| 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 | 39.4 | Very low | 45.8 | Very low | 240 Ų | 240 | 177.7 Ų | 177.7 | 100% | 1.182 | 82% | 0.823 | S | S | * | * | 0 | 89.6 | 0 | -70.7 | 175.6 | 167.2 | 0 | 0 | 108.4 | |||||
| 2 | L | 46.4 | Very low | 45.5 | Very low | 175 Ų | 175 | 175.2 Ų | 175.2 | 92% | 0.916 | 82% | 0.818 | S | S | * | * | trans | -142.8 | 90.2 | -176.9 | -135.3 | 84.2 | 0 | 0 | 0 | 108.5 | ||||
| 3 | P | 48.2 | Very low | 44.8 | Very low | 107 Ų | 107 | 175.4 Ų | 175.4 | 70% | 0.695 | 82% | 0.819 | S | S | * | * | trans | -129.6 | 14.3 | 174.5 | 36.3 | -19.5 | 0 | 0 | 0 | 115.1 | ||||
| 4 | R | 49.1 | Very low | 44.4 | Very low | 233 Ų | 233 | 170.2 Ų | 170.2 | 88% | 0.879 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -101 | -4.4 | -177.2 | -102.3 | -175.7 | -153.3 | -133.6 | 3.9 | 116.6 | ||
| 5 | L | 52.7 | Low | 43.7 | Very low | 139 Ų | 139 | 170.8 Ų | 170.8 | 73% | 0.728 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -95.6 | -10 | -177.9 | -137.3 | 76.4 | 0 | 0 | 0 | 113.8 | ||
| 6 | W | 43.5 | Very low | 43.3 | Very low | 214 Ų | 214 | 164.9 Ų | 164.9 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -83.4 | -19.9 | -172.2 | -143.9 | 19.7 | 0 | 0 | 0 | 114.1 | ||
| 7 | W | 43.1 | Very low | 42.9 | Very low | 225 Ų | 225 | 162.6 Ų | 162.6 | 85% | 0.852 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -23.2 | 178.7 | -75.4 | 65 | 0 | 0 | 0 | 113.4 | ||
| 8 | L | 44.2 | Very low | 42.1 | Very low | 123 Ų | 123 | 163.1 Ų | 163.1 | 64% | 0.644 | 81% | 0.809 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -18.6 | 179.1 | -74.8 | 162.3 | 0 | 0 | 0 | 113.1 | ||
| 9 | V | 48.8 | Very low | 41.5 | Very low | 100 Ų | 100 | 160.6 Ų | 160.6 | 61% | 0.606 | 81% | 0.806 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -22.1 | 179.4 | -178.5 | 0 | 0 | 0 | 0 | 111.5 | W11 | V9-W11 VanDerWaalsContact C-N 3.28Å; V9-W11 PolarHBondContact O-N 3.08Å |
| 10 | L | 45.7 | Very low | 41.2 | Very low | 157 Ų | 157 | 158.1 Ų | 158.1 | 82% | 0.822 | 81% | 0.811 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | -13.3 | -179.8 | -135.1 | 86.7 | 0 | 0 | 0 | 113.9 | ||
| 11 | W | 42.2 | Very low | 40.4 | Very low | 242 Ų | 242 | 156.2 Ų | 156.2 | 92% | 0.917 | 81% | 0.812 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | 0.2 | 179.9 | -108.4 | -1.5 | 0 | 0 | 0 | 114.9 | V9 | V9-W11 VanDerWaalsContact C-N 3.28Å; V9-W11 PolarHBondContact O-N 3.08Å |
| 12 | L | 42.4 | Very low | 39.8 | Very low | 147 Ų | 147 | 148.8 Ų | 148.8 | 77% | 0.77 | 79% | 0.789 | S | S | * | * | trans | -117.5 | 74.7 | 171.1 | -82.6 | 96.2 | 0 | 0 | 0 | 110.5 | ||||
| 13 | Q | 36.4 | Very low | 39 | Very low | 178 Ų | 178 | 146.4 Ų | 146.4 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | trans | -117.4 | 129 | 148.1 | -80.2 | -116.9 | -80.8 | 0 | 0 | 108.8 | ||||
| 14 | P | 38.9 | Very low | 37.8 | Very low | 103 Ų | 103 | 149.2 Ų | 149.2 | 67% | 0.669 | 79% | 0.785 | S | S | * | * | trans | -72.7 | 135.8 | -172.4 | -8.5 | 25.5 | 0 | 0 | 0 | 110.4 | A16 | P14-A16 HydrophobicContact CB-CB 4.17Å; P14-A16 PolarHBondContact O-N 2.75Å | ||
| 15 | L | 34.8 | Very low | 37 | Very low | 179 Ų | 179 | 145.3 Ų | 145.3 | 94% | 0.937 | 78% | 0.781 | S | S | * | * | trans | -69.8 | 70.3 | 159.8 | -167.6 | 70.4 | 0 | 0 | 0 | 108.5 | ||||
| 16 | A | 37.4 | Very low | 35.9 | Very low | 76 Ų | 76 | 147.3 Ų | 147.3 | 63% | 0.628 | 79% | 0.787 | S | S | * | * | trans | -108.3 | 75.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | P14 | P14-A16 HydrophobicContact CB-CB 4.17Å; P14-A16 PolarHBondContact O-N 2.75Å | ||
| 17 | T | 36.1 | Very low | 35.4 | Very low | 126 Ų | 126 | 145.3 Ų | 145.3 | 77% | 0.773 | 79% | 0.787 | S | S | * | * | trans | -164.3 | 82.5 | 159.6 | 35.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 18 | L | 29 | Very low | 34.6 | Very low | 172 Ų | 172 | 139.4 Ų | 139.4 | 90% | 0.901 | 79% | 0.785 | S | S | * | * | trans | -107.5 | 120.6 | 155.3 | -98.7 | 152.5 | 0 | 0 | 0 | 106.5 | ||||
| 19 | P | 31.1 | Very low | 34.1 | Very low | 116 Ų | 116 | 138 Ų | 138 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | trans | -72.9 | 140.1 | -178.6 | 29.9 | -31.1 | 0 | 0 | 0 | 109.9 | S21 | P19-S21 PolarHBondContact O-N 2.95Š| ||
| 20 | A | 34 | Very low | 33 | Very low | 109 Ų | 109 | 140.8 Ų | 140.8 | 90% | 0.901 | 80% | 0.8 | S | S | * | * | trans | -61.2 | 116.5 | 164.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 21 | S | 25.7 | Very low | 32.4 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 84% | 0.839 | 80% | 0.799 | S | S | * | * | trans | -120.5 | 115.4 | 160.1 | -163.9 | 0 | 0 | 0 | 0 | 107.6 | P19 | P19-S21 PolarHBondContact O-N 2.95Š| ||
| 22 | A | 26.7 | Very low | 32.1 | Very low | 84 Ų | 84 | 133 Ų | 133 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | -84.8 | 160.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 23 | V | 29 | Very low | 32.2 | Very low | 125 Ų | 125 | 130.1 Ų | 130.1 | 76% | 0.758 | 78% | 0.781 | S | S | * | * | trans | 77 | 107.7 | 157.9 | -167.2 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 24 | H | 23.9 | Very low | 32.9 | Very low | 166 Ų | 166 | 133.8 Ų | 133.8 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | -163.7 | 115.8 | 98.4 | -128.8 | -56.4 | 0 | 0 | 0 | 110.6 | |||||
| 25 | D | 32.3 | Very low | 33.7 | Very low | 151 Ų | 151 | 130.7 Ų | 130.7 | 81% | 0.807 | 77% | 0.767 | S | S | * | * | trans | -63.2 | 129.9 | 153.9 | -74.4 | -63.7 | 0 | 0 | 0 | 108.2 | ||||
| 26 | E | 28.2 | Very low | 35 | Very low | 181 Ų | 181 | 126.8 Ų | 126.8 | 85% | 0.846 | 74% | 0.743 | S | S | * | * | trans | -156.1 | 116.9 | 143.9 | -117.2 | -173.9 | 131.7 | 0 | 0 | 110.4 | A28 | E26-A28 PolarHBondContact O-N 2.84Š| ||
| 27 | E | 34.4 | Very low | 35.9 | Very low | 172 Ų | 172 | 126.6 Ų | 126.6 | 80% | 0.804 | 74% | 0.737 | S | S | * | * | trans | -12.4 | 113.5 | 160 | -109.7 | 89.2 | 166.3 | 0 | 0 | 117.1 | A29 | E27-A29 HydrophobicContact CG-CB 4.31Š| ||
| 28 | A | 25.9 | Very low | 36.9 | Very low | 100 Ų | 100 | 120.8 Ų | 120.8 | 83% | 0.826 | 70% | 0.701 | S | S | * | * | trans | -109.3 | 82.6 | 138.7 | 0 | 0 | 0 | 0 | 0 | 107.6 | E26 M30 | E26-A28 PolarHBondContact O-N 2.84Å; A28-M30 PolarHBondContact O-N 2.87Å | ||
| 29 | A | 33 | Very low | 38.1 | Very low | 93 Ų | 93 | 119.1 Ų | 119.1 | 77% | 0.769 | 69% | 0.686 | S | S | * | * | trans | -62.6 | 95.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | E27 | E27-A29 HydrophobicContact CG-CB 4.31Š| ||
| 30 | M | 26.9 | Very low | 38.8 | Very low | 159 Ų | 159 | 115.6 Ų | 115.6 | 78% | 0.783 | 66% | 0.66 | S | S | * | * | trans | -131.1 | 85.5 | 161.3 | -136 | 178.3 | -68.5 | 0 | 0 | 107.7 | A28 V32 | A28-M30 PolarHBondContact O-N 2.87Å; M30-V32 PolarHBondContact O-N 3.21Å | ||
| 31 | S | 31.5 | Very low | 39.2 | Very low | 116 Ų | 116 | 115.8 Ų | 115.8 | 81% | 0.811 | 65% | 0.65 | S | S | * | * | trans | 13.6 | 73.6 | 162.8 | 59.6 | 0 | 0 | 0 | 0 | 115.7 | P33 | S31-P33 WeakPolarHBondContact O-CD 3.42Š| ||
| 32 | V | 36.5 | Very low | 40 | Very low | 120 Ų | 120 | 112.9 Ų | 112.9 | 73% | 0.727 | 63% | 0.625 | S | S | * | * | trans | -72 | 119.4 | 166.4 | -179.2 | 0 | 0 | 0 | 0 | 106.2 | M30 R34 | M30-V32 PolarHBondContact O-N 3.21Å; V32-R34 PolarHBondContact O-N 3.33Å | ||
| 33 | P | 44.2 | Very low | 40.6 | Very low | 87 Ų | 87 | 114.1 Ų | 114.1 | 57% | 0.565 | 62% | 0.619 | S | S | * | * | trans | -54.9 | 137.9 | 172.8 | 21.2 | -29.4 | 0 | 0 | 0 | 108.3 | S31 C35 | S31-P33 WeakPolarHBondContact O-CD 3.42Å; P33-C35 VanDerWaalsContact C-N 3.27Å; P33-C35 PolarHBondContact O-N 2.91Å; P33-C35 PolarHBondContact O-SG 3.43Å | ||
| 34 | R | 50.9 | Low | 41.7 | Very low | 254 Ų | 254 | 110 Ų | 110 | 96% | 0.958 | 59% | 0.593 | S | S | * | * | trans | -58.9 | 88.2 | 179.9 | -72.9 | -174.4 | -178.8 | 170.1 | 0.2 | 109.9 | V32 | V32-R34 PolarHBondContact O-N 3.33Š| ||
| 35 | C | 55.8 | Low | 42.5 | Very low | 39 Ų | 39 | 109.3 Ų | 109.3 | 26% | 0.264 | 59% | 0.588 | S | S | . | * | P | Polyproline II helix | trans | -70.4 | 133.7 | -179 | -61.1 | 0 | 0 | 0 | 0 | 109.5 | P33 C51 C53 | P33-C35 VanDerWaalsContact C-N 3.27Å; P33-C35 PolarHBondContact O-N 2.91Å; P33-C35 PolarHBondContact O-SG 3.43Å; C35-C51 CarbonylContact C-O 3.56Å; C35-C51 VanDerWaalsContact CA-O 3.3Å; C35-C51 WeakPolarHBondContact CA-O 3.39Å; C35-C51 HydrophobicContact CB-CB 3.74Å; C35-C51 WeakPolarHBondContact CB-SG 3.21Å; C35-C51 WeakPolarHBondContact SG-CB 3.07Å; C35-C51 CovalentContact SG-SG 2.04Å; C35-C51 PolarHBondContact SG-SG 3.03Å; C35-C53 HydrophobicContact CB-CB 4.39Å; C35-C53 VanDerWaalsContact CB-SG 3.52Å |
| 36 | K | 63.2 | Low | 43.2 | Very low | 97 Ų | 97 | 103.2 Ų | 103.2 | 42% | 0.422 | 56% | 0.556 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -77 | 133.4 | 178.2 | -68.2 | 175.4 | -179.1 | 166.7 | 0 | 109.1 | D50 C51 Y52 C53 | K36-D50 IonicContact NZ-OD2 2.72Å; K36-D50 PolarHBondContact NZ-OD2 2.68Å; K36-C51 PolarHBondContact N-O 2.76Å; K36-Y52 HydrophobicContact CB-CD1 3.91Å; K36-Y52 HydrophobicContact CB-CE1 4.04Å; K36-Y52 HydrophobicContact CD-CE1 4.16Å; K36-Y52 WeakPolarHBondContact O-CA 3.31Å; K36-C53 PolarHBondContact O-N 3.3Å |
| 37 | S | 54.9 | Low | 43.9 | Very low | 72 Ų | 72 | 97.3 Ų | 97.3 | 50% | 0.503 | 54% | 0.535 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.6 | 127.1 | 176.2 | -166 | 0 | 0 | 0 | 0 | 109.8 | C53 N55 | S37-C53 CarbonylContact C-O 3.51Å; S37-C53 VanDerWaalsContact CA-O 3.26Å; S37-C53 WeakPolarHBondContact CA-O 3.39Å; S37-N55 PolarHBondContact OG-ND2 3.07Å |
| 38 | L | 58.3 | Low | 44.5 | Very low | 4 Ų | 4 | 92.6 Ų | 92.6 | 2% | 0.021 | 52% | 0.517 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 125.6 | 174.8 | -71 | 175.1 | 0 | 0 | 0 | 109.8 | I44 Y52 C53 Y54 F129 | L38-I44 HydrophobicContact CD2-CD1 3.39Å; L38-I44 HydrophobicContact CD2-CG1 4.35Å; L38-Y52 HydrophobicContact CD1-CD1 4.27Å; L38-Y52 HydrophobicContact CD1-CG 4.13Å; L38-Y52 HydrophobicContact CD2-CD1 3.53Å; L38-Y52 HydrophobicContact CD2-CE1 4.12Å; L38-Y52 HydrophobicContact CD2-CG 4.2Å; L38-Y52 HydrophobicContact CG-CD1 3.83Å; L38-Y52 HydrophobicContact CG-CG 4.16Å; L38-C53 PolarHBondContact N-O 3.22Å; L38-Y54 HydrophobicContact CB-CD2 4.22Å; L38-Y54 WeakPolarHBondContact O-CD2 3.3Å; L38-F129 HydrophobicContact CD1-CE1 3.73Å; L38-F129 HydrophobicContact CD1-CE2 4.45Å; L38-F129 HydrophobicContact CD1-CZ 3.4Å |
| 39 | K | 53.9 | Low | 45.6 | Very low | 136 Ų | 136 | 91.2 Ų | 91.2 | 59% | 0.591 | 50% | 0.502 | S | S | * | . | P | Polyproline II helix | trans | -98.7 | 152.9 | 171 | -152.3 | 176.6 | 178.6 | -179.2 | 0 | 110.1 | T41 D42 | K39-T41 PolarHBondContact O-N 3.14Å; K39-D42 WeakPolarHBondContact CA-OD2 3.4Å; K39-D42 WeakPolarHBondContact CB-OD2 3.44Å; K39-D42 PolarHBondContact N-OD2 3.49Å; K39-D42 WeakPolarHBondContact O-CB 3.07Å; K39-D42 PolarHBondContact O-N 3.45Å |
| 40 | E | 45.1 | Very low | 46.6 | Very low | 43 Ų | 43 | 88.8 Ų | 88.8 | 20% | 0.201 | 48% | 0.475 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | 133.5 | 175.8 | -170.6 | 160.6 | -144 | 0 | 0 | 110.8 | R146 | E40-R146 WeakPolarHBondContact OE1-CD 3.29Å; E40-R146 VanDerWaalsContact OE1-CG 3.23Å; E40-R146 WeakPolarHBondContact OE1-CG 3.19Å; E40-R146 IonicContact OE1-CZ 2.8Å; E40-R146 IonicContact OE1-NE 2.96Å; E40-R146 PolarHBondContact OE1-NE 2.97Å; E40-R146 IonicContact OE1-NH1 2.97Å; E40-R146 PolarHBondContact OE1-NH1 3.45Å; E40-R146 IonicContact OE1-NH2 3.34Å; E40-R146 PolarHBondContact OE1-NH2 3.45Å; E40-R146 IonicContact OE2-CZ 3.25Å; E40-R146 VanDerWaalsContact OE2-CZ 3.25Å; E40-R146 IonicContact OE2-NH1 2.65Å; E40-R146 PolarHBondContact OE2-NH1 3.46Å; E40-R146 IonicContact OE2-NH2 3.58Å |
| 41 | T | 43.8 | Very low | 48 | Very low | 112 Ų | 112 | 81.9 Ų | 81.9 | 69% | 0.687 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.5 | 5 | -171.6 | 71.7 | 0 | 0 | 0 | 0 | 117.7 | K39 L43 | K39-T41 PolarHBondContact O-N 3.14Å; T41-L43 PolarHBondContact O-N 3.5Å |
| 42 | D | 42.8 | Very low | 49.5 | Very low | 60 Ų | 60 | 76.3 Ų | 76.3 | 32% | 0.321 | 40% | 0.404 | S | S | . | . | trans | -71.8 | 132.7 | 176.3 | -73.2 | -21.4 | 0 | 0 | 0 | 111.9 | K39 I44 | K39-D42 WeakPolarHBondContact CA-OD2 3.4Å; K39-D42 WeakPolarHBondContact CB-OD2 3.44Å; K39-D42 PolarHBondContact N-OD2 3.49Å; K39-D42 WeakPolarHBondContact O-CB 3.07Å; K39-D42 PolarHBondContact O-N 3.45Å; D42-I44 HydrophobicContact CB-CG1 4.22Å | ||
| 43 | L | 38.9 | Very low | 50.4 | Low | 110 Ų | 110 | 71.6 Ų | 71.6 | 58% | 0.576 | 38% | 0.376 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 98.8 | 171.5 | -165.2 | 150.2 | 0 | 0 | 0 | 108 | T41 K45 I141 V142 | T41-L43 PolarHBondContact O-N 3.5Å; L43-K45 HydrophobicContact CD2-CG 3.97Å; L43-I141 HydrophobicContact CD2-CG2 3.83Å; L43-I141 HydrophobicContact CG-CG2 4.04Å; L43-V142 WeakPolarHBondContact CA-O 3.35Å |
| 44 | I | 52.1 | Low | 51.2 | Low | 38 Ų | 38 | 69.3 Ų | 69.3 | 20% | 0.195 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.7 | 117.3 | -176.7 | -54.2 | -173.8 | 0 | 0 | 0 | 108.8 | L38 D42 Y52 V142 | L38-I44 HydrophobicContact CD2-CD1 3.39Å; L38-I44 HydrophobicContact CD2-CG1 4.35Å; D42-I44 HydrophobicContact CB-CG1 4.22Å; I44-Y52 HydrophobicContact CD1-CD1 4.47Å; I44-Y52 HydrophobicContact CD1-CE1 3.95Å; I44-Y52 HydrophobicContact CG2-CE1 4.27Å; I44-V142 PolarHBondContact N-O 3.47Å; I44-V142 PolarHBondContact O-N 3.19Å |
| 45 | K | 40.1 | Very low | 51.2 | Low | 152 Ų | 152 | 61.6 Ų | 61.6 | 66% | 0.661 | 33% | 0.334 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 112.9 | 170.5 | -63.6 | -174.6 | 178.9 | 176.1 | 0 | 108.4 | L43 I141 | L43-K45 HydrophobicContact CD2-CG 3.97Å; K45-I141 HydrophobicContact CG-CG1 4.29Å |
| 46 | T | 48 | Very low | 51.1 | Low | 22 Ų | 22 | 62.8 Ų | 62.8 | 14% | 0.135 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135 | 150.3 | 177.4 | -91.2 | 0 | 0 | 0 | 0 | 109.6 | V48 Y52 Y140 | T46-V48 HydrophobicContact CG2-CB 4.28Å; T46-V48 VanDerWaalsContact CG2-N 3.28Å; T46-V48 WeakPolarHBondContact CG2-O 3.37Å; T46-Y52 PolarHBondContact OG1-OH 3.02Å; T46-Y140 HydrophobicContact CG2-CE1 3.86Å; T46-Y140 HydrophobicContact CG2-CE2 4.47Å; T46-Y140 WeakPolarHBondContact CG2-OH 3.38Å; T46-Y140 PolarHBondContact N-O 3.36Å; T46-Y140 WeakPolarHBondContact O-CD1 3.38Å; T46-Y140 VanDerWaalsContact O-CE1 3.31Å; T46-Y140 WeakPolarHBondContact O-CE1 3.46Å; T46-Y140 PolarHBondContact O-N 3.37Å |
| 47 | S | 42.7 | Very low | 50.3 | Low | 58 Ų | 58 | 65.5 Ų | 65.5 | 41% | 0.406 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -116.9 | 12.5 | 177.9 | 59.2 | 0 | 0 | 0 | 0 | 112.9 | L137 | S47-L137 WeakPolarHBondContact O-CD2 3.3Š|
| 48 | V | 45.8 | Very low | 49.9 | Very low | 73 Ų | 73 | 67.7 Ų | 67.7 | 44% | 0.442 | 37% | 0.365 | S | S | . | . | S | Bend | trans | -127.9 | 149.8 | -174.3 | -175.9 | 0 | 0 | 0 | 0 | 109.9 | T46 D50 Y140 | T46-V48 HydrophobicContact CG2-CB 4.28Å; T46-V48 VanDerWaalsContact CG2-N 3.28Å; T46-V48 WeakPolarHBondContact CG2-O 3.37Å; V48-D50 PolarHBondContact O-N 2.72Å; V48-Y140 WeakPolarHBondContact O-CE1 3.28Å; V48-Y140 PolarHBondContact O-OH 2.92Å |
| 49 | S | 49 | Very low | 49.1 | Very low | 71 Ų | 71 | 74.3 Ų | 74.3 | 50% | 0.497 | 40% | 0.396 | S | S | . | . | trans | -65.6 | 102.3 | 171.8 | 55.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 50 | D | 54 | Low | 48.8 | Very low | 41 Ų | 41 | 74.3 Ų | 74.3 | 22% | 0.219 | 40% | 0.401 | C | S | . | . | trans | -116 | 148.6 | 178.8 | -87 | -29.1 | 0 | 0 | 0 | 110.3 | K36 V48 Y52 | K36-D50 IonicContact NZ-OD2 2.72Å; K36-D50 PolarHBondContact NZ-OD2 2.68Å; V48-D50 PolarHBondContact O-N 2.72Å; D50-Y52 HydrophobicContact CB-CD2 4.44Å; D50-Y52 HydrophobicContact CB-CE2 3.68Å | ||
| 51 | C | 56.8 | Low | 49.1 | Very low | 14 Ų | 14 | 76.9 Ų | 76.9 | 10% | 0.095 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 134 | 172.2 | 176.8 | 0 | 0 | 0 | 0 | 109.6 | C35 K36 | C35-C51 CarbonylContact C-O 3.56Å; C35-C51 VanDerWaalsContact CA-O 3.3Å; C35-C51 WeakPolarHBondContact CA-O 3.39Å; C35-C51 HydrophobicContact CB-CB 3.74Å; C35-C51 WeakPolarHBondContact CB-SG 3.21Å; C35-C51 WeakPolarHBondContact SG-CB 3.07Å; C35-C51 CovalentContact SG-SG 2.04Å; C35-C51 PolarHBondContact SG-SG 3.03Å; K36-C51 PolarHBondContact N-O 2.76Å |
| 52 | Y | 63.1 | Low | 49.2 | Very low | 0 Ų | 0 | 81.9 Ų | 81.9 | 0% | 0 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 132 | -180 | -66.1 | -80.9 | 0 | 0 | 0 | 111 | K36 L38 I44 T46 D50 C128 F129 | K36-Y52 HydrophobicContact CB-CD1 3.91Å; K36-Y52 HydrophobicContact CB-CE1 4.04Å; K36-Y52 HydrophobicContact CD-CE1 4.16Å; K36-Y52 WeakPolarHBondContact O-CA 3.31Å; L38-Y52 HydrophobicContact CD1-CD1 4.27Å; L38-Y52 HydrophobicContact CD1-CG 4.13Å; L38-Y52 HydrophobicContact CD2-CD1 3.53Å; L38-Y52 HydrophobicContact CD2-CE1 4.12Å; L38-Y52 HydrophobicContact CD2-CG 4.2Å; L38-Y52 HydrophobicContact CG-CD1 3.83Å; L38-Y52 HydrophobicContact CG-CG 4.16Å; I44-Y52 HydrophobicContact CD1-CD1 4.47Å; I44-Y52 HydrophobicContact CD1-CE1 3.95Å; I44-Y52 HydrophobicContact CG2-CE1 4.27Å; T46-Y52 PolarHBondContact OG1-OH 3.02Å; D50-Y52 HydrophobicContact CB-CD2 4.44Å; D50-Y52 HydrophobicContact CB-CE2 3.68Å; Y52-C128 WeakPolarHBondContact O-CA 3.05Å; Y52-F129 HydrophobicContact CD2-CE2 4.49Å; Y52-F129 PolarHBondContact N-O 2.83Å; Y52-F129 PolarHBondContact O-N 3.34Å |
| 53 | C | 55.8 | Low | 49.5 | Very low | 20 Ų | 20 | 83.1 Ų | 83.1 | 14% | 0.135 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.2 | 125.1 | 178.1 | -70.8 | 0 | 0 | 0 | 0 | 110.1 | C35 K36 S37 L38 C128 | C35-C53 HydrophobicContact CB-CB 4.39Å; C35-C53 VanDerWaalsContact CB-SG 3.52Å; K36-C53 PolarHBondContact O-N 3.3Å; S37-C53 CarbonylContact C-O 3.51Å; S37-C53 VanDerWaalsContact CA-O 3.26Å; S37-C53 WeakPolarHBondContact CA-O 3.39Å; L38-C53 PolarHBondContact N-O 3.22Å; C53-C128 HydrophobicContact CB-CB 4.24Å; C53-C128 WeakPolarHBondContact CB-SG 3.31Å; C53-C128 WeakPolarHBondContact SG-CB 3.33Å; C53-C128 CovalentContact SG-SG 2.06Å; C53-C128 PolarHBondContact SG-SG 2.94Å |
| 54 | Y | 59.3 | Low | 50 | Low | 40 Ų | 40 | 80.8 Ų | 80.8 | 16% | 0.157 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 108.6 | 175 | -175.1 | -105.8 | 0 | 0 | 0 | 109.4 | L38 Q56 V127 | L38-Y54 HydrophobicContact CB-CD2 4.22Å; L38-Y54 WeakPolarHBondContact O-CD2 3.3Å; Y54-Q56 HydrophobicContact CD1-CG 3.95Å; Y54-Q56 HydrophobicContact CE1-CG 3.84Å; Y54-V127 PolarHBondContact N-O 3.38Å |
| 55 | N | 52.3 | Low | 49.9 | Very low | 92 Ų | 92 | 84.1 Ų | 84.1 | 49% | 0.492 | 43% | 0.429 | S | S | . | . | trans | -86.1 | 113.2 | 174.1 | -83.6 | -45.9 | 0 | 0 | 0 | 108.8 | S37 | S37-N55 PolarHBondContact OG-ND2 3.07Š| ||
| 56 | Q | 54.2 | Low | 50.1 | Low | 63 Ų | 63 | 81.5 Ų | 81.5 | 29% | 0.294 | 42% | 0.415 | S | S | . | . | trans | -70.2 | 133 | 177.9 | -67.9 | 173.1 | 25 | 0 | 0 | 110 | Y54 S58 P122 G124 | Y54-Q56 HydrophobicContact CD1-CG 3.95Å; Y54-Q56 HydrophobicContact CE1-CG 3.84Å; Q56-S58 PolarHBondContact O-N 3.38Å; Q56-P122 PolarHBondContact OE1-O 2.87Å; Q56-G124 VanDerWaalsContact CD-O 3.23Å; Q56-G124 PolarHBondContact NE2-O 3.43Å; Q56-G124 PolarHBondContact OE1-O 3.45Å | ||
| 57 | H | 46.2 | Very low | 49.7 | Very low | 155 Ų | 155 | 80.8 Ų | 80.8 | 72% | 0.718 | 41% | 0.411 | S | S | * | . | trans | -68.4 | 127.1 | 172 | -100 | -91.5 | 0 | 0 | 0 | 109.9 | Q59 | H57-Q59 PolarHBondContact O-N 3.46Å; H57-Q59 VanDerWaalsContact O-N 3.11Å | ||
| 58 | S | 44.8 | Very low | 49.8 | Very low | 117 Ų | 117 | 78.8 Ų | 78.8 | 82% | 0.818 | 40% | 0.397 | S | S | * | . | S | Bend | trans | -69.7 | -0.9 | -179.7 | 54.8 | 0 | 0 | 0 | 0 | 114.9 | Q56 | Q56-S58 PolarHBondContact O-N 3.38Š|
| 59 | Q | 42.5 | Very low | 49.9 | Very low | 144 Ų | 144 | 75.5 Ų | 75.5 | 67% | 0.673 | 38% | 0.376 | S | S | * | . | trans | -97.6 | 107.5 | -178.1 | -67.2 | -139.1 | 5.7 | 0 | 0 | 111.6 | H57 Q61 | H57-Q59 PolarHBondContact O-N 3.46Å; H57-Q59 VanDerWaalsContact O-N 3.11Å; Q59-Q61 PolarHBondContact O-N 3.47Å; Q59-Q61 VanDerWaalsContact O-N 3.12Å | ||
| 60 | I | 46.8 | Very low | 49.5 | Very low | 136 Ų | 136 | 74.8 Ų | 74.8 | 70% | 0.697 | 37% | 0.365 | S | S | * | . | trans | -75.6 | 95.6 | 174.8 | -54.4 | 165.7 | 0 | 0 | 0 | 108.2 | ||||
| 61 | Q | 52.9 | Low | 49 | Very low | 97 Ų | 97 | 73 Ų | 73 | 45% | 0.453 | 36% | 0.356 | S | S | . | . | trans | -82.7 | 137.6 | 160.9 | -60.3 | 177.9 | -31.3 | 0 | 0 | 108.8 | Q59 T63 Y64 | Q59-Q61 PolarHBondContact O-N 3.47Å; Q59-Q61 VanDerWaalsContact O-N 3.12Å; Q61-T63 PolarHBondContact O-N 3Å; Q61-T63 VanDerWaalsContact O-N 3.07Å; Q61-Y64 HydrophobicContact CB-CD2 3.6Å; Q61-Y64 HydrophobicContact CB-CE2 3.43Å; Q61-Y64 VanDerWaalsContact CB-CE2 3.43Å; Q61-Y64 HydrophobicContact CB-CG 4.37Å; Q61-Y64 HydrophobicContact CG-CD2 4.31Å; Q61-Y64 HydrophobicContact CG-CE2 3.71Å; Q61-Y64 VanDerWaalsContact O-CB 3.31Å; Q61-Y64 WeakPolarHBondContact O-CB 3.48Å; Q61-Y64 WeakPolarHBondContact O-CD2 3.2Å; Q61-Y64 PolarHBondContact O-N 3.23Å; Q61-Y64 VanDerWaalsContact OE1-CE2 3.27Å; Q61-Y64 PolarHBondContact OE1-OH 2.91Å | ||
| 62 | W | 45.4 | Very low | 48.1 | Very low | 216 Ų | 216 | 73.2 Ų | 73.2 | 82% | 0.818 | 36% | 0.357 | S | S | * | . | G | 310 helix | trans | -55.2 | -27.6 | -178.8 | -74.7 | 91.2 | 0 | 0 | 0 | 113.8 | Y64 M65 | W62-Y64 PolarHBondContact O-N 3.03Å; W62-Y64 VanDerWaalsContact O-N 3.17Å; W62-M65 PolarHBondContact O-N 2.92Å |
| 63 | T | 49.6 | Very low | 47.2 | Very low | 87 Ų | 87 | 73.2 Ų | 73.2 | 53% | 0.534 | 36% | 0.357 | S | S | . | . | G | 310 helix | trans | -62.3 | -16.8 | 174.5 | 48.1 | 0 | 0 | 0 | 0 | 113.3 | Q61 S67 | Q61-T63 PolarHBondContact O-N 3Å; Q61-T63 VanDerWaalsContact O-N 3.07Å; T63-S67 PolarHBondContact O-OG 2.92Å |
| 64 | Y | 48.3 | Very low | 46.2 | Very low | 60 Ų | 60 | 75.2 Ų | 75.2 | 24% | 0.235 | 37% | 0.369 | C | S | . | . | G | 310 helix | trans | -93.8 | -6.3 | -176.8 | -54.9 | -35.4 | 0 | 0 | 0 | 114.7 | Q61 W62 W66 Y123 R146 | Q61-Y64 HydrophobicContact CB-CD2 3.6Å; Q61-Y64 HydrophobicContact CB-CE2 3.43Å; Q61-Y64 VanDerWaalsContact CB-CE2 3.43Å; Q61-Y64 HydrophobicContact CB-CG 4.37Å; Q61-Y64 HydrophobicContact CG-CD2 4.31Å; Q61-Y64 HydrophobicContact CG-CE2 3.71Å; Q61-Y64 VanDerWaalsContact O-CB 3.31Å; Q61-Y64 WeakPolarHBondContact O-CB 3.48Å; Q61-Y64 WeakPolarHBondContact O-CD2 3.2Å; Q61-Y64 PolarHBondContact O-N 3.23Å; Q61-Y64 VanDerWaalsContact OE1-CE2 3.27Å; Q61-Y64 PolarHBondContact OE1-OH 2.91Å; W62-Y64 PolarHBondContact O-N 3.03Å; W62-Y64 VanDerWaalsContact O-N 3.17Å; Y64-W66 PolarHBondContact O-N 2.9Å; Y64-Y123 PolarHBondContact O-OH 2.83Å; Y64-R146 VanDerWaalsContact CD1-CZ 3.43Å |
| 65 | M | 49.4 | Very low | 45 | Very low | 109 Ų | 109 | 74 Ų | 74 | 54% | 0.537 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -21.2 | 177.6 | -133.5 | -175.7 | -170 | 0 | 0 | 112.6 | W62 | W62-M65 PolarHBondContact O-N 2.92Š|
| 66 | W | 45.6 | Very low | 44.1 | Very low | 97 Ų | 97 | 74.4 Ų | 74.4 | 37% | 0.367 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -121 | 7.1 | -172.2 | -47.8 | 102 | 0 | 0 | 0 | 114.2 | Y64 D150 L153 F157 | Y64-W66 PolarHBondContact O-N 2.9Å; W66-D150 PolarHBondContact O-N 3.36Å; W66-D150 VanDerWaalsContact O-N 3.09Å; W66-L153 HydrophobicContact CE3-CD2 3.79Å; W66-L153 HydrophobicContact CE3-CG 3.9Å; W66-L153 HydrophobicContact CZ3-CD2 4.45Å; W66-L153 HydrophobicContact CZ3-CG 4.26Å; W66-F157 HydrophobicContact CH2-CB 4.37Å; W66-F157 AromaticContact CH2-CD2 3.52Å; W66-F157 HydrophobicContact CH2-CD2 3.52Å; W66-F157 AromaticContact CH2-CE2 3.85Å; W66-F157 HydrophobicContact CH2-CE2 3.85Å; W66-F157 AromaticContact CH2-CG 3.92Å; W66-F157 HydrophobicContact CH2-CG 3.92Å; W66-F157 HydrophobicContact CH2-CZ 4.48Å; W66-F157 HydrophobicContact CZ2-CD2 4.49Å; W66-F157 HydrophobicContact CZ2-CE2 4.46Å; W66-F157 HydrophobicContact CZ3-CB 4.06Å; W66-F157 HydrophobicContact CZ3-CD2 4.03Å; W66-F157 HydrophobicContact CZ3-CG 4.11Å |
| 67 | S | 39.8 | Very low | 43.2 | Very low | 6 Ų | 6 | 72.5 Ų | 72.5 | 4% | 0.042 | 37% | 0.371 | C | S | . | . | trans | -98.1 | 145.3 | -177.4 | -56.3 | 0 | 0 | 0 | 0 | 110.9 | T63 P122 N147 I148 | T63-S67 PolarHBondContact O-OG 2.92Å; S67-P122 VanDerWaalsContact O-CG 3.31Å; S67-P122 WeakPolarHBondContact O-CG 2.93Å; S67-N147 WeakPolarHBondContact CA-O 3.4Å; S67-I148 PolarHBondContact OG-O 2.72Å | ||
| 68 | T | 44.5 | Very low | 42.6 | Very low | 17 Ų | 17 | 69.6 Ų | 69.6 | 10% | 0.104 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 131.3 | 171.5 | -60.2 | 0 | 0 | 0 | 0 | 108 | Q70 V119 N147 D150 | T68-Q70 HydrophobicContact CG2-CG 4.41Å; T68-V119 HydrophobicContact CG2-CG1 3.27Å; T68-N147 PolarHBondContact N-O 3.44Å; T68-N147 PolarHBondContact O-N 3.49Å; T68-D150 WeakPolarHBondContact CB-OD2 3.28Å; T68-D150 WeakPolarHBondContact OG1-CB 3.3Å; T68-D150 PolarHBondContact OG1-OD2 2.92Å |
| 69 | V | 48.1 | Very low | 42.3 | Very low | 3 Ų | 3 | 64.5 Ų | 64.5 | 2% | 0.018 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.6 | 115.2 | 178.4 | -179.5 | 0 | 0 | 0 | 0 | 107.9 | F120 P122 V144 | V69-F120 PolarHBondContact N-O 3.01Å; V69-F120 PolarHBondContact O-N 2.7Å; V69-F120 VanDerWaalsContact O-O 3.12Å; V69-P122 HydrophobicContact CG2-CB 4.16Å; V69-V144 HydrophobicContact CG1-CG1 3.98Å |
| 70 | Q | 39.2 | Very low | 42.1 | Very low | 56 Ų | 56 | 61.4 Ų | 61.4 | 26% | 0.262 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 121.5 | 178.7 | -59.6 | -176.5 | 15.2 | 0 | 0 | 108.6 | T68 V119 S145 | T68-Q70 HydrophobicContact CG2-CG 4.41Å; Q70-V119 HydrophobicContact CG-CG1 4.46Å; Q70-V119 HydrophobicContact CG-CG2 4.33Å; Q70-S145 PolarHBondContact N-O 2.77Å; Q70-S145 PolarHBondContact O-N 3.42Å |
| 71 | V | 44.3 | Very low | 41.9 | Very low | 4 Ų | 4 | 55.7 Ų | 55.7 | 2% | 0.024 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 109.6 | 171.2 | -179.9 | 0 | 0 | 0 | 0 | 106.8 | V73 I118 F120 F129 V142 V144 | V71-V73 HydrophobicContact CG1-CG2 4.28Å; V71-I118 PolarHBondContact N-O 3.42Å; V71-I118 PolarHBondContact O-N 2.84Å; V71-F120 HydrophobicContact CB-CD2 4.11Å; V71-F120 HydrophobicContact CB-CE2 3.76Å; V71-F120 HydrophobicContact CG2-CD2 3.61Å; V71-F120 HydrophobicContact CG2-CE2 3.57Å; V71-F129 HydrophobicContact CG1-CZ 4.37Å; V71-V142 HydrophobicContact CG1-CG1 4.15Å; V71-V144 HydrophobicContact CG1-CG2 4.29Å; V71-V144 HydrophobicContact CG2-CG1 4.12Å; V71-V144 HydrophobicContact CG2-CG2 4.1Å |
| 72 | T | 39 | Very low | 41.2 | Very low | 19 Ų | 19 | 53.5 Ų | 53.5 | 12% | 0.117 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.8 | 111.5 | 179.3 | -52.4 | 0 | 0 | 0 | 0 | 108.4 | T117 S143 | T72-T117 HydrophobicContact CG2-CG2 4.1Å; T72-S143 CarbonylContact C-O 3.58Å; T72-S143 PolarHBondContact N-O 2.69Å; T72-S143 PolarHBondContact O-N 2.85Å; T72-S143 PolarHBondContact O-OG 2.8Å |
| 73 | V | 43.3 | Very low | 40.9 | Very low | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 109.2 | 174.6 | -174.9 | 0 | 0 | 0 | 0 | 107.9 | V71 L79 I81 I116 Y140 V142 | V71-V73 HydrophobicContact CG1-CG2 4.28Å; V73-L79 HydrophobicContact CG1-CD1 3.88Å; V73-I81 HydrophobicContact CG2-CD1 4.49Å; V73-I116 PolarHBondContact N-O 3.37Å; V73-Y140 HydrophobicContact CG1-CD2 4.29Å; V73-V142 HydrophobicContact CG1-CG2 4.18Å; V73-V142 HydrophobicContact CG2-CG1 4.26Å; V73-V142 HydrophobicContact CG2-CG2 4.29Å |
| 74 | T | 35.3 | Very low | 40.4 | Very low | 62 Ų | 62 | 46.7 Ų | 46.7 | 38% | 0.38 | 25% | 0.247 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 118.3 | 179.3 | -44.1 | 0 | 0 | 0 | 0 | 108.7 | I141 | T74-I141 PolarHBondContact N-O 3.49Å; T74-I141 PolarHBondContact O-N 2.96Å |
| 75 | S | 34.5 | Very low | 39.9 | Very low | 15 Ų | 15 | 47.8 Ų | 47.8 | 11% | 0.105 | 26% | 0.26 | C | S | . | . | trans | -133.2 | 153 | 163.7 | 112.6 | 0 | 0 | 0 | 0 | 112.1 | G77 L79 Y140 | S75-G77 PolarHBondContact O-N 3.35Å; S75-G77 VanDerWaalsContact O-N 3.08Å; S75-G77 PolarHBondContact OG-N 3.47Å; S75-G77 PolarHBondContact OG-O 3.22Å; S75-L79 WeakPolarHBondContact OG-CD2 3.46Å; S75-L79 WeakPolarHBondContact OG-CG 3.23Å; S75-Y140 VanDerWaalsContact CB-CB 3.47Å | ||
| 76 | P | 32.4 | Very low | 39.3 | Very low | 99 Ų | 99 | 45.7 Ų | 45.7 | 64% | 0.643 | 27% | 0.266 | S | S | * | . | S | Bend | trans | -74.9 | 15.9 | -179.4 | 30.9 | -35.2 | 0 | 0 | 0 | 114.9 | L138 | P76-L138 HydrophobicContact CG-CB 4.14Å; P76-L138 HydrophobicContact CG-CD1 4.08Å |
| 77 | G | 35.8 | Very low | 38.7 | Very low | 24 Ų | 24 | 45.7 Ų | 45.7 | 25% | 0.247 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -157.9 | 170.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | S75 L79 | S75-G77 PolarHBondContact O-N 3.35Å; S75-G77 VanDerWaalsContact O-N 3.08Å; S75-G77 PolarHBondContact OG-N 3.47Å; S75-G77 PolarHBondContact OG-O 3.22Å; G77-L79 PolarHBondContact O-N 3.42Å; G77-L79 VanDerWaalsContact O-N 3.14Å |
| 78 | L | 33.1 | Very low | 39 | Very low | 94 Ų | 94 | 52.5 Ų | 52.5 | 49% | 0.492 | 31% | 0.311 | S | S | . | . | trans | -51.7 | 112.3 | -177.7 | -77.7 | 159.4 | 0 | 0 | 0 | 112 | E112 | L78-E112 HydrophobicContact CD2-CB 4.49Š| ||
| 79 | L | 38.8 | Very low | 38.9 | Very low | 10 Ų | 10 | 57.1 Ų | 57.1 | 5% | 0.052 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 130.4 | 176 | -69.4 | 168.3 | 0 | 0 | 0 | 109.3 | V73 S75 G77 I116 V131 | V73-L79 HydrophobicContact CG1-CD1 3.88Å; S75-L79 WeakPolarHBondContact OG-CD2 3.46Å; S75-L79 WeakPolarHBondContact OG-CG 3.23Å; G77-L79 PolarHBondContact O-N 3.42Å; G77-L79 VanDerWaalsContact O-N 3.14Å; L79-I116 HydrophobicContact CB-CD1 4.11Å; L79-I116 WeakPolarHBondContact O-CD1 3.31Å; L79-V131 HydrophobicContact CD2-CG1 4.37Å |
| 80 | N | 37.9 | Very low | 39.1 | Very low | 78 Ų | 78 | 58.8 Ų | 58.8 | 42% | 0.417 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 111.5 | 167.6 | -169.1 | -29.3 | 0 | 0 | 0 | 108.4 | V82 K132 V134 | N80-V82 PolarHBondContact O-N 3.12Å; N80-K132 PolarHBondContact O-N 3.32Å; N80-V134 HydrophobicContact CB-CG2 3.35Å |
| 81 | I | 43.2 | Very low | 39.3 | Very low | 17 Ų | 17 | 63.7 Ų | 63.7 | 9% | 0.087 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 101.1 | 176.6 | -60.4 | -179.9 | 0 | 0 | 0 | 108 | V73 Y83 I116 I118 | V73-I81 HydrophobicContact CG2-CD1 4.49Å; I81-Y83 HydrophobicContact CG2-CE2 4.36Å; I81-Y83 PolarHBondContact O-N 2.83Å; I81-I116 HydrophobicContact CB-CD1 4.41Å; I81-I116 HydrophobicContact CD1-CB 3.64Å; I81-I116 HydrophobicContact CD1-CD1 3.59Å; I81-I116 HydrophobicContact CD1-CG1 4.2Å; I81-I116 HydrophobicContact CD1-CG2 3.64Å; I81-I116 HydrophobicContact CG1-CD1 3.68Å; I81-I118 HydrophobicContact CD1-CD1 3.66Å; I81-I118 HydrophobicContact CD1-CG1 4.36Å; I81-I118 HydrophobicContact CG2-CD1 3.83Å |
| 82 | V | 38.5 | Very low | 39.3 | Very low | 50 Ų | 50 | 71.8 Ų | 71.8 | 30% | 0.303 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 102.2 | 174.7 | -176.6 | 0 | 0 | 0 | 0 | 107.8 | N80 I84 S130 | N80-V82 PolarHBondContact O-N 3.12Å; V82-I84 PolarHBondContact O-N 3.34Å; V82-S130 PolarHBondContact N-O 3.2Å; V82-S130 PolarHBondContact O-N 2.96Å |
| 83 | Y | 39.2 | Very low | 39.5 | Very low | 66 Ų | 66 | 73.9 Ų | 73.9 | 26% | 0.259 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.7 | 118.1 | 169.4 | -62.3 | -87.8 | 0 | 0 | 0 | 108.7 | I81 T85 I118 | I81-Y83 HydrophobicContact CG2-CE2 4.36Å; I81-Y83 PolarHBondContact O-N 2.83Å; Y83-T85 VanDerWaalsContact C-N 3.35Å; Y83-I118 HydrophobicContact CE1-CD1 4.13Å; Y83-I118 HydrophobicContact CE1-CG2 4.24Å; Y83-I118 WeakPolarHBondContact OH-CD1 3.34Å |
| 84 | I | 39.3 | Very low | 39.8 | Very low | 95 Ų | 95 | 83.5 Ų | 83.5 | 49% | 0.487 | 47% | 0.465 | S | S | . | . | trans | -81.3 | -17.6 | 179.2 | -72.9 | -167.3 | 0 | 0 | 0 | 111.5 | V82 G86 | V82-I84 PolarHBondContact O-N 3.34Å; I84-G86 PolarHBondContact O-N 2.97Å | ||
| 85 | T | 36 | Very low | 40.7 | Very low | 83 Ų | 83 | 84 Ų | 84 | 51% | 0.509 | 47% | 0.471 | S | S | . | . | S | Bend | trans | -91.9 | 98.1 | 179.4 | -45 | 0 | 0 | 0 | 0 | 111.6 | Y83 C128 | Y83-T85 VanDerWaalsContact C-N 3.35Å; T85-C128 PolarHBondContact OG1-O 2.95Å |
| 86 | G | 37.4 | Very low | 41.4 | Very low | 64 Ų | 64 | 89.8 Ų | 89.8 | 66% | 0.66 | 50% | 0.499 | S | S | * | . | S | Bend | trans | 101.3 | 86.8 | 155.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | I84 | I84-G86 PolarHBondContact O-N 2.97Š|
| 87 | S | 33.9 | Very low | 42.2 | Very low | 97 Ų | 97 | 91.7 Ų | 91.7 | 68% | 0.678 | 50% | 0.503 | S | S | * | . | trans | 2.2 | 121.4 | 155.5 | -170.7 | 0 | 0 | 0 | 0 | 116.8 | N89 | S87-N89 PolarHBondContact O-N 2.65Š| ||
| 88 | H | 44.8 | Very low | 42.9 | Very low | 149 Ų | 149 | 92.5 Ų | 92.5 | 69% | 0.69 | 51% | 0.505 | S | S | * | . | S | Bend | trans | -63.4 | 23.8 | 177.4 | -64.7 | -97.8 | 0 | 0 | 0 | 115.6 | ||
| 89 | N | 43.3 | Very low | 43.8 | Very low | 115 Ų | 115 | 92.3 Ų | 92.3 | 62% | 0.615 | 50% | 0.5 | S | S | * | . | trans | -111.1 | 90.8 | 177.5 | -80.1 | -19.3 | 0 | 0 | 0 | 110.2 | S87 Q91 | S87-N89 PolarHBondContact O-N 2.65Å; N89-Q91 PolarHBondContact O-N 2.96Å | ||
| 90 | C | 51.8 | Low | 44.6 | Very low | 38 Ų | 38 | 96.3 Ų | 96.3 | 26% | 0.257 | 52% | 0.521 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.6 | 33.5 | 171.4 | -55.1 | 0 | 0 | 0 | 0 | 112.8 | C102 N106 | C90-C102 HydrophobicContact CB-CB 4.17Å; C90-C102 WeakPolarHBondContact CB-SG 3.11Å; C90-C102 WeakPolarHBondContact SG-CB 3.1Å; C90-C102 CovalentContact SG-SG 2.07Å; C90-C102 PolarHBondContact SG-SG 3.23Å; C90-N106 PolarHBondContact SG-ND2 3.17Å; C90-N106 VanDerWaalsContact SG-ND2 3.42Å |
| 91 | Q | 44.3 | Very low | 45.3 | Very low | 159 Ų | 159 | 99.3 Ų | 99.3 | 74% | 0.743 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | -14.7 | -175.9 | -159.3 | 162.6 | -3.7 | 0 | 0 | 112.9 | N89 | N89-Q91 PolarHBondContact O-N 2.96Š|
| 92 | H | 43 | Very low | 45.9 | Very low | 173 Ų | 173 | 100.1 Ų | 100.1 | 80% | 0.801 | 54% | 0.537 | S | S | * | . | trans | -136.8 | 88.3 | 177.8 | -74.5 | -74.9 | 0 | 0 | 0 | 110.5 | ||||
| 93 | T | 44.9 | Very low | 46.7 | Very low | 64 Ų | 64 | 100.1 Ų | 100.1 | 39% | 0.393 | 54% | 0.537 | S | S | . | . | trans | -137.2 | 119.1 | 170.8 | -36.5 | 0 | 0 | 0 | 0 | 109 | S95 S98 | T93-S95 PolarHBondContact O-N 3.12Å; T93-S95 VanDerWaalsContact O-N 3.1Å; T93-S98 VanDerWaalsContact CG2-CB 3.48Å; T93-S98 WeakPolarHBondContact CG2-OG 3.33Å | ||
| 94 | E | 48.6 | Very low | 47.3 | Very low | 201 Ų | 201 | 100.6 Ų | 100.6 | 94% | 0.939 | 55% | 0.547 | S | S | * | . | S | Bend | trans | -72.4 | -0.5 | -166.1 | -59.2 | -156.9 | 140.3 | 0 | 0 | 115 | ||
| 95 | S | 54 | Low | 47.9 | Very low | 73 Ų | 73 | 100.8 Ų | 100.8 | 51% | 0.51 | 55% | 0.545 | S | S | . | . | S | Bend | trans | -138 | 141.3 | -176.4 | -70.7 | 0 | 0 | 0 | 0 | 112.7 | T93 L97 S98 F99 | T93-S95 PolarHBondContact O-N 3.12Å; T93-S95 VanDerWaalsContact O-N 3.1Å; S95-L97 VanDerWaalsContact C-N 3.26Å; S95-L97 PolarHBondContact O-N 2.93Å; S95-S98 WeakPolarHBondContact CB-OG 3.26Å; S95-S98 PolarHBondContact O-N 2.97Å; S95-S98 PolarHBondContact O-OG 3.09Å; S95-F99 PolarHBondContact O-N 3.24Å |
| 96 | I | 49 | Very low | 48.7 | Very low | 137 Ų | 137 | 101 Ų | 101 | 70% | 0.703 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -61.2 | -37 | -177.5 | -63 | 169.1 | 0 | 0 | 0 | 111.1 | F99 I100 | I96-F99 PolarHBondContact O-N 3.42Å; I96-I100 HydrophobicContact CG2-CD1 3.83Å; I96-I100 HydrophobicContact CG2-CG1 4.38Å; I96-I100 VanDerWaalsContact O-CG1 3.27Å; I96-I100 WeakPolarHBondContact O-CG1 3.16Å; I96-I100 PolarHBondContact O-N 3.3Å |
| 97 | L | 49.7 | Very low | 48.9 | Very low | 138 Ų | 138 | 105.3 Ų | 105.3 | 72% | 0.723 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.1 | -37.2 | -179.6 | -167.9 | 145.5 | 0 | 0 | 0 | 112.2 | S95 K101 | S95-L97 VanDerWaalsContact C-N 3.26Å; S95-L97 PolarHBondContact O-N 2.93Å; L97-K101 WeakPolarHBondContact O-CB 3.42Å; L97-K101 PolarHBondContact O-N 3.06Å |
| 98 | S | 50.8 | Low | 49.1 | Very low | 41 Ų | 41 | 110.2 Ų | 110.2 | 29% | 0.287 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -76.3 | -31 | 176.7 | 48.6 | 0 | 0 | 0 | 0 | 112.1 | T93 S95 K101 C102 | T93-S98 VanDerWaalsContact CG2-CB 3.48Å; T93-S98 WeakPolarHBondContact CG2-OG 3.33Å; S95-S98 WeakPolarHBondContact CB-OG 3.26Å; S95-S98 PolarHBondContact O-N 2.97Å; S95-S98 PolarHBondContact O-OG 3.09Å; S98-K101 PolarHBondContact O-N 2.87Å; S98-C102 WeakPolarHBondContact O-CB 3.45Å; S98-C102 PolarHBondContact O-N 3.07Å |
| 99 | F | 52.5 | Low | 49.1 | Very low | 90 Ų | 90 | 105.4 Ų | 105.4 | 40% | 0.395 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.7 | -47.7 | 167.5 | 179.2 | -99.1 | 0 | 0 | 0 | 112.3 | S95 I96 K101 C102 V103 | S95-F99 PolarHBondContact O-N 3.24Å; I96-F99 PolarHBondContact O-N 3.42Å; F99-K101 VanDerWaalsContact C-N 3.31Å; F99-K101 PolarHBondContact O-N 2.65Å; F99-C102 WeakPolarHBondContact O-CB 3.18Å; F99-C102 PolarHBondContact O-N 3.22Å; F99-V103 HydrophobicContact CD1-CG2 4.22Å; F99-V103 HydrophobicContact CD2-CG2 4.4Å; F99-V103 HydrophobicContact CE1-CG2 3.83Å; F99-V103 HydrophobicContact CE2-CG2 4.03Å; F99-V103 HydrophobicContact CZ-CG2 3.73Å; F99-V103 WeakPolarHBondContact O-CG2 3.33Å; F99-V103 PolarHBondContact O-N 2.04Å |
| 100 | I | 55.3 | Low | 48.9 | Very low | 95 Ų | 95 | 103.9 Ų | 103.9 | 49% | 0.487 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.5 | -45.1 | 176.4 | -68 | 166.5 | 0 | 0 | 0 | 109.8 | I96 C102 V103 T104 | I96-I100 HydrophobicContact CG2-CD1 3.83Å; I96-I100 HydrophobicContact CG2-CG1 4.38Å; I96-I100 VanDerWaalsContact O-CG1 3.27Å; I96-I100 WeakPolarHBondContact O-CG1 3.16Å; I96-I100 PolarHBondContact O-N 3.3Å; I100-C102 PolarHBondContact O-N 2.06Å; I100-V103 PolarHBondContact O-N 3.2Å; I100-T104 WeakPolarHBondContact O-CB 3.45Å; I100-T104 PolarHBondContact O-N 2.91Å; I100-T104 PolarHBondContact O-OG1 3.39Å |
| 101 | K | 52.7 | Low | 48.5 | Very low | 141 Ų | 141 | 111.2 Ų | 111.2 | 61% | 0.613 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -60.1 | -42.9 | 175.8 | -166 | 179.3 | 179.9 | -175.4 | 0 | 112.1 | L97 S98 F99 H105 | L97-K101 WeakPolarHBondContact O-CB 3.42Å; L97-K101 PolarHBondContact O-N 3.06Å; S98-K101 PolarHBondContact O-N 2.87Å; F99-K101 VanDerWaalsContact C-N 3.31Å; F99-K101 PolarHBondContact O-N 2.65Å; K101-H105 WeakPolarHBondContact O-CB 3.03Å; K101-H105 PolarHBondContact O-N 2.97Å |
| 102 | C | 55.7 | Low | 48.3 | Very low | 34 Ų | 34 | 110.7 Ų | 110.7 | 23% | 0.23 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -61 | -47.1 | 175.7 | -157.5 | 0 | 0 | 0 | 0 | 111.2 | C90 S98 F99 I100 H105 N106 | C90-C102 HydrophobicContact CB-CB 4.17Å; C90-C102 WeakPolarHBondContact CB-SG 3.11Å; C90-C102 WeakPolarHBondContact SG-CB 3.1Å; C90-C102 CovalentContact SG-SG 2.07Å; C90-C102 PolarHBondContact SG-SG 3.23Å; S98-C102 WeakPolarHBondContact O-CB 3.45Å; S98-C102 PolarHBondContact O-N 3.07Å; F99-C102 WeakPolarHBondContact O-CB 3.18Å; F99-C102 PolarHBondContact O-N 3.22Å; I100-C102 PolarHBondContact O-N 2.06Å; C102-H105 PolarHBondContact O-N 2.87Å; C102-N106 PolarHBondContact O-N 2.65Å; C102-N106 PolarHBondContact O-ND2 2.98Å |
| 103 | V | 54.5 | Low | 47.9 | Very low | 49 Ų | 49 | 104 Ų | 104 | 30% | 0.297 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -68.7 | -44.5 | -178.3 | 174.4 | 0 | 0 | 0 | 0 | 111.6 | F99 I100 H105 N106 F107 | F99-V103 HydrophobicContact CD1-CG2 4.22Å; F99-V103 HydrophobicContact CD2-CG2 4.4Å; F99-V103 HydrophobicContact CE1-CG2 3.83Å; F99-V103 HydrophobicContact CE2-CG2 4.03Å; F99-V103 HydrophobicContact CZ-CG2 3.73Å; F99-V103 WeakPolarHBondContact O-CG2 3.33Å; F99-V103 PolarHBondContact O-N 2.04Å; I100-V103 PolarHBondContact O-N 3.2Å; V103-H105 VanDerWaalsContact C-N 3.33Å; V103-H105 PolarHBondContact O-N 3.48Å; V103-N106 PolarHBondContact O-N 3.19Å; V103-F107 VanDerWaalsContact O-CB 3.29Å; V103-F107 WeakPolarHBondContact O-CB 3.08Å; V103-F107 PolarHBondContact O-N 2.88Å |
| 104 | T | 52.1 | Low | 47.5 | Very low | 77 Ų | 77 | 108.2 Ų | 108.2 | 47% | 0.472 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.8 | -38.3 | 176.8 | -56.5 | 0 | 0 | 0 | 0 | 111.4 | I100 F107 W108 | I100-T104 WeakPolarHBondContact O-CB 3.45Å; I100-T104 PolarHBondContact O-N 2.91Å; I100-T104 PolarHBondContact O-OG1 3.39Å; T104-F107 PolarHBondContact O-N 2.97Å; T104-W108 WeakPolarHBondContact O-CB 3.41Å; T104-W108 PolarHBondContact O-N 3.44Å |
| 105 | H | 50.9 | Low | 46.6 | Very low | 98 Ų | 98 | 104.4 Ų | 104.4 | 45% | 0.454 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.3 | -42.7 | 175.5 | -171.8 | -86.8 | 0 | 0 | 0 | 112.1 | K101 C102 V103 F107 W108 A109 | K101-H105 WeakPolarHBondContact O-CB 3.03Å; K101-H105 PolarHBondContact O-N 2.97Å; C102-H105 PolarHBondContact O-N 2.87Å; V103-H105 VanDerWaalsContact C-N 3.33Å; V103-H105 PolarHBondContact O-N 3.48Å; H105-F107 VanDerWaalsContact C-N 3.32Å; H105-F107 PolarHBondContact O-N 3.07Å; H105-W108 PolarHBondContact O-N 3.23Å; H105-A109 WeakPolarHBondContact O-CA 3.35Å; H105-A109 VanDerWaalsContact O-CB 3.27Å; H105-A109 WeakPolarHBondContact O-CB 3.27Å; H105-A109 PolarHBondContact O-N 3.47Å |
| 106 | N | 52.6 | Low | 46 | Very low | 88 Ų | 88 | 101.5 Ų | 101.5 | 47% | 0.471 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.8 | -33 | 174.8 | -81.4 | -83.7 | 0 | 0 | 0 | 112.6 | C90 C102 V103 | C90-N106 PolarHBondContact SG-ND2 3.17Å; C90-N106 VanDerWaalsContact SG-ND2 3.42Å; C102-N106 PolarHBondContact O-N 2.65Å; C102-N106 PolarHBondContact O-ND2 2.98Å; V103-N106 PolarHBondContact O-N 3.19Å |
| 107 | F | 42.7 | Very low | 45.2 | Very low | 155 Ų | 155 | 98.6 Ų | 98.6 | 68% | 0.68 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -74.2 | -28.1 | 177.9 | -172.4 | -97.3 | 0 | 0 | 0 | 112.8 | V103 T104 H105 | V103-F107 VanDerWaalsContact O-CB 3.29Å; V103-F107 WeakPolarHBondContact O-CB 3.08Å; V103-F107 PolarHBondContact O-N 2.88Å; T104-F107 PolarHBondContact O-N 2.97Å; H105-F107 VanDerWaalsContact C-N 3.32Å; H105-F107 PolarHBondContact O-N 3.07Å |
| 108 | W | 37.5 | Very low | 45.1 | Very low | 200 Ų | 200 | 92.5 Ų | 92.5 | 76% | 0.758 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -107.7 | 2.2 | -177.8 | -135.7 | -82.7 | 0 | 0 | 0 | 113.8 | T104 H105 P110 | T104-W108 WeakPolarHBondContact O-CB 3.41Å; T104-W108 PolarHBondContact O-N 3.44Å; H105-W108 PolarHBondContact O-N 3.23Å; W108-P110 WeakPolarHBondContact O-CD 3.5Å |
| 109 | A | 44.5 | Very low | 44.5 | Very low | 48 Ų | 48 | 94.6 Ų | 94.6 | 40% | 0.397 | 48% | 0.477 | S | S | . | . | trans | -66.8 | 115 | 176.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | H105 E111 | H105-A109 WeakPolarHBondContact O-CA 3.35Å; H105-A109 VanDerWaalsContact O-CB 3.27Å; H105-A109 WeakPolarHBondContact O-CB 3.27Å; H105-A109 PolarHBondContact O-N 3.47Å; A109-E111 PolarHBondContact O-N 2.92Å; A109-E111 VanDerWaalsContact O-N 3.12Å | ||
| 110 | P | 38.9 | Very low | 44.3 | Very low | 82 Ų | 82 | 92 Ų | 92 | 53% | 0.532 | 47% | 0.466 | S | S | . | . | trans | -67.6 | 114.4 | 172.4 | 27.2 | -29.3 | 0 | 0 | 0 | 107.2 | W108 E112 | W108-P110 WeakPolarHBondContact O-CD 3.5Å; P110-E112 VanDerWaalsContact C-N 3.31Å; P110-E112 PolarHBondContact O-N 3.19Å | ||
| 111 | E | 43.3 | Very low | 43.5 | Very low | 192 Ų | 192 | 91.4 Ų | 91.4 | 90% | 0.897 | 47% | 0.47 | S | S | * | . | S | Bend | trans | -64.4 | -37.4 | -174.8 | -158.4 | 168.8 | 166.3 | 0 | 0 | 110.7 | A109 | A109-E111 PolarHBondContact O-N 2.92Å; A109-E111 VanDerWaalsContact O-N 3.12Å |
| 112 | E | 40.4 | Very low | 42.9 | Very low | 148 Ų | 148 | 86 Ų | 86 | 69% | 0.692 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -155.4 | 128.9 | 171.9 | -62.5 | -162.5 | 173.4 | 0 | 0 | 110.7 | L78 P110 | L78-E112 HydrophobicContact CD2-CB 4.49Å; P110-E112 VanDerWaalsContact C-N 3.31Å; P110-E112 PolarHBondContact O-N 3.19Å |
| 113 | A | 35.5 | Very low | 42.1 | Very low | 33 Ų | 33 | 89.6 Ų | 89.6 | 27% | 0.273 | 46% | 0.459 | S | S | . | . | trans | -150.1 | 142 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | E115 I116 | A113-E115 PolarHBondContact O-N 3.34Å; A113-I116 HydrophobicContact CB-CG1 4.42Å; A113-I116 WeakPolarHBondContact O-CG1 3.48Å | ||
| 114 | E | 36.6 | Very low | 41.7 | Very low | 153 Ų | 153 | 89.5 Ų | 89.5 | 72% | 0.715 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -62.4 | -19.5 | 175.3 | -71.4 | -178.2 | 152.6 | 0 | 0 | 113.1 | ||
| 115 | E | 30.1 | Very low | 41.1 | Very low | 120 Ų | 120 | 94 Ų | 94 | 56% | 0.561 | 48% | 0.483 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 113.6 | 176.3 | -173.8 | 174.7 | -165.4 | 0 | 0 | 108.3 | A113 | A113-E115 PolarHBondContact O-N 3.34Å |
| 116 | I | 40.7 | Very low | 40.7 | Very low | 13 Ų | 13 | 93.3 Ų | 93.3 | 7% | 0.067 | 49% | 0.486 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.9 | 103.8 | 179.3 | -52.5 | 168.4 | 0 | 0 | 0 | 108.3 | V73 L79 I81 A113 I118 | V73-I116 PolarHBondContact N-O 3.37Å; L79-I116 HydrophobicContact CB-CD1 4.11Å; L79-I116 WeakPolarHBondContact O-CD1 3.31Å; I81-I116 HydrophobicContact CB-CD1 4.41Å; I81-I116 HydrophobicContact CD1-CB 3.64Å; I81-I116 HydrophobicContact CD1-CD1 3.59Å; I81-I116 HydrophobicContact CD1-CG1 4.2Å; I81-I116 HydrophobicContact CD1-CG2 3.64Å; I81-I116 HydrophobicContact CG1-CD1 3.68Å; A113-I116 HydrophobicContact CB-CG1 4.42Å; A113-I116 WeakPolarHBondContact O-CG1 3.48Å; I116-I118 HydrophobicContact CG2-CD1 4.43Å; I116-I118 HydrophobicContact CG2-CG1 3.85Å |
| 117 | T | 32.8 | Very low | 40.7 | Very low | 76 Ų | 76 | 91.4 Ų | 91.4 | 47% | 0.466 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88 | 104.9 | 170.7 | 54.6 | 0 | 0 | 0 | 0 | 108.7 | T72 | T72-T117 HydrophobicContact CG2-CG2 4.1Å |
| 118 | I | 47.2 | Very low | 41.1 | Very low | 9 Ų | 9 | 85.5 Ų | 85.5 | 5% | 0.046 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.8 | 111.8 | 175.9 | -52.4 | 175.6 | 0 | 0 | 0 | 108 | V71 I81 Y83 I116 F120 | V71-I118 PolarHBondContact N-O 3.42Å; V71-I118 PolarHBondContact O-N 2.84Å; I81-I118 HydrophobicContact CD1-CD1 3.66Å; I81-I118 HydrophobicContact CD1-CG1 4.36Å; I81-I118 HydrophobicContact CG2-CD1 3.83Å; Y83-I118 HydrophobicContact CE1-CD1 4.13Å; Y83-I118 HydrophobicContact CE1-CG2 4.24Å; Y83-I118 WeakPolarHBondContact OH-CD1 3.34Å; I116-I118 HydrophobicContact CG2-CD1 4.43Å; I116-I118 HydrophobicContact CG2-CG1 3.85Å; I118-F120 HydrophobicContact CB-CD2 4.47Å; I118-F120 HydrophobicContact CB-CE2 3.87Å; I118-F120 HydrophobicContact CB-CZ 4.05Å; I118-F120 HydrophobicContact CG2-CD1 4.13Å; I118-F120 HydrophobicContact CG2-CD2 4.01Å; I118-F120 HydrophobicContact CG2-CE1 3.6Å; I118-F120 HydrophobicContact CG2-CE2 3.5Å; I118-F120 VanDerWaalsContact CG2-CE2 3.5Å; I118-F120 HydrophobicContact CG2-CG 4.32Å; I118-F120 HydrophobicContact CG2-CZ 3.28Å |
| 119 | V | 38.2 | Very low | 42 | Very low | 85 Ų | 85 | 76 Ų | 76 | 52% | 0.515 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 106.1 | 178.2 | -175.2 | 0 | 0 | 0 | 0 | 107.9 | T68 Q70 | T68-V119 HydrophobicContact CG2-CG1 3.27Å; Q70-V119 HydrophobicContact CG-CG1 4.46Å; Q70-V119 HydrophobicContact CG-CG2 4.33Å |
| 120 | F | 47.6 | Very low | 42 | Very low | 37 Ų | 37 | 74.2 Ų | 74.2 | 16% | 0.162 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 133.8 | 174.5 | -62.5 | -76.8 | 0 | 0 | 0 | 109.8 | V69 V71 I118 V127 F129 | V69-F120 PolarHBondContact N-O 3.01Å; V69-F120 PolarHBondContact O-N 2.7Å; V69-F120 VanDerWaalsContact O-O 3.12Å; V71-F120 HydrophobicContact CB-CD2 4.11Å; V71-F120 HydrophobicContact CB-CE2 3.76Å; V71-F120 HydrophobicContact CG2-CD2 3.61Å; V71-F120 HydrophobicContact CG2-CE2 3.57Å; I118-F120 HydrophobicContact CB-CD2 4.47Å; I118-F120 HydrophobicContact CB-CE2 3.87Å; I118-F120 HydrophobicContact CB-CZ 4.05Å; I118-F120 HydrophobicContact CG2-CD1 4.13Å; I118-F120 HydrophobicContact CG2-CD2 4.01Å; I118-F120 HydrophobicContact CG2-CE1 3.6Å; I118-F120 HydrophobicContact CG2-CE2 3.5Å; I118-F120 VanDerWaalsContact CG2-CE2 3.5Å; I118-F120 HydrophobicContact CG2-CG 4.32Å; I118-F120 HydrophobicContact CG2-CZ 3.28Å; F120-V127 HydrophobicContact CE1-CB 4.44Å; F120-V127 HydrophobicContact CE1-CG1 3.91Å; F120-F129 HydrophobicContact CZ-CD1 4.25Å; F120-F129 HydrophobicContact CZ-CE1 4.35Å |
| 121 | S | 38.7 | Very low | 42.7 | Very low | 81 Ų | 81 | 70.3 Ų | 70.3 | 57% | 0.566 | 38% | 0.379 | S | S | * | . | trans | -68.8 | 130.3 | 162 | -179 | 0 | 0 | 0 | 0 | 108 | Y123 | S121-Y123 PolarHBondContact O-N 3.31Š| ||
| 122 | P | 41.5 | Very low | 42.6 | Very low | 29 Ų | 29 | 66.7 Ų | 66.7 | 19% | 0.188 | 36% | 0.36 | C | S | . | . | S | Bend | trans | -68.9 | 7.1 | -178.4 | 28.4 | -35.6 | 0 | 0 | 0 | 114.7 | Q56 S67 V69 | Q56-P122 PolarHBondContact OE1-O 2.87Å; S67-P122 VanDerWaalsContact O-CG 3.31Å; S67-P122 WeakPolarHBondContact O-CG 2.93Å; V69-P122 HydrophobicContact CG2-CB 4.16Å |
| 123 | Y | 39 | Very low | 42.6 | Very low | 108 Ų | 108 | 61.8 Ų | 61.8 | 42% | 0.424 | 34% | 0.341 | S | S | . | . | S | Bend | trans | -127.1 | 115.8 | -177.3 | -63.5 | -75.1 | 0 | 0 | 0 | 111 | Y64 S121 | Y64-Y123 PolarHBondContact O-OH 2.83Å; S121-Y123 PolarHBondContact O-N 3.31Å |
| 124 | G | 44.8 | Very low | 42.6 | Very low | 47 Ų | 47 | 64.5 Ų | 64.5 | 49% | 0.485 | 35% | 0.354 | S | S | . | . | S | Bend | trans | 156.5 | -174 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q56 | Q56-G124 VanDerWaalsContact CD-O 3.23Å; Q56-G124 PolarHBondContact NE2-O 3.43Å; Q56-G124 PolarHBondContact OE1-O 3.45Å |
| 125 | E | 39.8 | Very low | 43.1 | Very low | 171 Ų | 171 | 60 Ų | 60 | 80% | 0.799 | 35% | 0.349 | S | S | * | . | S | Bend | trans | -58 | 155.5 | 175.9 | -67.4 | 174.8 | 174.7 | 0 | 0 | 112.6 | V127 | E125-V127 WeakPolarHBondContact O-CG2 3.47Å; E125-V127 PolarHBondContact O-N 2.97Å |
| 126 | T | 42.3 | Very low | 43.4 | Very low | 85 Ų | 85 | 65.4 Ų | 65.4 | 52% | 0.521 | 36% | 0.364 | S | S | . | . | P | Polyproline II helix | trans | -56 | 119.7 | 177.2 | 49.3 | 0 | 0 | 0 | 0 | 110.5 | ||
| 127 | V | 52.9 | Low | 43.3 | Very low | 47 Ų | 47 | 71.1 Ų | 71.1 | 29% | 0.285 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.6 | 120 | -179.8 | -166.7 | 0 | 0 | 0 | 0 | 108.8 | Y54 F120 E125 | Y54-V127 PolarHBondContact N-O 3.38Å; F120-V127 HydrophobicContact CE1-CB 4.44Å; F120-V127 HydrophobicContact CE1-CG1 3.91Å; E125-V127 WeakPolarHBondContact O-CG2 3.47Å; E125-V127 PolarHBondContact O-N 2.97Å |
| 128 | C | 50.1 | Low | 43.5 | Very low | 31 Ų | 31 | 71.7 Ų | 71.7 | 21% | 0.209 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 131.9 | 173 | -67.3 | 0 | 0 | 0 | 0 | 109 | Y52 C53 T85 | Y52-C128 WeakPolarHBondContact O-CA 3.05Å; C53-C128 HydrophobicContact CB-CB 4.24Å; C53-C128 WeakPolarHBondContact CB-SG 3.31Å; C53-C128 WeakPolarHBondContact SG-CB 3.33Å; C53-C128 CovalentContact SG-SG 2.06Å; C53-C128 PolarHBondContact SG-SG 2.94Å; T85-C128 PolarHBondContact OG1-O 2.95Å |
| 129 | F | 57.6 | Low | 43.2 | Very low | 0 Ų | 0 | 75.1 Ų | 75.1 | 0% | 0 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 147.8 | 177.5 | 61.1 | -88.8 | 0 | 0 | 0 | 110.3 | L38 Y52 V71 F120 V131 | L38-F129 HydrophobicContact CD1-CE1 3.73Å; L38-F129 HydrophobicContact CD1-CE2 4.45Å; L38-F129 HydrophobicContact CD1-CZ 3.4Å; Y52-F129 HydrophobicContact CD2-CE2 4.49Å; Y52-F129 PolarHBondContact N-O 2.83Å; Y52-F129 PolarHBondContact O-N 3.34Å; V71-F129 HydrophobicContact CG1-CZ 4.37Å; F120-F129 HydrophobicContact CZ-CD1 4.25Å; F120-F129 HydrophobicContact CZ-CE1 4.35Å; F129-V131 HydrophobicContact CD2-CG2 3.8Å; F129-V131 HydrophobicContact CE2-CG2 3.84Å |
| 130 | S | 44.1 | Very low | 43.3 | Very low | 12 Ų | 12 | 71.2 Ų | 71.2 | 8% | 0.084 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 121.2 | 172.6 | -178.9 | 0 | 0 | 0 | 0 | 108.7 | V82 | V82-S130 PolarHBondContact N-O 3.2Å; V82-S130 PolarHBondContact O-N 2.96Å |
| 131 | V | 52.8 | Low | 43.2 | Very low | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.3 | 114.9 | 175.4 | -174.5 | 0 | 0 | 0 | 0 | 106.9 | L79 F129 Y140 | L79-V131 HydrophobicContact CD2-CG1 4.37Å; F129-V131 HydrophobicContact CD2-CG2 3.8Å; F129-V131 HydrophobicContact CE2-CG2 3.84Å; V131-Y140 HydrophobicContact CG1-CE2 4.43Å |
| 132 | K | 41.6 | Very low | 43.6 | Very low | 116 Ų | 116 | 68.7 Ų | 68.7 | 50% | 0.504 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.2 | 110.5 | 173.2 | -71.4 | -175.7 | 179.8 | 176.5 | 0 | 108.2 | N80 V134 | N80-K132 PolarHBondContact O-N 3.32Å; K132-V134 PolarHBondContact O-N 2.93Å |
| 133 | P | 40.6 | Very low | 43.6 | Very low | 45 Ų | 45 | 68.8 Ų | 68.8 | 29% | 0.292 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.5 | 134.2 | 176.9 | 25.7 | -31.4 | 0 | 0 | 0 | 110.1 | G135 | P133-G135 PolarHBondContact O-N 2.94Å |
| 134 | V | 36.5 | Very low | 43.9 | Very low | 90 Ų | 90 | 64.1 Ų | 64.1 | 55% | 0.545 | 36% | 0.358 | S | S | . | . | S | Bend | trans | -94.4 | 94.1 | 170.5 | 179.2 | 0 | 0 | 0 | 0 | 107.3 | N80 K132 | N80-V134 HydrophobicContact CB-CG2 3.35Å; K132-V134 PolarHBondContact O-N 2.93Å |
| 135 | G | 47 | Very low | 43.8 | Very low | 59 Ų | 59 | 65 Ų | 65 | 61% | 0.608 | 36% | 0.357 | S | S | * | . | S | Bend | trans | 124.3 | -159.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | P133 | P133-G135 PolarHBondContact O-N 2.94Š|
| 136 | R | 35.7 | Very low | 44.1 | Very low | 233 Ų | 233 | 59.9 Ų | 59.9 | 88% | 0.879 | 33% | 0.33 | S | S | * | . | S | Bend | trans | -63.1 | 137.9 | -172.5 | -65.3 | -170.1 | -170.5 | -165.2 | 4.1 | 110.8 | L138 | R136-L138 VanDerWaalsContact C-N 3.28Å; R136-L138 PolarHBondContact O-N 3.32Å |
| 137 | L | 38 | Very low | 44.6 | Very low | 132 Ų | 132 | 59.4 Ų | 59.4 | 69% | 0.691 | 32% | 0.324 | S | S | * | . | trans | -58.8 | 78.1 | -178 | -64.9 | 110.9 | 0 | 0 | 0 | 112.9 | S47 | S47-L137 WeakPolarHBondContact O-CD2 3.3Š| ||
| 138 | L | 37.6 | Very low | 44.4 | Very low | 88 Ų | 88 | 62.6 Ų | 62.6 | 46% | 0.461 | 34% | 0.339 | S | S | . | . | trans | -90 | 141.1 | 169.9 | -67.4 | 171.5 | 0 | 0 | 0 | 109.4 | P76 R136 Y140 | P76-L138 HydrophobicContact CG-CB 4.14Å; P76-L138 HydrophobicContact CG-CD1 4.08Å; R136-L138 VanDerWaalsContact C-N 3.28Å; R136-L138 PolarHBondContact O-N 3.32Å; L138-Y140 PolarHBondContact O-N 2.9Å | ||
| 139 | P | 40.9 | Very low | 44.4 | Very low | 82 Ų | 82 | 64.2 Ų | 64.2 | 53% | 0.532 | 35% | 0.347 | S | S | . | . | trans | -63.9 | 126.3 | 176.3 | 26.6 | -32.8 | 0 | 0 | 0 | 109.8 | ||||
| 140 | Y | 40.7 | Very low | 44.6 | Very low | 2 Ų | 2 | 66 Ų | 66 | 1% | 0.008 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.1 | 144.9 | 176.7 | 62.6 | -89.2 | 0 | 0 | 0 | 110.2 | T46 V48 V73 S75 V131 L138 V142 | T46-Y140 HydrophobicContact CG2-CE1 3.86Å; T46-Y140 HydrophobicContact CG2-CE2 4.47Å; T46-Y140 WeakPolarHBondContact CG2-OH 3.38Å; T46-Y140 PolarHBondContact N-O 3.36Å; T46-Y140 WeakPolarHBondContact O-CD1 3.38Å; T46-Y140 VanDerWaalsContact O-CE1 3.31Å; T46-Y140 WeakPolarHBondContact O-CE1 3.46Å; T46-Y140 PolarHBondContact O-N 3.37Å; V48-Y140 WeakPolarHBondContact O-CE1 3.28Å; V48-Y140 PolarHBondContact O-OH 2.92Å; V73-Y140 HydrophobicContact CG1-CD2 4.29Å; S75-Y140 VanDerWaalsContact CB-CB 3.47Å; V131-Y140 HydrophobicContact CG1-CE2 4.43Å; L138-Y140 PolarHBondContact O-N 2.9Å; Y140-V142 HydrophobicContact CD2-CG2 3.76Å; Y140-V142 HydrophobicContact CE2-CG2 3.71Å |
| 141 | I | 44.7 | Very low | 45.7 | Very low | 65 Ų | 65 | 72.6 Ų | 72.6 | 33% | 0.333 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 115.9 | -179.6 | -54.8 | -179.7 | 0 | 0 | 0 | 107.5 | L43 K45 T74 | L43-I141 HydrophobicContact CD2-CG2 3.83Å; L43-I141 HydrophobicContact CG-CG2 4.04Å; K45-I141 HydrophobicContact CG-CG1 4.29Å; T74-I141 PolarHBondContact N-O 3.49Å; T74-I141 PolarHBondContact O-N 2.96Å |
| 142 | V | 46.8 | Very low | 46.4 | Very low | 0 Ų | 0 | 80.2 Ų | 80.2 | 0% | 0 | 42% | 0.418 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.7 | 118 | 169.8 | -178.2 | 0 | 0 | 0 | 0 | 107.4 | L43 I44 V71 V73 Y140 | L43-V142 WeakPolarHBondContact CA-O 3.35Å; I44-V142 PolarHBondContact N-O 3.47Å; I44-V142 PolarHBondContact O-N 3.19Å; V71-V142 HydrophobicContact CG1-CG1 4.15Å; V73-V142 HydrophobicContact CG1-CG2 4.18Å; V73-V142 HydrophobicContact CG2-CG1 4.26Å; V73-V142 HydrophobicContact CG2-CG2 4.29Å; Y140-V142 HydrophobicContact CD2-CG2 3.76Å; Y140-V142 HydrophobicContact CE2-CG2 3.71Å |
| 143 | S | 41.3 | Very low | 47.6 | Very low | 31 Ų | 31 | 78 Ų | 78 | 22% | 0.217 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 127.9 | 176.1 | 64.6 | 0 | 0 | 0 | 0 | 110.3 | T72 | T72-S143 CarbonylContact C-O 3.58Å; T72-S143 PolarHBondContact N-O 2.69Å; T72-S143 PolarHBondContact O-N 2.85Å; T72-S143 PolarHBondContact O-OG 2.8Å |
| 144 | V | 45.7 | Very low | 49.1 | Very low | 10 Ų | 10 | 81.2 Ų | 81.2 | 6% | 0.061 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.8 | 103.3 | 176.2 | -175.6 | 0 | 0 | 0 | 0 | 108.2 | V69 V71 | V69-V144 HydrophobicContact CG1-CG1 3.98Å; V71-V144 HydrophobicContact CG1-CG2 4.29Å; V71-V144 HydrophobicContact CG2-CG1 4.12Å; V71-V144 HydrophobicContact CG2-CG2 4.1Å |
| 145 | S | 42.6 | Very low | 51 | Low | 67 Ų | 67 | 82 Ų | 82 | 47% | 0.469 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 117.4 | 177.9 | -170.7 | 0 | 0 | 0 | 0 | 110.1 | Q70 | Q70-S145 PolarHBondContact N-O 2.77Å; Q70-S145 PolarHBondContact O-N 3.42Å |
| 146 | R | 45.9 | Very low | 52.5 | Low | 63 Ų | 63 | 83.7 Ų | 83.7 | 24% | 0.238 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 112 | 175.9 | -168.9 | -165.7 | -157.3 | 133.4 | 24.8 | 108.9 | E40 Y64 I148 | E40-R146 WeakPolarHBondContact OE1-CD 3.29Å; E40-R146 VanDerWaalsContact OE1-CG 3.23Å; E40-R146 WeakPolarHBondContact OE1-CG 3.19Å; E40-R146 IonicContact OE1-CZ 2.8Å; E40-R146 IonicContact OE1-NE 2.96Å; E40-R146 PolarHBondContact OE1-NE 2.97Å; E40-R146 IonicContact OE1-NH1 2.97Å; E40-R146 PolarHBondContact OE1-NH1 3.45Å; E40-R146 IonicContact OE1-NH2 3.34Å; E40-R146 PolarHBondContact OE1-NH2 3.45Å; E40-R146 IonicContact OE2-CZ 3.25Å; E40-R146 VanDerWaalsContact OE2-CZ 3.25Å; E40-R146 IonicContact OE2-NH1 2.65Å; E40-R146 PolarHBondContact OE2-NH1 3.46Å; E40-R146 IonicContact OE2-NH2 3.58Å; Y64-R146 VanDerWaalsContact CD1-CZ 3.43Å; R146-I148 PolarHBondContact O-N 3.2Å |
| 147 | N | 53 | Low | 54.4 | Low | 74 Ų | 74 | 77.4 Ų | 77.4 | 40% | 0.396 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88 | 111.2 | 170.4 | -149.9 | -2.8 | 0 | 0 | 0 | 108.7 | S67 T68 V149 | S67-N147 WeakPolarHBondContact CA-O 3.4Å; T68-N147 PolarHBondContact N-O 3.44Å; T68-N147 PolarHBondContact O-N 3.49Å; N147-V149 PolarHBondContact O-N 3.12Å |
| 148 | I | 49.9 | Very low | 56.6 | Low | 115 Ų | 115 | 74.1 Ų | 74.1 | 59% | 0.59 | 38% | 0.384 | S | S | * | . | S | Bend | trans | -64.5 | -31.9 | -171.9 | -58.7 | 170.4 | 0 | 0 | 0 | 110.7 | S67 R146 | S67-I148 PolarHBondContact OG-O 2.72Å; R146-I148 PolarHBondContact O-N 3.2Å |
| 149 | V | 50 | Low | 58.8 | Low | 64 Ų | 64 | 73.6 Ų | 73.6 | 39% | 0.388 | 38% | 0.384 | S | S | . | . | trans | -130 | 108.2 | 179.3 | -174.1 | 0 | 0 | 0 | 0 | 109.1 | N147 F151 F154 | N147-V149 PolarHBondContact O-N 3.12Å; V149-F151 PolarHBondContact O-N 3.44Å; V149-F151 VanDerWaalsContact O-N 3.12Å; V149-F154 HydrophobicContact CG1-CB 4.46Å | ||
| 150 | D | 61.8 | Low | 61 | Low | 38 Ų | 38 | 71.5 Ų | 71.5 | 20% | 0.203 | 38% | 0.378 | C | S | . | . | trans | -74.7 | 101.1 | 167.3 | -162.2 | -36.4 | 0 | 0 | 0 | 108.5 | W66 T68 K152 L153 F154 | W66-D150 PolarHBondContact O-N 3.36Å; W66-D150 VanDerWaalsContact O-N 3.09Å; T68-D150 WeakPolarHBondContact CB-OD2 3.28Å; T68-D150 WeakPolarHBondContact OG1-CB 3.3Å; T68-D150 PolarHBondContact OG1-OD2 2.92Å; D150-K152 PolarHBondContact O-N 3.11Å; D150-K152 WeakPolarHBondContact OD1-CB 3.42Å; D150-K152 PolarHBondContact OD1-N 3.16Å; D150-L153 HydrophobicContact CB-CB 4.03Å; D150-L153 PolarHBondContact O-N 3.32Å; D150-F154 PolarHBondContact O-N 3.48Å | ||
| 151 | F | 66.9 | Low | 63.1 | Low | 151 Ų | 151 | 75.1 Ų | 75.1 | 66% | 0.662 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -52.3 | -30.7 | 178.4 | -79.8 | -80 | 0 | 0 | 0 | 112 | V149 L155 | V149-F151 PolarHBondContact O-N 3.44Å; V149-F151 VanDerWaalsContact O-N 3.12Å; F151-L155 WeakPolarHBondContact O-CB 3.3Å; F151-L155 WeakPolarHBondContact O-CG 3.28Å; F151-L155 PolarHBondContact O-N 3.01Å |
| 152 | K | 66.5 | Low | 65.1 | Low | 160 Ų | 160 | 77.2 Ų | 77.2 | 70% | 0.696 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -65.8 | -44.3 | 176.4 | -169 | -179.5 | 178.3 | 179.7 | 0 | 111.1 | D150 L155 V156 | D150-K152 PolarHBondContact O-N 3.11Å; D150-K152 WeakPolarHBondContact OD1-CB 3.42Å; D150-K152 PolarHBondContact OD1-N 3.16Å; K152-L155 PolarHBondContact O-N 3.29Å; K152-V156 VanDerWaalsContact O-CG2 3.28Å; K152-V156 WeakPolarHBondContact O-CG2 3.47Å; K152-V156 PolarHBondContact O-N 3.43Å |
| 153 | L | 66.6 | Low | 66.9 | Low | 69 Ų | 69 | 81.1 Ų | 81.1 | 36% | 0.361 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -69.8 | -39.2 | 178.9 | -168.4 | 64.9 | 0 | 0 | 0 | 111.4 | W66 D150 V156 F157 | W66-L153 HydrophobicContact CE3-CD2 3.79Å; W66-L153 HydrophobicContact CE3-CG 3.9Å; W66-L153 HydrophobicContact CZ3-CD2 4.45Å; W66-L153 HydrophobicContact CZ3-CG 4.26Å; D150-L153 HydrophobicContact CB-CB 4.03Å; D150-L153 PolarHBondContact O-N 3.32Å; L153-V156 PolarHBondContact O-N 3.5Å; L153-F157 PolarHBondContact O-N 3.41Å |
| 154 | F | 72.8 | Confident | 69 | Low | 113 Ų | 113 | 87.6 Ų | 87.6 | 50% | 0.496 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 171.5 | -179.9 | -99.8 | 0 | 0 | 0 | 111.8 | V149 D150 V156 F157 V158 | V149-F154 HydrophobicContact CG1-CB 4.46Å; D150-F154 PolarHBondContact O-N 3.48Å; F154-V156 PolarHBondContact O-N 2.91Å; F154-F157 WeakPolarHBondContact O-CB 3.49Å; F154-F157 PolarHBondContact O-N 2.9Å; F154-V158 HydrophobicContact CD1-CG2 4.17Å; F154-V158 HydrophobicContact CE1-CG2 3.76Å; F154-V158 HydrophobicContact CE2-CG2 4.23Å; F154-V158 HydrophobicContact CZ-CG2 3.79Å; F154-V158 WeakPolarHBondContact O-CG2 3.28Å; F154-V158 PolarHBondContact O-N 2.85Å |
| 155 | L | 75.8 | Confident | 70.7 | Confident | 107 Ų | 107 | 92.9 Ų | 92.9 | 56% | 0.56 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -62.5 | -40.6 | 176 | -75.8 | 170.2 | 0 | 0 | 0 | 112.4 | F151 K152 F157 V158 T159 | F151-L155 WeakPolarHBondContact O-CB 3.3Å; F151-L155 WeakPolarHBondContact O-CG 3.28Å; F151-L155 PolarHBondContact O-N 3.01Å; K152-L155 PolarHBondContact O-N 3.29Å; L155-F157 VanDerWaalsContact C-N 3.33Å; L155-V158 PolarHBondContact O-N 2.93Å; L155-T159 VanDerWaalsContact O-CB 3.3Å; L155-T159 WeakPolarHBondContact O-CB 3.47Å; L155-T159 PolarHBondContact O-N 3.38Å; L155-T159 PolarHBondContact O-OG1 2.96Å |
| 156 | V | 78.8 | Confident | 72.3 | Confident | 93 Ų | 93 | 94.7 Ų | 94.7 | 56% | 0.564 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -61.9 | -42.6 | 174.8 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | K152 L153 F154 T159 G160 | K152-V156 VanDerWaalsContact O-CG2 3.28Å; K152-V156 WeakPolarHBondContact O-CG2 3.47Å; K152-V156 PolarHBondContact O-N 3.43Å; L153-V156 PolarHBondContact O-N 3.5Å; F154-V156 PolarHBondContact O-N 2.91Å; V156-T159 PolarHBondContact O-N 3.44Å; V156-G160 PolarHBondContact O-N 2.07Å |
| 157 | F | 77.3 | Confident | 73.9 | Confident | 101 Ų | 101 | 94 Ų | 94 | 44% | 0.443 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.2 | -48.2 | 176.8 | -177.9 | -106.5 | 0 | 0 | 0 | 112.3 | W66 L153 F154 L155 T159 G160 I161 | W66-F157 HydrophobicContact CH2-CB 4.37Å; W66-F157 AromaticContact CH2-CD2 3.52Å; W66-F157 HydrophobicContact CH2-CD2 3.52Å; W66-F157 AromaticContact CH2-CE2 3.85Å; W66-F157 HydrophobicContact CH2-CE2 3.85Å; W66-F157 AromaticContact CH2-CG 3.92Å; W66-F157 HydrophobicContact CH2-CG 3.92Å; W66-F157 HydrophobicContact CH2-CZ 4.48Å; W66-F157 HydrophobicContact CZ2-CD2 4.49Å; W66-F157 HydrophobicContact CZ2-CE2 4.46Å; W66-F157 HydrophobicContact CZ3-CB 4.06Å; W66-F157 HydrophobicContact CZ3-CD2 4.03Å; W66-F157 HydrophobicContact CZ3-CG 4.11Å; L153-F157 PolarHBondContact O-N 3.41Å; F154-F157 WeakPolarHBondContact O-CB 3.49Å; F154-F157 PolarHBondContact O-N 2.9Å; L155-F157 VanDerWaalsContact C-N 3.33Å; F157-T159 VanDerWaalsContact C-N 3.3Å; F157-T159 PolarHBondContact O-N 2.89Å; F157-G160 PolarHBondContact O-N 3.41Å; F157-G160 VanDerWaalsContact O-N 3.16Å; F157-I161 HydrophobicContact CD1-CD1 3.81Å; F157-I161 HydrophobicContact CE1-CD1 3.32Å; F157-I161 HydrophobicContact CE1-CG1 4.4Å; F157-I161 HydrophobicContact CE2-CD1 4.36Å; F157-I161 HydrophobicContact CZ-CD1 3.65Å; F157-I161 HydrophobicContact CZ-CG1 4.42Å; F157-I161 PolarHBondContact O-N 3.49Å |
| 158 | V | 82.4 | Confident | 74.9 | Confident | 64 Ų | 64 | 97.9 Ų | 97.9 | 39% | 0.388 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.5 | -41.7 | 176.3 | 173 | 0 | 0 | 0 | 0 | 111 | F154 L155 G160 I161 F162 | F154-V158 HydrophobicContact CD1-CG2 4.17Å; F154-V158 HydrophobicContact CE1-CG2 3.76Å; F154-V158 HydrophobicContact CE2-CG2 4.23Å; F154-V158 HydrophobicContact CZ-CG2 3.79Å; F154-V158 WeakPolarHBondContact O-CG2 3.28Å; F154-V158 PolarHBondContact O-N 2.85Å; L155-V158 PolarHBondContact O-N 2.93Å; V158-G160 VanDerWaalsContact C-N 3.34Å; V158-G160 PolarHBondContact O-N 2.99Å; V158-I161 PolarHBondContact O-N 3.28Å; V158-F162 WeakPolarHBondContact O-CB 3.43Å; V158-F162 PolarHBondContact O-N 2.9Å |
| 159 | T | 85.5 | Confident | 75.9 | Confident | 76 Ų | 76 | 96.8 Ų | 96.8 | 47% | 0.466 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 175.7 | -56.7 | 0 | 0 | 0 | 0 | 111.1 | L155 V156 F157 I161 F162 L163 | L155-T159 VanDerWaalsContact O-CB 3.3Å; L155-T159 WeakPolarHBondContact O-CB 3.47Å; L155-T159 PolarHBondContact O-N 3.38Å; L155-T159 PolarHBondContact O-OG1 2.96Å; V156-T159 PolarHBondContact O-N 3.44Å; F157-T159 VanDerWaalsContact C-N 3.3Å; F157-T159 PolarHBondContact O-N 2.89Å; T159-I161 PolarHBondContact O-N 3.4Å; T159-F162 PolarHBondContact O-N 3.18Å; T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.38Å; T159-L163 WeakPolarHBondContact O-CB 3.36Å; T159-L163 VanDerWaalsContact O-CG 3.28Å; T159-L163 WeakPolarHBondContact O-CG 3.39Å; T159-L163 PolarHBondContact O-N 2.91Å |
| 160 | G | 85.5 | Confident | 76.9 | Confident | 39 Ų | 39 | 95.5 Ų | 95.5 | 40% | 0.402 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | V156 F157 V158 L163 F164 | V156-G160 PolarHBondContact O-N 2.07Å; F157-G160 PolarHBondContact O-N 3.41Å; F157-G160 VanDerWaalsContact O-N 3.16Å; V158-G160 VanDerWaalsContact C-N 3.34Å; V158-G160 PolarHBondContact O-N 2.99Å; G160-L163 PolarHBondContact O-N 2.95Å; G160-F164 WeakPolarHBondContact O-CB 3.34Å; G160-F164 PolarHBondContact O-N 2.87Å |
| 161 | I | 86.6 | Confident | 77.3 | Confident | 77 Ų | 77 | 98 Ų | 98 | 40% | 0.395 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 175.1 | -67.4 | 170.3 | 0 | 0 | 0 | 110.7 | F157 V158 T159 L163 F164 L165 | F157-I161 HydrophobicContact CD1-CD1 3.81Å; F157-I161 HydrophobicContact CE1-CD1 3.32Å; F157-I161 HydrophobicContact CE1-CG1 4.4Å; F157-I161 HydrophobicContact CE2-CD1 4.36Å; F157-I161 HydrophobicContact CZ-CD1 3.65Å; F157-I161 HydrophobicContact CZ-CG1 4.42Å; F157-I161 PolarHBondContact O-N 3.49Å; V158-I161 PolarHBondContact O-N 3.28Å; T159-I161 PolarHBondContact O-N 3.4Å; I161-L163 PolarHBondContact O-N 3.4Å; I161-F164 PolarHBondContact O-N 3.34Å; I161-L165 HydrophobicContact CG2-CD1 3.88Å; I161-L165 HydrophobicContact CG2-CG 4.27Å; I161-L165 WeakPolarHBondContact O-CG 3.35Å; I161-L165 PolarHBondContact O-N 3.27Å |
| 162 | F | 86.1 | Confident | 77.9 | Confident | 110 Ų | 110 | 97.8 Ų | 97.8 | 48% | 0.482 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.3 | -47.8 | 177.8 | -169.8 | -91.2 | 0 | 0 | 0 | 110.9 | V158 T159 F164 L165 Y166 | V158-F162 WeakPolarHBondContact O-CB 3.43Å; V158-F162 PolarHBondContact O-N 2.9Å; T159-F162 PolarHBondContact O-N 3.18Å; F162-F164 VanDerWaalsContact C-N 3.28Å; F162-F164 PolarHBondContact O-N 2.82Å; F162-L165 PolarHBondContact O-N 3.48Å; F162-Y166 AromaticContact CD1-CD2 3.89Å; F162-Y166 HydrophobicContact CD1-CD2 3.89Å; F162-Y166 HydrophobicContact CD1-CE2 4.47Å; F162-Y166 HydrophobicContact CD1-CG 4.49Å; F162-Y166 AromaticContact CD2-CD2 3.66Å; F162-Y166 HydrophobicContact CD2-CD2 3.66Å; F162-Y166 AromaticContact CD2-CE2 3.5Å; F162-Y166 HydrophobicContact CD2-CE2 3.5Å; F162-Y166 VanDerWaalsContact CD2-CE2 3.5Å; F162-Y166 AromaticContact CE1-CD2 3.74Å; F162-Y166 HydrophobicContact CE1-CD2 3.74Å; F162-Y166 HydrophobicContact CE1-CE2 4.16Å; F162-Y166 HydrophobicContact CE1-CG 4.1Å; F162-Y166 AromaticContact CE2-CD2 3.52Å; F162-Y166 HydrophobicContact CE2-CD2 3.52Å; F162-Y166 AromaticContact CE2-CE2 3.11Å; F162-Y166 HydrophobicContact CE2-CE2 3.11Å; F162-Y166 HydrophobicContact CE2-CG 4.47Å; F162-Y166 AromaticContact CE2-CZ 3.78Å; F162-Y166 AromaticContact CG-CD2 3.85Å; F162-Y166 HydrophobicContact CG-CD2 3.85Å; F162-Y166 HydrophobicContact CG-CE2 4.18Å; F162-Y166 AromaticContact CZ-CD2 3.55Å; F162-Y166 HydrophobicContact CZ-CD2 3.55Å; F162-Y166 HydrophobicContact CZ-CE1 4.44Å; F162-Y166 AromaticContact CZ-CE2 3.48Å; F162-Y166 HydrophobicContact CZ-CE2 3.48Å; F162-Y166 VanDerWaalsContact CZ-CE2 3.48Å; F162-Y166 HydrophobicContact CZ-CG 4.09Å; F162-Y166 AromaticContact CZ-CZ 3.94Å; F162-Y166 WeakPolarHBondContact O-CB 3.46Å; F162-Y166 VanDerWaalsContact O-CD2 3.28Å; F162-Y166 WeakPolarHBondContact O-CD2 3.29Å; F162-Y166 PolarHBondContact O-N 3.18Å |
| 163 | L | 85.3 | Confident | 78.4 | Confident | 82 Ų | 82 | 91.9 Ų | 91.9 | 43% | 0.429 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -58.8 | -39.2 | 175.4 | -72.6 | 172.8 | 0 | 0 | 0 | 112.2 | T159 G160 I161 A167 L170 F176 | T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.38Å; T159-L163 WeakPolarHBondContact O-CB 3.36Å; T159-L163 VanDerWaalsContact O-CG 3.28Å; T159-L163 WeakPolarHBondContact O-CG 3.39Å; T159-L163 PolarHBondContact O-N 2.91Å; G160-L163 PolarHBondContact O-N 2.95Å; I161-L163 PolarHBondContact O-N 3.4Å; L163-A167 VanDerWaalsContact O-CA 3.25Å; L163-A167 WeakPolarHBondContact O-CA 3.28Å; L163-A167 VanDerWaalsContact O-CB 3.28Å; L163-A167 WeakPolarHBondContact O-CB 3.35Å; L163-A167 PolarHBondContact O-N 3.37Å; L163-L170 HydrophobicContact CD2-CD1 3.99Å; L163-F176 HydrophobicContact CD2-CZ 4.45Å |
| 164 | F | 83.4 | Confident | 78.9 | Confident | 166 Ų | 166 | 92.8 Ų | 92.8 | 73% | 0.728 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.1 | -46.9 | 178.3 | -177.2 | -99.3 | 0 | 0 | 0 | 112.5 | G160 I161 F162 A167 | G160-F164 WeakPolarHBondContact O-CB 3.34Å; G160-F164 PolarHBondContact O-N 2.87Å; I161-F164 PolarHBondContact O-N 3.34Å; F162-F164 VanDerWaalsContact C-N 3.28Å; F162-F164 PolarHBondContact O-N 2.82Å; F164-A167 WeakPolarHBondContact O-CB 3.29Å; F164-A167 PolarHBondContact O-N 3.45Å |
| 165 | L | 81.9 | Confident | 79.1 | Confident | 121 Ų | 121 | 93 Ų | 93 | 63% | 0.634 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.8 | -40 | 179.6 | -67.9 | 176.2 | 0 | 0 | 0 | 112 | I161 F162 A167 | I161-L165 HydrophobicContact CG2-CD1 3.88Å; I161-L165 HydrophobicContact CG2-CG 4.27Å; I161-L165 WeakPolarHBondContact O-CG 3.35Å; I161-L165 PolarHBondContact O-N 3.27Å; F162-L165 PolarHBondContact O-N 3.48Å; L165-A167 VanDerWaalsContact C-N 3.35Å |
| 166 | Y | 77 | Confident | 79.2 | Confident | 106 Ų | 106 | 91.3 Ų | 91.3 | 42% | 0.416 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -89.7 | 2.3 | 179.9 | -71.8 | -88.9 | 0 | 0 | 0 | 113.2 | F162 K168 T169 L170 | F162-Y166 AromaticContact CD1-CD2 3.89Å; F162-Y166 HydrophobicContact CD1-CD2 3.89Å; F162-Y166 HydrophobicContact CD1-CE2 4.47Å; F162-Y166 HydrophobicContact CD1-CG 4.49Å; F162-Y166 AromaticContact CD2-CD2 3.66Å; F162-Y166 HydrophobicContact CD2-CD2 3.66Å; F162-Y166 AromaticContact CD2-CE2 3.5Å; F162-Y166 HydrophobicContact CD2-CE2 3.5Å; F162-Y166 VanDerWaalsContact CD2-CE2 3.5Å; F162-Y166 AromaticContact CE1-CD2 3.74Å; F162-Y166 HydrophobicContact CE1-CD2 3.74Å; F162-Y166 HydrophobicContact CE1-CE2 4.16Å; F162-Y166 HydrophobicContact CE1-CG 4.1Å; F162-Y166 AromaticContact CE2-CD2 3.52Å; F162-Y166 HydrophobicContact CE2-CD2 3.52Å; F162-Y166 AromaticContact CE2-CE2 3.11Å; F162-Y166 HydrophobicContact CE2-CE2 3.11Å; F162-Y166 HydrophobicContact CE2-CG 4.47Å; F162-Y166 AromaticContact CE2-CZ 3.78Å; F162-Y166 AromaticContact CG-CD2 3.85Å; F162-Y166 HydrophobicContact CG-CD2 3.85Å; F162-Y166 HydrophobicContact CG-CE2 4.18Å; F162-Y166 AromaticContact CZ-CD2 3.55Å; F162-Y166 HydrophobicContact CZ-CD2 3.55Å; F162-Y166 HydrophobicContact CZ-CE1 4.44Å; F162-Y166 AromaticContact CZ-CE2 3.48Å; F162-Y166 HydrophobicContact CZ-CE2 3.48Å; F162-Y166 VanDerWaalsContact CZ-CE2 3.48Å; F162-Y166 HydrophobicContact CZ-CG 4.09Å; F162-Y166 AromaticContact CZ-CZ 3.94Å; F162-Y166 WeakPolarHBondContact O-CB 3.46Å; F162-Y166 VanDerWaalsContact O-CD2 3.28Å; F162-Y166 WeakPolarHBondContact O-CD2 3.29Å; F162-Y166 PolarHBondContact O-N 3.18Å; Y166-K168 PolarHBondContact O-N 3.05Å; Y166-K168 VanDerWaalsContact O-N 3.12Å; Y166-T169 PolarHBondContact O-N 3.01Å; Y166-L170 WeakPolarHBondContact O-CB 3.21Å; Y166-L170 VanDerWaalsContact O-CG 3.29Å; Y166-L170 WeakPolarHBondContact O-CG 3.26Å; Y166-L170 PolarHBondContact O-N 3.09Å |
| 167 | A | 78.4 | Confident | 79.2 | Confident | 49 Ų | 49 | 95 Ų | 95 | 41% | 0.405 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -52.6 | -41.2 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L163 F164 L165 S171 | L163-A167 VanDerWaalsContact O-CA 3.25Å; L163-A167 WeakPolarHBondContact O-CA 3.28Å; L163-A167 VanDerWaalsContact O-CB 3.28Å; L163-A167 WeakPolarHBondContact O-CB 3.35Å; L163-A167 PolarHBondContact O-N 3.37Å; F164-A167 WeakPolarHBondContact O-CB 3.29Å; F164-A167 PolarHBondContact O-N 3.45Å; L165-A167 VanDerWaalsContact C-N 3.35Å; A167-S171 WeakPolarHBondContact O-CB 3.24Å; A167-S171 PolarHBondContact O-N 2.94Å |
| 168 | K | 73.9 | Confident | 79.3 | Confident | 154 Ų | 154 | 98.1 Ų | 98.1 | 67% | 0.67 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -69.1 | -42.1 | 179.6 | -168.7 | 171.8 | -177.8 | 170.2 | 0 | 112.3 | Y166 Q172 | Y166-K168 PolarHBondContact O-N 3.05Å; Y166-K168 VanDerWaalsContact O-N 3.12Å; K168-Q172 WeakPolarHBondContact O-CG 3.31Å; K168-Q172 PolarHBondContact O-N 2.89Å |
| 169 | T | 72.4 | Confident | 79.3 | Confident | 93 Ų | 93 | 97.6 Ų | 97.6 | 57% | 0.571 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -71.5 | -42.1 | 179.4 | -48.8 | 0 | 0 | 0 | 0 | 111.3 | Y166 Q172 S173 | Y166-T169 PolarHBondContact O-N 3.01Å; T169-Q172 PolarHBondContact O-N 3.27Å; T169-S173 PolarHBondContact O-N 2.97Å |
| 170 | L | 70.7 | Confident | 79.1 | Confident | 36 Ų | 36 | 97 Ų | 97 | 19% | 0.188 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -67.6 | -44.1 | 178 | -70 | 169.4 | 0 | 0 | 0 | 111.3 | L163 Y166 Q172 S173 F176 | L163-L170 HydrophobicContact CD2-CD1 3.99Å; Y166-L170 WeakPolarHBondContact O-CB 3.21Å; Y166-L170 VanDerWaalsContact O-CG 3.29Å; Y166-L170 WeakPolarHBondContact O-CG 3.26Å; Y166-L170 PolarHBondContact O-N 3.09Å; L170-Q172 VanDerWaalsContact C-N 3.26Å; L170-Q172 PolarHBondContact O-N 3.33Å; L170-S173 PolarHBondContact O-N 3.03Å; L170-S173 PolarHBondContact O-OG 3.45Å; L170-F176 HydrophobicContact CB-CD1 3.73Å; L170-F176 HydrophobicContact CB-CD2 4.43Å; L170-F176 HydrophobicContact CB-CE1 3.88Å; L170-F176 HydrophobicContact CB-CG 4.01Å; L170-F176 HydrophobicContact CB-CZ 4.29Å; L170-F176 HydrophobicContact CD1-CE2 4.29Å; L170-F176 HydrophobicContact CD1-CZ 4.18Å; L170-F176 HydrophobicContact CD2-CB 4.4Å; L170-F176 HydrophobicContact CD2-CD1 4.47Å; L170-F176 HydrophobicContact CD2-CD2 3.66Å; L170-F176 HydrophobicContact CD2-CE2 3.94Å; L170-F176 HydrophobicContact CD2-CG 3.93Å; L170-F176 HydrophobicContact CD2-CZ 4.47Å; L170-F176 HydrophobicContact CG-CD2 4.49Å; L170-F176 HydrophobicContact CG-CE2 4.49Å; L170-F176 WeakPolarHBondContact O-CB 3.33Å |
| 171 | S | 70.3 | Confident | 79 | Confident | 92 Ų | 92 | 97.2 Ų | 97.2 | 64% | 0.643 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.2 | -26.2 | 178.8 | -177.9 | 0 | 0 | 0 | 0 | 113.5 | A167 | A167-S171 WeakPolarHBondContact O-CB 3.24Å; A167-S171 PolarHBondContact O-N 2.94Å |
| 172 | Q | 79.4 | Confident | 78.8 | Confident | 145 Ų | 145 | 96.8 Ų | 96.8 | 68% | 0.678 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -87.2 | -18.5 | 176.7 | -73 | -179.4 | -7.5 | 0 | 0 | 112.7 | K168 T169 L170 P174 | K168-Q172 WeakPolarHBondContact O-CG 3.31Å; K168-Q172 PolarHBondContact O-N 2.89Å; T169-Q172 PolarHBondContact O-N 3.27Å; L170-Q172 VanDerWaalsContact C-N 3.26Å; L170-Q172 PolarHBondContact O-N 3.33Å; Q172-P174 WeakPolarHBondContact O-CD 3.35Å |
| 173 | S | 77 | Confident | 78.7 | Confident | 37 Ų | 37 | 96.1 Ų | 96.1 | 26% | 0.259 | 51% | 0.514 | S | S | . | . | trans | -78.3 | 121.9 | 178.6 | 74.5 | 0 | 0 | 0 | 0 | 110.5 | T169 L170 V175 F176 Y177 | T169-S173 PolarHBondContact O-N 2.97Å; L170-S173 PolarHBondContact O-N 3.03Å; L170-S173 PolarHBondContact O-OG 3.45Å; S173-V175 VanDerWaalsContact C-N 3.25Å; S173-V175 PolarHBondContact O-N 2.91Å; S173-F176 PolarHBondContact O-N 3.47Å; S173-F176 WeakPolarHBondContact OG-CB 3.32Å; S173-Y177 PolarHBondContact O-N 3.47Å | ||
| 174 | P | 77.3 | Confident | 78.5 | Confident | 88 Ų | 88 | 97.3 Ų | 97.3 | 57% | 0.571 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.1 | -35.5 | -179.9 | 22.3 | -31.1 | 0 | 0 | 0 | 111.5 | Q172 F176 Y177 Y178 | Q172-P174 WeakPolarHBondContact O-CD 3.35Å; P174-F176 PolarHBondContact O-N 3.3Å; P174-Y177 PolarHBondContact O-N 2.98Å; P174-Y178 HydrophobicContact CB-CD2 4.45Å; P174-Y178 HydrophobicContact CB-CE2 4.36Å; P174-Y178 WeakPolarHBondContact O-CD2 3.42Å; P174-Y178 PolarHBondContact O-N 2.91Å |
| 175 | V | 77 | Confident | 78.6 | Confident | 116 Ų | 116 | 91 Ų | 91 | 70% | 0.703 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -58.9 | -44.5 | 179.8 | -179 | 0 | 0 | 0 | 0 | 111.9 | S173 S179 | S173-V175 VanDerWaalsContact C-N 3.25Å; S173-V175 PolarHBondContact O-N 2.91Å; V175-S179 WeakPolarHBondContact O-CB 3.3Å; V175-S179 PolarHBondContact O-N 3.47Å; V175-S179 PolarHBondContact O-OG 3.45Å; V175-S179 VanDerWaalsContact O-OG 3.13Å |
| 176 | F | 77.4 | Confident | 78.8 | Confident | 73 Ų | 73 | 90 Ų | 90 | 32% | 0.32 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.9 | -37.2 | -179.9 | -174.8 | -100.1 | 0 | 0 | 0 | 112.4 | L163 L170 S173 P174 S179 S180 | L163-F176 HydrophobicContact CD2-CZ 4.45Å; L170-F176 HydrophobicContact CB-CD1 3.73Å; L170-F176 HydrophobicContact CB-CD2 4.43Å; L170-F176 HydrophobicContact CB-CE1 3.88Å; L170-F176 HydrophobicContact CB-CG 4.01Å; L170-F176 HydrophobicContact CB-CZ 4.29Å; L170-F176 HydrophobicContact CD1-CE2 4.29Å; L170-F176 HydrophobicContact CD1-CZ 4.18Å; L170-F176 HydrophobicContact CD2-CB 4.4Å; L170-F176 HydrophobicContact CD2-CD1 4.47Å; L170-F176 HydrophobicContact CD2-CD2 3.66Å; L170-F176 HydrophobicContact CD2-CE2 3.94Å; L170-F176 HydrophobicContact CD2-CG 3.93Å; L170-F176 HydrophobicContact CD2-CZ 4.47Å; L170-F176 HydrophobicContact CG-CD2 4.49Å; L170-F176 HydrophobicContact CG-CE2 4.49Å; L170-F176 WeakPolarHBondContact O-CB 3.33Å; S173-F176 PolarHBondContact O-N 3.47Å; S173-F176 WeakPolarHBondContact OG-CB 3.32Å; P174-F176 PolarHBondContact O-N 3.3Å; F176-S179 WeakPolarHBondContact CA-OG 3.48Å; F176-S179 PolarHBondContact O-OG 2.86Å; F176-S180 WeakPolarHBondContact O-CB 3.41Å; F176-S180 PolarHBondContact O-N 3.34Å |
| 177 | Y | 78.2 | Confident | 78.9 | Confident | 169 Ų | 169 | 89.7 Ų | 89.7 | 66% | 0.663 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.8 | -48 | 176.6 | -176.1 | -95.1 | 0 | 0 | 0 | 111.3 | S173 P174 G181 | S173-Y177 PolarHBondContact O-N 3.47Å; P174-Y177 PolarHBondContact O-N 2.98Å; Y177-G181 PolarHBondContact O-N 3.05Å |
| 178 | Y | 80.8 | Confident | 78.8 | Confident | 167 Ų | 167 | 93.4 Ų | 93.4 | 66% | 0.655 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65 | -46 | 176.4 | -74.5 | -68.7 | 0 | 0 | 0 | 111.7 | P174 G181 T182 | P174-Y178 HydrophobicContact CB-CD2 4.45Å; P174-Y178 HydrophobicContact CB-CE2 4.36Å; P174-Y178 WeakPolarHBondContact O-CD2 3.42Å; P174-Y178 PolarHBondContact O-N 2.91Å; Y178-G181 PolarHBondContact O-N 2.97Å; Y178-T182 WeakPolarHBondContact O-CB 3.25Å; Y178-T182 PolarHBondContact O-N 2.97Å; Y178-T182 PolarHBondContact O-OG1 3.46Å |
| 179 | S | 80.4 | Confident | 79.2 | Confident | 54 Ų | 54 | 89.4 Ų | 89.4 | 38% | 0.378 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65 | -44.1 | -179 | 68.2 | 0 | 0 | 0 | 0 | 112.5 | V175 F176 G181 T182 V183 | V175-S179 WeakPolarHBondContact O-CB 3.3Å; V175-S179 PolarHBondContact O-N 3.47Å; V175-S179 PolarHBondContact O-OG 3.45Å; V175-S179 VanDerWaalsContact O-OG 3.13Å; F176-S179 WeakPolarHBondContact CA-OG 3.48Å; F176-S179 PolarHBondContact O-OG 2.86Å; S179-G181 VanDerWaalsContact C-N 3.35Å; S179-T182 PolarHBondContact O-N 2.9Å; S179-V183 VanDerWaalsContact O-CG2 3.28Å; S179-V183 WeakPolarHBondContact O-CG2 3.26Å; S179-V183 PolarHBondContact O-N 2.69Å |
| 180 | S | 82 | Confident | 79.3 | Confident | 62 Ų | 62 | 89.4 Ų | 89.4 | 43% | 0.434 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 177.2 | -177.6 | 0 | 0 | 0 | 0 | 111.1 | F176 V183 L184 | F176-S180 WeakPolarHBondContact O-CB 3.41Å; F176-S180 PolarHBondContact O-N 3.34Å; S180-V183 PolarHBondContact O-N 3.43Å; S180-L184 WeakPolarHBondContact O-CB 3.23Å; S180-L184 PolarHBondContact O-N 2.91Å |
| 181 | G | 84 | Confident | 79.5 | Confident | 44 Ų | 44 | 90.9 Ų | 90.9 | 45% | 0.454 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y177 Y178 S179 L184 G185 | Y177-G181 PolarHBondContact O-N 3.05Å; Y178-G181 PolarHBondContact O-N 2.97Å; S179-G181 VanDerWaalsContact C-N 3.35Å; G181-L184 PolarHBondContact O-N 2.89Å; G181-G185 PolarHBondContact O-N 3.18Å |
| 182 | T | 81.9 | Confident | 79.8 | Confident | 68 Ų | 68 | 92.6 Ų | 92.6 | 42% | 0.417 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.6 | -45.5 | 176.9 | -59.2 | 0 | 0 | 0 | 0 | 112 | Y178 S179 L184 G185 I186 | Y178-T182 WeakPolarHBondContact O-CB 3.25Å; Y178-T182 PolarHBondContact O-N 2.97Å; Y178-T182 PolarHBondContact O-OG1 3.46Å; S179-T182 PolarHBondContact O-N 2.9Å; T182-L184 PolarHBondContact O-N 3.16Å; T182-G185 PolarHBondContact O-N 2.92Å; T182-I186 HydrophobicContact CG2-CD1 3.83Å; T182-I186 HydrophobicContact CG2-CG1 4.41Å; T182-I186 VanDerWaalsContact O-CG1 3.29Å; T182-I186 WeakPolarHBondContact O-CG1 3.2Å; T182-I186 PolarHBondContact O-N 3.5Å |
| 183 | V | 83.9 | Confident | 79.5 | Confident | 97 Ų | 97 | 87.8 Ų | 87.8 | 59% | 0.588 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.8 | -43.3 | 178.2 | 171.9 | 0 | 0 | 0 | 0 | 111 | S179 S180 G185 I186 L187 | S179-V183 VanDerWaalsContact O-CG2 3.28Å; S179-V183 WeakPolarHBondContact O-CG2 3.26Å; S179-V183 PolarHBondContact O-N 2.69Å; S180-V183 PolarHBondContact O-N 3.43Å; V183-G185 VanDerWaalsContact C-N 3.33Å; V183-G185 PolarHBondContact O-N 3.38Å; V183-I186 PolarHBondContact O-N 2.79Å; V183-L187 WeakPolarHBondContact O-CB 3.33Å; V183-L187 PolarHBondContact O-N 3.27Å |
| 184 | L | 80.7 | Confident | 79.3 | Confident | 107 Ų | 107 | 90.5 Ų | 90.5 | 56% | 0.56 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.6 | -40.9 | 176 | -171.7 | 68.3 | 0 | 0 | 0 | 111.4 | S180 G181 T182 L187 M188 | S180-L184 WeakPolarHBondContact O-CB 3.23Å; S180-L184 PolarHBondContact O-N 2.91Å; G181-L184 PolarHBondContact O-N 2.89Å; T182-L184 PolarHBondContact O-N 3.16Å; L184-L187 PolarHBondContact O-N 2.93Å; L184-M188 WeakPolarHBondContact O-CB 3.43Å; L184-M188 VanDerWaalsContact O-CG 3.23Å; L184-M188 WeakPolarHBondContact O-CG 3.1Å; L184-M188 PolarHBondContact O-N 3.06Å |
| 185 | G | 85.6 | Confident | 78.6 | Confident | 33 Ų | 33 | 90.9 Ų | 90.9 | 34% | 0.34 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.1 | -50.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G181 T182 V183 L187 M188 T189 | G181-G185 PolarHBondContact O-N 3.18Å; T182-G185 PolarHBondContact O-N 2.92Å; V183-G185 VanDerWaalsContact C-N 3.33Å; V183-G185 PolarHBondContact O-N 3.38Å; G185-L187 VanDerWaalsContact C-N 3.31Å; G185-L187 PolarHBondContact O-N 2.87Å; G185-M188 PolarHBondContact O-N 3.33Å; G185-T189 PolarHBondContact O-N 3.19Å; G185-T189 PolarHBondContact O-OG1 3.49Å; G185-T189 VanDerWaalsContact O-OG1 3.05Å |
| 186 | I | 85.6 | Confident | 77.9 | Confident | 101 Ų | 101 | 88.3 Ų | 88.3 | 52% | 0.518 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59 | -44.7 | 177.2 | -67.4 | 166.1 | 0 | 0 | 0 | 110.5 | T182 V183 T189 L190 | T182-I186 HydrophobicContact CG2-CD1 3.83Å; T182-I186 HydrophobicContact CG2-CG1 4.41Å; T182-I186 VanDerWaalsContact O-CG1 3.29Å; T182-I186 WeakPolarHBondContact O-CG1 3.2Å; T182-I186 PolarHBondContact O-N 3.5Å; V183-I186 PolarHBondContact O-N 2.79Å; I186-T189 PolarHBondContact O-N 2.91Å; I186-L190 VanDerWaalsContact O-CB 3.29Å; I186-L190 WeakPolarHBondContact O-CB 3.28Å; I186-L190 PolarHBondContact O-N 3.32Å |
| 187 | L | 79.3 | Confident | 77.1 | Confident | 98 Ų | 98 | 87.4 Ų | 87.4 | 51% | 0.513 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62 | -45.4 | 179.2 | -174.7 | 63.9 | 0 | 0 | 0 | 111.6 | V183 L184 G185 L190 V191 | V183-L187 WeakPolarHBondContact O-CB 3.33Å; V183-L187 PolarHBondContact O-N 3.27Å; L184-L187 PolarHBondContact O-N 2.93Å; G185-L187 VanDerWaalsContact C-N 3.31Å; G185-L187 PolarHBondContact O-N 2.87Å; L187-L190 PolarHBondContact O-N 3.44Å; L187-V191 VanDerWaalsContact O-CG2 3.31Å; L187-V191 WeakPolarHBondContact O-CG2 3.33Å; L187-V191 PolarHBondContact O-N 3.47Å |
| 188 | M | 76.9 | Confident | 75.9 | Confident | 128 Ų | 128 | 86.3 Ų | 86.3 | 63% | 0.631 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.7 | -43.6 | 177.4 | -72.4 | -65.8 | -74.6 | 0 | 0 | 111.9 | L184 G185 F192 | L184-M188 WeakPolarHBondContact O-CB 3.43Å; L184-M188 VanDerWaalsContact O-CG 3.23Å; L184-M188 WeakPolarHBondContact O-CG 3.1Å; L184-M188 PolarHBondContact O-N 3.06Å; G185-M188 PolarHBondContact O-N 3.33Å; M188-F192 WeakPolarHBondContact O-CB 3.43Å; M188-F192 PolarHBondContact O-N 3.15Å |
| 189 | T | 81.6 | Confident | 74.7 | Confident | 69 Ų | 69 | 85.9 Ų | 85.9 | 42% | 0.423 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 176 | -55.9 | 0 | 0 | 0 | 0 | 111.6 | G185 I186 F192 V193 | G185-T189 PolarHBondContact O-N 3.19Å; G185-T189 PolarHBondContact O-OG1 3.49Å; G185-T189 VanDerWaalsContact O-OG1 3.05Å; I186-T189 PolarHBondContact O-N 2.91Å; T189-F192 WeakPolarHBondContact O-CB 3.32Å; T189-F192 PolarHBondContact O-N 3.34Å; T189-V193 WeakPolarHBondContact O-CG2 3.38Å; T189-V193 PolarHBondContact O-N 3.37Å |
| 190 | L | 74.8 | Confident | 73.1 | Confident | 94 Ų | 94 | 87.9 Ų | 87.9 | 49% | 0.492 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.8 | -43.9 | 179.3 | -171.4 | 131.7 | 0 | 0 | 0 | 111.7 | I186 L187 F192 V193 L194 | I186-L190 VanDerWaalsContact O-CB 3.29Å; I186-L190 WeakPolarHBondContact O-CB 3.28Å; I186-L190 PolarHBondContact O-N 3.32Å; L187-L190 PolarHBondContact O-N 3.44Å; L190-F192 VanDerWaalsContact C-N 3.33Å; L190-F192 PolarHBondContact O-N 2.86Å; L190-V193 PolarHBondContact O-N 3.22Å; L190-L194 HydrophobicContact CD2-CD1 3.69Å; L190-L194 HydrophobicContact CD2-CG 4.42Å; L190-L194 HydrophobicContact CG-CD1 4.48Å; L190-L194 VanDerWaalsContact O-CG 3.3Å; L190-L194 WeakPolarHBondContact O-CG 3.14Å; L190-L194 PolarHBondContact O-N 2.91Å |
| 191 | V | 76.6 | Confident | 71.7 | Confident | 66 Ų | 66 | 92.6 Ų | 92.6 | 40% | 0.4 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.5 | -44 | 173.6 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | L187 V193 L194 L195 | L187-V191 VanDerWaalsContact O-CG2 3.31Å; L187-V191 WeakPolarHBondContact O-CG2 3.33Å; L187-V191 PolarHBondContact O-N 3.47Å; V191-V193 PolarHBondContact O-N 3.29Å; V191-L194 PolarHBondContact O-N 3.03Å; V191-L195 HydrophobicContact CG1-CD1 3.87Å; V191-L195 HydrophobicContact CG1-CG 4.31Å; V191-L195 WeakPolarHBondContact O-CB 3.37Å; V191-L195 VanDerWaalsContact O-CG 3.25Å; V191-L195 WeakPolarHBondContact O-CG 3.28Å; V191-L195 PolarHBondContact O-N 3.27Å |
| 192 | F | 74.6 | Confident | 69.8 | Low | 129 Ų | 129 | 93.7 Ų | 93.7 | 57% | 0.566 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.7 | -44.2 | 176.8 | -176.7 | -98 | 0 | 0 | 0 | 112.2 | M188 T189 L190 L195 M196 | M188-F192 WeakPolarHBondContact O-CB 3.43Å; M188-F192 PolarHBondContact O-N 3.15Å; T189-F192 WeakPolarHBondContact O-CB 3.32Å; T189-F192 PolarHBondContact O-N 3.34Å; L190-F192 VanDerWaalsContact C-N 3.33Å; L190-F192 PolarHBondContact O-N 2.86Å; F192-L195 PolarHBondContact O-N 3.37Å; F192-M196 HydrophobicContact CD1-CG 4.1Å; F192-M196 HydrophobicContact CE1-CG 3.73Å; F192-M196 HydrophobicContact CE2-CE 4.33Å; F192-M196 HydrophobicContact CE2-CG 4.42Å; F192-M196 HydrophobicContact CZ-CE 4.34Å; F192-M196 HydrophobicContact CZ-CG 3.9Å; F192-M196 HydrophobicContact CZ-SD 4.24Å; F192-M196 WeakPolarHBondContact O-CB 3.25Å; F192-M196 VanDerWaalsContact O-CG 3.32Å; F192-M196 WeakPolarHBondContact O-CG 3.41Å; F192-M196 PolarHBondContact O-N 3.39Å |
| 193 | V | 74.5 | Confident | 68.4 | Low | 43 Ų | 43 | 100 Ų | 100 | 26% | 0.261 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.8 | -45.5 | 175.9 | 166.2 | 0 | 0 | 0 | 0 | 111.5 | T189 L190 V191 L195 M196 A197 L209 | T189-V193 WeakPolarHBondContact O-CG2 3.38Å; T189-V193 PolarHBondContact O-N 3.37Å; L190-V193 PolarHBondContact O-N 3.22Å; V191-V193 PolarHBondContact O-N 3.29Å; V193-L195 VanDerWaalsContact C-N 3.34Å; V193-L195 PolarHBondContact O-N 3.35Å; V193-M196 PolarHBondContact O-N 2.8Å; V193-A197 VanDerWaalsContact O-CB 3.3Å; V193-A197 WeakPolarHBondContact O-CB 3.41Å; V193-A197 PolarHBondContact O-N 3.13Å; V193-L209 HydrophobicContact CB-CD2 4.4Å; V193-L209 HydrophobicContact CG1-CD2 3.53Å; V193-L209 HydrophobicContact CG2-CD2 4.03Å |
| 194 | L | 72 | Confident | 66.9 | Low | 95 Ų | 95 | 99.4 Ų | 99.4 | 50% | 0.497 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.9 | -40.2 | 177.3 | -70.4 | 173.9 | 0 | 0 | 0 | 111.9 | L190 V191 A197 K198 | L190-L194 HydrophobicContact CD2-CD1 3.69Å; L190-L194 HydrophobicContact CD2-CG 4.42Å; L190-L194 HydrophobicContact CG-CD1 4.48Å; L190-L194 VanDerWaalsContact O-CG 3.3Å; L190-L194 WeakPolarHBondContact O-CG 3.14Å; L190-L194 PolarHBondContact O-N 2.91Å; V191-L194 PolarHBondContact O-N 3.03Å; L194-A197 PolarHBondContact O-N 3.48Å; L194-K198 VanDerWaalsContact O-CB 3.3Å; L194-K198 WeakPolarHBondContact O-CB 3.43Å; L194-K198 PolarHBondContact O-N 2.9Å |
| 195 | L | 63.3 | Low | 65.8 | Low | 95 Ų | 95 | 97.7 Ų | 97.7 | 50% | 0.497 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.4 | -38.5 | 175.8 | -71 | 174.6 | 0 | 0 | 0 | 112 | V191 F192 V193 K199 | V191-L195 HydrophobicContact CG1-CD1 3.87Å; V191-L195 HydrophobicContact CG1-CG 4.31Å; V191-L195 WeakPolarHBondContact O-CB 3.37Å; V191-L195 VanDerWaalsContact O-CG 3.25Å; V191-L195 WeakPolarHBondContact O-CG 3.28Å; V191-L195 PolarHBondContact O-N 3.27Å; F192-L195 PolarHBondContact O-N 3.37Å; V193-L195 VanDerWaalsContact C-N 3.34Å; V193-L195 PolarHBondContact O-N 3.35Å; L195-K199 VanDerWaalsContact O-CB 3.23Å; L195-K199 WeakPolarHBondContact O-CB 3.1Å; L195-K199 PolarHBondContact O-N 3.01Å |
| 196 | M | 61.7 | Low | 64.4 | Low | 62 Ų | 62 | 106 Ų | 106 | 31% | 0.305 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.1 | -43.9 | 173.8 | -76 | -66.6 | 111 | 0 | 0 | 111.8 | F192 V193 K198 K199 H200 | F192-M196 HydrophobicContact CD1-CG 4.1Å; F192-M196 HydrophobicContact CE1-CG 3.73Å; F192-M196 HydrophobicContact CE2-CE 4.33Å; F192-M196 HydrophobicContact CE2-CG 4.42Å; F192-M196 HydrophobicContact CZ-CE 4.34Å; F192-M196 HydrophobicContact CZ-CG 3.9Å; F192-M196 HydrophobicContact CZ-SD 4.24Å; F192-M196 WeakPolarHBondContact O-CB 3.25Å; F192-M196 VanDerWaalsContact O-CG 3.32Å; F192-M196 WeakPolarHBondContact O-CG 3.41Å; F192-M196 PolarHBondContact O-N 3.39Å; V193-M196 PolarHBondContact O-N 2.8Å; M196-K198 VanDerWaalsContact C-N 3.32Å; M196-K198 PolarHBondContact O-N 2.96Å; M196-K199 PolarHBondContact O-N 3.34Å; M196-K199 VanDerWaalsContact O-N 3.16Å; M196-H200 PolarHBondContact O-N 2.96Å |
| 197 | A | 59.8 | Low | 63.1 | Low | 55 Ų | 55 | 112.2 Ų | 112.2 | 46% | 0.455 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.8 | -38.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | V193 L194 | V193-A197 VanDerWaalsContact O-CB 3.3Å; V193-A197 WeakPolarHBondContact O-CB 3.41Å; V193-A197 PolarHBondContact O-N 3.13Å; L194-A197 PolarHBondContact O-N 3.48Å |
| 198 | K | 54.8 | Low | 62 | Low | 146 Ų | 146 | 112.7 Ų | 112.7 | 64% | 0.635 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -68.8 | -34.3 | 173.6 | -174.8 | 177.9 | 174.2 | 175.5 | 0 | 112.6 | L194 M196 | L194-K198 VanDerWaalsContact O-CB 3.3Å; L194-K198 WeakPolarHBondContact O-CB 3.43Å; L194-K198 PolarHBondContact O-N 2.9Å; M196-K198 VanDerWaalsContact C-N 3.32Å; M196-K198 PolarHBondContact O-N 2.96Å |
| 199 | K | 55.3 | Low | 61.3 | Low | 158 Ų | 158 | 110.1 Ų | 110.1 | 69% | 0.687 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -87.2 | -18.5 | -176.3 | -171.5 | 161.6 | 177.4 | 168.4 | 0 | 113.7 | L195 M196 | L195-K199 VanDerWaalsContact O-CB 3.23Å; L195-K199 WeakPolarHBondContact O-CB 3.1Å; L195-K199 PolarHBondContact O-N 3.01Å; M196-K199 PolarHBondContact O-N 3.34Å; M196-K199 VanDerWaalsContact O-N 3.16Å |
| 200 | H | 47.3 | Very low | 60.3 | Low | 96 Ų | 96 | 112.2 Ų | 112.2 | 44% | 0.444 | 55% | 0.554 | S | S | . | * | trans | -139.8 | 96.1 | -175 | -79.2 | -59.9 | 0 | 0 | 0 | 112 | M196 P202 | M196-H200 PolarHBondContact O-N 2.96Å; H200-P202 VanDerWaalsContact CB-CD 3.46Å; H200-P202 HydrophobicContact CB-CG 4.33Å; H200-P202 VanDerWaalsContact O-CD 3.28Å; H200-P202 WeakPolarHBondContact O-CD 3.1Å | ||
| 201 | I | 51.6 | Low | 59.7 | Low | 160 Ų | 160 | 114.9 Ų | 114.9 | 82% | 0.821 | 56% | 0.562 | S | S | * | * | trans | -93.5 | 83.5 | 147.3 | -52.3 | -179.8 | 0 | 0 | 0 | 108.4 | ||||
| 202 | P | 44.6 | Very low | 59.1 | Low | 68 Ų | 68 | 114.6 Ų | 114.6 | 44% | 0.442 | 56% | 0.561 | S | S | . | * | trans | -110.5 | 128.8 | 141.3 | 31.8 | -23.4 | 0 | 0 | 0 | 107.2 | H200 A204 | H200-P202 VanDerWaalsContact CB-CD 3.46Å; H200-P202 HydrophobicContact CB-CG 4.33Å; H200-P202 VanDerWaalsContact O-CD 3.28Å; H200-P202 WeakPolarHBondContact O-CD 3.1Å; P202-A204 PolarHBondContact O-N 2.89Å | ||
| 203 | K | 52.2 | Low | 58.4 | Low | 200 Ų | 200 | 111.5 Ų | 111.5 | 87% | 0.87 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | 10.9 | -176.4 | -71.3 | 178 | 172.1 | 164.6 | 0 | 115.9 | ||
| 204 | A | 52.8 | Low | 57.6 | Low | 85 Ų | 85 | 113.9 Ų | 113.9 | 70% | 0.702 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | -15.2 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | P202 | P202-A204 PolarHBondContact O-N 2.89Š|
| 205 | M | 56.3 | Low | 57 | Low | 71 Ų | 71 | 113.6 Ų | 113.6 | 35% | 0.35 | 57% | 0.568 | S | S | . | * | trans | -106.9 | 32.5 | -168.8 | -157.3 | 162.3 | 69.5 | 0 | 0 | 114.6 | L208 | M205-L208 HydrophobicContact CG-CB 3.77Å; M205-L208 HydrophobicContact CG-CD1 4.24Å; M205-L208 HydrophobicContact SD-CD1 4.5Å | ||
| 206 | W | 57.7 | Low | 56.8 | Low | 208 Ų | 208 | 112.1 Ų | 112.1 | 79% | 0.788 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -78.9 | -30.7 | 170.9 | -79.5 | 60.1 | 0 | 0 | 0 | 111.9 | L208 | W206-L208 PolarHBondContact O-N 3.48Å |
| 207 | W | 56.9 | Low | 56.7 | Low | 231 Ų | 231 | 113.9 Ų | 113.9 | 88% | 0.875 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -73.4 | -25.1 | -177.7 | -67.1 | 71.4 | 0 | 0 | 0 | 113.9 | ||
| 208 | L | 57.7 | Low | 56.6 | Low | 108 Ų | 108 | 115.1 Ų | 115.1 | 57% | 0.565 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -81.7 | -26.1 | -178.2 | -119.6 | 152.2 | 0 | 0 | 0 | 112.2 | M205 W206 F211 V212 | M205-L208 HydrophobicContact CG-CB 3.77Å; M205-L208 HydrophobicContact CG-CD1 4.24Å; M205-L208 HydrophobicContact SD-CD1 4.5Å; W206-L208 PolarHBondContact O-N 3.48Å; L208-F211 PolarHBondContact O-N 3.1Å; L208-V212 HydrophobicContact CD2-CG2 4.3Å; L208-V212 WeakPolarHBondContact O-CG2 3.32Å; L208-V212 PolarHBondContact O-N 2.89Å |
| 209 | L | 60.4 | Low | 57 | Low | 73 Ų | 73 | 111.8 Ų | 111.8 | 38% | 0.382 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -72.3 | -38.8 | 177.1 | -81.5 | 162.7 | 0 | 0 | 0 | 112.2 | V193 F211 V212 A213 | V193-L209 HydrophobicContact CB-CD2 4.4Å; V193-L209 HydrophobicContact CG1-CD2 3.53Å; V193-L209 HydrophobicContact CG2-CD2 4.03Å; L209-F211 VanDerWaalsContact C-N 3.3Å; L209-F211 PolarHBondContact O-N 3.48Å; L209-V212 PolarHBondContact O-N 3.36Å; L209-A213 VanDerWaalsContact O-CB 3.28Å; L209-A213 WeakPolarHBondContact O-CB 3.46Å; L209-A213 PolarHBondContact O-N 3.07Å |
| 210 | D | 60.7 | Low | 57.3 | Low | 113 Ų | 113 | 107.3 Ų | 107.3 | 60% | 0.604 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -59.9 | -43.1 | 172.5 | -117.7 | -50.2 | 0 | 0 | 0 | 111 | L214 | D210-L214 WeakPolarHBondContact O-CB 3.27Å; D210-L214 WeakPolarHBondContact O-CD1 3.44Å; D210-L214 WeakPolarHBondContact O-CG 3.44Å; D210-L214 PolarHBondContact O-N 2.87Å |
| 211 | F | 62 | Low | 57.9 | Low | 150 Ų | 150 | 104.4 Ų | 104.4 | 66% | 0.658 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -68.9 | -39.1 | -179.3 | -138.2 | -90.6 | 0 | 0 | 0 | 113.2 | L208 L209 L215 | L208-F211 PolarHBondContact O-N 3.1Å; L209-F211 VanDerWaalsContact C-N 3.3Å; L209-F211 PolarHBondContact O-N 3.48Å; F211-L215 HydrophobicContact CD1-CD1 4.33Å; F211-L215 PolarHBondContact O-N 3.05Å |
| 212 | V | 65.4 | Low | 58.2 | Low | 61 Ų | 61 | 102.5 Ų | 102.5 | 37% | 0.37 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -76.2 | -31.3 | 179.2 | 171.5 | 0 | 0 | 0 | 0 | 112.1 | L208 L209 P216 | L208-V212 HydrophobicContact CD2-CG2 4.3Å; L208-V212 WeakPolarHBondContact O-CG2 3.32Å; L208-V212 PolarHBondContact O-N 2.89Å; L209-V212 PolarHBondContact O-N 3.36Å; V212-P216 WeakPolarHBondContact O-CD 3.44Å |
| 213 | A | 59.3 | Low | 58.8 | Low | 63 Ų | 63 | 105 Ų | 105 | 52% | 0.521 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.9 | -29.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L209 | L209-A213 VanDerWaalsContact O-CB 3.28Å; L209-A213 WeakPolarHBondContact O-CB 3.46Å; L209-A213 PolarHBondContact O-N 3.07Å |
| 214 | L | 58.1 | Low | 59.1 | Low | 93 Ų | 93 | 101.4 Ų | 101.4 | 49% | 0.487 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -82.2 | -24.2 | -179.9 | -82.7 | 160.6 | 0 | 0 | 0 | 114.4 | D210 V217 T218 | D210-L214 WeakPolarHBondContact O-CB 3.27Å; D210-L214 WeakPolarHBondContact O-CD1 3.44Å; D210-L214 WeakPolarHBondContact O-CG 3.44Å; D210-L214 PolarHBondContact O-N 2.87Å; L214-V217 PolarHBondContact O-N 2.94Å; L214-T218 WeakPolarHBondContact O-CB 3.29Å; L214-T218 WeakPolarHBondContact O-CG2 3.23Å; L214-T218 PolarHBondContact O-N 3.27Å; L214-T218 PolarHBondContact O-OG1 3.24Å |
| 215 | L | 59.4 | Low | 59.3 | Low | 89 Ų | 89 | 103.8 Ų | 103.8 | 47% | 0.466 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.2 | -47.4 | -179.8 | -105.9 | 150 | 0 | 0 | 0 | 114.6 | F211 T218 V219 | F211-L215 HydrophobicContact CD1-CD1 4.33Å; F211-L215 PolarHBondContact O-N 3.05Å; L215-T218 PolarHBondContact O-OG1 2.93Å; L215-V219 HydrophobicContact CD2-CG2 4.41Å; L215-V219 WeakPolarHBondContact O-CB 3.4Å; L215-V219 WeakPolarHBondContact O-CG2 3.41Å; L215-V219 PolarHBondContact O-N 3.32Å |
| 216 | P | 59.1 | Low | 59.2 | Low | 64 Ų | 64 | 108.9 Ų | 108.9 | 42% | 0.416 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -69.8 | -34.8 | 176.8 | 23.7 | -29.8 | 0 | 0 | 0 | 112.3 | V212 T220 | V212-P216 WeakPolarHBondContact O-CD 3.44Å; P216-T220 VanDerWaalsContact O-CB 3.24Å; P216-T220 WeakPolarHBondContact O-CB 3.33Å; P216-T220 PolarHBondContact O-N 3.5Å; P216-T220 PolarHBondContact O-OG1 3.4Å |
| 217 | V | 58.8 | Low | 58.8 | Low | 100 Ų | 100 | 100.4 Ų | 100.4 | 61% | 0.606 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -68.4 | -41.1 | 179.9 | -178.3 | 0 | 0 | 0 | 0 | 111.4 | L214 G221 | L214-V217 PolarHBondContact O-N 2.94Å; V217-G221 PolarHBondContact O-N 3.26Å |
| 218 | T | 58.6 | Low | 58.4 | Low | 81 Ų | 81 | 92.3 Ų | 92.3 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -72.7 | -40.8 | 177.6 | 47.7 | 0 | 0 | 0 | 0 | 112.4 | L214 L215 L222 | L214-T218 WeakPolarHBondContact O-CB 3.29Å; L214-T218 WeakPolarHBondContact O-CG2 3.23Å; L214-T218 PolarHBondContact O-N 3.27Å; L214-T218 PolarHBondContact O-OG1 3.24Å; L215-T218 PolarHBondContact O-OG1 2.93Å; T218-L222 VanDerWaalsContact O-CB 3.26Å; T218-L222 WeakPolarHBondContact O-CB 3.32Å; T218-L222 PolarHBondContact O-N 2.84Å |
| 219 | V | 61.8 | Low | 58 | Low | 75 Ų | 75 | 94 Ų | 94 | 46% | 0.455 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -71.1 | -40.9 | 179.4 | 174 | 0 | 0 | 0 | 0 | 111.8 | L215 L222 L223 | L215-V219 HydrophobicContact CD2-CG2 4.41Å; L215-V219 WeakPolarHBondContact O-CB 3.4Å; L215-V219 WeakPolarHBondContact O-CG2 3.41Å; L215-V219 PolarHBondContact O-N 3.32Å; V219-L222 PolarHBondContact O-N 2.98Å; V219-L223 HydrophobicContact CG1-CD1 3.99Å; V219-L223 WeakPolarHBondContact O-CB 3.06Å; V219-L223 PolarHBondContact O-N 3.25Å |
| 220 | T | 62.6 | Low | 57.5 | Low | 65 Ų | 65 | 95.5 Ų | 95.5 | 40% | 0.399 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68.8 | -38.9 | 175 | -57.5 | 0 | 0 | 0 | 0 | 111.7 | P216 L223 L224 | P216-T220 VanDerWaalsContact O-CB 3.24Å; P216-T220 WeakPolarHBondContact O-CB 3.33Å; P216-T220 PolarHBondContact O-N 3.5Å; P216-T220 PolarHBondContact O-OG1 3.4Å; T220-L223 PolarHBondContact O-N 3.37Å; T220-L224 HydrophobicContact CG2-CD1 4.25Å; T220-L224 WeakPolarHBondContact O-CG 3.48Å; T220-L224 PolarHBondContact O-N 3.32Å |
| 221 | G | 60.8 | Low | 56.9 | Low | 34 Ų | 34 | 99.2 Ų | 99.2 | 35% | 0.351 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.6 | -41.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | V217 L224 M225 | V217-G221 PolarHBondContact O-N 3.26Å; G221-L224 PolarHBondContact O-N 3.44Å; G221-M225 WeakPolarHBondContact O-CG 3.33Å; G221-M225 PolarHBondContact O-N 3.02Å |
| 222 | L | 57.1 | Low | 56.1 | Low | 120 Ų | 120 | 97.1 Ų | 97.1 | 63% | 0.628 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -69.1 | -36.7 | 178 | -156.1 | 80.4 | 0 | 0 | 0 | 112.2 | T218 V219 R226 | T218-L222 VanDerWaalsContact O-CB 3.26Å; T218-L222 WeakPolarHBondContact O-CB 3.32Å; T218-L222 PolarHBondContact O-N 2.84Å; V219-L222 PolarHBondContact O-N 2.98Å; L222-R226 WeakPolarHBondContact O-CB 3.45Å; L222-R226 PolarHBondContact O-N 3.32Å |
| 223 | L | 57.6 | Low | 55.3 | Low | 120 Ų | 120 | 99.9 Ų | 99.9 | 63% | 0.628 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -68.2 | -37.4 | 174.7 | -90.7 | 157.2 | 0 | 0 | 0 | 112.6 | V219 T220 G227 | V219-L223 HydrophobicContact CG1-CD1 3.99Å; V219-L223 WeakPolarHBondContact O-CB 3.06Å; V219-L223 PolarHBondContact O-N 3.25Å; T220-L223 PolarHBondContact O-N 3.37Å; L223-G227 PolarHBondContact O-N 3.29Å |
| 224 | L | 57.6 | Low | 54.7 | Low | 125 Ų | 125 | 100.1 Ų | 100.1 | 65% | 0.654 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -69.3 | -39.9 | 175.5 | -72.9 | 172.6 | 0 | 0 | 0 | 112 | T220 G221 G227 A228 | T220-L224 HydrophobicContact CG2-CD1 4.25Å; T220-L224 WeakPolarHBondContact O-CG 3.48Å; T220-L224 PolarHBondContact O-N 3.32Å; G221-L224 PolarHBondContact O-N 3.44Å; L224-G227 PolarHBondContact O-N 3.02Å; L224-A228 PolarHBondContact O-N 2.97Å; L224-A228 VanDerWaalsContact O-N 3.09Å |
| 225 | M | 56.6 | Low | 54.2 | Low | 136 Ų | 136 | 105.5 Ų | 105.5 | 67% | 0.67 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -66.2 | -42.8 | 175.5 | -71.3 | -73 | -80.5 | 0 | 0 | 111.9 | G221 G227 A228 E229 | G221-M225 WeakPolarHBondContact O-CG 3.33Å; G221-M225 PolarHBondContact O-N 3.02Å; M225-G227 PolarHBondContact O-N 3.12Å; M225-A228 PolarHBondContact O-N 2.77Å; M225-E229 PolarHBondContact O-N 3.37Å |
| 226 | R | 54.1 | Low | 53.9 | Low | 178 Ų | 178 | 106.3 Ų | 106.3 | 67% | 0.672 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -66.7 | -35 | 176.1 | -122.9 | 171.2 | -175 | 169.9 | 1.1 | 113 | L222 A228 T230 | L222-R226 WeakPolarHBondContact O-CB 3.45Å; L222-R226 PolarHBondContact O-N 3.32Å; R226-A228 VanDerWaalsContact C-N 3.35Å; R226-T230 PolarHBondContact O-N 2.86Å; R226-T230 PolarHBondContact O-OG1 3.47Å |
| 227 | G | 49 | Very low | 53.6 | Low | 30 Ų | 30 | 108.5 Ų | 108.5 | 31% | 0.309 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -66.4 | -34.7 | 174 | 0 | 0 | 0 | 0 | 0 | 113 | L223 L224 M225 T230 F231 | L223-G227 PolarHBondContact O-N 3.29Å; L224-G227 PolarHBondContact O-N 3.02Å; M225-G227 PolarHBondContact O-N 3.12Å; G227-T230 WeakPolarHBondContact CA-OG1 3.07Å; G227-T230 PolarHBondContact O-OG1 2.9Å; G227-F231 PolarHBondContact O-N 3.18Å |
| 228 | A | 49.9 | Very low | 53.3 | Low | 60 Ų | 60 | 109 Ų | 109 | 50% | 0.496 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -70.8 | -37.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L224 M225 R226 T230 F231 S232 | L224-A228 PolarHBondContact O-N 2.97Å; L224-A228 VanDerWaalsContact O-N 3.09Å; M225-A228 PolarHBondContact O-N 2.77Å; R226-A228 VanDerWaalsContact C-N 3.35Å; A228-T230 VanDerWaalsContact C-N 3.35Å; A228-F231 PolarHBondContact O-N 3.18Å; A228-S232 PolarHBondContact O-N 2.8Å |
| 229 | E | 48.8 | Very low | 53 | Low | 143 Ų | 143 | 110.6 Ų | 110.6 | 67% | 0.668 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -66.9 | -35.5 | 174.8 | -72 | -176.6 | 116.8 | 0 | 0 | 112 | M225 F231 S232 | M225-E229 PolarHBondContact O-N 3.37Å; E229-F231 VanDerWaalsContact C-N 3.27Å; E229-F231 PolarHBondContact O-N 3.26Å; E229-S232 PolarHBondContact O-N 3.37Å |
| 230 | T | 49.8 | Very low | 52.5 | Low | 106 Ų | 106 | 112.9 Ų | 112.9 | 65% | 0.65 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -72.2 | -16.4 | 176.6 | 51.1 | 0 | 0 | 0 | 0 | 114.5 | R226 G227 A228 | R226-T230 PolarHBondContact O-N 2.86Å; R226-T230 PolarHBondContact O-OG1 3.47Å; G227-T230 WeakPolarHBondContact CA-OG1 3.07Å; G227-T230 PolarHBondContact O-OG1 2.9Å; A228-T230 VanDerWaalsContact C-N 3.35Å |
| 231 | F | 47.8 | Very low | 51.8 | Low | 190 Ų | 190 | 116.1 Ų | 116.1 | 83% | 0.833 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -9.1 | 174.7 | -100.5 | -89.2 | 0 | 0 | 0 | 113.6 | G227 A228 E229 | G227-F231 PolarHBondContact O-N 3.18Å; A228-F231 PolarHBondContact O-N 3.18Å; E229-F231 VanDerWaalsContact C-N 3.27Å; E229-F231 PolarHBondContact O-N 3.26Å |
| 232 | S | 46.1 | Very low | 51.2 | Low | 106 Ų | 106 | 121.9 Ų | 121.9 | 74% | 0.741 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -96.1 | 0.8 | 179.4 | -99 | 0 | 0 | 0 | 0 | 115.2 | A228 E229 | A228-S232 PolarHBondContact O-N 2.8Å; E229-S232 PolarHBondContact O-N 3.37Å |
| 233 | C | 48.2 | Very low | 50.7 | Low | 120 Ų | 120 | 122.1 Ų | 122.1 | 81% | 0.811 | 71% | 0.705 | S | S | * | * | trans | -119.4 | 80.3 | 172.7 | -81.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 234 | G | 45.9 | Very low | 50.1 | Low | 67 Ų | 67 | 122.3 Ų | 122.3 | 69% | 0.691 | 71% | 0.711 | S | S | * | * | trans | -131 | 120.1 | 160.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 235 | P | 47.8 | Very low | 49.5 | Very low | 206 Ų | 206 | 122 Ų | 122 | 100% | 1.338 | 72% | 0.716 | S | S | * | * | trans | -69.9 | 0 | 166.2 | 30.5 | -33.1 | 0 | 0 | 0 | 112.2 |
Retrieved 235 of 235 residues in 864.3 ms
(Link to these results)