarHBondContact O-OG1 3.08Å; T210-W214 VanDerWaalsContact O-CD1 3.27Å; T210-W214 PolarHBondContact O-N 3.14Å; T210-W214 VanDerWaalsContact OG1-CD1 3.27Å |
| 211 | Y | 84.5 | Confident | 85.9 | Confident | 108 Ų | 108 | 65.2 Ų | 65.2 | 42% | 0.424 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -60.9 | -47.7 | -173.1 | 177.1 | -88 | 0 | 0 | 0 | 110.8 | F204 A206 P207 F208 T213 W214 A215 | F204-Y211 AromaticContact CD1-CE2 3.93Å; F204-Y211 HydrophobicContact CD1-CE2 3.93Å; F204-Y211 HydrophobicContact CE1-CE2 4.11Å; A206-Y211 HydrophobicContact CB-CD2 3.82Å; A206-Y211 HydrophobicContact CB-CE2 4.43Å; P207-Y211 WeakPolarHBondContact O-CA 3.47Å; P207-Y211 PolarHBondContact O-N 3.42Å; F208-Y211 PolarHBondContact O-N 3.5Å; Y211-T213 PolarHBondContact O-N 3.36Å; Y211-W214 PolarHBondContact O-N 2.8Å; Y211-A215 HydrophobicContact CE1-CB 4.29Å; Y211-A215 WeakPolarHBondContact O-CB 3.32Å; Y211-A215 PolarHBondContact O-N 3.19Å |
| 212 | S | 84.4 | Confident | 86.2 | Confident | 60 Ų | 60 | 62.1 Ų | 62.1 | 42% | 0.42 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -62.4 | -40 | 179.9 | 52.3 | 0 | 0 | 0 | 0 | 112.7 | T210 L216 | T210-S212 PolarHBondContact O-N 3.05Å; S212-L216 WeakPolarHBondContact O-CB 3.26Å; S212-L216 PolarHBondContact O-N 3.35Å |
| 213 | T | 89.5 | Confident | 86.6 | Confident | 83 Ų | 83 | 62 Ų | 62 | 51% | 0.509 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -71.6 | -42.5 | -180 | 55.2 | 0 | 0 | 0 | 0 | 111.7 | T210 Y211 A217 | T210-T213 WeakPolarHBondContact CB-OG1 3.05Å; T210-T213 PolarHBondContact O-N 3.36Å; T210-T213 PolarHBondContact O-OG1 3.08Å; Y211-T213 PolarHBondContact O-N 3.36Å; T213-A217 VanDerWaalsContact O-CB 3.25Å; T213-A217 WeakPolarHBondContact O-CB 3.25Å; T213-A217 PolarHBondContact O-N 3.48Å |
| 214 | W | 89.3 | Confident | 87.1 | Confident | 103 Ų | 103 | 62.4 Ų | 62.4 | 39% | 0.39 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -66.3 | -46.4 | 174.5 | -82.1 | 109.5 | 0 | 0 | 0 | 112.4 | H191 A206 T210 Y211 L216 A217 V218 | H191-W214 AromaticContact NE2-CD2 3.72Å; H191-W214 AromaticContact NE2-CE3 3.66Å; A206-W214 HydrophobicContact CB-CB 3.77Å; A206-W214 HydrophobicContact CB-CG 4.36Å; T210-W214 VanDerWaalsContact O-CD1 3.27Å; T210-W214 PolarHBondContact O-N 3.14Å; T210-W214 VanDerWaalsContact OG1-CD1 3.27Å; Y211-W214 PolarHBondContact O-N 2.8Å; W214-L216 VanDerWaalsContact C-N 3.3Å; W214-L216 PolarHBondContact O-N 3.06Å; W214-A217 PolarHBondContact O-N 2.85Å; W214-V218 WeakPolarHBondContact O-CB 3.14Å; W214-V218 WeakPolarHBondContact O-CG2 3.26Å; W214-V218 PolarHBondContact O-N 3.24Å |
| 215 | A | 87.9 | Confident | 87.8 | Confident | 12 Ų | 12 | 62.2 Ų | 62.2 | 10% | 0.099 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59 | -43.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | F204 Y211 T219 T282 | F204-A215 HydrophobicContact CE1-CB 4.2Å; Y211-A215 HydrophobicContact CE1-CB 4.29Å; Y211-A215 WeakPolarHBondContact O-CB 3.32Å; Y211-A215 PolarHBondContact O-N 3.19Å; A215-T219 WeakPolarHBondContact O-CB 3.39Å; A215-T219 PolarHBondContact O-N 3.12Å; A215-T219 PolarHBondContact O-OG1 3.16Å; A215-T282 HydrophobicContact CB-CG2 4.29Å |
| 216 | L | 91.4 | Very high | 88.5 | Confident | 36 Ų | 36 | 59.2 Ų | 59.2 | 19% | 0.188 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -65.4 | -45.7 | 174.9 | -177.1 | 62.9 | 0 | 0 | 0 | 111.9 | S212 W214 T219 L220 T282 L283 | S212-L216 WeakPolarHBondContact O-CB 3.26Å; S212-L216 PolarHBondContact O-N 3.35Å; W214-L216 VanDerWaalsContact C-N 3.3Å; W214-L216 PolarHBondContact O-N 3.06Å; L216-T219 PolarHBondContact O-N 2.94Å; L216-L220 HydrophobicContact CD1-CD1 3.94Å; L216-L220 HydrophobicContact CD1-CD2 4.49Å; L216-L220 HydrophobicContact CD1-CG 3.93Å; L216-L220 HydrophobicContact CG-CD1 3.86Å; L216-L220 HydrophobicContact CG-CG 4.25Å; L216-L220 WeakPolarHBondContact O-CB 3.44Å; L216-L220 VanDerWaalsContact O-CG 3.26Å; L216-L220 WeakPolarHBondContact O-CG 3.3Å; L216-L220 PolarHBondContact O-N 3.42Å; L216-T282 HydrophobicContact CB-CG2 4.23Å; L216-T282 HydrophobicContact CD1-CG2 4.23Å; L216-L283 HydrophobicContact CD1-CD2 3.74Å |
| 217 | A | 92.4 | Very high | 89.3 | Confident | 46 Ų | 46 | 59.7 Ų | 59.7 | 38% | 0.38 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62 | -44.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T213 W214 S221 | T213-A217 VanDerWaalsContact O-CB 3.25Å; T213-A217 WeakPolarHBondContact O-CB 3.25Å; T213-A217 PolarHBondContact O-N 3.48Å; W214-A217 PolarHBondContact O-N 2.85Å; A217-S221 VanDerWaalsContact O-CB 3.27Å; A217-S221 WeakPolarHBondContact O-CB 3.34Å; A217-S221 PolarHBondContact O-N 3.25Å; A217-S221 PolarHBondContact O-OG 2.87Å |
| 218 | V | 91.5 | Very high | 90.2 | Very high | 22 Ų | 22 | 61.3 Ų | 61.3 | 13% | 0.133 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.7 | -53.1 | 174.3 | 167.2 | 0 | 0 | 0 | 0 | 109.7 | E188 F204 W214 L220 S221 T222 | E188-V218 HydrophobicContact CB-CG1 4.23Å; E188-V218 HydrophobicContact CG-CG1 3.92Å; F204-V218 HydrophobicContact CE2-CG2 4.33Å; F204-V218 HydrophobicContact CZ-CG2 4.37Å; W214-V218 WeakPolarHBondContact O-CB 3.14Å; W214-V218 WeakPolarHBondContact O-CG2 3.26Å; W214-V218 PolarHBondContact O-N 3.24Å; V218-L220 VanDerWaalsContact C-N 3.34Å; V218-L220 PolarHBondContact O-N 2.8Å; V218-S221 CarbonylContact O-C 3.56Å; V218-S221 WeakPolarHBondContact O-CA 3.15Å; V218-S221 WeakPolarHBondContact O-CB 3.31Å; V218-S221 PolarHBondContact O-N 3.16Å; V218-T222 WeakPolarHBondContact O-CB 3.3Å; V218-T222 PolarHBondContact O-N 3.42Å; V218-T222 PolarHBondContact O-OG1 2.88Å |
| 219 | T | 92.8 | Very high | 91.4 | Very high | 9 Ų | 9 | 56.4 Ų | 56.4 | 6% | 0.055 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -57.4 | -44.2 | -179.2 | -65.8 | 0 | 0 | 0 | 0 | 113 | A215 L216 T223 L278 L279 T282 | A215-T219 WeakPolarHBondContact O-CB 3.39Å; A215-T219 PolarHBondContact O-N 3.12Å; A215-T219 PolarHBondContact O-OG1 3.16Å; L216-T219 PolarHBondContact O-N 2.94Å; T219-T223 WeakPolarHBondContact O-CB 3.4Å; T219-T223 PolarHBondContact O-N 3.43Å; T219-T223 PolarHBondContact O-OG1 3.41Å; T219-L278 HydrophobicContact CG2-CD2 3.97Å; T219-L278 HydrophobicContact CG2-CG 3.72Å; T219-L279 HydrophobicContact CG2-CD1 4.32Å; T219-T282 HydrophobicContact CG2-CG2 4.31Å; T219-T282 PolarHBondContact OG1-OG1 3.42Å |
| 220 | L | 94.6 | Very high | 92.4 | Very high | 72 Ų | 72 | 47.8 Ų | 47.8 | 38% | 0.377 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.7 | -42.7 | 175.8 | -71.8 | 176.7 | 0 | 0 | 0 | 111.2 | L216 V218 T223 I224 L279 | L216-L220 HydrophobicContact CD1-CD1 3.94Å; L216-L220 HydrophobicContact CD1-CD2 4.49Å; L216-L220 HydrophobicContact CD1-CG 3.93Å; L216-L220 HydrophobicContact CG-CD1 3.86Å; L216-L220 HydrophobicContact CG-CG 4.25Å; L216-L220 WeakPolarHBondContact O-CB 3.44Å; L216-L220 VanDerWaalsContact O-CG 3.26Å; L216-L220 WeakPolarHBondContact O-CG 3.3Å; L216-L220 PolarHBondContact O-N 3.42Å; V218-L220 VanDerWaalsContact C-N 3.34Å; V218-L220 PolarHBondContact O-N 2.8Å; L220-T223 PolarHBondContact O-N 2.97Å; L220-I224 VanDerWaalsContact O-CB 3.31Å; L220-I224 WeakPolarHBondContact O-CB 3.35Å; L220-I224 WeakPolarHBondContact O-CD1 3.46Å; L220-I224 WeakPolarHBondContact O-CG1 3.44Å; L220-I224 PolarHBondContact O-N 3Å; L220-L279 HydrophobicContact CD2-CD1 3.96Å |
| 221 | S | 94.4 | Very high | 93.1 | Very high | 57 Ų | 57 | 48.7 Ų | 48.7 | 40% | 0.399 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.3 | -50.1 | 177.5 | -59.8 | 0 | 0 | 0 | 0 | 111.1 | A217 V218 T223 I224 L225 | A217-S221 VanDerWaalsContact O-CB 3.27Å; A217-S221 WeakPolarHBondContact O-CB 3.34Å; A217-S221 PolarHBondContact O-N 3.25Å; A217-S221 PolarHBondContact O-OG 2.87Å; V218-S221 CarbonylContact O-C 3.56Å; V218-S221 WeakPolarHBondContact O-CA 3.15Å; V218-S221 WeakPolarHBondContact O-CB 3.31Å; V218-S221 PolarHBondContact O-N 3.16Å; S221-T223 VanDerWaalsContact C-N 3.31Å; S221-T223 PolarHBondContact O-N 3.39Å; S221-I224 PolarHBondContact O-N 3.27Å; S221-L225 WeakPolarHBondContact O-CB 3.26Å; S221-L225 VanDerWaalsContact O-CG 3.32Å; S221-L225 WeakPolarHBondContact O-CG 3.4Å; S221-L225 PolarHBondContact O-N 2.97Å |
| 222 | T | 94.1 | Very high | 93.7 | Very high | 4 Ų | 4 | 46.2 Ų | 46.2 | 3% | 0.025 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.9 | -39.6 | 176.5 | -48.9 | 0 | 0 | 0 | 0 | 111.3 | Y138 E188 V218 G226 H275 | Y138-T222 WeakPolarHBondContact OH-CA 3.36Å; E188-T222 PolarHBondContact OE2-OG1 3.33Å; V218-T222 WeakPolarHBondContact O-CB 3.3Å; V218-T222 PolarHBondContact O-N 3.42Å; V218-T222 PolarHBondContact O-OG1 2.88Å; T222-G226 VanDerWaalsContact O-CA 3.27Å; T222-G226 WeakPolarHBondContact O-CA 3.34Å; T222-G226 PolarHBondContact O-N 3.42Å; T222-H275 PolarHBondContact O-CE1 3.42Å; T222-H275 VanDerWaalsContact O-CE1 3.29Å |
| 223 | T | 96.1 | Very high | 94.3 | Very high | 8 Ų | 8 | 46.3 Ų | 46.3 | 5% | 0.049 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -70.8 | -39.8 | 177.9 | -61.3 | 0 | 0 | 0 | 0 | 113 | T219 L220 S221 F227 L228 H275 | T219-T223 WeakPolarHBondContact O-CB 3.4Å; T219-T223 PolarHBondContact O-N 3.43Å; T219-T223 PolarHBondContact O-OG1 3.41Å; L220-T223 PolarHBondContact O-N 2.97Å; S221-T223 VanDerWaalsContact C-N 3.31Å; S221-T223 PolarHBondContact O-N 3.39Å; T223-F227 PolarHBondContact O-N 3.32Å; T223-L228 HydrophobicContact CG2-CD1 4.01Å; T223-L228 HydrophobicContact CG2-CG 4.08Å; T223-L228 PolarHBondContact O-N 2.83Å; T223-H275 WeakPolarHBondContact CA-ND1 3.2Å; T223-H275 HydrophobicContact CG2-CB 4.12Å; T223-H275 PolarHBondContact OG1-ND1 2.89Å |
| 224 | I | 96.9 | Very high | 94.6 | Very high | 82 Ų | 82 | 42.4 Ų | 42.4 | 42% | 0.421 | 23% | 0.23 | S | C | . | . | I | π-helix | trans | -67 | -51.5 | 177.4 | -70.7 | 164.7 | 0 | 0 | 0 | 110 | L220 S221 L228 L229 | L220-I224 VanDerWaalsContact O-CB 3.31Å; L220-I224 WeakPolarHBondContact O-CB 3.35Å; L220-I224 WeakPolarHBondContact O-CD1 3.46Å; L220-I224 WeakPolarHBondContact O-CG1 3.44Å; L220-I224 PolarHBondContact O-N 3Å; S221-I224 PolarHBondContact O-N 3.27Å; I224-L228 HydrophobicContact CG1-CD1 4.18Å; I224-L228 PolarHBondContact O-N 2.99Å; I224-L229 VanDerWaalsContact O-CB 3.26Å; I224-L229 WeakPolarHBondContact O-CB 3.44Å; I224-L229 PolarHBondContact O-N 2.84Å |
| 225 | L | 96.3 | Very high | 94.9 | Very high | 44 Ų | 44 | 38.4 Ų | 38.4 | 23% | 0.23 | 22% | 0.218 | C | C | . | . | I | π-helix | trans | -76.3 | -32.3 | -174.9 | -63.9 | 173.4 | 0 | 0 | 0 | 112.8 | Y138 I184 S221 P230 | Y138-L225 HydrophobicContact CD1-CB 4.46Å; Y138-L225 HydrophobicContact CE1-CB 3.88Å; I184-L225 HydrophobicContact CD1-CD1 4.14Å; I184-L225 HydrophobicContact CG1-CD1 4.32Å; I184-L225 HydrophobicContact CG2-CD1 3.69Å; S221-L225 WeakPolarHBondContact O-CB 3.26Å; S221-L225 VanDerWaalsContact O-CG 3.32Å; S221-L225 WeakPolarHBondContact O-CG 3.4Å; S221-L225 PolarHBondContact O-N 2.97Å; L225-P230 WeakPolarHBondContact O-CD 3.41Å; L225-P230 WeakPolarHBondContact O-CG 3.33Å |
| 226 | G | 94.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 24% | 0.236 | C | C | . | . | I | π-helix | trans | -81.7 | -31.8 | 179 | 0 | 0 | 0 | 0 | 0 | 113.8 | T222 | T222-G226 VanDerWaalsContact O-CA 3.27Å; T222-G226 WeakPolarHBondContact O-CA 3.34Å; T222-G226 PolarHBondContact O-N 3.42Å |
| 227 | F | 96.2 | Very high | 95.4 | Very high | 16 Ų | 16 | 42 Ų | 42 | 7% | 0.07 | 24% | 0.237 | C | C | . | . | I | π-helix | trans | -137.4 | -55.9 | -171.9 | -177.6 | -103.4 | 0 | 0 | 0 | 115.6 | T223 L229 P230 F231 F267 W271 L272 H275 | T223-F227 PolarHBondContact O-N 3.32Å; F227-L229 VanDerWaalsContact C-N 3.31Å; F227-L229 PolarHBondContact O-N 3.44Å; F227-P230 WeakPolarHBondContact O-CD 3.43Å; F227-F231 HydrophobicContact CD2-CB 4.38Å; F227-F231 HydrophobicContact CE2-CB 4.19Å; F227-F231 HydrophobicContact CE2-CG 4.4Å; F227-F231 HydrophobicContact CZ-CB 4.37Å; F227-F231 HydrophobicContact CZ-CG 4.31Å; F227-F231 WeakPolarHBondContact O-CB 3.29Å; F227-F231 PolarHBondContact O-N 3.19Å; F227-F267 HydrophobicContact CD2-CD1 4.28Å; F227-F267 AromaticContact CD2-CE1 3.63Å; F227-F267 HydrophobicContact CD2-CE1 3.63Å; F227-F267 HydrophobicContact CD2-CZ 4.44Å; F227-F267 HydrophobicContact CE2-CD1 4.25Å; F227-F267 HydrophobicContact CE2-CE1 4.02Å; F227-W271 HydrophobicContact CD2-CB 3.68Å; F227-W271 HydrophobicContact CE2-CB 4.24Å; F227-L272 HydrophobicContact CE1-CD1 3.61Å; F227-L272 HydrophobicContact CE2-CB 4.12Å; F227-L272 HydrophobicContact CE2-CD1 4.46Å; F227-L272 HydrophobicContact CZ-CB 3.99Å; F227-L272 HydrophobicContact CZ-CD1 3.58Å; F227-L272 HydrophobicContact CZ-CG 4.33Å; F227-H275 HydrophobicContact CB-CB 4.48Å; F227-H275 WeakPolarHBondContact CB-CD2 3.39Å; F227-H275 AromaticContact CG-CD2 3.99Å |
| 228 | L | 96.9 | Very high | 95.3 | Very high | 101 Ų | 101 | 40 Ų | 40 | 53% | 0.529 | 22% | 0.219 | S | C | . | . | I | π-helix | trans | -67 | -30.1 | -169.9 | -61.4 | 174.4 | 0 | 0 | 0 | 113.7 | T223 I224 P232 | T223-L228 HydrophobicContact CG2-CD1 4.01Å; T223-L228 HydrophobicContact CG2-CG 4.08Å; T223-L228 PolarHBondContact O-N 2.83Å; I224-L228 HydrophobicContact CG1-CD1 4.18Å; I224-L228 PolarHBondContact O-N 2.99Å; L228-P232 WeakPolarHBondContact O-CD 3.28Å; L228-P232 WeakPolarHBondContact O-CG 3.42Å |
| 229 | L | 97 | Very high | 95.4 | Very high | 87 Ų | 87 | 42.9 Ų | 42.9 | 46% | 0.455 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | -48.4 | 173.1 | 177.3 | 75.7 | 0 | 0 | 0 | 112.1 | I224 F227 P232 L233 | I224-L229 VanDerWaalsContact O-CB 3.26Å; I224-L229 WeakPolarHBondContact O-CB 3.44Å; I224-L229 PolarHBondContact O-N 2.84Å; F227-L229 VanDerWaalsContact C-N 3.31Å; F227-L229 PolarHBondContact O-N 3.44Å; L229-P232 WeakPolarHBondContact O-CD 3.34Å; L229-P232 WeakPolarHBondContact O-CG 3.41Å; L229-L233 HydrophobicContact CD1-CD1 4.32Å; L229-L233 HydrophobicContact CG-CD1 4.28Å; L229-L233 WeakPolarHBondContact O-CG 3.19Å |
| 230 | P | 97 | Very high | 95.3 | Very high | 2 Ų | 2 | 45.7 Ų | 45.7 | 1% | 0.013 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.7 | -43.6 | 179.5 | -26.2 | 35.6 | 0 | 0 | 0 | 114.8 | I141 V145 L225 F227 L233 I234 F267 | I141-P230 HydrophobicContact CG2-CB 3.56Å; I141-P230 HydrophobicContact CG2-CG 3.36Å; V145-P230 HydrophobicContact CG2-CB 3.69Å; V145-P230 HydrophobicContact CG2-CG 4.47Å; L225-P230 WeakPolarHBondContact O-CD 3.41Å; L225-P230 WeakPolarHBondContact O-CG 3.33Å; F227-P230 WeakPolarHBondContact O-CD 3.43Å; P230-L233 PolarHBondContact O-N 3.16Å; P230-I234 HydrophobicContact CB-CD1 4.25Å; P230-I234 WeakPolarHBondContact O-CB 3.21Å; P230-I234 VanDerWaalsContact O-CG1 3.29Å; P230-I234 WeakPolarHBondContact O-CG1 3.47Å; P230-I234 PolarHBondContact O-N 3.38Å; P230-F267 HydrophobicContact CB-CE1 4.4Å; P230-F267 HydrophobicContact CB-CE2 4.44Å; P230-F267 HydrophobicContact CB-CZ 3.76Å |
| 231 | F | 97.1 | Very high | 95 | Very high | 70 Ų | 70 | 42.5 Ų | 42.5 | 31% | 0.307 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -54 | -55.8 | -176 | 169.8 | -111.2 | 0 | 0 | 0 | 113.5 | F227 L233 I234 A235 V264 F267 V268 | F227-F231 HydrophobicContact CD2-CB 4.38Å; F227-F231 HydrophobicContact CE2-CB 4.19Å; F227-F231 HydrophobicContact CE2-CG 4.4Å; F227-F231 HydrophobicContact CZ-CB 4.37Å; F227-F231 HydrophobicContact CZ-CG 4.31Å; F227-F231 WeakPolarHBondContact O-CB 3.29Å; F227-F231 PolarHBondContact O-N 3.19Å; F231-L233 VanDerWaalsContact C-N 3.3Å; F231-L233 PolarHBondContact O-N 2.94Å; F231-I234 PolarHBondContact O-N 3.15Å; F231-A235 HydrophobicContact CE2-CB 4.4Å; F231-A235 VanDerWaalsContact O-CB 3.29Å; F231-A235 WeakPolarHBondContact O-CB 3.23Å; F231-A235 PolarHBondContact O-N 3.21Å; F231-V264 HydrophobicContact CE2-CG1 3.89Å; F231-F267 HydrophobicContact CB-CD1 4.19Å; F231-F267 HydrophobicContact CB-CE1 3.84Å; F231-F267 HydrophobicContact CD2-CD1 4.16Å; F231-V268 HydrophobicContact CD2-CG2 3.65Å; F231-V268 HydrophobicContact CE2-CG2 3.24Å; F231-V268 HydrophobicContact CZ-CG2 4.1Å |
| 232 | P | 97.4 | Very high | 94.7 | Very high | 56 Ų | 56 | 40.4 Ų | 40.4 | 36% | 0.364 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -64.1 | -35.8 | -179.1 | 24.9 | -34.6 | 0 | 0 | 0 | 112 | L228 L229 A235 V236 | L228-P232 WeakPolarHBondContact O-CD 3.28Å; L228-P232 WeakPolarHBondContact O-CG 3.42Å; L229-P232 WeakPolarHBondContact O-CD 3.34Å; L229-P232 WeakPolarHBondContact O-CG 3.41Å; P232-A235 PolarHBondContact O-N 3.46Å; P232-V236 VanDerWaalsContact O-CB 3.27Å; P232-V236 WeakPolarHBondContact O-CB 3.4Å; P232-V236 WeakPolarHBondContact O-CG2 3.47Å; P232-V236 PolarHBondContact O-N 3.44Å |
| 233 | L | 97 | Very high | 94.4 | Very high | 63 Ų | 63 | 44.2 Ų | 44.2 | 33% | 0.33 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63.6 | -50.9 | 176.2 | -65.6 | 174.1 | 0 | 0 | 0 | 110.7 | V145 L229 P230 F231 A235 V236 F237 | V145-L233 HydrophobicContact CG1-CB 3.94Å; V145-L233 HydrophobicContact CG1-CD1 3.79Å; L229-L233 HydrophobicContact CD1-CD1 4.32Å; L229-L233 HydrophobicContact CG-CD1 4.28Å; L229-L233 WeakPolarHBondContact O-CG 3.19Å; P230-L233 PolarHBondContact O-N 3.16Å; F231-L233 VanDerWaalsContact C-N 3.3Å; F231-L233 PolarHBondContact O-N 2.94Å; L233-A235 VanDerWaalsContact C-N 3.34Å; L233-A235 PolarHBondContact O-N 3.31Å; L233-V236 PolarHBondContact O-N 3.12Å; L233-F237 HydrophobicContact CD2-CE2 4.23Å; L233-F237 WeakPolarHBondContact O-CB 3.29Å; L233-F237 WeakPolarHBondContact O-CD2 3.48Å; L233-F237 PolarHBondContact O-N 3.05Å |
| 234 | I | 95 | Very high | 93.9 | Very high | 1 Ų | 1 | 52 Ų | 52 | 1% | 0.005 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -58.2 | -48.7 | 177 | -67.6 | 165.6 | 0 | 0 | 0 | 109.8 | L144 V145 P230 F231 N238 V264 F267 | L144-I234 HydrophobicContact CD2-CD1 3.83Å; L144-I234 HydrophobicContact CG-CD1 3.79Å; L144-I234 HydrophobicContact CG-CG1 4.35Å; V145-I234 HydrophobicContact CG2-CD1 4.01Å; V145-I234 HydrophobicContact CG2-CG1 3.89Å; P230-I234 HydrophobicContact CB-CD1 4.25Å; P230-I234 WeakPolarHBondContact O-CB 3.21Å; P230-I234 VanDerWaalsContact O-CG1 3.29Å; P230-I234 WeakPolarHBondContact O-CG1 3.47Å; P230-I234 PolarHBondContact O-N 3.38Å; F231-I234 PolarHBondContact O-N 3.15Å; I234-N238 WeakPolarHBondContact CG2-ND2 3.1Å; I234-N238 VanDerWaalsContact O-CB 3.24Å; I234-N238 WeakPolarHBondContact O-CB 3.31Å; I234-N238 PolarHBondContact O-N 2.88Å; I234-N238 PolarHBondContact O-ND2 2.89Å; I234-V264 HydrophobicContact CG2-CG2 4.48Å; I234-F267 HydrophobicContact CD1-CD1 4.44Å; I234-F267 HydrophobicContact CD1-CD2 3.67Å; I234-F267 HydrophobicContact CD1-CE1 4.44Å; I234-F267 HydrophobicContact CD1-CE2 3.68Å; I234-F267 HydrophobicContact CD1-CG 4.07Å; I234-F267 HydrophobicContact CD1-CZ 4.1Å |
| 235 | A | 95.5 | Very high | 93.3 | Very high | 19 Ų | 19 | 50.3 Ų | 50.3 | 16% | 0.157 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.9 | -53.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112 | F231 P232 L233 N238 V239 V264 | F231-A235 HydrophobicContact CE2-CB 4.4Å; F231-A235 VanDerWaalsContact O-CB 3.29Å; F231-A235 WeakPolarHBondContact O-CB 3.23Å; F231-A235 PolarHBondContact O-N 3.21Å; P232-A235 PolarHBondContact O-N 3.46Å; L233-A235 VanDerWaalsContact C-N 3.34Å; L233-A235 PolarHBondContact O-N 3.31Å; A235-N238 PolarHBondContact O-N 3.46Å; A235-V239 WeakPolarHBondContact O-CB 3.13Å; A235-V239 WeakPolarHBondContact O-CG2 3.33Å; A235-V239 PolarHBondContact O-N 3.41Å; A235-V264 HydrophobicContact CB-CG1 4.14Å; A235-V264 HydrophobicContact CB-CG2 4.41Å |
| 236 | V | 96.1 | Very high | 92.5 | Very high | 78 Ų | 78 | 56.8 Ų | 56.8 | 47% | 0.473 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.2 | -51.4 | -178.5 | 169.7 | 0 | 0 | 0 | 0 | 110.8 | P232 L233 N238 V239 L240 | P232-V236 VanDerWaalsContact O-CB 3.27Å; P232-V236 WeakPolarHBondContact O-CB 3.4Å; P232-V236 WeakPolarHBondContact O-CG2 3.47Å; P232-V236 PolarHBondContact O-N 3.44Å; L233-V236 PolarHBondContact O-N 3.12Å; V236-N238 PolarHBondContact O-N 2.94Å; V236-V239 PolarHBondContact O-N 3.26Å; V236-L240 HydrophobicContact CG1-CD1 3.79Å; V236-L240 HydrophobicContact CG1-CG 4.26Å; V236-L240 WeakPolarHBondContact O-CB 3.27Å; V236-L240 VanDerWaalsContact O-CG 3.23Å; V236-L240 WeakPolarHBondContact O-CG 3.4Å; V236-L240 PolarHBondContact O-N 3.42Å |
| 237 | F | 94.3 | Very high | 91.7 | Very high | 46 Ų | 46 | 61.6 Ų | 61.6 | 20% | 0.202 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -69.3 | -34.2 | -176.2 | -76.7 | -73.4 | 0 | 0 | 0 | 113.2 | V149 Y152 L233 T241 | V149-F237 HydrophobicContact CB-CD2 4.47Å; V149-F237 HydrophobicContact CB-CG 4.47Å; V149-F237 HydrophobicContact CG1-CE1 4.21Å; V149-F237 HydrophobicContact CG1-CZ 4.25Å; V149-F237 HydrophobicContact CG2-CD1 4.37Å; V149-F237 HydrophobicContact CG2-CD2 3.53Å; V149-F237 HydrophobicContact CG2-CE1 4.36Å; V149-F237 HydrophobicContact CG2-CE2 3.57Å; V149-F237 HydrophobicContact CG2-CG 3.98Å; V149-F237 HydrophobicContact CG2-CZ 3.99Å; Y152-F237 AromaticContact CD1-CD1 3.91Å; Y152-F237 HydrophobicContact CD1-CD1 3.91Å; Y152-F237 AromaticContact CD1-CE1 3.94Å; Y152-F237 HydrophobicContact CD1-CE1 3.94Å; Y152-F237 HydrophobicContact CG-CD1 4.03Å; L233-F237 HydrophobicContact CD2-CE2 4.23Å; L233-F237 WeakPolarHBondContact O-CB 3.29Å; L233-F237 WeakPolarHBondContact O-CD2 3.48Å; L233-F237 PolarHBondContact O-N 3.05Å; F237-T241 VanDerWaalsContact O-CB 3.23Å; F237-T241 WeakPolarHBondContact O-CB 3.22Å; F237-T241 PolarHBondContact O-N 3.13Å; F237-T241 PolarHBondContact O-OG1 2.84Å |
| 238 | N | 91.3 | Very high | 90.4 | Very high | 2 Ų | 2 | 66.8 Ų | 66.8 | 1% | 0.011 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -70.9 | -37.7 | 174 | -78.5 | -76.1 | 0 | 0 | 0 | 112 | S148 I234 A235 V236 T241 A242 M260 V264 | S148-N238 WeakPolarHBondContact CB-ND2 3.25Å; S148-N238 PolarHBondContact OG-ND2 3.33Å; I234-N238 WeakPolarHBondContact CG2-ND2 3.1Å; I234-N238 VanDerWaalsContact O-CB 3.24Å; I234-N238 WeakPolarHBondContact O-CB 3.31Å; I234-N238 PolarHBondContact O-N 2.88Å; I234-N238 PolarHBondContact O-ND2 2.89Å; A235-N238 PolarHBondContact O-N 3.46Å; V236-N238 PolarHBondContact O-N 2.94Å; N238-T241 PolarHBondContact O-N 3.38Å; N238-A242 WeakPolarHBondContact O-CB 3.39Å; N238-A242 PolarHBondContact O-N 3.34Å; N238-M260 HydrophobicContact CB-CB 4.19Å; N238-M260 HydrophobicContact CB-SD 4.44Å; N238-M260 PolarHBondContact OD1-SD 3.37Å; N238-V264 HydrophobicContact CB-CG2 4.15Å |
| 239 | V | 92.1 | Very high | 89.2 | Confident | 84 Ų | 84 | 71 Ų | 71 | 51% | 0.509 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.9 | -46.5 | 174 | 169.7 | 0 | 0 | 0 | 0 | 110.9 | A235 V236 T241 A242 C243 | A235-V239 WeakPolarHBondContact O-CB 3.13Å; A235-V239 WeakPolarHBondContact O-CG2 3.33Å; A235-V239 PolarHBondContact O-N 3.41Å; V236-V239 PolarHBondContact O-N 3.26Å; V239-T241 VanDerWaalsContact C-N 3.31Å; V239-T241 PolarHBondContact O-N 3.48Å; V239-A242 PolarHBondContact O-N 3.46Å; V239-C243 WeakPolarHBondContact O-CB 2.99Å; V239-C243 PolarHBondContact O-N 3.09Å; V239-C243 PolarHBondContact O-SG 2.73Å |
| 240 | L | 92 | Very high | 88 | Confident | 68 Ų | 68 | 71.4 Ų | 71.4 | 36% | 0.356 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.6 | -43.1 | 175.9 | -71.1 | 176.1 | 0 | 0 | 0 | 111.5 | Y152 V236 C243 R244 | Y152-L240 HydrophobicContact CD2-CB 3.71Å; Y152-L240 HydrophobicContact CE2-CB 3.66Å; Y152-L240 HydrophobicContact CE2-CD1 4.33Å; Y152-L240 HydrophobicContact CG-CB 4.49Å; V236-L240 HydrophobicContact CG1-CD1 3.79Å; V236-L240 HydrophobicContact CG1-CG 4.26Å; V236-L240 WeakPolarHBondContact O-CB 3.27Å; V236-L240 VanDerWaalsContact O-CG 3.23Å; V236-L240 WeakPolarHBondContact O-CG 3.4Å; V236-L240 PolarHBondContact O-N 3.42Å; L240-C243 PolarHBondContact O-N 3.37Å; L240-R244 WeakPolarHBondContact O-CG 3.37Å; L240-R244 PolarHBondContact O-N 2.9Å |
| 241 | T | 88.4 | Confident | 86.7 | Confident | 4 Ų | 4 | 76.7 Ų | 76.7 | 3% | 0.025 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -59.6 | -49.2 | 173.7 | -64.6 | 0 | 0 | 0 | 0 | 111.1 | L155 F237 N238 V239 C243 R244 L245 M260 | L155-T241 HydrophobicContact CD1-CG2 3.71Å; F237-T241 VanDerWaalsContact O-CB 3.23Å; F237-T241 WeakPolarHBondContact O-CB 3.22Å; F237-T241 PolarHBondContact O-N 3.13Å; F237-T241 PolarHBondContact O-OG1 2.84Å; N238-T241 PolarHBondContact O-N 3.38Å; V239-T241 VanDerWaalsContact C-N 3.31Å; V239-T241 PolarHBondContact O-N 3.48Å; T241-C243 PolarHBondContact O-N 3.32Å; T241-R244 PolarHBondContact O-N 2.77Å; T241-L245 HydrophobicContact CG2-CD1 3.84Å; T241-L245 WeakPolarHBondContact O-CD1 3.41Å; T241-L245 PolarHBondContact O-N 2.97Å; T241-M260 HydrophobicContact CG2-CE 4.48Å; T241-M260 HydrophobicContact CG2-CG 4.5Å; T241-M260 HydrophobicContact CG2-SD 4.09Å |
| 242 | A | 87.7 | Confident | 85.5 | Confident | 13 Ų | 13 | 80.9 Ų | 80.9 | 11% | 0.107 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -59.4 | -45.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | N238 V239 R244 L245 R246 C257 M260 | N238-A242 WeakPolarHBondContact O-CB 3.39Å; N238-A242 PolarHBondContact O-N 3.34Å; V239-A242 PolarHBondContact O-N 3.46Å; A242-R244 VanDerWaalsContact C-N 3.31Å; A242-R244 PolarHBondContact O-N 3.01Å; A242-L245 PolarHBondContact O-N 3.06Å; A242-R246 WeakPolarHBondContact O-CB 3.34Å; A242-R246 PolarHBondContact O-N 2.87Å; A242-C257 HydrophobicContact CB-CB 4.33Å; A242-C257 PolarHBondContact O-SG 2.89Å; A242-M260 HydrophobicContact CB-CB 3.99Å; A242-M260 HydrophobicContact CB-CG 4.02Å |
| 243 | C | 88.8 | Confident | 84.4 | Confident | 84 Ų | 84 | 78.7 Ų | 78.7 | 57% | 0.568 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -60.4 | -38.8 | 177.4 | -72.6 | 0 | 0 | 0 | 0 | 112.5 | V239 L240 T241 | V239-C243 WeakPolarHBondContact O-CB 2.99Å; V239-C243 PolarHBondContact O-N 3.09Å; V239-C243 PolarHBondContact O-SG 2.73Å; L240-C243 PolarHBondContact O-N 3.37Å; T241-C243 PolarHBondContact O-N 3.32Å |
| 244 | R | 85.1 | Confident | 83.5 | Confident | 171 Ų | 171 | 84.4 Ų | 84.4 | 65% | 0.645 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -71.8 | -35.8 | 177.5 | -70.4 | -69.3 | -171.4 | -133.2 | -1.1 | 113 | Y152 L240 T241 A242 R246 | Y152-R244 HydrophobicContact CE2-CG 4.22Å; L240-R244 WeakPolarHBondContact O-CG 3.37Å; L240-R244 PolarHBondContact O-N 2.9Å; T241-R244 PolarHBondContact O-N 2.77Å; A242-R244 VanDerWaalsContact C-N 3.31Å; A242-R244 PolarHBondContact O-N 3.01Å; R244-R246 VanDerWaalsContact C-N 3.32Å |
| 245 | L | 82.9 | Confident | 82.7 | Confident | 48 Ų | 48 | 90.2 Ų | 90.2 | 25% | 0.251 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -80.9 | -13.1 | 177.4 | -85.5 | 84.8 | 0 | 0 | 0 | 113.3 | L155 T241 A242 Q247 S253 H256 | L155-L245 HydrophobicContact CD1-CD1 3.31Å; L155-L245 HydrophobicContact CD2-CD1 3.86Å; L155-L245 HydrophobicContact CG-CD1 4.23Å; T241-L245 HydrophobicContact CG2-CD1 3.84Å; T241-L245 WeakPolarHBondContact O-CD1 3.41Å; T241-L245 PolarHBondContact O-N 2.97Å; A242-L245 PolarHBondContact O-N 3.06Å; L245-Q247 PolarHBondContact O-N 3.25Å; L245-S253 WeakPolarHBondContact O-CB 3Å; L245-S253 PolarHBondContact O-OG 3.46Å; L245-H256 HydrophobicContact CD2-CB 4.09Å |
| 246 | R | 81.1 | Confident | 81.9 | Confident | 179 Ų | 179 | 92.4 Ų | 92.4 | 68% | 0.675 | 45% | 0.447 | S | S | * | . | trans | -68.9 | 103 | -176.1 | -171.4 | 177.1 | 179.9 | -178 | -1.2 | 110.6 | A242 R244 S253 | A242-R246 WeakPolarHBondContact O-CB 3.34Å; A242-R246 PolarHBondContact O-N 2.87Å; R244-R246 VanDerWaalsContact C-N 3.32Å; R246-S253 WeakPolarHBondContact CA-OG 3.44Å | ||
| 247 | Q | 76.7 | Confident | 81.3 | Confident | 102 Ų | 102 | 89.8 Ų | 89.8 | 48% | 0.477 | 43% | 0.432 | S | S | . | . | trans | -105.5 | 118.9 | 164.4 | -65.3 | -176.8 | 2 | 0 | 0 | 108.2 | L245 E249 Q250 S253 | L245-Q247 PolarHBondContact O-N 3.25Å; Q247-E249 PolarHBondContact O-N 3.48Å; Q247-Q250 HydrophobicContact CB-CB 4.41Å; Q247-Q250 PolarHBondContact O-N 2.86Å; Q247-Q250 VanDerWaalsContact OE1-CD 3.23Å; Q247-S253 PolarHBondContact N-OG 3.22Å; Q247-S253 PolarHBondContact O-OG 3.33Å | ||
| 248 | P | 69.1 | Low | 80.8 | Confident | 125 Ų | 125 | 92.6 Ų | 92.6 | 81% | 0.812 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | -31.9 | -172.1 | -25.1 | 32.1 | 0 | 0 | 0 | 114.2 | ||
| 249 | E | 71.6 | Confident | 80.5 | Confident | 188 Ų | 188 | 93.3 Ų | 93.3 | 88% | 0.879 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.2 | 1 | -170.7 | -56.7 | -142.2 | 132.8 | 0 | 0 | 114.6 | Q247 | Q247-E249 PolarHBondContact O-N 3.48Š|
| 250 | Q | 72.9 | Confident | 80.3 | Confident | 97 Ų | 97 | 90 Ų | 90 | 45% | 0.453 | 43% | 0.431 | S | S | . | . | trans | -111.9 | 119.7 | -176.3 | -69 | -164.6 | 18.4 | 0 | 0 | 113.2 | Q247 K252 S253 R254 | Q247-Q250 HydrophobicContact CB-CB 4.41Å; Q247-Q250 PolarHBondContact O-N 2.86Å; Q247-Q250 VanDerWaalsContact OE1-CD 3.23Å; Q250-K252 PolarHBondContact O-N 3Å; Q250-S253 WeakPolarHBondContact O-CB 3.33Å; Q250-S253 PolarHBondContact O-N 3.35Å; Q250-R254 PolarHBondContact O-N 3.43Å | ||
| 251 | P | 68.9 | Low | 80 | Confident | 113 Ų | 113 | 90.6 Ų | 90.6 | 73% | 0.734 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -62.4 | -26.8 | 177.8 | 23 | -32.1 | 0 | 0 | 0 | 113 | S253 R254 R255 | P251-S253 VanDerWaalsContact C-N 3.32Å; P251-S253 PolarHBondContact O-N 3.47Å; P251-R254 PolarHBondContact O-N 2.84Å; P251-R255 PolarHBondContact O-N 3.33Å |
| 252 | K | 70.8 | Confident | 80.1 | Confident | 158 Ų | 158 | 91.9 Ų | 91.9 | 69% | 0.687 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64 | -35.4 | 173.5 | -66.8 | 180 | -178.9 | 173.7 | 0 | 112.4 | Q250 R255 H256 | Q250-K252 PolarHBondContact O-N 3Å; K252-R255 PolarHBondContact O-N 2.86Å; K252-H256 PolarHBondContact O-N 3.46Å; K252-H256 PolarHBondContact O-ND1 3.14Å |
| 253 | S | 75.1 | Confident | 80 | Confident | 9 Ų | 9 | 91.6 Ų | 91.6 | 6% | 0.063 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -67.8 | -43.4 | 177.9 | 133.7 | 0 | 0 | 0 | 0 | 111.1 | L245 R246 Q247 Q250 P251 R255 H256 C257 | L245-S253 WeakPolarHBondContact O-CB 3Å; L245-S253 PolarHBondContact O-OG 3.46Å; R246-S253 WeakPolarHBondContact CA-OG 3.44Å; Q247-S253 PolarHBondContact N-OG 3.22Å; Q247-S253 PolarHBondContact O-OG 3.33Å; Q250-S253 WeakPolarHBondContact O-CB 3.33Å; Q250-S253 PolarHBondContact O-N 3.35Å; P251-S253 VanDerWaalsContact C-N 3.32Å; P251-S253 PolarHBondContact O-N 3.47Å; S253-R255 VanDerWaalsContact C-N 3.34Å; S253-R255 PolarHBondContact O-N 3.38Å; S253-H256 PolarHBondContact O-N 3.37Å; S253-C257 PolarHBondContact O-N 3.47Å; S253-C257 PolarHBondContact O-SG 3.24Å |
| 254 | R | 77.5 | Confident | 80.2 | Confident | 184 Ų | 184 | 89 Ų | 89 | 69% | 0.694 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -58.1 | -43.5 | 174.3 | -176 | 178.5 | 176.8 | -173.4 | -0.8 | 112.2 | Q250 P251 H256 C257 L258 | Q250-R254 PolarHBondContact O-N 3.43Å; P251-R254 PolarHBondContact O-N 2.84Å; R254-H256 PolarHBondContact O-N 3.49Å; R254-C257 PolarHBondContact O-N 2.84Å; R254-L258 HydrophobicContact CG-CD1 4.29Å; R254-L258 WeakPolarHBondContact O-CG 3.22Å; R254-L258 PolarHBondContact O-N 2.97Å |
| 255 | R | 79.8 | Confident | 80.6 | Confident | 122 Ų | 122 | 83 Ų | 83 | 46% | 0.46 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.2 | -40.7 | 177.7 | -176.8 | 175.8 | 171.9 | 165.9 | -0 | 112.2 | P251 K252 S253 L258 L259 L323 | P251-R255 PolarHBondContact O-N 3.33Å; K252-R255 PolarHBondContact O-N 2.86Å; S253-R255 VanDerWaalsContact C-N 3.34Å; S253-R255 PolarHBondContact O-N 3.38Å; R255-L258 PolarHBondContact O-N 2.93Å; R255-L259 PolarHBondContact O-N 3.26Å; R255-L323 PolarHBondContact NE-O 3.29Å; R255-L323 PolarHBondContact NH2-O 3.42Å |
| 256 | H | 78.6 | Confident | 81.1 | Confident | 65 Ų | 65 | 81.8 Ų | 81.8 | 30% | 0.301 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.4 | -42 | 175.7 | -66.4 | 148.2 | 0 | 0 | 0 | 112.1 | L245 K252 S253 R254 L258 L259 M260 | L245-H256 HydrophobicContact CD2-CB 4.09Å; K252-H256 PolarHBondContact O-N 3.46Å; K252-H256 PolarHBondContact O-ND1 3.14Å; S253-H256 PolarHBondContact O-N 3.37Å; R254-H256 PolarHBondContact O-N 3.49Å; H256-L258 PolarHBondContact O-N 3.02Å; H256-L259 WeakPolarHBondContact O-CB 3.47Å; H256-L259 PolarHBondContact O-N 2.99Å; H256-M260 WeakPolarHBondContact O-CG 3.17Å; H256-M260 PolarHBondContact O-N 3.2Å |
| 257 | C | 83.1 | Confident | 81.7 | Confident | 23 Ų | 23 | 73.5 Ų | 73.5 | 16% | 0.155 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -61.5 | -44 | 174.9 | -64.9 | 0 | 0 | 0 | 0 | 112.2 | A242 S253 R254 L259 M260 C261 | A242-C257 HydrophobicContact CB-CB 4.33Å; A242-C257 PolarHBondContact O-SG 2.89Å; S253-C257 PolarHBondContact O-N 3.47Å; S253-C257 PolarHBondContact O-SG 3.24Å; R254-C257 PolarHBondContact O-N 2.84Å; C257-L259 VanDerWaalsContact C-N 3.27Å; C257-L259 PolarHBondContact O-N 3.35Å; C257-M260 WeakPolarHBondContact O-CB 3.32Å; C257-M260 PolarHBondContact O-N 2.9Å; C257-M260 VanDerWaalsContact O-N 3.13Å; C257-C261 PolarHBondContact O-N 3.12Å; C257-C261 PolarHBondContact O-SG 3.12Å; C257-C261 VanDerWaalsContact O-SG 3.42Å |
| 258 | L | 84.4 | Confident | 82.6 | Confident | 106 Ų | 106 | 70.5 Ų | 70.5 | 56% | 0.555 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -60 | -38.6 | 175.4 | -72.6 | 171.5 | 0 | 0 | 0 | 111.9 | R254 R255 H256 C261 A262 | R254-L258 HydrophobicContact CG-CD1 4.29Å; R254-L258 WeakPolarHBondContact O-CG 3.22Å; R254-L258 PolarHBondContact O-N 2.97Å; R255-L258 PolarHBondContact O-N 2.93Å; H256-L258 PolarHBondContact O-N 3.02Å; L258-C261 PolarHBondContact O-N 3.07Å; L258-A262 WeakPolarHBondContact O-CB 3.39Å; L258-A262 PolarHBondContact O-N 3.07Å |
| 259 | L | 84.3 | Confident | 83.8 | Confident | 16 Ų | 16 | 69.4 Ų | 69.4 | 8% | 0.084 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.5 | -40.5 | 175.1 | -173.5 | 63.6 | 0 | 0 | 0 | 111.9 | R255 H256 C257 A262 Y263 L319 L323 | R255-L259 PolarHBondContact O-N 3.26Å; H256-L259 WeakPolarHBondContact O-CB 3.47Å; H256-L259 PolarHBondContact O-N 2.99Å; C257-L259 VanDerWaalsContact C-N 3.27Å; C257-L259 PolarHBondContact O-N 3.35Å; L259-A262 WeakPolarHBondContact O-CB 3.33Å; L259-A262 PolarHBondContact O-N 3.1Å; L259-Y263 HydrophobicContact CD1-CE2 4.38Å; L259-Y263 HydrophobicContact CD2-CE2 4.22Å; L259-Y263 HydrophobicContact CG-CE2 3.72Å; L259-Y263 VanDerWaalsContact O-CD2 3.23Å; L259-Y263 WeakPolarHBondContact O-CD2 3.5Å; L259-Y263 PolarHBondContact O-N 2.79Å; L259-L319 HydrophobicContact CD1-CD2 4.44Å; L259-L319 WeakPolarHBondContact CD1-O 3.5Å; L259-L323 HydrophobicContact CD1-CB 3.76Å; L259-L323 HydrophobicContact CD1-CD1 4.31Å; L259-L323 HydrophobicContact CD1-CG 4.42Å |
| 260 | M | 86.7 | Confident | 85 | Confident | 15 Ų | 15 | 60.5 Ų | 60.5 | 7% | 0.074 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -63 | -43 | 174.6 | -62.8 | -50.8 | 132.1 | 0 | 0 | 112 | N238 T241 A242 H256 C257 A262 Y263 V264 | N238-M260 HydrophobicContact CB-CB 4.19Å; N238-M260 HydrophobicContact CB-SD 4.44Å; N238-M260 PolarHBondContact OD1-SD 3.37Å; T241-M260 HydrophobicContact CG2-CE 4.48Å; T241-M260 HydrophobicContact CG2-CG 4.5Å; T241-M260 HydrophobicContact CG2-SD 4.09Å; A242-M260 HydrophobicContact CB-CB 3.99Å; A242-M260 HydrophobicContact CB-CG 4.02Å; H256-M260 WeakPolarHBondContact O-CG 3.17Å; H256-M260 PolarHBondContact O-N 3.2Å; C257-M260 WeakPolarHBondContact O-CB 3.32Å; C257-M260 PolarHBondContact O-N 2.9Å; C257-M260 VanDerWaalsContact O-N 3.13Å; M260-A262 VanDerWaalsContact C-N 3.31Å; M260-A262 PolarHBondContact O-N 3.32Å; M260-Y263 HydrophobicContact CE-CE2 4.04Å; M260-Y263 PolarHBondContact O-N 3.36Å; M260-Y263 HydrophobicContact SD-CD2 4.01Å; M260-Y263 HydrophobicContact SD-CE2 4.07Å; M260-V264 PolarHBondContact O-N 3.01Å |
| 261 | C | 87 | Confident | 86.1 | Confident | 81 Ų | 81 | 56 Ų | 56 | 55% | 0.547 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.6 | -38.7 | 173.4 | -65.7 | 0 | 0 | 0 | 0 | 111.9 | C257 L258 Y263 V264 A265 | C257-C261 PolarHBondContact O-N 3.12Å; C257-C261 PolarHBondContact O-SG 3.12Å; C257-C261 VanDerWaalsContact O-SG 3.42Å; L258-C261 PolarHBondContact O-N 3.07Å; C261-Y263 PolarHBondContact O-N 2.8Å; C261-V264 PolarHBondContact O-N 2.74Å; C261-A265 WeakPolarHBondContact O-CB 3.41Å; C261-A265 PolarHBondContact O-N 2.7Å |
| 262 | A | 89.3 | Confident | 87.4 | Confident | 31 Ų | 31 | 53.8 Ų | 53.8 | 26% | 0.256 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.6 | -39.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L258 L259 M260 V264 A265 V266 L319 | L258-A262 WeakPolarHBondContact O-CB 3.39Å; L258-A262 PolarHBondContact O-N 3.07Å; L259-A262 WeakPolarHBondContact O-CB 3.33Å; L259-A262 PolarHBondContact O-N 3.1Å; M260-A262 VanDerWaalsContact C-N 3.31Å; M260-A262 PolarHBondContact O-N 3.32Å; A262-V264 VanDerWaalsContact C-N 3.35Å; A262-V264 PolarHBondContact O-N 2.84Å; A262-A265 PolarHBondContact O-N 3.14Å; A262-V266 WeakPolarHBondContact O-CB 3.09Å; A262-V266 VanDerWaalsContact O-CG2 3.3Å; A262-V266 WeakPolarHBondContact O-CG2 3.3Å; A262-V266 PolarHBondContact O-N 2.56Å; A262-L319 HydrophobicContact CB-CD2 4.09Å |
| 263 | Y | 87.3 | Confident | 88.6 | Confident | 7 Ų | 7 | 48.4 Ų | 48.4 | 3% | 0.027 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.4 | -46.1 | 174.8 | -68.1 | -54.1 | 0 | 0 | 0 | 112.2 | R151 L259 M260 C261 F267 L319 Y320 | R151-Y263 PolarHBondContact NH1-OH 3.29Å; L259-Y263 HydrophobicContact CD1-CE2 4.38Å; L259-Y263 HydrophobicContact CD2-CE2 4.22Å; L259-Y263 HydrophobicContact CG-CE2 3.72Å; L259-Y263 VanDerWaalsContact O-CD2 3.23Å; L259-Y263 WeakPolarHBondContact O-CD2 3.5Å; L259-Y263 PolarHBondContact O-N 2.79Å; M260-Y263 HydrophobicContact CE-CE2 4.04Å; M260-Y263 PolarHBondContact O-N 3.36Å; M260-Y263 HydrophobicContact SD-CD2 4.01Å; M260-Y263 HydrophobicContact SD-CE2 4.07Å; C261-Y263 PolarHBondContact O-N 2.8Å; Y263-F267 WeakPolarHBondContact O-CB 3.48Å; Y263-F267 PolarHBondContact O-N 3.11Å; Y263-F267 VanDerWaalsContact O-N 3.08Å; Y263-L319 HydrophobicContact CD1-CB 3.9Å; Y263-L319 HydrophobicContact CD1-CD1 3.55Å; Y263-L319 HydrophobicContact CD1-CG 4.35Å; Y263-L319 HydrophobicContact CE1-CB 3.29Å; Y263-L319 HydrophobicContact CE1-CD1 3.88Å; Y263-L319 HydrophobicContact CE1-CG 4.2Å; Y263-L319 PolarHBondContact OH-O 3.16Å; Y263-L319 VanDerWaalsContact OH-O 3.09Å; Y263-Y320 AromaticContact CD1-CE1 3.71Å; Y263-Y320 HydrophobicContact CD1-CE1 3.71Å; Y263-Y320 AromaticContact CD1-CZ 3.9Å; Y263-Y320 AromaticContact CE1-CD1 3.46Å; Y263-Y320 HydrophobicContact CE1-CD1 3.46Å; Y263-Y320 VanDerWaalsContact CE1-CD1 3.46Å; Y263-Y320 AromaticContact CE1-CE1 2.97Å; Y263-Y320 HydrophobicContact CE1-CE1 2.97Å; Y263-Y320 HydrophobicContact CE1-CE2 4.41Å; Y263-Y320 HydrophobicContact CE1-CG 4.34Å; Y263-Y320 AromaticContact CE1-CZ 3.48Å; Y263-Y320 VanDerWaalsContact CE1-CZ 3.48Å; Y263-Y320 HydrophobicContact CE2-CE1 4.33Å; Y263-Y320 AromaticContact CZ-CD1 3.55Å; Y263-Y320 AromaticContact CZ-CE1 3.38Å; Y263-Y320 WeakPolarHBondContact OH-CD1 3.42Å |
| 264 | V | 91.9 | Very high | 89.6 | Confident | 28 Ų | 28 | 48.5 Ų | 48.5 | 17% | 0.17 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -66.7 | -45.6 | -179.9 | -178.4 | 0 | 0 | 0 | 0 | 110.8 | F231 I234 A235 N238 M260 C261 A262 F267 V268 | F231-V264 HydrophobicContact CE2-CG1 3.89Å; I234-V264 HydrophobicContact CG2-CG2 4.48Å; A235-V264 HydrophobicContact CB-CG1 4.14Å; A235-V264 HydrophobicContact CB-CG2 4.41Å; N238-V264 HydrophobicContact CB-CG2 4.15Å; M260-V264 PolarHBondContact O-N 3.01Å; C261-V264 PolarHBondContact O-N 2.74Å; A262-V264 VanDerWaalsContact C-N 3.35Å; A262-V264 PolarHBondContact O-N 2.84Å; V264-F267 PolarHBondContact O-N 3.45Å; V264-V268 WeakPolarHBondContact O-CG2 3.47Å; V264-V268 PolarHBondContact O-N 3.37Å; V264-V268 VanDerWaalsContact O-N 3.09Å |
| 265 | A | 93.3 | Very high | 90.5 | Very high | 45 Ų | 45 | 39.9 Ų | 39.9 | 37% | 0.372 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.5 | -45.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | C261 A262 F267 V268 I269 | C261-A265 WeakPolarHBondContact O-CB 3.41Å; C261-A265 PolarHBondContact O-N 2.7Å; A262-A265 PolarHBondContact O-N 3.14Å; A265-F267 VanDerWaalsContact C-N 3.35Å; A265-F267 PolarHBondContact O-N 3.34Å; A265-V268 PolarHBondContact O-N 3.36Å; A265-I269 WeakPolarHBondContact O-CB 3.08Å; A265-I269 VanDerWaalsContact O-CG1 3.25Å; A265-I269 WeakPolarHBondContact O-CG1 3.27Å; A265-I269 PolarHBondContact O-N 3.13Å |
| 266 | V | 93 | Very high | 91.2 | Very high | 24 Ų | 24 | 37.2 Ų | 37.2 | 15% | 0.145 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.6 | -42.9 | 178.2 | 166.2 | 0 | 0 | 0 | 0 | 111 | A262 V268 I269 C270 I315 L319 | A262-V266 WeakPolarHBondContact O-CB 3.09Å; A262-V266 VanDerWaalsContact O-CG2 3.3Å; A262-V266 WeakPolarHBondContact O-CG2 3.3Å; A262-V266 PolarHBondContact O-N 2.56Å; V266-V268 VanDerWaalsContact C-N 3.32Å; V266-V268 PolarHBondContact O-N 2.92Å; V266-I269 PolarHBondContact O-N 2.96Å; V266-C270 WeakPolarHBondContact O-CB 3.4Å; V266-C270 PolarHBondContact O-N 2.03Å; V266-C270 PolarHBondContact O-SG 3.29Å; V266-I315 HydrophobicContact CB-CG2 4.29Å; V266-I315 HydrophobicContact CG1-CB 3.97Å; V266-I315 HydrophobicContact CG1-CD1 4.12Å; V266-I315 HydrophobicContact CG1-CG2 3.52Å; V266-I315 HydrophobicContact CG2-CG2 3.82Å; V266-L319 HydrophobicContact CB-CD1 4.1Å; V266-L319 HydrophobicContact CG1-CD1 4.21Å; V266-L319 HydrophobicContact CG2-CD1 4.01Å |
| 267 | F | 94 | Very high | 92.1 | Very high | 5 Ų | 5 | 34.5 Ų | 34.5 | 2% | 0.022 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -57.7 | -46.6 | 176.1 | -170.9 | -92.5 | 0 | 0 | 0 | 111.4 | I141 L144 F227 P230 F231 I234 Y263 V264 A265 W271 | I141-F267 HydrophobicContact CG2-CE2 4.35Å; I141-F267 HydrophobicContact CG2-CZ 4.45Å; L144-F267 HydrophobicContact CD2-CD2 3.76Å; L144-F267 HydrophobicContact CD2-CE2 4.27Å; F227-F267 HydrophobicContact CD2-CD1 4.28Å; F227-F267 AromaticContact CD2-CE1 3.63Å; F227-F267 HydrophobicContact CD2-CE1 3.63Å; F227-F267 HydrophobicContact CD2-CZ 4.44Å; F227-F267 HydrophobicContact CE2-CD1 4.25Å; F227-F267 HydrophobicContact CE2-CE1 4.02Å; P230-F267 HydrophobicContact CB-CE1 4.4Å; P230-F267 HydrophobicContact CB-CE2 4.44Å; P230-F267 HydrophobicContact CB-CZ 3.76Å; F231-F267 HydrophobicContact CB-CD1 4.19Å; F231-F267 HydrophobicContact CB-CE1 3.84Å; F231-F267 HydrophobicContact CD2-CD1 4.16Å; I234-F267 HydrophobicContact CD1-CD1 4.44Å; I234-F267 HydrophobicContact CD1-CD2 3.67Å; I234-F267 HydrophobicContact CD1-CE1 4.44Å; I234-F267 HydrophobicContact CD1-CE2 3.68Å; I234-F267 HydrophobicContact CD1-CG 4.07Å; I234-F267 HydrophobicContact CD1-CZ 4.1Å; Y263-F267 WeakPolarHBondContact O-CB 3.48Å; Y263-F267 PolarHBondContact O-N 3.11Å; Y263-F267 VanDerWaalsContact O-N 3.08Å; V264-F267 PolarHBondContact O-N 3.45Å; A265-F267 VanDerWaalsContact C-N 3.35Å; A265-F267 PolarHBondContact O-N 3.34Å; F267-W271 AromaticContact CD2-CD1 3.53Å; F267-W271 AromaticContact CD2-NE1 3.84Å; F267-W271 HydrophobicContact CE1-CB 4.48Å; F267-W271 HydrophobicContact CE1-CG 4.46Å; F267-W271 AromaticContact CE2-CD1 3.47Å; F267-W271 VanDerWaalsContact CE2-CD1 3.47Å; F267-W271 HydrophobicContact CE2-CG 4.2Å; F267-W271 AromaticContact CE2-NE1 3.62Å; F267-W271 AromaticContact CG-CD1 3.94Å; F267-W271 AromaticContact CZ-CD1 3.83Å; F267-W271 HydrophobicContact CZ-CG 4.15Å; F267-W271 WeakPolarHBondContact O-CB 3.24Å; F267-W271 VanDerWaalsContact O-CD1 3.22Å; F267-W271 PolarHBondContact O-N 3.46Å |
| 268 | V | 95.8 | Very high | 92.6 | Very high | 39 Ų | 39 | 34.5 Ų | 34.5 | 24% | 0.236 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.1 | -47.5 | 177.9 | 175.1 | 0 | 0 | 0 | 0 | 111.8 | F231 V264 A265 V266 C270 W271 L272 | F231-V268 HydrophobicContact CD2-CG2 3.65Å; F231-V268 HydrophobicContact CE2-CG2 3.24Å; F231-V268 HydrophobicContact CZ-CG2 4.1Å; V264-V268 WeakPolarHBondContact O-CG2 3.47Å; V264-V268 PolarHBondContact O-N 3.37Å; V264-V268 VanDerWaalsContact O-N 3.09Å; A265-V268 PolarHBondContact O-N 3.36Å; V266-V268 VanDerWaalsContact C-N 3.32Å; V266-V268 PolarHBondContact O-N 2.92Å; V268-C270 VanDerWaalsContact C-N 3.29Å; V268-C270 PolarHBondContact O-N 2.83Å; V268-W271 PolarHBondContact O-N 3.24Å; V268-L272 HydrophobicContact CG1-CB 4.04Å; V268-L272 HydrophobicContact CG1-CD2 3.87Å; V268-L272 WeakPolarHBondContact O-CB 3Å; V268-L272 PolarHBondContact O-N 3.12Å |
| 269 | I | 95.2 | Very high | 93 | Very high | 102 Ų | 102 | 32 Ų | 32 | 52% | 0.523 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -62.9 | -37.7 | -177.4 | -69.5 | 165.2 | 0 | 0 | 0 | 111.5 | A265 V266 P273 | A265-I269 WeakPolarHBondContact O-CB 3.08Å; A265-I269 VanDerWaalsContact O-CG1 3.25Å; A265-I269 WeakPolarHBondContact O-CG1 3.27Å; A265-I269 PolarHBondContact O-N 3.13Å; V266-I269 PolarHBondContact O-N 2.96Å; I269-P273 WeakPolarHBondContact O-CD 3.45Å; I269-P273 WeakPolarHBondContact O-CG 3.09Å |
| 270 | C | 95.3 | Very high | 93.5 | Very high | 1 Ų | 1 | 33.7 Ų | 33.7 | 1% | 0.007 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -74.7 | -46.7 | 179.2 | -61.3 | 0 | 0 | 0 | 0 | 111.6 | V266 V268 F308 S309 H312 | V266-C270 WeakPolarHBondContact O-CB 3.4Å; V266-C270 PolarHBondContact O-N 2.03Å; V266-C270 PolarHBondContact O-SG 3.29Å; V268-C270 VanDerWaalsContact C-N 3.29Å; V268-C270 PolarHBondContact O-N 2.83Å; C270-F308 CarbonylContact C-O 3.57Å; C270-F308 WeakPolarHBondContact CA-O 3.34Å; C270-F308 WeakPolarHBondContact CB-O 3.49Å; C270-F308 CarbonylContact O-C 3.54Å; C270-S309 VanDerWaalsContact O-CA 3.26Å; C270-S309 WeakPolarHBondContact O-CA 3.13Å; C270-S309 PolarHBondContact O-N 2.97Å; C270-S309 VanDerWaalsContact O-N 3.12Å; C270-H312 HydrophobicContact CB-CB 4.19Å |
| 271 | W | 95.9 | Very high | 93.7 | Very high | 1 Ų | 1 | 33.9 Ų | 33.9 | 0% | 0.004 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -95.9 | -35.4 | -166 | -70.3 | 99.6 | 0 | 0 | 0 | 115.1 | M137 I141 F227 F267 V268 Y274 H275 H312 | M137-W271 HydrophobicContact CG-CH2 3.41Å; M137-W271 VanDerWaalsContact CG-CH2 3.41Å; M137-W271 HydrophobicContact CG-CZ2 4.39Å; M137-W271 HydrophobicContact CG-CZ3 4.07Å; M137-W271 HydrophobicContact SD-CH2 3.85Å; M137-W271 HydrophobicContact SD-CZ3 3.86Å; I141-W271 HydrophobicContact CD1-CD2 4.5Å; I141-W271 HydrophobicContact CD1-CE3 4.41Å; I141-W271 HydrophobicContact CD1-CH2 3.56Å; I141-W271 HydrophobicContact CD1-CZ2 3.56Å; I141-W271 HydrophobicContact CD1-CZ3 3.96Å; I141-W271 HydrophobicContact CG1-CH2 4.11Å; I141-W271 HydrophobicContact CG1-CZ2 3.61Å; F227-W271 HydrophobicContact CD2-CB 3.68Å; F227-W271 HydrophobicContact CE2-CB 4.24Å; F267-W271 AromaticContact CD2-CD1 3.53Å; F267-W271 AromaticContact CD2-NE1 3.84Å; F267-W271 HydrophobicContact CE1-CB 4.48Å; F267-W271 HydrophobicContact CE1-CG 4.46Å; F267-W271 AromaticContact CE2-CD1 3.47Å; F267-W271 VanDerWaalsContact CE2-CD1 3.47Å; F267-W271 HydrophobicContact CE2-CG 4.2Å; F267-W271 AromaticContact CE2-NE1 3.62Å; F267-W271 AromaticContact CG-CD1 3.94Å; F267-W271 AromaticContact CZ-CD1 3.83Å; F267-W271 HydrophobicContact CZ-CG 4.15Å; F267-W271 WeakPolarHBondContact O-CB 3.24Å; F267-W271 VanDerWaalsContact O-CD1 3.22Å; F267-W271 PolarHBondContact O-N 3.46Å; V268-W271 PolarHBondContact O-N 3.24Å; W271-Y274 PolarHBondContact O-N 3.39Å; W271-H275 AromaticContact CE3-NE2 3.48Å; W271-H275 PolarHBondContact O-CD2 3.37Å; W271-H275 VanDerWaalsContact O-CD2 3.24Å; W271-H275 PolarHBondContact O-N 2.88Å; W271-H275 VanDerWaalsContact O-N 3.12Å; W271-H312 AromaticContact CH2-CE1 3.99Å; W271-H312 AromaticContact CZ2-CE1 3.43Å; W271-H312 VanDerWaalsContact CZ2-CE1 3.43Å; W271-H312 WeakPolarHBondContact CZ2-CE1 3.4Å; W271-H312 AromaticContact CZ2-CG 3.91Å; W271-H312 AromaticContact CZ2-ND1 3.41Å; W271-H312 WeakPolarHBondContact CZ2-ND1 3.36Å; W271-H312 AromaticContact CZ2-NE2 3.92Å; W271-H312 AromaticContact NE1-CG 3.97Å |
| 272 | L | 96.6 | Very high | 93.9 | Very high | 68 Ų | 68 | 31.4 Ų | 31.4 | 36% | 0.356 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -60.9 | -45.3 | -174.2 | -178.1 | 68.6 | 0 | 0 | 0 | 112.6 | F227 V268 Y274 H275 V276 | F227-L272 HydrophobicContact CE1-CD1 3.61Å; F227-L272 HydrophobicContact CE2-CB 4.12Å; F227-L272 HydrophobicContact CE2-CD1 4.46Å; F227-L272 HydrophobicContact CZ-CB 3.99Å; F227-L272 HydrophobicContact CZ-CD1 3.58Å; F227-L272 HydrophobicContact CZ-CG 4.33Å; V268-L272 HydrophobicContact CG1-CB 4.04Å; V268-L272 HydrophobicContact CG1-CD2 3.87Å; V268-L272 WeakPolarHBondContact O-CB 3Å; V268-L272 PolarHBondContact O-N 3.12Å; L272-Y274 VanDerWaalsContact C-N 3.3Å; L272-Y274 PolarHBondContact O-N 3.28Å; L272-H275 PolarHBondContact O-N 2.79Å; L272-V276 HydrophobicContact CD1-CG2 3.6Å; L272-V276 HydrophobicContact CG-CG2 3.98Å; L272-V276 WeakPolarHBondContact O-CB 3.33Å; L272-V276 VanDerWaalsContact O-CG2 3.25Å; L272-V276 WeakPolarHBondContact O-CG2 3.35Å; L272-V276 PolarHBondContact O-N 2.96Å |
| 273 | P | 96.6 | Very high | 94 | Very high | 45 Ų | 45 | 31.6 Ų | 31.6 | 29% | 0.292 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -58.3 | -42.7 | -179.5 | -24.9 | 35.9 | 0 | 0 | 0 | 112.6 | I269 T277 I305 | I269-P273 WeakPolarHBondContact O-CD 3.45Å; I269-P273 WeakPolarHBondContact O-CG 3.09Å; P273-T277 VanDerWaalsContact O-CB 3.29Å; P273-T277 WeakPolarHBondContact O-CB 3.37Å; P273-T277 PolarHBondContact O-N 2.9Å; P273-T277 PolarHBondContact O-OG1 2.88Å; P273-I305 VanDerWaalsContact C-CG2 3.49Å; P273-I305 HydrophobicContact CB-CG2 3.99Å; P273-I305 WeakPolarHBondContact O-CG2 3.44Å |
| 274 | Y | 95.8 | Very high | 94 | Very high | 10 Ų | 10 | 34.3 Ų | 34.3 | 4% | 0.039 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.5 | -54.7 | 178.3 | 172.5 | -103.6 | 0 | 0 | 0 | 111.8 | W271 L272 V276 T277 L278 Y302 D306 | W271-Y274 PolarHBondContact O-N 3.39Å; L272-Y274 VanDerWaalsContact C-N 3.3Å; L272-Y274 PolarHBondContact O-N 3.28Å; Y274-V276 PolarHBondContact O-N 3.02Å; Y274-T277 PolarHBondContact O-N 3.49Å; Y274-L278 HydrophobicContact CE1-CD2 4.29Å; Y274-L278 WeakPolarHBondContact O-CB 3.49Å; Y274-L278 PolarHBondContact O-N 2.87Å; Y274-Y302 HydrophobicContact CE2-CE2 4.46Å; Y274-D306 HydrophobicContact CD2-CB 4.07Å; Y274-D306 WeakPolarHBondContact CD2-OD1 3.16Å; Y274-D306 HydrophobicContact CE2-CB 4.28Å; Y274-D306 WeakPolarHBondContact CE2-OD1 3.31Å |
| 275 | H | 96 | Very high | 93.3 | Very high | 4 Ų | 4 | 36 Ų | 36 | 2% | 0.019 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.7 | -34.5 | -176.5 | -74.1 | -66.1 | 0 | 0 | 0 | 113.5 | T222 T223 F227 W271 L272 L279 | T222-H275 PolarHBondContact O-CE1 3.42Å; T222-H275 VanDerWaalsContact O-CE1 3.29Å; T223-H275 WeakPolarHBondContact CA-ND1 3.2Å; T223-H275 HydrophobicContact CG2-CB 4.12Å; T223-H275 PolarHBondContact OG1-ND1 2.89Å; F227-H275 HydrophobicContact CB-CB 4.48Å; F227-H275 WeakPolarHBondContact CB-CD2 3.39Å; F227-H275 AromaticContact CG-CD2 3.99Å; W271-H275 AromaticContact CE3-NE2 3.48Å; W271-H275 PolarHBondContact O-CD2 3.37Å; W271-H275 VanDerWaalsContact O-CD2 3.24Å; W271-H275 PolarHBondContact O-N 2.88Å; W271-H275 VanDerWaalsContact O-N 3.12Å; L272-H275 PolarHBondContact O-N 2.79Å; H275-L279 VanDerWaalsContact O-CB 3.31Å; H275-L279 WeakPolarHBondContact O-CB 3.16Å; H275-L279 PolarHBondContact O-N 3.03Å |
| 276 | V | 96.3 | Very high | 92.7 | Very high | 65 Ų | 65 | 37.5 Ų | 37.5 | 39% | 0.394 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -64.4 | -47 | 173.5 | 170.1 | 0 | 0 | 0 | 0 | 110.2 | L272 Y274 L279 L280 | L272-V276 HydrophobicContact CD1-CG2 3.6Å; L272-V276 HydrophobicContact CG-CG2 3.98Å; L272-V276 WeakPolarHBondContact O-CB 3.33Å; L272-V276 VanDerWaalsContact O-CG2 3.25Å; L272-V276 WeakPolarHBondContact O-CG2 3.35Å; L272-V276 PolarHBondContact O-N 2.96Å; Y274-V276 PolarHBondContact O-N 3.02Å; V276-L279 PolarHBondContact O-N 3.38Å; V276-L280 HydrophobicContact CG1-CD1 3.83Å; V276-L280 HydrophobicContact CG1-CG 4.29Å; V276-L280 WeakPolarHBondContact O-CB 3.32Å; V276-L280 VanDerWaalsContact O-CG 3.25Å; V276-L280 WeakPolarHBondContact O-CG 3.4Å; V276-L280 PolarHBondContact O-N 3.01Å |
| 277 | T | 95.4 | Very high | 92.4 | Very high | 8 Ų | 8 | 42.7 Ų | 42.7 | 5% | 0.049 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.3 | -46 | 179.7 | -59.4 | 0 | 0 | 0 | 0 | 111.4 | P273 Y274 L279 L280 L281 L298 Y302 I305 | P273-T277 VanDerWaalsContact O-CB 3.29Å; P273-T277 WeakPolarHBondContact O-CB 3.37Å; P273-T277 PolarHBondContact O-N 2.9Å; P273-T277 PolarHBondContact O-OG1 2.88Å; Y274-T277 PolarHBondContact O-N 3.49Å; T277-L279 PolarHBondContact O-N 2.87Å; T277-L280 PolarHBondContact O-N 2.59Å; T277-L281 HydrophobicContact CG2-CD1 3.94Å; T277-L281 HydrophobicContact CG2-CG 4.33Å; T277-L281 WeakPolarHBondContact O-CB 3.38Å; T277-L281 WeakPolarHBondContact O-CG 3.07Å; T277-L281 PolarHBondContact O-N 3.27Å; T277-L298 HydrophobicContact CG2-CB 4.31Å; T277-L298 HydrophobicContact CG2-CD2 4.01Å; T277-Y302 HydrophobicContact CG2-CD2 4.01Å; T277-I305 HydrophobicContact CG2-CD1 4.1Å |
| 278 | L | 93.8 | Very high | 92.1 | Very high | 23 Ų | 23 | 45.1 Ų | 45.1 | 12% | 0.12 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -56.4 | -49.8 | 176.3 | -173.4 | 69.1 | 0 | 0 | 0 | 110.9 | T219 Y274 L280 L281 T282 Y302 | T219-L278 HydrophobicContact CG2-CD2 3.97Å; T219-L278 HydrophobicContact CG2-CG 3.72Å; Y274-L278 HydrophobicContact CE1-CD2 4.29Å; Y274-L278 WeakPolarHBondContact O-CB 3.49Å; Y274-L278 PolarHBondContact O-N 2.87Å; L278-L280 PolarHBondContact O-N 3Å; L278-L281 PolarHBondContact O-N 3.12Å; L278-T282 WeakPolarHBondContact O-CB 3.42Å; L278-T282 PolarHBondContact O-N 2.94Å; L278-T282 PolarHBondContact O-OG1 3.12Å; L278-Y302 HydrophobicContact CD1-CE2 4.47Å |
| 279 | L | 94.6 | Very high | 91.7 | Very high | 53 Ų | 53 | 48.8 Ų | 48.8 | 28% | 0.277 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63.3 | -43 | 179.3 | -173.7 | 66.8 | 0 | 0 | 0 | 112.5 | T219 L220 H275 V276 T277 T282 L283 | T219-L279 HydrophobicContact CG2-CD1 4.32Å; L220-L279 HydrophobicContact CD2-CD1 3.96Å; H275-L279 VanDerWaalsContact O-CB 3.31Å; H275-L279 WeakPolarHBondContact O-CB 3.16Å; H275-L279 PolarHBondContact O-N 3.03Å; V276-L279 PolarHBondContact O-N 3.38Å; T277-L279 PolarHBondContact O-N 2.87Å; L279-T282 PolarHBondContact O-N 2.93Å; L279-L283 HydrophobicContact CD1-CD1 3.86Å; L279-L283 HydrophobicContact CD1-CG 4.06Å; L279-L283 HydrophobicContact CD2-CD1 4.36Å; L279-L283 HydrophobicContact CG-CD1 3.73Å; L279-L283 HydrophobicContact CG-CG 4.27Å; L279-L283 WeakPolarHBondContact O-CB 3.42Å; L279-L283 VanDerWaalsContact O-CG 3.23Å; L279-L283 WeakPolarHBondContact O-CG 3.32Å; L279-L283 PolarHBondContact O-N 3.37Å |
| 280 | L | 94.2 | Very high | 91.4 | Very high | 52 Ų | 52 | 45.7 Ų | 45.7 | 27% | 0.272 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 178.6 | -75.1 | 176.6 | 0 | 0 | 0 | 111.9 | V276 T277 L278 H284 I288 L290 L298 | V276-L280 HydrophobicContact CG1-CD1 3.83Å; V276-L280 HydrophobicContact CG1-CG 4.29Å; V276-L280 WeakPolarHBondContact O-CB 3.32Å; V276-L280 VanDerWaalsContact O-CG 3.25Å; V276-L280 WeakPolarHBondContact O-CG 3.4Å; V276-L280 PolarHBondContact O-N 3.01Å; T277-L280 PolarHBondContact O-N 2.59Å; L278-L280 PolarHBondContact O-N 3Å; L280-H284 WeakPolarHBondContact O-CB 3.39Å; L280-H284 PolarHBondContact O-N 3.23Å; L280-H284 VanDerWaalsContact O-N 3.1Å; L280-I288 HydrophobicContact CD2-CD1 3.99Å; L280-L290 HydrophobicContact CB-CD1 4.03Å; L280-L290 HydrophobicContact CD2-CD1 4.35Å; L280-L290 HydrophobicContact CD2-CD2 4.42Å; L280-L298 HydrophobicContact CB-CD1 4.23Å; L280-L298 HydrophobicContact CD1-CD1 4.23Å |
| 281 | L | 91.3 | Very high | 91 | Very high | 19 Ų | 19 | 50.7 Ų | 50.7 | 10% | 0.099 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.4 | -39.1 | 178.5 | -70.5 | 178.4 | 0 | 0 | 0 | 111.8 | T277 L278 L298 Y299 Y302 | T277-L281 HydrophobicContact CG2-CD1 3.94Å; T277-L281 HydrophobicContact CG2-CG 4.33Å; T277-L281 WeakPolarHBondContact O-CB 3.38Å; T277-L281 WeakPolarHBondContact O-CG 3.07Å; T277-L281 PolarHBondContact O-N 3.27Å; L278-L281 PolarHBondContact O-N 3.12Å; L281-L298 HydrophobicContact CD2-CB 3.81Å; L281-L298 HydrophobicContact CD2-CD1 4.33Å; L281-L298 HydrophobicContact CG-CB 4.29Å; L281-Y299 HydrophobicContact CD1-CD1 4.18Å; L281-Y299 HydrophobicContact CD1-CE1 4.14Å; L281-Y299 HydrophobicContact CD2-CD1 4.39Å; L281-Y299 HydrophobicContact CD2-CD2 3.91Å; L281-Y299 HydrophobicContact CD2-CE1 4.22Å; L281-Y299 HydrophobicContact CD2-CE2 3.72Å; L281-Y299 HydrophobicContact CD2-CG 4.24Å; L281-Y302 HydrophobicContact CD1-CD2 3.9Å; L281-Y302 HydrophobicContact CD1-CE2 4.46Å |
| 282 | T | 90.7 | Very high | 90.4 | Very high | 29 Ų | 29 | 53.4 Ų | 53.4 | 18% | 0.178 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -72.5 | -36.5 | 178.5 | -56.7 | 0 | 0 | 0 | 0 | 113.5 | A215 L216 T219 L278 L279 H284 | A215-T282 HydrophobicContact CB-CG2 4.29Å; L216-T282 HydrophobicContact CB-CG2 4.23Å; L216-T282 HydrophobicContact CD1-CG2 4.23Å; T219-T282 HydrophobicContact CG2-CG2 4.31Å; T219-T282 PolarHBondContact OG1-OG1 3.42Å; L278-T282 WeakPolarHBondContact O-CB 3.42Å; L278-T282 PolarHBondContact O-N 2.94Å; L278-T282 PolarHBondContact O-OG1 3.12Å; L279-T282 PolarHBondContact O-N 2.93Å; T282-H284 VanDerWaalsContact C-N 3.31Å |
| 283 | L | 90.7 | Very high | 89.9 | Confident | 35 Ų | 35 | 54.6 Ų | 54.6 | 18% | 0.183 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -76.5 | -21.4 | 178 | -68.4 | 175.6 | 0 | 0 | 0 | 112.6 | L216 L279 G285 T286 H287 I288 | L216-L283 HydrophobicContact CD1-CD2 3.74Å; L279-L283 HydrophobicContact CD1-CD1 3.86Å; L279-L283 HydrophobicContact CD1-CG 4.06Å; L279-L283 HydrophobicContact CD2-CD1 4.36Å; L279-L283 HydrophobicContact CG-CD1 3.73Å; L279-L283 HydrophobicContact CG-CG 4.27Å; L279-L283 WeakPolarHBondContact O-CB 3.42Å; L279-L283 VanDerWaalsContact O-CG 3.23Å; L279-L283 WeakPolarHBondContact O-CG 3.32Å; L279-L283 PolarHBondContact O-N 3.37Å; L283-G285 PolarHBondContact O-N 3.32Å; L283-T286 PolarHBondContact O-N 2.95Å; L283-T286 PolarHBondContact O-OG1 3.49Å; L283-H287 HydrophobicContact CD2-CB 4.08Å; L283-H287 PolarHBondContact O-N 2.75Å; L283-I288 HydrophobicContact CB-CD1 3.79Å; L283-I288 HydrophobicContact CB-CG1 3.76Å; L283-I288 PolarHBondContact O-N 3.03Å; L283-I288 VanDerWaalsContact O-N 3.09Å |
| 284 | H | 87.5 | Confident | 89.5 | Confident | 64 Ų | 64 | 55.8 Ų | 55.8 | 30% | 0.296 | 32% | 0.316 | S | S | . | . | B | Isolated β-bridge | trans | -60.7 | 130.8 | 177.8 | -179.1 | 52 | 0 | 0 | 0 | 111.2 | L280 T282 T286 I288 L290 | L280-H284 WeakPolarHBondContact O-CB 3.39Å; L280-H284 PolarHBondContact O-N 3.23Å; L280-H284 VanDerWaalsContact O-N 3.1Å; T282-H284 VanDerWaalsContact C-N 3.31Å; H284-T286 VanDerWaalsContact C-N 3.29Å; H284-T286 PolarHBondContact O-N 2.96Å; H284-I288 WeakPolarHBondContact CA-O 3.26Å; H284-L290 HydrophobicContact CB-CD1 4.35Å; H284-L290 PolarHBondContact ND1-N 3.4Å |
| 285 | G | 76.6 | Confident | 89.2 | Confident | 65 Ų | 65 | 56.1 Ų | 56.1 | 67% | 0.67 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86 | -11.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | L283 I288 | L283-G285 PolarHBondContact O-N 3.32Å; G285-I288 PolarHBondContact N-O 2.85Å |
| 286 | T | 82.3 | Confident | 88.8 | Confident | 75 Ų | 75 | 59.6 Ų | 59.6 | 46% | 0.46 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.9 | -52.9 | 176.9 | 54.6 | 0 | 0 | 0 | 0 | 112.4 | L283 H284 | L283-T286 PolarHBondContact O-N 2.95Å; L283-T286 PolarHBondContact O-OG1 3.49Å; H284-T286 VanDerWaalsContact C-N 3.29Å; H284-T286 PolarHBondContact O-N 2.96Å |
| 287 | H | 85.8 | Confident | 88.5 | Confident | 133 Ų | 133 | 60.3 Ų | 60.3 | 62% | 0.616 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.4 | -29.6 | -175.1 | -67.5 | -72.5 | 0 | 0 | 0 | 113 | L283 | L283-H287 HydrophobicContact CD2-CB 4.08Å; L283-H287 PolarHBondContact O-N 2.75Å |
| 288 | I | 88.4 | Confident | 88.4 | Confident | 57 Ų | 57 | 60.7 Ų | 60.7 | 29% | 0.292 | 34% | 0.339 | S | S | . | . | B | Isolated β-bridge | trans | -131.2 | 150.1 | 178.9 | 68.7 | 179.1 | 0 | 0 | 0 | 110.7 | L280 L283 H284 G285 L290 | L280-I288 HydrophobicContact CD2-CD1 3.99Å; L283-I288 HydrophobicContact CB-CD1 3.79Å; L283-I288 HydrophobicContact CB-CG1 3.76Å; L283-I288 PolarHBondContact O-N 3.03Å; L283-I288 VanDerWaalsContact O-N 3.09Å; H284-I288 WeakPolarHBondContact CA-O 3.26Å; G285-I288 PolarHBondContact N-O 2.85Å; I288-L290 HydrophobicContact CD1-CD1 4.25Å; I288-L290 HydrophobicContact CD1-CD2 3.95Å; I288-L290 HydrophobicContact CD1-CG 4Å; I288-L290 HydrophobicContact CG1-CG 4.3Å |
| 289 | S | 87.8 | Confident | 88.1 | Confident | 115 Ų | 115 | 66.2 Ų | 66.2 | 80% | 0.804 | 36% | 0.359 | S | S | * | . | trans | -111.9 | 110.7 | 170.1 | -64.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 290 | L | 87.6 | Confident | 87.9 | Confident | 37 Ų | 37 | 64.5 Ų | 64.5 | 19% | 0.194 | 35% | 0.349 | C | S | . | . | trans | -90.8 | 152.9 | 176.9 | -66.2 | 176.9 | 0 | 0 | 0 | 109.2 | L280 H284 I288 L294 V295 L298 | L280-L290 HydrophobicContact CB-CD1 4.03Å; L280-L290 HydrophobicContact CD2-CD1 4.35Å; L280-L290 HydrophobicContact CD2-CD2 4.42Å; H284-L290 HydrophobicContact CB-CD1 4.35Å; H284-L290 PolarHBondContact ND1-N 3.4Å; I288-L290 HydrophobicContact CD1-CD1 4.25Å; I288-L290 HydrophobicContact CD1-CD2 3.95Å; I288-L290 HydrophobicContact CD1-CG 4Å; I288-L290 HydrophobicContact CG1-CG 4.3Å; L290-L294 HydrophobicContact CD2-CD2 4.17Å; L290-V295 HydrophobicContact CB-CG2 3.58Å; L290-V295 HydrophobicContact CD1-CG2 4.37Å; L290-L298 HydrophobicContact CD1-CD1 4.35Å | ||
| 291 | H | 86.8 | Confident | 87.8 | Confident | 107 Ų | 107 | 65.6 Ų | 65.6 | 50% | 0.495 | 35% | 0.352 | S | S | . | . | trans | -65.1 | 139.6 | 176.6 | -162.8 | 72.8 | 0 | 0 | 0 | 110.5 | H293 L294 V295 | H291-H293 VanDerWaalsContact C-N 3.33Å; H291-H293 AromaticContact CD2-CD2 3.88Å; H291-H293 AromaticContact NE2-CD2 3.65Å; H291-H293 PolarHBondContact O-N 3.01Å; H291-L294 WeakPolarHBondContact O-CA 3.35Å; H291-L294 WeakPolarHBondContact O-CB 3.49Å; H291-L294 PolarHBondContact O-N 2.74Å; H291-V295 PolarHBondContact O-N 2.87Å; H291-V295 VanDerWaalsContact O-N 3.1Å | ||
| 292 | C | 84.8 | Confident | 87.9 | Confident | 58 Ų | 58 | 67.5 Ų | 67.5 | 39% | 0.392 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -53.3 | -44.3 | -173.1 | 177.8 | 0 | 0 | 0 | 0 | 113.5 | C43 L294 V295 H296 | C43-C292 HydrophobicContact CB-CB 4.17Å; C43-C292 WeakPolarHBondContact CB-SG 3.46Å; C43-C292 WeakPolarHBondContact SG-CB 3.47Å; C43-C292 CovalentContact SG-SG 2.04Å; C43-C292 PolarHBondContact SG-SG 2.92Å; C292-L294 VanDerWaalsContact C-N 3.34Å; C292-L294 PolarHBondContact O-N 3.41Å; C292-V295 PolarHBondContact O-N 3.4Å; C292-H296 PolarHBondContact O-N 3.38Å |
| 293 | H | 85.7 | Confident | 88 | Confident | 92 Ų | 92 | 67.6 Ų | 67.6 | 43% | 0.426 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60.8 | -38.7 | 174.7 | -71.4 | -68.1 | 0 | 0 | 0 | 113.6 | V45 H291 L297 | V45-H293 WeakPolarHBondContact CG2-ND1 3.31Å; H291-H293 VanDerWaalsContact C-N 3.33Å; H291-H293 AromaticContact CD2-CD2 3.88Å; H291-H293 AromaticContact NE2-CD2 3.65Å; H291-H293 PolarHBondContact O-N 3.01Å; H293-L297 WeakPolarHBondContact O-CB 3.35Å; H293-L297 PolarHBondContact O-N 2.88Å |
| 294 | L | 88.2 | Confident | 88.2 | Confident | 70 Ų | 70 | 67.3 Ų | 67.3 | 37% | 0.366 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -67.4 | -43.1 | 178.8 | 176.6 | 62.3 | 0 | 0 | 0 | 110.5 | L290 H291 C292 H296 L297 L298 | L290-L294 HydrophobicContact CD2-CD2 4.17Å; H291-L294 WeakPolarHBondContact O-CA 3.35Å; H291-L294 WeakPolarHBondContact O-CB 3.49Å; H291-L294 PolarHBondContact O-N 2.74Å; C292-L294 VanDerWaalsContact C-N 3.34Å; C292-L294 PolarHBondContact O-N 3.41Å; L294-H296 PolarHBondContact O-N 2.74Å; L294-L297 WeakPolarHBondContact O-CB 3.25Å; L294-L297 PolarHBondContact O-N 2.94Å; L294-L298 HydrophobicContact CD1-CD1 4.15Å; L294-L298 HydrophobicContact CD1-CD2 4.43Å; L294-L298 HydrophobicContact CD1-CG 4.03Å; L294-L298 HydrophobicContact CG-CD1 3.98Å; L294-L298 HydrophobicContact CG-CG 4.3Å; L294-L298 WeakPolarHBondContact O-CB 3.22Å; L294-L298 VanDerWaalsContact O-CG 3.23Å; L294-L298 WeakPolarHBondContact O-CG 3.34Å; L294-L298 PolarHBondContact O-N 3.3Å |
| 295 | V | 88.6 | Confident | 88.5 | Confident | 17 Ų | 17 | 65.5 Ų | 65.5 | 10% | 0.103 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61 | -46.7 | 177.3 | 176.4 | 0 | 0 | 0 | 0 | 110.7 | L290 H291 C292 L297 L298 Y299 | L290-V295 HydrophobicContact CB-CG2 3.58Å; L290-V295 HydrophobicContact CD1-CG2 4.37Å; H291-V295 PolarHBondContact O-N 2.87Å; H291-V295 VanDerWaalsContact O-N 3.1Å; C292-V295 PolarHBondContact O-N 3.4Å; V295-L297 VanDerWaalsContact C-N 3.34Å; V295-L297 PolarHBondContact O-N 3.37Å; V295-L298 PolarHBondContact O-N 2.8Å; V295-Y299 HydrophobicContact CG1-CD2 3.59Å; V295-Y299 HydrophobicContact CG1-CE2 3.51Å; V295-Y299 VanDerWaalsContact O-CD2 3.3Å; V295-Y299 WeakPolarHBondContact O-CD2 3.35Å; V295-Y299 PolarHBondContact O-N 3.33Å |
| 296 | H | 87.6 | Confident | 89.4 | Confident | 77 Ų | 77 | 63.4 Ų | 63.4 | 36% | 0.356 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.6 | -41.5 | 177.5 | -165.8 | -87.7 | 0 | 0 | 0 | 112.2 | V45 C292 L294 F300 | V45-H296 PolarHBondContact O-CE1 2.95Å; C292-H296 PolarHBondContact O-N 3.38Å; L294-H296 PolarHBondContact O-N 2.74Å; H296-F300 VanDerWaalsContact O-CB 3.3Å; H296-F300 WeakPolarHBondContact O-CB 3.3Å; H296-F300 PolarHBondContact O-N 3.04Å |
| 297 | L | 90.4 | Very high | 90 | Very high | 80 Ų | 80 | 60.1 Ų | 60.1 | 42% | 0.419 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.6 | -47.9 | 174.3 | -169.9 | 89.4 | 0 | 0 | 0 | 111.4 | H293 L294 V295 Y299 F300 F301 | H293-L297 WeakPolarHBondContact O-CB 3.35Å; H293-L297 PolarHBondContact O-N 2.88Å; L294-L297 WeakPolarHBondContact O-CB 3.25Å; L294-L297 PolarHBondContact O-N 2.94Å; V295-L297 VanDerWaalsContact C-N 3.34Å; V295-L297 PolarHBondContact O-N 3.37Å; L297-Y299 PolarHBondContact O-N 2.92Å; L297-F300 PolarHBondContact O-N 3.31Å; L297-F301 HydrophobicContact CD1-CD2 3.76Å; L297-F301 HydrophobicContact CD1-CE2 3.52Å; L297-F301 HydrophobicContact CG-CD2 3.8Å; L297-F301 HydrophobicContact CG-CE2 4.11Å; L297-F301 WeakPolarHBondContact O-CB 3.29Å; L297-F301 WeakPolarHBondContact O-CD2 3.35Å; L297-F301 PolarHBondContact O-N 2.94Å |
| 298 | L | 92.4 | Very high | 90.4 | Very high | 17 Ų | 17 | 57.7 Ų | 57.7 | 9% | 0.089 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.2 | -41.9 | -178.7 | -70.7 | 174.6 | 0 | 0 | 0 | 111.8 | T277 L280 L281 L290 L294 V295 Y302 | T277-L298 HydrophobicContact CG2-CB 4.31Å; T277-L298 HydrophobicContact CG2-CD2 4.01Å; L280-L298 HydrophobicContact CB-CD1 4.23Å; L280-L298 HydrophobicContact CD1-CD1 4.23Å; L281-L298 HydrophobicContact CD2-CB 3.81Å; L281-L298 HydrophobicContact CD2-CD1 4.33Å; L281-L298 HydrophobicContact CG-CB 4.29Å; L290-L298 HydrophobicContact CD1-CD1 4.35Å; L294-L298 HydrophobicContact CD1-CD1 4.15Å; L294-L298 HydrophobicContact CD1-CD2 4.43Å; L294-L298 HydrophobicContact CD1-CG 4.03Å; L294-L298 HydrophobicContact CG-CD1 3.98Å; L294-L298 HydrophobicContact CG-CG 4.3Å; L294-L298 WeakPolarHBondContact O-CB 3.22Å; L294-L298 VanDerWaalsContact O-CG 3.23Å; L294-L298 WeakPolarHBondContact O-CG 3.34Å; L294-L298 PolarHBondContact O-N 3.3Å; V295-L298 PolarHBondContact O-N 2.8Å; L298-Y302 WeakPolarHBondContact O-CA 3.31Å; L298-Y302 WeakPolarHBondContact O-CB 3.18Å; L298-Y302 PolarHBondContact O-N 3.25Å |
| 299 | Y | 89.5 | Confident | 90.7 | Very high | 138 Ų | 138 | 55 Ų | 55 | 54% | 0.541 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -65.7 | -45.7 | 173.9 | -83.3 | -65.2 | 0 | 0 | 0 | 112.1 | L281 V295 L297 F301 Y302 | L281-Y299 HydrophobicContact CD1-CD1 4.18Å; L281-Y299 HydrophobicContact CD1-CE1 4.14Å; L281-Y299 HydrophobicContact CD2-CD1 4.39Å; L281-Y299 HydrophobicContact CD2-CD2 3.91Å; L281-Y299 HydrophobicContact CD2-CE1 4.22Å; L281-Y299 HydrophobicContact CD2-CE2 3.72Å; L281-Y299 HydrophobicContact CD2-CG 4.24Å; V295-Y299 HydrophobicContact CG1-CD2 3.59Å; V295-Y299 HydrophobicContact CG1-CE2 3.51Å; V295-Y299 VanDerWaalsContact O-CD2 3.3Å; V295-Y299 WeakPolarHBondContact O-CD2 3.35Å; V295-Y299 PolarHBondContact O-N 3.33Å; L297-Y299 PolarHBondContact O-N 2.92Å; Y299-F301 VanDerWaalsContact C-N 3.35Å; Y299-F301 PolarHBondContact O-N 2.81Å; Y299-Y302 WeakPolarHBondContact O-CB 3.48Å; Y299-Y302 PolarHBondContact O-N 2.86Å |
| 300 | F | 89.3 | Confident | 91 | Very high | 18 Ų | 18 | 49.6 Ų | 49.6 | 8% | 0.079 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.5 | -41.1 | -179.3 | -178.5 | -90.8 | 0 | 0 | 0 | 112.5 | L47 E49 K52 H296 L297 | L47-F300 HydrophobicContact CB-CD1 4.13Å; L47-F300 HydrophobicContact CB-CD2 3.61Å; L47-F300 HydrophobicContact CB-CE1 3.87Å; L47-F300 HydrophobicContact CB-CE2 3.31Å; L47-F300 HydrophobicContact CB-CG 4.02Å; L47-F300 HydrophobicContact CB-CZ 3.45Å; L47-F300 VanDerWaalsContact CB-CZ 3.45Å; L47-F300 HydrophobicContact CD1-CB 3.99Å; L47-F300 HydrophobicContact CD1-CD1 3.83Å; L47-F300 HydrophobicContact CD1-CD2 4.02Å; L47-F300 HydrophobicContact CD1-CE1 4.34Å; L47-F300 HydrophobicContact CD1-CG 3.66Å; L47-F300 HydrophobicContact CD2-CD1 4.01Å; L47-F300 HydrophobicContact CD2-CE1 3.79Å; L47-F300 HydrophobicContact CD2-CZ 4.19Å; L47-F300 HydrophobicContact CG-CD1 4.21Å; L47-F300 HydrophobicContact CG-CD2 4.36Å; L47-F300 HydrophobicContact CG-CE1 4.21Å; L47-F300 HydrophobicContact CG-CE2 4.36Å; L47-F300 HydrophobicContact CG-CG 4.29Å; L47-F300 HydrophobicContact CG-CZ 4.29Å; E49-F300 VanDerWaalsContact OE1-CD2 3.25Å; E49-F300 WeakPolarHBondContact OE1-CD2 3.4Å; E49-F300 WeakPolarHBondContact OE1-CE2 3.4Å; K52-F300 HydrophobicContact CB-CE1 4.35Å; K52-F300 HydrophobicContact CB-CE2 4.23Å; K52-F300 HydrophobicContact CB-CZ 3.71Å; K52-F300 HydrophobicContact CD-CD1 4.47Å; K52-F300 HydrophobicContact CD-CD2 4.2Å; K52-F300 HydrophobicContact CD-CE1 4.2Å; K52-F300 HydrophobicContact CD-CE2 3.91Å; K52-F300 HydrophobicContact CD-CG 4.48Å; K52-F300 HydrophobicContact CD-CZ 3.9Å; K52-F300 VanDerWaalsContact CD-O 3.22Å; K52-F300 WeakPolarHBondContact CD-O 3.45Å; K52-F300 HydrophobicContact CG-CE1 4.38Å; K52-F300 HydrophobicContact CG-CZ 4.11Å; H296-F300 VanDerWaalsContact O-CB 3.3Å; H296-F300 WeakPolarHBondContact O-CB 3.3Å; H296-F300 PolarHBondContact O-N 3.04Å; L297-F300 PolarHBondContact O-N 3.31Å |
| 301 | F | 92.4 | Very high | 91.3 | Very high | 75 Ų | 75 | 50.6 Ų | 50.6 | 33% | 0.329 | 24% | 0.244 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | 3.4 | -179.5 | -72.8 | -76.4 | 0 | 0 | 0 | 113.9 | L47 L297 Y299 D303 V304 I305 | L47-F301 HydrophobicContact CD2-CE2 4.26Å; L47-F301 HydrophobicContact CD2-CZ 4.26Å; L297-F301 HydrophobicContact CD1-CD2 3.76Å; L297-F301 HydrophobicContact CD1-CE2 3.52Å; L297-F301 HydrophobicContact CG-CD2 3.8Å; L297-F301 HydrophobicContact CG-CE2 4.11Å; L297-F301 WeakPolarHBondContact O-CB 3.29Å; L297-F301 WeakPolarHBondContact O-CD2 3.35Å; L297-F301 PolarHBondContact O-N 2.94Å; Y299-F301 VanDerWaalsContact C-N 3.35Å; Y299-F301 PolarHBondContact O-N 2.81Å; F301-D303 PolarHBondContact O-N 3.39Å; F301-V304 HydrophobicContact CD1-CB 4.39Å; F301-V304 HydrophobicContact CD1-CG2 4.34Å; F301-V304 WeakPolarHBondContact O-CB 3.49Å; F301-V304 PolarHBondContact O-N 3.49Å; F301-V304 VanDerWaalsContact O-N 3.07Å; F301-I305 HydrophobicContact CB-CD1 4.18Å; F301-I305 HydrophobicContact CB-CG1 4.47Å; F301-I305 WeakPolarHBondContact O-CB 3.36Å; F301-I305 WeakPolarHBondContact O-CG1 3.25Å; F301-I305 PolarHBondContact O-N 3.31Å |
| 302 | Y | 92.7 | Very high | 91.6 | Very high | 58 Ų | 58 | 45.8 Ų | 45.8 | 23% | 0.227 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -53.6 | -50.2 | -174.9 | 179.3 | -97.2 | 0 | 0 | 0 | 112.4 | Y274 T277 L278 L281 L298 Y299 V304 I305 D306 | Y274-Y302 HydrophobicContact CE2-CE2 4.46Å; T277-Y302 HydrophobicContact CG2-CD2 4.01Å; L278-Y302 HydrophobicContact CD1-CE2 4.47Å; L281-Y302 HydrophobicContact CD1-CD2 3.9Å; L281-Y302 HydrophobicContact CD1-CE2 4.46Å; L298-Y302 WeakPolarHBondContact O-CA 3.31Å; L298-Y302 WeakPolarHBondContact O-CB 3.18Å; L298-Y302 PolarHBondContact O-N 3.25Å; Y299-Y302 WeakPolarHBondContact O-CB 3.48Å; Y299-Y302 PolarHBondContact O-N 2.86Å; Y302-V304 VanDerWaalsContact C-N 3.3Å; Y302-V304 PolarHBondContact O-N 2.95Å; Y302-I305 CarbonylContact O-C 3.55Å; Y302-I305 WeakPolarHBondContact O-CA 3.49Å; Y302-I305 WeakPolarHBondContact O-CB 3.39Å; Y302-I305 PolarHBondContact O-N 3.44Å; Y302-I305 VanDerWaalsContact O-N 3.11Å; Y302-D306 PolarHBondContact O-N 2.96Å |
| 303 | D | 92.9 | Very high | 92 | Very high | 31 Ų | 31 | 43 Ų | 43 | 17% | 0.166 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -65.8 | -34 | -179.5 | -57.9 | -35.1 | 0 | 0 | 0 | 112.4 | L56 Y117 F301 I305 D306 C307 | L56-D303 HydrophobicContact CD1-CB 3.69Å; L56-D303 HydrophobicContact CD2-CB 3.68Å; L56-D303 HydrophobicContact CG-CB 4.35Å; Y117-D303 WeakPolarHBondContact CE1-OD2 3.44Å; Y117-D303 PolarHBondContact OH-OD2 3.5Å; F301-D303 PolarHBondContact O-N 3.39Å; D303-I305 VanDerWaalsContact C-N 3.34Å; D303-D306 PolarHBondContact O-N 3.31Å; D303-C307 PolarHBondContact O-N 3.02Å; D303-C307 PolarHBondContact O-SG 2.94Å |
| 304 | V | 94.4 | Very high | 92.3 | Very high | 29 Ų | 29 | 39.3 Ų | 39.3 | 18% | 0.176 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -68.6 | -39.2 | 175.7 | 179.8 | 0 | 0 | 0 | 0 | 109.7 | L56 F301 Y302 C307 F308 | L56-V304 HydrophobicContact CD2-CB 4.5Å; L56-V304 HydrophobicContact CD2-CG2 3.78Å; L56-V304 HydrophobicContact CG-CG2 4.32Å; F301-V304 HydrophobicContact CD1-CB 4.39Å; F301-V304 HydrophobicContact CD1-CG2 4.34Å; F301-V304 WeakPolarHBondContact O-CB 3.49Å; F301-V304 PolarHBondContact O-N 3.49Å; F301-V304 VanDerWaalsContact O-N 3.07Å; Y302-V304 VanDerWaalsContact C-N 3.3Å; Y302-V304 PolarHBondContact O-N 2.95Å; V304-C307 VanDerWaalsContact O-CB 3.3Å; V304-C307 WeakPolarHBondContact O-CB 3.4Å; V304-C307 PolarHBondContact O-N 3.1Å; V304-F308 VanDerWaalsContact O-CD2 3.26Å; V304-F308 WeakPolarHBondContact O-CD2 3.3Å |
| 305 | I | 95.4 | Very high | 92.4 | Very high | 27 Ų | 27 | 38.1 Ų | 38.1 | 14% | 0.138 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.2 | -40.3 | 174.5 | -70.4 | 167.1 | 0 | 0 | 0 | 110.3 | P273 T277 F301 Y302 D303 C307 F308 | P273-I305 VanDerWaalsContact C-CG2 3.49Å; P273-I305 HydrophobicContact CB-CG2 3.99Å; P273-I305 WeakPolarHBondContact O-CG2 3.44Å; T277-I305 HydrophobicContact CG2-CD1 4.1Å; F301-I305 HydrophobicContact CB-CD1 4.18Å; F301-I305 HydrophobicContact CB-CG1 4.47Å; F301-I305 WeakPolarHBondContact O-CB 3.36Å; F301-I305 WeakPolarHBondContact O-CG1 3.25Å; F301-I305 PolarHBondContact O-N 3.31Å; Y302-I305 CarbonylContact O-C 3.55Å; Y302-I305 WeakPolarHBondContact O-CA 3.49Å; Y302-I305 WeakPolarHBondContact O-CB 3.39Å; Y302-I305 PolarHBondContact O-N 3.44Å; Y302-I305 VanDerWaalsContact O-N 3.11Å; D303-I305 VanDerWaalsContact C-N 3.34Å; I305-C307 VanDerWaalsContact C-N 3.29Å; I305-C307 PolarHBondContact O-N 3.44Å; I305-F308 VanDerWaalsContact O-CB 3.31Å; I305-F308 WeakPolarHBondContact O-CB 3.43Å; I305-F308 PolarHBondContact O-N 2.95Å |
| 306 | D | 94.2 | Very high | 92.4 | Very high | 21 Ų | 21 | 37.6 Ų | 37.6 | 11% | 0.112 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -65.2 | -32.3 | 174.4 | -172.7 | 38.8 | 0 | 0 | 0 | 112 | Y133 Y274 Y302 D303 F308 S309 M310 | Y133-D306 PolarHBondContact OH-OD1 3.31Å; Y274-D306 HydrophobicContact CD2-CB 4.07Å; Y274-D306 WeakPolarHBondContact CD2-OD1 3.16Å; Y274-D306 HydrophobicContact CE2-CB 4.28Å; Y274-D306 WeakPolarHBondContact CE2-OD1 3.31Å; Y302-D306 PolarHBondContact O-N 2.96Å; D303-D306 PolarHBondContact O-N 3.31Å; D306-F308 PolarHBondContact O-N 3.44Å; D306-F308 VanDerWaalsContact O-N 3.15Å; D306-S309 WeakPolarHBondContact O-CA 3.27Å; D306-S309 VanDerWaalsContact O-CB 3.26Å; D306-S309 WeakPolarHBondContact O-CB 3.43Å; D306-S309 PolarHBondContact O-N 3.48Å; D306-S309 PolarHBondContact O-OG 2.92Å; D306-S309 PolarHBondContact OD1-OG 3.03Å; D306-M310 PolarHBondContact O-N 2.79Å; D306-M310 VanDerWaalsContact O-N 3.13Å |
| 307 | C | 95.3 | Very high | 92.2 | Very high | 5 Ų | 5 | 34.1 Ų | 34.1 | 3% | 0.034 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -56.1 | -33.6 | 170.2 | -66.1 | 0 | 0 | 0 | 0 | 112.3 | L59 Y60 M63 D303 V304 I305 S309 M310 L311 | L59-C307 HydrophobicContact CD1-CB 4.38Å; Y60-C307 WeakPolarHBondContact CE1-SG 3.43Å; M63-C307 HydrophobicContact CE-CB 4.09Å; D303-C307 PolarHBondContact O-N 3.02Å; D303-C307 PolarHBondContact O-SG 2.94Å; V304-C307 VanDerWaalsContact O-CB 3.3Å; V304-C307 WeakPolarHBondContact O-CB 3.4Å; V304-C307 PolarHBondContact O-N 3.1Å; I305-C307 VanDerWaalsContact C-N 3.29Å; I305-C307 PolarHBondContact O-N 3.44Å; C307-S309 VanDerWaalsContact C-N 3.29Å; C307-S309 PolarHBondContact O-N 3Å; C307-M310 PolarHBondContact O-N 3.42Å; C307-L311 WeakPolarHBondContact O-CG 3.44Å; C307-L311 PolarHBondContact O-N 3.34Å |
| 308 | F | 94.8 | Very high | 91.8 | Very high | 83 Ų | 83 | 33.2 Ų | 33.2 | 36% | 0.364 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -63.4 | -37.8 | 174 | -75 | -99.2 | 0 | 0 | 0 | 111.6 | C270 V304 I305 D306 M310 L311 | C270-F308 CarbonylContact C-O 3.57Å; C270-F308 WeakPolarHBondContact CA-O 3.34Å; C270-F308 WeakPolarHBondContact CB-O 3.49Å; C270-F308 CarbonylContact O-C 3.54Å; V304-F308 VanDerWaalsContact O-CD2 3.26Å; V304-F308 WeakPolarHBondContact O-CD2 3.3Å; I305-F308 VanDerWaalsContact O-CB 3.31Å; I305-F308 WeakPolarHBondContact O-CB 3.43Å; I305-F308 PolarHBondContact O-N 2.95Å; D306-F308 PolarHBondContact O-N 3.44Å; D306-F308 VanDerWaalsContact O-N 3.15Å; F308-M310 VanDerWaalsContact C-N 3.3Å; F308-M310 PolarHBondContact O-N 3.37Å; F308-L311 HydrophobicContact CD1-CD1 4.2Å; F308-L311 WeakPolarHBondContact O-CB 3.23Å; F308-L311 PolarHBondContact O-N 2.83Å |
| 309 | S | 94.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -59.8 | -46 | 174.8 | 95 | 0 | 0 | 0 | 0 | 109.2 | Y133 C270 D306 C307 L311 H312 | Y133-S309 PolarHBondContact OH-OG 3.3Å; C270-S309 VanDerWaalsContact O-CA 3.26Å; C270-S309 WeakPolarHBondContact O-CA 3.13Å; C270-S309 PolarHBondContact O-N 2.97Å; C270-S309 VanDerWaalsContact O-N 3.12Å; D306-S309 WeakPolarHBondContact O-CA 3.27Å; D306-S309 VanDerWaalsContact O-CB 3.26Å; D306-S309 WeakPolarHBondContact O-CB 3.43Å; D306-S309 PolarHBondContact O-N 3.48Å; D306-S309 PolarHBondContact O-OG 2.92Å; D306-S309 PolarHBondContact OD1-OG 3.03Å; C307-S309 VanDerWaalsContact C-N 3.29Å; C307-S309 PolarHBondContact O-N 3Å; S309-L311 PolarHBondContact O-N 2.86Å; S309-H312 PolarHBondContact O-ND1 2.99Å |
| 310 | M | 94.3 | Very high | 90.3 | Very high | 2 Ų | 2 | 26.9 Ų | 26.9 | 1% | 0.01 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -66.5 | -28 | 179.8 | -62.5 | -178.6 | 173.5 | 0 | 0 | 114.3 | Y60 M63 L106 Y133 D306 C307 F308 H312 C313 | Y60-M310 HydrophobicContact CD1-SD 4.44Å; Y60-M310 HydrophobicContact CE1-SD 3.99Å; M63-M310 HydrophobicContact CE-CB 4.18Å; M63-M310 HydrophobicContact CE-SD 4.37Å; M63-M310 HydrophobicContact SD-CB 3.92Å; L106-M310 HydrophobicContact CD2-CE 4.48Å; L106-M310 HydrophobicContact CD2-SD 3.55Å; L106-M310 VanDerWaalsContact CD2-SD 3.55Å; Y133-M310 HydrophobicContact CD2-CE 4.33Å; Y133-M310 HydrophobicContact CE2-CE 3.55Å; Y133-M310 HydrophobicContact CE2-CG 4.29Å; D306-M310 PolarHBondContact O-N 2.79Å; D306-M310 VanDerWaalsContact O-N 3.13Å; C307-M310 PolarHBondContact O-N 3.42Å; F308-M310 VanDerWaalsContact C-N 3.3Å; F308-M310 PolarHBondContact O-N 3.37Å; M310-H312 PolarHBondContact O-N 2.9Å; M310-C313 PolarHBondContact O-N 2.04Å; M310-C313 PolarHBondContact O-SG 3.25Å |
| 311 | L | 94.2 | Very high | 89.2 | Confident | 58 Ų | 58 | 26.4 Ų | 26.4 | 30% | 0.304 | 13% | 0.129 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -24.6 | -179.8 | -77.1 | 174.2 | 0 | 0 | 0 | 113.8 | M63 C307 F308 S309 C313 V314 I315 | M63-L311 HydrophobicContact CG-CD2 4.12Å; M63-L311 HydrophobicContact SD-CD2 3.85Å; M63-L311 HydrophobicContact SD-CG 4.21Å; C307-L311 WeakPolarHBondContact O-CG 3.44Å; C307-L311 PolarHBondContact O-N 3.34Å; F308-L311 HydrophobicContact CD1-CD1 4.2Å; F308-L311 WeakPolarHBondContact O-CB 3.23Å; F308-L311 PolarHBondContact O-N 2.83Å; S309-L311 PolarHBondContact O-N 2.86Å; L311-C313 PolarHBondContact O-N 2.69Å; L311-V314 PolarHBondContact O-N 3.22Å; L311-V314 VanDerWaalsContact O-N 3.13Å; L311-I315 HydrophobicContact CB-CD1 4.07Å; L311-I315 WeakPolarHBondContact O-CG1 3.23Å; L311-I315 PolarHBondContact O-N 3.29Å |
| 312 | H | 92.3 | Very high | 87.5 | Confident | 6 Ų | 6 | 27 Ų | 27 | 3% | 0.028 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -57.1 | -35.3 | 177.4 | 82.2 | -82.6 | 0 | 0 | 0 | 112.4 | D99 S140 C270 W271 S309 M310 V314 I315 N316 | D99-H312 IonicContact OD1-CD2 3.55Å; D99-H312 IonicContact OD1-NE2 2.86Å; S140-H312 PolarHBondContact OG-NE2 2.83Å; C270-H312 HydrophobicContact CB-CB 4.19Å; W271-H312 AromaticContact CH2-CE1 3.99Å; W271-H312 AromaticContact CZ2-CE1 3.43Å; W271-H312 VanDerWaalsContact CZ2-CE1 3.43Å; W271-H312 WeakPolarHBondContact CZ2-CE1 3.4Å; W271-H312 AromaticContact CZ2-CG 3.91Å; W271-H312 AromaticContact CZ2-ND1 3.41Å; W271-H312 WeakPolarHBondContact CZ2-ND1 3.36Å; W271-H312 AromaticContact CZ2-NE2 3.92Å; W271-H312 AromaticContact NE1-CG 3.97Å; S309-H312 PolarHBondContact O-ND1 2.99Å; M310-H312 PolarHBondContact O-N 2.9Å; H312-V314 PolarHBondContact O-N 3.39Å; H312-I315 PolarHBondContact O-N 3.39Å; H312-N316 WeakPolarHBondContact O-CB 3.5Å; H312-N316 PolarHBondContact O-N 2.83Å; H312-N316 PolarHBondContact O-ND2 3.4Å |
| 313 | C | 92.4 | Very high | 85.6 | Confident | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -69.1 | -19 | -176.9 | 76.3 | 0 | 0 | 0 | 0 | 112.9 | N71 D99 M310 L311 P317 | N71-C313 PolarHBondContact ND2-O 3.46Å; D99-C313 HydrophobicContact CB-CB 3.87Å; M310-C313 PolarHBondContact O-N 2.04Å; M310-C313 PolarHBondContact O-SG 3.25Å; L311-C313 PolarHBondContact O-N 2.69Å; C313-P317 WeakPolarHBondContact O-CD 3.25Å |
| 314 | V | 92.1 | Very high | 83.9 | Confident | 13 Ų | 13 | 28 Ų | 28 | 8% | 0.079 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -95.4 | -45 | 175.5 | -172.2 | 0 | 0 | 0 | 0 | 110.5 | M63 V66 L311 H312 N316 P317 | M63-V314 HydrophobicContact CB-CG2 4.2Å; M63-V314 HydrophobicContact CG-CG2 4.27Å; V66-V314 HydrophobicContact CB-CG1 3.93Å; V66-V314 HydrophobicContact CG1-CG1 3.42Å; V66-V314 VanDerWaalsContact CG1-CG1 3.42Å; L311-V314 PolarHBondContact O-N 3.22Å; L311-V314 VanDerWaalsContact O-N 3.13Å; H312-V314 PolarHBondContact O-N 3.39Å; V314-N316 VanDerWaalsContact C-N 3.35Å; V314-N316 PolarHBondContact O-N 2.93Å; V314-P317 WeakPolarHBondContact O-CD 3.47Å |
| 315 | I | 91.8 | Very high | 82 | Confident | 46 Ų | 46 | 30.2 Ų | 30.2 | 24% | 0.236 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -71.5 | -32.1 | -175 | -59.9 | 168.1 | 0 | 0 | 0 | 111.7 | V266 L311 H312 I318 L319 | V266-I315 HydrophobicContact CB-CG2 4.29Å; V266-I315 HydrophobicContact CG1-CB 3.97Å; V266-I315 HydrophobicContact CG1-CD1 4.12Å; V266-I315 HydrophobicContact CG1-CG2 3.52Å; V266-I315 HydrophobicContact CG2-CG2 3.82Å; L311-I315 HydrophobicContact CB-CD1 4.07Å; L311-I315 WeakPolarHBondContact O-CG1 3.23Å; L311-I315 PolarHBondContact O-N 3.29Å; H312-I315 PolarHBondContact O-N 3.39Å; I315-I318 WeakPolarHBondContact O-CB 3.26Å; I315-I318 PolarHBondContact O-N 3.1Å; I315-I318 VanDerWaalsContact O-N 3.16Å; I315-L319 HydrophobicContact CG2-CD1 3.89Å; I315-L319 HydrophobicContact CG2-CD2 4.48Å; I315-L319 HydrophobicContact CG2-CG 3.88Å; I315-L319 WeakPolarHBondContact O-CG 3.35Å; I315-L319 PolarHBondContact O-N 3.09Å |
| 316 | N | 86.9 | Confident | 79.9 | Confident | 5 Ų | 5 | 35.7 Ų | 35.7 | 3% | 0.027 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -52 | -62.1 | 179.5 | -89.1 | -16.5 | 0 | 0 | 0 | 112.2 | H312 V314 I318 L319 Y320 | H312-N316 WeakPolarHBondContact O-CB 3.5Å; H312-N316 PolarHBondContact O-N 2.83Å; H312-N316 PolarHBondContact O-ND2 3.4Å; V314-N316 VanDerWaalsContact C-N 3.35Å; V314-N316 PolarHBondContact O-N 2.93Å; N316-I318 PolarHBondContact O-N 3.41Å; N316-I318 VanDerWaalsContact O-N 3.17Å; N316-L319 PolarHBondContact O-N 2.84Å; N316-L319 VanDerWaalsContact O-N 3.1Å; N316-Y320 HydrophobicContact CB-CD2 4.28Å; N316-Y320 HydrophobicContact CB-CE2 3.61Å; N316-Y320 WeakPolarHBondContact O-CD2 3.47Å; N316-Y320 WeakPolarHBondContact O-CE2 3.16Å; N316-Y320 PolarHBondContact O-N 3.44Å; N316-Y320 VanDerWaalsContact O-N 3.07Å; N316-Y320 PolarHBondContact OD1-OH 3.04Å |
| 317 | P | 84.9 | Confident | 78 | Confident | 5 Ų | 5 | 35.2 Ų | 35.2 | 3% | 0.032 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -48.8 | -41.1 | 174.7 | -31.4 | 35.8 | 0 | 0 | 0 | 114.6 | E70 N71 V74 C313 V314 Y320 N321 | E70-P317 HydrophobicContact CB-CB 3.98Å; E70-P317 HydrophobicContact CB-CG 4.39Å; N71-P317 VanDerWaalsContact OD1-CG 3.25Å; N71-P317 WeakPolarHBondContact OD1-CG 3.17Å; V74-P317 HydrophobicContact CG2-CB 3.97Å; V74-P317 HydrophobicContact CG2-CG 4.47Å; C313-P317 WeakPolarHBondContact O-CD 3.25Å; V314-P317 WeakPolarHBondContact O-CD 3.47Å; P317-Y320 PolarHBondContact O-N 3.33Å; P317-N321 WeakPolarHBondContact O-CB 2.88Å; P317-N321 PolarHBondContact O-N 3.19Å; P317-N321 PolarHBondContact O-ND2 2.96Å |
| 318 | I | 81.2 | Confident | 76.3 | Confident | 60 Ų | 60 | 43.4 Ų | 43.4 | 31% | 0.308 | 21% | 0.211 | S | C | . | . | I | π-helix | trans | -59.3 | -51 | 178.9 | -62 | 172.9 | 0 | 0 | 0 | 110.6 | E70 I315 N316 Y320 F322 L323 | E70-I318 VanDerWaalsContact OE1-CG1 3.24Å; E70-I318 WeakPolarHBondContact OE1-CG1 3.19Å; I315-I318 WeakPolarHBondContact O-CB 3.26Å; I315-I318 PolarHBondContact O-N 3.1Å; I315-I318 VanDerWaalsContact O-N 3.16Å; N316-I318 PolarHBondContact O-N 3.41Å; N316-I318 VanDerWaalsContact O-N 3.17Å; I318-Y320 PolarHBondContact O-N 3.31Å; I318-F322 PolarHBondContact O-N 3.43Å; I318-L323 HydrophobicContact CG2-CD1 4.24Å |
| 319 | L | 79.6 | Confident | 74.6 | Confident | 12 Ų | 12 | 41 Ų | 41 | 6% | 0.063 | 21% | 0.21 | C | C | . | . | I | π-helix | trans | -65.5 | -38.5 | -178.5 | -63.3 | 176.1 | 0 | 0 | 0 | 112.6 | L259 A262 Y263 V266 I315 N316 L323 | L259-L319 HydrophobicContact CD1-CD2 4.44Å; L259-L319 WeakPolarHBondContact CD1-O 3.5Å; A262-L319 HydrophobicContact CB-CD2 4.09Å; Y263-L319 HydrophobicContact CD1-CB 3.9Å; Y263-L319 HydrophobicContact CD1-CD1 3.55Å; Y263-L319 HydrophobicContact CD1-CG 4.35Å; Y263-L319 HydrophobicContact CE1-CB 3.29Å; Y263-L319 HydrophobicContact CE1-CD1 3.88Å; Y263-L319 HydrophobicContact CE1-CG 4.2Å; Y263-L319 PolarHBondContact OH-O 3.16Å; Y263-L319 VanDerWaalsContact OH-O 3.09Å; V266-L319 HydrophobicContact CB-CD1 4.1Å; V266-L319 HydrophobicContact CG1-CD1 4.21Å; V266-L319 HydrophobicContact CG2-CD1 4.01Å; I315-L319 HydrophobicContact CG2-CD1 3.89Å; I315-L319 HydrophobicContact CG2-CD2 4.48Å; I315-L319 HydrophobicContact CG2-CG 3.88Å; I315-L319 WeakPolarHBondContact O-CG 3.35Å; I315-L319 PolarHBondContact O-N 3.09Å; N316-L319 PolarHBondContact O-N 2.84Å; N316-L319 VanDerWaalsContact O-N 3.1Å; L319-L323 HydrophobicContact CD2-CD1 3.95Å |
| 320 | Y | 70.4 | Confident | 72.9 | Confident | 11 Ų | 11 | 44.6 Ų | 44.6 | 4% | 0.043 | 22% | 0.223 | C | C | . | . | I | π-helix | trans | -78 | -33.9 | -178.3 | -56.9 | -58.4 | 0 | 0 | 0 | 113.4 | M95 L144 L147 R151 Y263 N316 P317 I318 S324 | M95-Y320 HydrophobicContact CE-CD2 3.37Å; M95-Y320 HydrophobicContact CE-CE2 3.12Å; M95-Y320 HydrophobicContact CE-CG 4.36Å; M95-Y320 HydrophobicContact SD-CE2 4.01Å; L144-Y320 WeakPolarHBondContact CD1-OH 2.92Å; L147-Y320 HydrophobicContact CD2-CD1 3.98Å; L147-Y320 HydrophobicContact CD2-CE1 3.59Å; R151-Y320 VanDerWaalsContact NH2-CD1 3.35Å; Y263-Y320 AromaticContact CD1-CE1 3.71Å; Y263-Y320 HydrophobicContact CD1-CE1 3.71Å; Y263-Y320 AromaticContact CD1-CZ 3.9Å; Y263-Y320 AromaticContact CE1-CD1 3.46Å; Y263-Y320 HydrophobicContact CE1-CD1 3.46Å; Y263-Y320 VanDerWaalsContact CE1-CD1 3.46Å; Y263-Y320 AromaticContact CE1-CE1 2.97Å; Y263-Y320 HydrophobicContact CE1-CE1 2.97Å; Y263-Y320 HydrophobicContact CE1-CE2 4.41Å; Y263-Y320 HydrophobicContact CE1-CG 4.34Å; Y263-Y320 AromaticContact CE1-CZ 3.48Å; Y263-Y320 VanDerWaalsContact CE1-CZ 3.48Å; Y263-Y320 HydrophobicContact CE2-CE1 4.33Å; Y263-Y320 AromaticContact CZ-CD1 3.55Å; Y263-Y320 AromaticContact CZ-CE1 3.38Å; Y263-Y320 WeakPolarHBondContact OH-CD1 3.42Å; N316-Y320 HydrophobicContact CB-CD2 4.28Å; N316-Y320 HydrophobicContact CB-CE2 3.61Å; N316-Y320 WeakPolarHBondContact O-CD2 3.47Å; N316-Y320 WeakPolarHBondContact O-CE2 3.16Å; N316-Y320 PolarHBondContact O-N 3.44Å; N316-Y320 VanDerWaalsContact O-N 3.07Å; N316-Y320 PolarHBondContact OD1-OH 3.04Å; P317-Y320 PolarHBondContact O-N 3.33Å; I318-Y320 PolarHBondContact O-N 3.31Å; Y320-S324 WeakPolarHBondContact O-CB 3.32Å |
| 321 | N | 66.1 | Low | 71.3 | Confident | 7 Ų | 7 | 45.8 Ų | 45.8 | 4% | 0.037 | 23% | 0.23 | C | C | . | . | I | π-helix | trans | -112.4 | -41.5 | -162.5 | -61.3 | -61.8 | 0 | 0 | 0 | 113.4 | V74 P317 F327 | V74-N321 WeakPolarHBondContact CG2-ND2 3.39Å; P317-N321 WeakPolarHBondContact O-CB 2.88Å; P317-N321 PolarHBondContact O-N 3.19Å; P317-N321 PolarHBondContact O-ND2 2.96Å; N321-F327 HydrophobicContact CB-CD1 3.52Å; N321-F327 HydrophobicContact CB-CD2 4.06Å; N321-F327 HydrophobicContact CB-CE1 3.57Å; N321-F327 HydrophobicContact CB-CE2 4.08Å; N321-F327 HydrophobicContact CB-CG 3.77Å; N321-F327 HydrophobicContact CB-CZ 3.85Å; N321-F327 VanDerWaalsContact O-CB 3.29Å; N321-F327 WeakPolarHBondContact O-CB 3.42Å; N321-F327 WeakPolarHBondContact O-CD1 3.34Å; N321-F327 VanDerWaalsContact OD1-CD2 3.28Å; N321-F327 WeakPolarHBondContact OD1-CD2 3.45Å; N321-F327 WeakPolarHBondContact OD1-CE2 3.21Å |
| 322 | F | 57 | Low | 69.8 | Low | 89 Ų | 89 | 47.8 Ų | 47.8 | 39% | 0.39 | 24% | 0.24 | S | C | . | . | I | π-helix | trans | -88 | -25.8 | -175.7 | -70.3 | -83.4 | 0 | 0 | 0 | 113 | L73 I318 L331 | L73-F322 HydrophobicContact CD2-CZ 4.14Å; I318-F322 PolarHBondContact O-N 3.43Å; F322-L331 HydrophobicContact CD1-CD2 4.43Å; F322-L331 HydrophobicContact CE1-CD2 3.62Å; F322-L331 HydrophobicContact CZ-CD2 4.18Å |
| 323 | L | 53.5 | Low | 68.5 | Low | 70 Ų | 70 | 53.2 Ų | 53.2 | 37% | 0.366 | 27% | 0.269 | S | S | . | . | S | Bend | trans | -88 | -15.3 | 177.3 | -76 | 127.3 | 0 | 0 | 0 | 114.2 | R255 L259 I318 L319 | R255-L323 PolarHBondContact NE-O 3.29Å; R255-L323 PolarHBondContact NH2-O 3.42Å; L259-L323 HydrophobicContact CD1-CB 3.76Å; L259-L323 HydrophobicContact CD1-CD1 4.31Å; L259-L323 HydrophobicContact CD1-CG 4.42Å; I318-L323 HydrophobicContact CG2-CD1 4.24Å; L319-L323 HydrophobicContact CD2-CD1 3.95Å |
| 324 | S | 56.3 | Low | 67.1 | Low | 38 Ų | 38 | 54.5 Ų | 54.5 | 27% | 0.266 | 28% | 0.28 | S | S | . | . | S | Bend | trans | -90.4 | 121 | 176.1 | -178.5 | 0 | 0 | 0 | 0 | 112.2 | Y320 H326 F327 | Y320-S324 WeakPolarHBondContact O-CB 3.32Å; S324-H326 PolarHBondContact O-N 3.4Å; S324-H326 VanDerWaalsContact O-N 3.12Å; S324-F327 PolarHBondContact O-N 2.9Å |
| 325 | P | 54.3 | Low | 65.8 | Low | 76 Ų | 76 | 57.4 Ų | 57.4 | 49% | 0.494 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -56.6 | -30.8 | -177.8 | -24.4 | 32.5 | 0 | 0 | 0 | 114.8 | ||
| 326 | H | 53 | Low | 64.6 | Low | 142 Ų | 142 | 58.9 Ų | 58.9 | 66% | 0.657 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -71 | -34.4 | -176.2 | -175.9 | -97.7 | 0 | 0 | 0 | 112.9 | S324 R330 | S324-H326 PolarHBondContact O-N 3.4Å; S324-H326 VanDerWaalsContact O-N 3.12Å; H326-R330 PolarHBondContact O-N 3.16Å |
| 327 | F | 53.3 | Low | 63.3 | Low | 12 Ų | 12 | 66.4 Ų | 66.4 | 5% | 0.053 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -77.9 | -36.4 | 178.4 | -178.5 | -84 | 0 | 0 | 0 | 111.8 | V77 N321 S324 G329 R330 L331 | V77-F327 HydrophobicContact CB-CE2 3.91Å; V77-F327 HydrophobicContact CB-CZ 4.11Å; V77-F327 HydrophobicContact CG1-CD2 4.16Å; V77-F327 HydrophobicContact CG1-CE2 3.4Å; V77-F327 VanDerWaalsContact CG1-CE2 3.4Å; V77-F327 HydrophobicContact CG1-CZ 3.92Å; V77-F327 HydrophobicContact CG2-CE2 4.39Å; V77-F327 HydrophobicContact CG2-CZ 4.1Å; N321-F327 HydrophobicContact CB-CD1 3.52Å; N321-F327 HydrophobicContact CB-CD2 4.06Å; N321-F327 HydrophobicContact CB-CE1 3.57Å; N321-F327 HydrophobicContact CB-CE2 4.08Å; N321-F327 HydrophobicContact CB-CG 3.77Å; N321-F327 HydrophobicContact CB-CZ 3.85Å; N321-F327 VanDerWaalsContact O-CB 3.29Å; N321-F327 WeakPolarHBondContact O-CB 3.42Å; N321-F327 WeakPolarHBondContact O-CD1 3.34Å; N321-F327 VanDerWaalsContact OD1-CD2 3.28Å; N321-F327 WeakPolarHBondContact OD1-CD2 3.45Å; N321-F327 WeakPolarHBondContact OD1-CE2 3.21Å; S324-F327 PolarHBondContact O-N 2.9Å; F327-G329 PolarHBondContact O-N 2.88Å; F327-R330 CarbonylContact O-C 3.49Å; F327-R330 WeakPolarHBondContact O-CA 3.25Å; F327-R330 PolarHBondContact O-N 2.96Å; F327-L331 HydrophobicContact CD1-CB 4.1Å; F327-L331 HydrophobicContact CE1-CB 3.81Å; F327-L331 HydrophobicContact CE1-CD1 4.35Å; F327-L331 HydrophobicContact CE1-CD2 4.18Å; F327-L331 HydrophobicContact CE1-CG 4.34Å; F327-L331 WeakPolarHBondContact O-CB 3.5Å; F327-L331 PolarHBondContact O-N 2.84Å |
| 328 | R | 60.3 | Low | 61.9 | Low | 176 Ų | 176 | 73.1 Ų | 73.1 | 66% | 0.664 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -53.9 | -38.8 | 174.8 | -166.4 | 175.4 | 179 | 176.8 | -0.2 | 111.8 | L332 | R328-L332 HydrophobicContact CG-CD1 4.23Å; R328-L332 WeakPolarHBondContact O-CB 3.49Å; R328-L332 WeakPolarHBondContact O-CD1 3.47Å; R328-L332 WeakPolarHBondContact O-CG 3.25Å; R328-L332 PolarHBondContact O-N 3.4Å |
| 329 | G | 58.7 | Low | 60.6 | Low | 34 Ų | 34 | 75.3 Ų | 75.3 | 35% | 0.351 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -66.7 | -40.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114 | F327 N333 | F327-G329 PolarHBondContact O-N 2.88Å; G329-N333 WeakPolarHBondContact O-CB 3.48Å; G329-N333 PolarHBondContact O-N 2.97Å; G329-N333 PolarHBondContact O-ND2 3.47Å |
| 330 | R | 58.8 | Low | 58.9 | Low | 75 Ų | 75 | 80 Ų | 80 | 28% | 0.283 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -68 | -39.7 | 174.9 | -77.7 | 178.3 | 52.2 | 179.4 | -6.2 | 113 | V77 H326 F327 N333 A334 | V77-R330 HydrophobicContact CG1-CB 4.45Å; V77-R330 PolarHBondContact O-NH2 2.97Å; H326-R330 PolarHBondContact O-N 3.16Å; F327-R330 CarbonylContact O-C 3.49Å; F327-R330 WeakPolarHBondContact O-CA 3.25Å; F327-R330 PolarHBondContact O-N 2.96Å; R330-N333 PolarHBondContact O-N 2.77Å; R330-A334 WeakPolarHBondContact O-CB 3.29Å; R330-A334 PolarHBondContact O-N 3.49Å |
| 331 | L | 59.7 | Low | 57.9 | Low | 27 Ų | 27 | 88.4 Ų | 88.4 | 14% | 0.141 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -64.3 | -47.9 | 175.7 | -179.8 | 64.4 | 0 | 0 | 0 | 110.5 | L73 F322 F327 N333 A334 V335 | L73-L331 HydrophobicContact CD1-CD1 3.75Å; L73-L331 HydrophobicContact CD2-CD1 3.77Å; L73-L331 HydrophobicContact CG-CD1 4.15Å; F322-L331 HydrophobicContact CD1-CD2 4.43Å; F322-L331 HydrophobicContact CE1-CD2 3.62Å; F322-L331 HydrophobicContact CZ-CD2 4.18Å; F327-L331 HydrophobicContact CD1-CB 4.1Å; F327-L331 HydrophobicContact CE1-CB 3.81Å; F327-L331 HydrophobicContact CE1-CD1 4.35Å; F327-L331 HydrophobicContact CE1-CD2 4.18Å; F327-L331 HydrophobicContact CE1-CG 4.34Å; F327-L331 WeakPolarHBondContact O-CB 3.5Å; F327-L331 PolarHBondContact O-N 2.84Å; L331-N333 VanDerWaalsContact C-N 3.31Å; L331-N333 PolarHBondContact O-N 3.32Å; L331-A334 PolarHBondContact O-N 2.59Å; L331-A334 VanDerWaalsContact O-N 3.16Å; L331-V335 HydrophobicContact CD1-CG2 4.01Å; L331-V335 HydrophobicContact CG-CG2 4.28Å; L331-V335 WeakPolarHBondContact O-CB 3.49Å; L331-V335 VanDerWaalsContact O-CG2 3.29Å; L331-V335 WeakPolarHBondContact O-CG2 3.24Å; L331-V335 PolarHBondContact O-N 2.7Å |
| 332 | L | 63.8 | Low | 56.9 | Low | 99 Ų | 99 | 95.1 Ų | 95.1 | 52% | 0.518 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -55.9 | -46.5 | 173.7 | -82.5 | 160.7 | 0 | 0 | 0 | 111 | R328 A334 V335 V336 | R328-L332 HydrophobicContact CG-CD1 4.23Å; R328-L332 WeakPolarHBondContact O-CB 3.49Å; R328-L332 WeakPolarHBondContact O-CD1 3.47Å; R328-L332 WeakPolarHBondContact O-CG 3.25Å; R328-L332 PolarHBondContact O-N 3.4Å; L332-A334 PolarHBondContact O-N 3.36Å; L332-V335 PolarHBondContact O-N 2.79Å; L332-V336 WeakPolarHBondContact O-CB 3.38Å; L332-V336 WeakPolarHBondContact O-CG2 3.5Å; L332-V336 PolarHBondContact O-N 3.39Å |
| 333 | N | 63.5 | Low | 56.4 | Low | 120 Ų | 120 | 99.4 Ų | 99.4 | 64% | 0.642 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.2 | -36.7 | 177.3 | -77 | -21.3 | 0 | 0 | 0 | 113.4 | G329 R330 L331 H337 | G329-N333 WeakPolarHBondContact O-CB 3.48Å; G329-N333 PolarHBondContact O-N 2.97Å; G329-N333 PolarHBondContact O-ND2 3.47Å; R330-N333 PolarHBondContact O-N 2.77Å; L331-N333 VanDerWaalsContact C-N 3.31Å; L331-N333 PolarHBondContact O-N 3.32Å; N333-H337 WeakPolarHBondContact O-CB 3.05Å; N333-H337 PolarHBondContact O-N 2.93Å; N333-H337 VanDerWaalsContact O-N 3.11Å |
| 334 | A | 64.4 | Low | 55.9 | Low | 28 Ų | 28 | 102.8 Ų | 102.8 | 23% | 0.231 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -69.4 | -44.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | R330 L331 L332 H337 Y338 | R330-A334 WeakPolarHBondContact O-CB 3.29Å; R330-A334 PolarHBondContact O-N 3.49Å; L331-A334 PolarHBondContact O-N 2.59Å; L331-A334 VanDerWaalsContact O-N 3.16Å; L332-A334 PolarHBondContact O-N 3.36Å; A334-H337 WeakPolarHBondContact O-CB 3.39Å; A334-H337 PolarHBondContact O-N 3.38Å; A334-Y338 WeakPolarHBondContact O-CD2 3.17Å; A334-Y338 PolarHBondContact O-N 3.18Å |
| 335 | V | 64.6 | Low | 55.5 | Low | 74 Ų | 74 | 112.4 Ų | 112.4 | 45% | 0.448 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -67.7 | -40.2 | 177.7 | 174.2 | 0 | 0 | 0 | 0 | 111.1 | L331 L332 H337 Y338 L339 | L331-V335 HydrophobicContact CD1-CG2 4.01Å; L331-V335 HydrophobicContact CG-CG2 4.28Å; L331-V335 WeakPolarHBondContact O-CB 3.49Å; L331-V335 VanDerWaalsContact O-CG2 3.29Å; L331-V335 WeakPolarHBondContact O-CG2 3.24Å; L331-V335 PolarHBondContact O-N 2.7Å; L332-V335 PolarHBondContact O-N 2.79Å; V335-H337 VanDerWaalsContact C-N 3.25Å; V335-H337 PolarHBondContact O-N 2.79Å; V335-Y338 CarbonylContact O-C 3.17Å; V335-Y338 WeakPolarHBondContact O-CA 3.31Å; V335-Y338 WeakPolarHBondContact O-CB 3.35Å; V335-Y338 PolarHBondContact O-N 3.11Å; V335-L339 PolarHBondContact O-N 3.22Å |
| 336 | V | 65.6 | Low | 54.9 | Low | 77 Ų | 77 | 113.7 Ų | 113.7 | 47% | 0.467 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.9 | -29.1 | 174.4 | 170.4 | 0 | 0 | 0 | 0 | 112.1 | L332 Y338 | L332-V336 WeakPolarHBondContact O-CB 3.38Å; L332-V336 WeakPolarHBondContact O-CG2 3.5Å; L332-V336 PolarHBondContact O-N 3.39Å; V336-Y338 VanDerWaalsContact C-N 3.28Å |
| 337 | H | 59.4 | Low | 54.1 | Low | 163 Ų | 163 | 110.9 Ų | 110.9 | 76% | 0.755 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -74 | -20 | 172.3 | -165.7 | -66.4 | 0 | 0 | 0 | 112.9 | N333 A334 V335 | N333-H337 WeakPolarHBondContact O-CB 3.05Å; N333-H337 PolarHBondContact O-N 2.93Å; N333-H337 VanDerWaalsContact O-N 3.11Å; A334-H337 WeakPolarHBondContact O-CB 3.39Å; A334-H337 PolarHBondContact O-N 3.38Å; V335-H337 VanDerWaalsContact C-N 3.25Å; V335-H337 PolarHBondContact O-N 2.79Å |
| 338 | Y | 56.8 | Low | 53.3 | Low | 146 Ų | 146 | 115.4 Ų | 115.4 | 57% | 0.573 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -92.6 | -17.4 | 174.4 | -82.8 | -68.9 | 0 | 0 | 0 | 114 | R80 A334 V335 V336 | R80-Y338 PolarHBondContact NH1-OH 2.77Å; R80-Y338 PolarHBondContact NH2-OH 2.87Å; A334-Y338 WeakPolarHBondContact O-CD2 3.17Å; A334-Y338 PolarHBondContact O-N 3.18Å; V335-Y338 CarbonylContact O-C 3.17Å; V335-Y338 WeakPolarHBondContact O-CA 3.31Å; V335-Y338 WeakPolarHBondContact O-CB 3.35Å; V335-Y338 PolarHBondContact O-N 3.11Å; V336-Y338 VanDerWaalsContact C-N 3.28Å |
| 339 | L | 52.6 | Low | 52.3 | Low | 106 Ų | 106 | 116 Ų | 116 | 56% | 0.555 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -65.9 | 124.9 | 165.2 | -80.7 | 162.6 | 0 | 0 | 0 | 107.8 | V335 K341 | V335-L339 PolarHBondContact O-N 3.22Å; L339-K341 PolarHBondContact O-N 3Å |
| 340 | P | 43.9 | Very low | 51.2 | Low | 111 Ų | 111 | 119.9 Ų | 119.9 | 72% | 0.721 | 66% | 0.658 | S | S | * | * | trans | -55.3 | 117.5 | 173 | -16.5 | 27.7 | 0 | 0 | 0 | 107.3 | D342 | P340-D342 PolarHBondContact O-N 3.12Š| ||
| 341 | K | 49.7 | Very low | 49.9 | Very low | 186 Ų | 186 | 121.9 Ų | 121.9 | 81% | 0.809 | 68% | 0.683 | S | S | * | * | trans | -65.9 | 106.5 | 161 | -86.1 | -178.7 | 175.5 | 175.2 | 0 | 105.1 | L339 Q343 | L339-K341 PolarHBondContact O-N 3Å; K341-Q343 VanDerWaalsContact C-N 3.27Å; K341-Q343 PolarHBondContact O-N 3.05Å | ||
| 342 | D | 45 | Very low | 48.9 | Very low | 148 Ų | 148 | 126.3 Ų | 126.3 | 79% | 0.791 | 72% | 0.717 | S | S | * | * | trans | -53.4 | 101.3 | 162.4 | -87.6 | -24 | 0 | 0 | 0 | 107.1 | P340 T344 | P340-D342 PolarHBondContact O-N 3.12Å; D342-T344 PolarHBondContact O-N 3.37Å | ||
| 343 | Q | 46.8 | Very low | 47.4 | Very low | 180 Ų | 180 | 127.2 Ų | 127.2 | 84% | 0.841 | 73% | 0.731 | S | S | * | * | trans | -72.9 | 77.9 | 169.3 | -82.4 | -174.9 | -18.5 | 0 | 0 | 107.3 | K341 R345 | K341-Q343 VanDerWaalsContact C-N 3.27Å; K341-Q343 PolarHBondContact O-N 3.05Å; Q343-R345 PolarHBondContact O-N 3.07Å | ||
| 344 | T | 42.8 | Very low | 46.3 | Very low | 140 Ų | 140 | 127.5 Ų | 127.5 | 86% | 0.859 | 74% | 0.742 | S | S | * | * | trans | -75.6 | 68 | 154.6 | 26.1 | 0 | 0 | 0 | 0 | 108.7 | D342 | D342-T344 PolarHBondContact O-N 3.37Š| ||
| 345 | R | 47.4 | Very low | 44.6 | Very low | 240 Ų | 240 | 132.2 Ų | 132.2 | 91% | 0.906 | 77% | 0.773 | S | S | * | * | trans | -137.1 | 85 | 158.4 | -89.5 | -168.9 | 171.6 | 176.3 | -2.4 | 108.3 | Q343 | Q343-R345 PolarHBondContact O-N 3.07Š| ||
| 346 | A | 41.9 | Very low | 43.3 | Very low | 103 Ų | 103 | 133.8 Ų | 133.8 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | -139.5 | 114.6 | 157.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 347 | G | 37.8 | Very low | 41.7 | Very low | 83 Ų | 83 | 136.4 Ų | 136.4 | 86% | 0.856 | 80% | 0.803 | S | S | * | * | trans | 91.1 | 88.7 | 146.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 348 | A | 35.7 | Very low | 40.8 | Very low | 108 Ų | 108 | 137.4 Ų | 137.4 | 89% | 0.893 | 81% | 0.808 | S | S | * | * | trans | -163.2 | 95 | 130.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 349 | H | 38.9 | Very low | 39.5 | Very low | 189 Ų | 189 | 138.8 Ų | 138.8 | 88% | 0.875 | 82% | 0.819 | S | S | * | * | trans | -81.2 | 149.6 | 162.8 | -102.3 | -82.1 | 0 | 0 | 0 | 110 | ||||
| 350 | S | 35.5 | Very low | 38.7 | Very low | 114 Ų | 114 | 137.7 Ų | 137.7 | 80% | 0.797 | 82% | 0.821 | S | S | * | * | trans | 71.7 | 107.9 | 157.8 | 67.2 | 0 | 0 | 0 | 0 | 120 | ||||
| 351 | S | 31.8 | Very low | 38.1 | Very low | 117 Ų | 117 | 140.1 Ų | 140.1 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | -160.4 | 124 | 106.8 | 54 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 352 | S | 39.3 | Very low | 37.2 | Very low | 121 Ų | 121 | 137.2 Ų | 137.2 | 85% | 0.846 | 82% | 0.818 | S | S | * | * | trans | -64 | 131.4 | 168.6 | 53.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 353 | S | 32.6 | Very low | 36.8 | Very low | 117 Ų | 117 | 138.2 Ų | 138.2 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | trans | -155.8 | 124.9 | 142.4 | 53.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 354 | S | 40.1 | Very low | 36.1 | Very low | 126 Ų | 126 | 135.2 Ų | 135.2 | 88% | 0.881 | 82% | 0.816 | S | S | * | * | trans | -70.9 | 130 | 171.6 | -51 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 355 | C | 28.5 | Very low | 35.6 | Very low | 128 Ų | 128 | 138.8 Ų | 138.8 | 87% | 0.865 | 82% | 0.819 | S | S | * | * | trans | -158.1 | 125 | 149 | -146.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 356 | S | 37.4 | Very low | 34.7 | Very low | 106 Ų | 106 | 130.4 Ų | 130.4 | 74% | 0.741 | 81% | 0.807 | S | S | * | * | trans | -64.2 | 136.3 | 168.1 | -179.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 357 | T | 30.9 | Very low | 34.1 | Very low | 133 Ų | 133 | 133.1 Ų | 133.1 | 82% | 0.816 | 81% | 0.807 | S | S | * | * | trans | -174.8 | 127.9 | 131.8 | 25.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 358 | Q | 41.9 | Very low | 33.8 | Very low | 184 Ų | 184 | 134.9 Ų | 134.9 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | -56.8 | 135.6 | 153.9 | -68.1 | 170.5 | -26.8 | 0 | 0 | 109.3 | ||||
| 359 | H | 28.9 | Very low | 33.9 | Very low | 174 Ų | 174 | 138.8 Ų | 138.8 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | trans | -164.1 | 138.5 | 136 | -125.6 | -89.5 | 0 | 0 | 0 | 112.7 | ||||
| 360 | S | 35.7 | Very low | 34.2 | Very low | 84 Ų | 84 | 135.1 Ų | 135.1 | 59% | 0.587 | 80% | 0.8 | S | S | * | * | trans | -49.8 | 141.7 | 169.9 | 42.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 361 | I | 31.9 | Very low | 33.9 | Very low | 162 Ų | 162 | 134.5 Ų | 134.5 | 83% | 0.831 | 80% | 0.801 | S | S | * | * | trans | -102.2 | 107 | 163.6 | -64.2 | 177.4 | 0 | 0 | 0 | 108.4 | ||||
| 362 | I | 30 | Very low | 33.9 | Very low | 125 Ų | 125 | 133.3 Ų | 133.3 | 64% | 0.641 | 80% | 0.799 | S | S | * | * | trans | -65.6 | 130.9 | 162.1 | -67.8 | 162.4 | 0 | 0 | 0 | 108 | T364 | I362-T364 HydrophobicContact CG2-CG2 3.79Š| ||
| 363 | I | 36.2 | Very low | 33.5 | Very low | 168 Ų | 168 | 131.6 Ų | 131.6 | 86% | 0.862 | 79% | 0.792 | S | S | * | * | trans | -96.4 | 108.6 | 163.3 | -61.4 | 177.1 | 0 | 0 | 0 | 107.1 | ||||
| 364 | T | 32.8 | Very low | 33.6 | Very low | 118 Ų | 118 | 132.3 Ų | 132.3 | 72% | 0.724 | 79% | 0.791 | S | S | * | * | trans | -111.8 | 127 | 168.7 | 31.4 | 0 | 0 | 0 | 0 | 110.5 | I362 | I362-T364 HydrophobicContact CG2-CG2 3.79Š| ||
| 365 | K | 31.8 | Very low | 33.8 | Very low | 215 Ų | 215 | 131.3 Ų | 131.3 | 94% | 0.935 | 78% | 0.782 | S | S | * | * | trans | 177.2 | 114.1 | 141.3 | -115.9 | 179 | 171.2 | 177.5 | 0 | 105.8 | ||||
| 366 | G | 28.6 | Very low | 34 | Very low | 63 Ų | 63 | 133.9 Ų | 133.9 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | cis | 115.5 | 91.5 | 45.3 | 0 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 367 | D | 30.3 | Very low | 34.4 | Very low | 160 Ų | 160 | 134.5 Ų | 134.5 | 86% | 0.856 | 78% | 0.782 | S | S | * | * | 93.8 | 118.7 | 90.3 | -86.6 | -26.8 | 0 | 0 | 0 | 112.4 | |||||
| 368 | S | 30.7 | Very low | 34.2 | Very low | 121 Ų | 121 | 136.4 Ų | 136.4 | 85% | 0.846 | 78% | 0.782 | S | S | * | * | trans | -165.3 | 80 | 156.5 | -69.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 369 | Q | 37.5 | Very low | 34.7 | Very low | 190 Ų | 190 | 132.3 Ų | 132.3 | 89% | 0.888 | 77% | 0.771 | S | S | * | * | trans | 61.3 | 160.4 | 131.9 | -96.4 | -175.4 | -17.7 | 0 | 0 | 123.1 | ||||
| 370 | P | 44.8 | Very low | 34.6 | Very low | 112 Ų | 112 | 129.9 Ų | 129.9 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | -135.4 | -168.8 | -116.3 | 40.4 | -18.7 | 0 | 0 | 0 | 116.2 | |||||
| 371 | A | 30.5 | Very low | 34.4 | Very low | 100 Ų | 100 | 133.2 Ų | 133.2 | 83% | 0.826 | 78% | 0.784 | S | S | * | * | trans | 95.4 | 137.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 372 | A | 31.4 | Very low | 34.2 | Very low | 93 Ų | 93 | 130.7 Ų | 130.7 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | cis | -161.6 | 153.2 | 13.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 373 | A | 30.3 | Very low | 34.1 | Very low | 84 Ų | 84 | 134 Ų | 134 | 69% | 0.694 | 79% | 0.791 | S | S | * | * | trans | 58.4 | 117 | 139.1 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 374 | T | 35.3 | Very low | 33.8 | Very low | 133 Ų | 133 | 134.8 Ų | 134.8 | 82% | 0.816 | 79% | 0.791 | S | S | * | * | 139.2 | 173.6 | 61.9 | 36.1 | 0 | 0 | 0 | 0 | 107.2 | |||||
| 375 | P | 44.8 | Very low | 33.7 | Very low | 104 Ų | 104 | 133.4 Ų | 133.4 | 68% | 0.675 | 79% | 0.792 | S | S | * | * | -134 | 155.6 | -84.3 | 34.5 | -12.1 | 0 | 0 | 0 | 117.2 | |||||
| 376 | H | 32 | Very low | 33.8 | Very low | 183 Ų | 183 | 128.7 Ų | 128.7 | 85% | 0.847 | 79% | 0.785 | S | S | * | * | trans | 55.3 | 167.2 | 149.5 | -79.6 | -61.5 | 0 | 0 | 0 | 122 | ||||
| 377 | P | 45.7 | Very low | 34.9 | Very low | 118 Ų | 118 | 131 Ų | 131 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | cis | -131.5 | 172.7 | -7.1 | 27.2 | -3.2 | 0 | 0 | 0 | 116.4 | ||||
| 378 | E | 28.1 | Very low | 35.1 | Very low | 174 Ų | 174 | 130.7 Ų | 130.7 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | trans | -59 | -169.2 | 158.9 | -112.5 | -162.9 | 157.5 | 0 | 0 | 113.8 | ||||
| 379 | P | 50.6 | Low | 35.3 | Very low | 98 Ų | 98 | 131.8 Ų | 131.8 | 64% | 0.636 | 78% | 0.782 | S | S | * | * | cis | -137.6 | 177.2 | -28.7 | 32.5 | -13.1 | 0 | 0 | 0 | 113 | ||||
| 380 | S | 28.4 | Very low | 36.1 | Very low | 123 Ų | 123 | 128 Ų | 128 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | trans | -172.4 | 126.4 | 139.1 | 55.4 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 381 | L | 30.3 | Very low | 35.6 | Very low | 153 Ų | 153 | 129.3 Ų | 129.3 | 80% | 0.801 | 78% | 0.775 | S | S | * | * | trans | -73 | 159.5 | 167.6 | -78.9 | 112.5 | 0 | 0 | 0 | 114 | ||||
| 382 | S | 27.4 | Very low | 35.7 | Very low | 110 Ų | 110 | 131.6 Ų | 131.6 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | 141.3 | 118.7 | 131.8 | 59.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 383 | F | 29.6 | Very low | 36 | Very low | 194 Ų | 194 | 132.3 Ų | 132.3 | 85% | 0.851 | 78% | 0.778 | S | S | * | * | 97.6 | 144.2 | 60.5 | -113.4 | -79 | 0 | 0 | 0 | 113.9 | |||||
| 384 | Q | 28.5 | Very low | 37.2 | Very low | 185 Ų | 185 | 133.2 Ų | 133.2 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | 92.6 | 145.3 | 168.2 | -71.2 | -178.9 | -51.7 | 0 | 0 | 118.5 | ||||
| 385 | A | 30.9 | Very low | 37 | Very low | 89 Ų | 89 | 136.6 Ų | 136.6 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | cis | 164.7 | 140.5 | -24.8 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 386 | S | 35.1 | Very low | 36.5 | Very low | 115 Ų | 115 | 136.7 Ų | 136.7 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -67.6 | 173.6 | 174.4 | -45.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 387 | P | 51.5 | Low | 37.3 | Very low | 112 Ų | 112 | 133.4 Ų | 133.4 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | -159.6 | 160.4 | 88.1 | 34.4 | -11 | 0 | 0 | 0 | 120.5 | |||||
| 388 | L | 33.8 | Very low | 36.8 | Very low | 154 Ų | 154 | 133.2 Ų | 133.2 | 81% | 0.806 | 78% | 0.78 | S | S | * | * | trans | 56 | 118.7 | 135.4 | -75 | 135.7 | 0 | 0 | 0 | 126.1 | ||||
| 389 | L | 35.3 | Very low | 37.4 | Very low | 143 Ų | 143 | 133.4 Ų | 133.4 | 75% | 0.749 | 78% | 0.781 | S | S | * | * | 33.6 | 166.2 | 120.4 | -83.4 | 151 | 0 | 0 | 0 | 122.3 | |||||
| 390 | P | 53.3 | Low | 37.5 | Very low | 111 Ų | 111 | 134.1 Ų | 134.1 | 72% | 0.721 | 79% | 0.786 | S | S | * | * | cis | -149.7 | 170.1 | 28.3 | 39.8 | -16.1 | 0 | 0 | 0 | 121.4 | ||||
| 391 | N | 35 | Very low | 38.1 | Very low | 139 Ų | 139 | 135.2 Ų | 135.2 | 74% | 0.743 | 78% | 0.781 | S | S | * | * | trans | 28.6 | 138.6 | 143.5 | -74.1 | -11 | 0 | 0 | 0 | 125 | ||||
| 392 | T | 33.4 | Very low | 38.6 | Very low | 149 Ų | 149 | 134.3 Ų | 134.3 | 91% | 0.914 | 78% | 0.782 | S | S | * | * | -179.1 | 145.4 | 106.7 | 28 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 393 | S | 36.6 | Very low | 39.4 | Very low | 107 Ų | 107 | 134 Ų | 134 | 75% | 0.748 | 78% | 0.78 | S | S | * | * | trans | -108.4 | -160.6 | 176.1 | 54.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 394 | P | 55.1 | Low | 40.2 | Very low | 103 Ų | 103 | 134.2 Ų | 134.2 | 67% | 0.669 | 81% | 0.805 | S | S | * | * | cis | -125.8 | -179 | -45.2 | 28.7 | -8.1 | 0 | 0 | 0 | 111.5 | ||||
| 395 | F | 30.9 | Very low | 40.8 | Very low | 205 Ų | 205 | 131.7 Ų | 131.7 | 90% | 0.899 | 80% | 0.803 | S | S | * | * | trans | -179.3 | 131.7 | 140.1 | -105.1 | -74.8 | 0 | 0 | 0 | 112.3 | ||||
| 396 | S | 35.6 | Very low | 41.3 | Very low | 106 Ų | 106 | 133.9 Ų | 133.9 | 74% | 0.741 | 81% | 0.806 | S | S | * | * | trans | -114.5 | 157.2 | 157 | -49.2 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 397 | P | 49.1 | Very low | 41.6 | Very low | 114 Ų | 114 | 134.9 Ų | 134.9 | 74% | 0.74 | 81% | 0.806 | S | S | * | * | -157.6 | -177.7 | 76.7 | 37.4 | -14.1 | 0 | 0 | 0 | 117.3 | |||||
| 398 | S | 33.3 | Very low | 41 | Very low | 114 Ų | 114 | 136.3 Ų | 136.3 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | trans | 82.3 | 120.9 | 146.2 | 47.5 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 399 | Q | 41.1 | Very low | 41.5 | Very low | 178 Ų | 178 | 135.2 Ų | 135.2 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | trans | -57.5 | 168.1 | 154.3 | -91.6 | -167.8 | -5.8 | 0 | 0 | 113.3 | ||||
| 400 | P | 52.5 | Low | 41.9 | Very low | 112 Ų | 112 | 134.7 Ų | 134.7 | 73% | 0.727 | 82% | 0.815 | S | S | * | * | -153.8 | -179 | 55.4 | 38.7 | -13.8 | 0 | 0 | 0 | 119.5 | |||||
| 401 | L | 41.4 | Very low | 41.1 | Very low | 147 Ų | 147 | 136.4 Ų | 136.4 | 77% | 0.77 | 82% | 0.822 | S | S | * | * | trans | -9.5 | 143.4 | 166.9 | -69.9 | 92.2 | 0 | 0 | 0 | 120.8 | ||||
| 402 | T | 41.1 | Very low | 41.6 | Very low | 134 Ų | 134 | 136.2 Ų | 136.2 | 82% | 0.822 | 83% | 0.828 | S | S | * | * | 177.7 | 147.3 | 110.5 | 29.1 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 403 | S | 43.9 | Very low | 42.2 | Very low | 104 Ų | 104 | 135.1 Ų | 135.1 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | trans | -11.7 | 137.1 | 161.9 | 53.7 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 404 | S | 46.2 | Very low | 42.8 | Very low | 197 Ų | 197 | 137.6 Ų | 137.6 | 100% | 1.378 | 83% | 0.827 | S | S | * | * | -161.5 | 0 | 118.3 | -71.1 | 0 | 0 | 0 | 0 | 109.9 |
Retrieved 404 of 404 residues in 322.3 ms
(Link to these results)