| 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 | A | 31.7 | Very low | 29.6 | Very low | 150 Ų | 150 | 147.6 Ų | 147.6 | 100% | 1.24 | 87% | 0.867 | S | S | * | * | 0 | 106.2 | 0 | 0 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 2 | L | 27.5 | Very low | 29.4 | Very low | 181 Ų | 181 | 140.1 Ų | 140.1 | 95% | 0.948 | 84% | 0.843 | S | S | * | * | trans | -170.6 | 90.3 | 156.2 | -103.1 | 148.4 | 0 | 0 | 0 | 104.3 | ||||
| 3 | Q | 25.6 | Very low | 29.6 | Very low | 192 Ų | 192 | 142.6 Ų | 142.6 | 90% | 0.897 | 85% | 0.85 | S | S | * | * | trans | -71.5 | 128 | -174.8 | -98.3 | 161.8 | -42.9 | 0 | 0 | 110.2 | ||||
| 4 | C | 25 | Very low | 29.6 | Very low | 126 Ų | 126 | 148.6 Ų | 148.6 | 85% | 0.851 | 85% | 0.85 | S | S | * | * | trans | -86 | 103.7 | 166.9 | -155.9 | 0 | 0 | 0 | 0 | 107.3 | T6 | C4-T6 PolarHBondContact O-N 2.72Š| ||
| 5 | T | 30.2 | Very low | 29.6 | Very low | 131 Ų | 131 | 146.1 Ų | 146.1 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | trans | -71.8 | 125.7 | 177.1 | 17 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 6 | T | 31.7 | Very low | 29.9 | Very low | 129 Ų | 129 | 151.5 Ų | 151.5 | 79% | 0.791 | 84% | 0.838 | S | S | * | * | trans | -89.5 | 120.7 | 175.4 | -54.4 | 0 | 0 | 0 | 0 | 108.3 | C4 | C4-T6 PolarHBondContact O-N 2.72Š| ||
| 7 | V | 29.3 | Very low | 30 | Very low | 126 Ų | 126 | 153.5 Ų | 153.5 | 76% | 0.764 | 84% | 0.84 | S | S | * | * | trans | -119.5 | 109.6 | 158.4 | -179.8 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 8 | A | 31.7 | Very low | 29.9 | Very low | 93 Ų | 93 | 154.7 Ų | 154.7 | 77% | 0.769 | 84% | 0.838 | S | S | * | * | trans | -88.9 | 117.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 9 | T | 28.7 | Very low | 30.1 | Very low | 121 Ų | 121 | 151.6 Ų | 151.6 | 74% | 0.742 | 84% | 0.836 | S | S | * | * | trans | -127.9 | 122.4 | 164.6 | 10.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 10 | K | 34.9 | Very low | 30.2 | Very low | 208 Ų | 208 | 152 Ų | 152 | 90% | 0.904 | 84% | 0.837 | S | S | * | * | trans | -74.1 | 121.8 | 167.4 | -92.3 | 179.6 | 169.1 | 179.4 | 0 | 108.5 | ||||
| 11 | M | 28.8 | Very low | 30.5 | Very low | 167 Ų | 167 | 153.5 Ų | 153.5 | 82% | 0.823 | 84% | 0.838 | S | S | * | * | trans | -168.4 | 119.8 | 161 | -105.5 | 141.5 | 164.2 | 0 | 0 | 104.8 | ||||
| 12 | G | 28.2 | Very low | 30.6 | Very low | 57 Ų | 57 | 155.7 Ų | 155.7 | 59% | 0.588 | 82% | 0.823 | S | S | * | * | 96.4 | 113.2 | 64 | 0 | 0 | 0 | 0 | 0 | 107.1 | R14 | G12-R14 PolarHBondContact O-N 3.38Š| |||
| 13 | D | 32.1 | Very low | 30.8 | Very low | 173 Ų | 173 | 153.5 Ų | 153.5 | 93% | 0.925 | 81% | 0.812 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.1 | 49.8 | -171.9 | -84.8 | -37.5 | 0 | 0 | 0 | 115.8 | ||
| 14 | R | 29.3 | Very low | 31.2 | Very low | 227 Ų | 227 | 152.6 Ų | 152.6 | 86% | 0.857 | 81% | 0.813 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.8 | 4.8 | -175.7 | -89.9 | -171.4 | -91 | 174.9 | -5.3 | 116.9 | G12 Y16 | G12-R14 PolarHBondContact O-N 3.38Å; R14-Y16 PolarHBondContact O-N 2.94Å |
| 15 | D | 29.1 | Very low | 31.5 | Very low | 110 Ų | 110 | 150.5 Ų | 150.5 | 59% | 0.588 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.9 | 30.5 | -170.9 | -59.9 | -15.3 | 0 | 0 | 0 | 114.9 | ||
| 16 | Y | 34.7 | Very low | 31.7 | Very low | 233 Ų | 233 | 152.9 Ų | 152.9 | 91% | 0.914 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | -6.6 | 174.4 | -81.5 | -75.5 | 0 | 0 | 0 | 114.1 | R14 | R14-Y16 PolarHBondContact O-N 2.94Š|
| 17 | E | 31.1 | Very low | 31.7 | Very low | 186 Ų | 186 | 151.5 Ų | 151.5 | 87% | 0.869 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -117 | -3.1 | -174 | -76.3 | -176.8 | 153.9 | 0 | 0 | 115.5 | ||
| 18 | E | 29.5 | Very low | 32 | Very low | 174 Ų | 174 | 154.8 Ų | 154.8 | 81% | 0.813 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -108.8 | 10.6 | -169.3 | -112.6 | 175.8 | -171.8 | 0 | 0 | 116.2 | ||
| 19 | A | 32.9 | Very low | 32.2 | Very low | 97 Ų | 97 | 157.2 Ų | 157.2 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -94.8 | 6.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 20 | D | 32.5 | Very low | 32.4 | Very low | 159 Ų | 159 | 159.1 Ų | 159.1 | 85% | 0.85 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -106.7 | 25.1 | -172.3 | -83.5 | -13.5 | 0 | 0 | 0 | 114.4 | ||
| 21 | Q | 36.6 | Very low | 32.6 | Very low | 183 Ų | 183 | 158.3 Ų | 158.3 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -135 | 78.8 | 174.7 | -72.4 | -175 | -2.7 | 0 | 0 | 111.7 | ||||
| 22 | E | 33.8 | Very low | 33.2 | Very low | 197 Ų | 197 | 159 Ų | 159 | 92% | 0.921 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -159.3 | 129.1 | 150.1 | -113.5 | 166.7 | -161 | 0 | 0 | 111.4 | ||
| 23 | D | 30.2 | Very low | 33.8 | Very low | 134 Ų | 134 | 166.1 Ų | 166.1 | 72% | 0.717 | 82% | 0.822 | S | S | * | * | trans | 86.7 | 76.8 | 169.1 | -149.3 | 6 | 0 | 0 | 0 | 119.2 | S25 | D23-S25 PolarHBondContact O-N 3.34Å; D23-S25 PolarHBondContact OD1-OG 3.29Å | ||
| 24 | N | 35 | Very low | 34.6 | Very low | 173 Ų | 173 | 162.4 Ų | 162.4 | 93% | 0.925 | 80% | 0.799 | S | S | * | * | trans | -80.9 | 80.2 | 157.2 | -89.1 | -21.8 | 0 | 0 | 0 | 110 | ||||
| 25 | S | 31.9 | Very low | 35.7 | Very low | 82 Ų | 82 | 156.6 Ų | 156.6 | 57% | 0.573 | 79% | 0.789 | S | S | * | * | trans | -140.1 | 83.3 | 161.1 | 59.1 | 0 | 0 | 0 | 0 | 110.6 | D23 P27 | D23-S25 PolarHBondContact O-N 3.34Å; D23-S25 PolarHBondContact OD1-OG 3.29Å; S25-P27 WeakPolarHBondContact O-CD 3.39Å | ||
| 26 | E | 33 | Very low | 37 | Very low | 181 Ų | 181 | 153.9 Ų | 153.9 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | trans | -69 | 128.1 | 174.4 | -67.6 | -176.8 | 157 | 0 | 0 | 111.1 | ||||
| 27 | P | 33.4 | Very low | 38.3 | Very low | 101 Ų | 101 | 147.7 Ų | 147.7 | 66% | 0.656 | 78% | 0.777 | S | S | * | * | trans | -85.2 | 118.9 | 150.9 | 28.9 | -22.4 | 0 | 0 | 0 | 108.5 | S25 I29 | S25-P27 WeakPolarHBondContact O-CD 3.39Å; P27-I29 PolarHBondContact O-N 3.49Å | ||
| 28 | E | 35.6 | Very low | 39.8 | Very low | 194 Ų | 194 | 144.1 Ų | 144.1 | 91% | 0.907 | 76% | 0.758 | S | S | * | * | trans | -54.1 | 103.3 | 170.4 | -78.7 | -175.8 | 149.3 | 0 | 0 | 110.2 | ||||
| 29 | I | 35.5 | Very low | 41.5 | Very low | 144 Ų | 144 | 143.6 Ų | 143.6 | 74% | 0.738 | 75% | 0.749 | S | S | * | * | trans | -101.3 | 114.1 | 169.5 | -65.9 | 164.6 | 0 | 0 | 0 | 107.6 | P27 Q31 | P27-I29 PolarHBondContact O-N 3.49Å; I29-Q31 PolarHBondContact O-N 3Å | ||
| 30 | N | 32.9 | Very low | 43.1 | Very low | 161 Ų | 161 | 146.8 Ų | 146.8 | 86% | 0.861 | 75% | 0.745 | S | S | * | * | trans | -39.2 | 104.9 | 173.3 | -85.5 | -37.5 | 0 | 0 | 0 | 112.1 | E32 | N30-E32 PolarHBondContact O-N 3.2Š| ||
| 31 | Q | 37.7 | Very low | 44.8 | Very low | 191 Ų | 191 | 145 Ų | 145 | 89% | 0.893 | 73% | 0.729 | S | S | * | * | trans | -69.7 | 96.5 | 169.1 | -73.9 | -177.3 | -5.7 | 0 | 0 | 108.8 | I29 K33 | I29-Q31 PolarHBondContact O-N 3Å; Q31-K33 PolarHBondContact O-N 3.32Å | ||
| 32 | E | 41.3 | Very low | 46.3 | Very low | 181 Ų | 181 | 137.3 Ų | 137.3 | 85% | 0.846 | 69% | 0.694 | S | S | * | * | trans | -57.9 | 128.7 | 162.4 | -87 | -177.8 | 151.8 | 0 | 0 | 109.1 | N30 E34 | N30-E32 PolarHBondContact O-N 3.2Å; E32-E34 PolarHBondContact O-N 2.98Å | ||
| 33 | K | 41.5 | Very low | 48.1 | Very low | 207 Ų | 207 | 130.8 Ų | 130.8 | 90% | 0.9 | 67% | 0.665 | S | S | * | * | trans | -51.6 | 95.5 | 179.5 | -80.7 | 173.3 | 172.5 | 171.4 | 0 | 111.5 | Q31 T35 | Q31-K33 PolarHBondContact O-N 3.32Å; K33-T35 PolarHBondContact O-N 3.19Å | ||
| 34 | E | 49.1 | Very low | 50.2 | Low | 95 Ų | 95 | 128.9 Ų | 128.9 | 44% | 0.444 | 65% | 0.654 | S | S | . | * | trans | -64 | 124 | 165.7 | -80.1 | -163.9 | 148.6 | 0 | 0 | 109.9 | E32 G36 M55 | E32-E34 PolarHBondContact O-N 2.98Å; E34-G36 PolarHBondContact O-N 3.18Å; E34-M55 VanDerWaalsContact OE1-CE 3.23Å; E34-M55 WeakPolarHBondContact OE1-CE 3.39Å; E34-M55 WeakPolarHBondContact OE2-CE 3.41Å | ||
| 35 | T | 52 | Low | 52.2 | Low | 106 Ų | 106 | 122.2 Ų | 122.2 | 65% | 0.65 | 62% | 0.618 | S | S | * | * | trans | -57.4 | 132.5 | -179.3 | 56.8 | 0 | 0 | 0 | 0 | 111.1 | K33 C37 F38 | K33-T35 PolarHBondContact O-N 3.19Å; T35-C37 PolarHBondContact O-N 3.31Å; T35-F38 PolarHBondContact O-N 2.88Å; T35-F38 VanDerWaalsContact O-N 3.07Å | ||
| 36 | G | 57.5 | Low | 54.3 | Low | 53 Ų | 53 | 118.9 Ų | 118.9 | 55% | 0.546 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -59.3 | -14.8 | -168.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | E34 K40 | E34-G36 PolarHBondContact O-N 3.18Å; G36-K40 WeakPolarHBondContact O-CG 3.13Å; G36-K40 PolarHBondContact O-N 3.48Å |
| 37 | C | 61 | Low | 56.4 | Low | 103 Ų | 103 | 111 Ų | 111 | 70% | 0.696 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -71.5 | -45.3 | 174.5 | -172.7 | 0 | 0 | 0 | 0 | 112 | T35 R39 K40 F41 | T35-C37 PolarHBondContact O-N 3.31Å; C37-R39 PolarHBondContact O-N 3.33Å; C37-K40 PolarHBondContact O-N 2.87Å; C37-F41 PolarHBondContact O-N 2.87Å |
| 38 | F | 63.2 | Low | 58.3 | Low | 110 Ų | 110 | 110.1 Ų | 110.1 | 48% | 0.482 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.7 | -44.6 | -179.4 | -166.4 | -120.2 | 0 | 0 | 0 | 110.7 | T35 K40 F41 Q42 | T35-F38 PolarHBondContact O-N 2.88Å; T35-F38 VanDerWaalsContact O-N 3.07Å; F38-K40 PolarHBondContact O-N 2.95Å; F38-F41 PolarHBondContact O-N 3.1Å; F38-Q42 VanDerWaalsContact O-CG 3.23Å; F38-Q42 WeakPolarHBondContact O-CG 3.34Å; F38-Q42 PolarHBondContact O-N 3.4Å |
| 39 | R | 64.6 | Low | 60.1 | Low | 163 Ų | 163 | 106.5 Ų | 106.5 | 62% | 0.615 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -61.5 | -38.7 | 176.4 | -159.6 | 172.5 | -173.1 | -165.6 | 2.4 | 113.2 | C37 N43 | C37-R39 PolarHBondContact O-N 3.33Å; R39-N43 WeakPolarHBondContact O-CB 3.32Å; R39-N43 PolarHBondContact O-N 3.3Å; R39-N43 VanDerWaalsContact O-N 3.09Å; R39-N43 PolarHBondContact O-ND2 2.85Å |
| 40 | K | 66.1 | Low | 61.8 | Low | 165 Ų | 165 | 102 Ų | 102 | 72% | 0.717 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66.1 | -43.8 | 174.8 | -84.4 | -177.7 | 177.8 | -179.1 | 0 | 112.3 | G36 C37 F38 N43 L44 | G36-K40 WeakPolarHBondContact O-CG 3.13Å; G36-K40 PolarHBondContact O-N 3.48Å; C37-K40 PolarHBondContact O-N 2.87Å; F38-K40 PolarHBondContact O-N 2.95Å; K40-N43 PolarHBondContact O-N 3.12Å; K40-L44 PolarHBondContact O-N 3.23Å |
| 41 | F | 69.2 | Low | 63.7 | Low | 121 Ų | 121 | 97.5 Ų | 97.5 | 53% | 0.531 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 178 | -175.1 | -107 | 0 | 0 | 0 | 112.1 | C37 F38 L44 I45 | C37-F41 PolarHBondContact O-N 2.87Å; F38-F41 PolarHBondContact O-N 3.1Å; F41-L44 VanDerWaalsContact O-CB 3.25Å; F41-L44 WeakPolarHBondContact O-CB 3.47Å; F41-L44 PolarHBondContact O-N 3.12Å; F41-I45 HydrophobicContact CD1-CD1 3.66Å; F41-I45 HydrophobicContact CD2-CD1 4.45Å; F41-I45 HydrophobicContact CE1-CD1 3.2Å; F41-I45 HydrophobicContact CE2-CD1 4.07Å; F41-I45 HydrophobicContact CG-CD1 4.28Å; F41-I45 HydrophobicContact CZ-CD1 3.45Å; F41-I45 VanDerWaalsContact CZ-CD1 3.45Å; F41-I45 WeakPolarHBondContact O-CG1 3.36Å; F41-I45 PolarHBondContact O-N 3.04Å |
| 42 | Q | 67.9 | Low | 65.1 | Low | 22 Ų | 22 | 94.3 Ų | 94.3 | 10% | 0.103 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -62.4 | -47.1 | 174.7 | -70.1 | 165.9 | -11.6 | 0 | 0 | 112.6 | F38 L44 I45 I46 M55 | F38-Q42 VanDerWaalsContact O-CG 3.23Å; F38-Q42 WeakPolarHBondContact O-CG 3.34Å; F38-Q42 PolarHBondContact O-N 3.4Å; Q42-L44 PolarHBondContact O-N 3.15Å; Q42-L44 VanDerWaalsContact O-N 3.14Å; Q42-I45 PolarHBondContact O-N 3.15Å; Q42-I46 PolarHBondContact O-N 3.14Å; Q42-M55 PolarHBondContact NE2-SD 3.29Å; Q42-M55 VanDerWaalsContact NE2-SD 3.37Å |
| 43 | N | 70.6 | Confident | 66.4 | Low | 59 Ų | 59 | 91.6 Ų | 91.6 | 32% | 0.316 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.4 | -27.3 | 177.6 | -71.7 | -14.9 | 0 | 0 | 0 | 112.1 | R39 K40 R51 K201 | R39-N43 WeakPolarHBondContact O-CB 3.32Å; R39-N43 PolarHBondContact O-N 3.3Å; R39-N43 VanDerWaalsContact O-N 3.09Å; R39-N43 PolarHBondContact O-ND2 2.85Å; K40-N43 PolarHBondContact O-N 3.12Å; N43-R51 PolarHBondContact O-NH2 2.99Å; N43-R51 PolarHBondContact OD1-NE 3.47Å; N43-R51 PolarHBondContact OD1-NH1 2.91Å; N43-K201 PolarHBondContact O-NZ 3.4Å |
| 44 | L | 75.2 | Confident | 67.7 | Low | 94 Ų | 94 | 86.5 Ų | 86.5 | 49% | 0.492 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -72.1 | -40.6 | 175.3 | -164.7 | 68.2 | 0 | 0 | 0 | 111.8 | K40 F41 Q42 K201 F204 | K40-L44 PolarHBondContact O-N 3.23Å; F41-L44 VanDerWaalsContact O-CB 3.25Å; F41-L44 WeakPolarHBondContact O-CB 3.47Å; F41-L44 PolarHBondContact O-N 3.12Å; Q42-L44 PolarHBondContact O-N 3.15Å; Q42-L44 VanDerWaalsContact O-N 3.14Å; L44-K201 VanDerWaalsContact O-CD 3.27Å; L44-K201 WeakPolarHBondContact O-CD 3.49Å; L44-K201 VanDerWaalsContact O-CE 3.3Å; L44-K201 WeakPolarHBondContact O-CE 3.48Å; L44-K201 PolarHBondContact O-NZ 2.89Å; L44-F204 HydrophobicContact CB-CZ 4.41Å; L44-F204 HydrophobicContact CD1-CZ 4.49Å; L44-F204 HydrophobicContact CD2-CE1 4.36Å; L44-F204 HydrophobicContact CD2-CE2 4.39Å; L44-F204 HydrophobicContact CD2-CZ 3.59Å; L44-F204 HydrophobicContact CG-CE2 3.8Å; L44-F204 HydrophobicContact CG-CZ 3.5Å; L44-F204 VanDerWaalsContact CG-CZ 3.5Å; L44-F204 WeakPolarHBondContact O-CE2 3.44Å |
| 45 | I | 77.1 | Confident | 68.4 | Low | 34 Ų | 34 | 84.8 Ų | 84.8 | 17% | 0.174 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -86.8 | -45 | -172.9 | -64.1 | 171.2 | 0 | 0 | 0 | 113.4 | F41 Q42 K201 F204 | F41-I45 HydrophobicContact CD1-CD1 3.66Å; F41-I45 HydrophobicContact CD2-CD1 4.45Å; F41-I45 HydrophobicContact CE1-CD1 3.2Å; F41-I45 HydrophobicContact CE2-CD1 4.07Å; F41-I45 HydrophobicContact CG-CD1 4.28Å; F41-I45 HydrophobicContact CZ-CD1 3.45Å; F41-I45 VanDerWaalsContact CZ-CD1 3.45Å; F41-I45 WeakPolarHBondContact O-CG1 3.36Å; F41-I45 PolarHBondContact O-N 3.04Å; Q42-I45 PolarHBondContact O-N 3.15Å; I45-K201 PolarHBondContact O-N 3.07Å; I45-F204 HydrophobicContact CB-CG 4.33Å; I45-F204 HydrophobicContact CG1-CD1 3.72Å; I45-F204 HydrophobicContact CG1-CD2 4.33Å; I45-F204 HydrophobicContact CG1-CE1 3.92Å; I45-F204 HydrophobicContact CG1-CG 3.94Å; I45-F204 HydrophobicContact CG1-CZ 4.33Å; I45-F204 HydrophobicContact CG2-CB 4.15Å; I45-F204 HydrophobicContact CG2-CG 4.32Å |
| 46 | I | 76.5 | Confident | 68.9 | Low | 11 Ų | 11 | 86.7 Ų | 86.7 | 6% | 0.056 | 42% | 0.423 | C | S | . | . | S | Bend | trans | -107.4 | 127.9 | -167 | -53 | -179.8 | 0 | 0 | 0 | 110 | Q42 F50 R51 Y54 | Q42-I46 PolarHBondContact O-N 3.14Å; I46-F50 HydrophobicContact CG2-CB 3.91Å; I46-R51 HydrophobicContact CB-CG 4.23Å; I46-R51 HydrophobicContact CG2-CG 4.01Å; I46-R51 PolarHBondContact O-NE 3.19Å; I46-R51 PolarHBondContact O-NH2 3.3Å; I46-Y54 HydrophobicContact CD1-CD1 3.39Å; I46-Y54 HydrophobicContact CD1-CD2 3.73Å; I46-Y54 HydrophobicContact CD1-CE1 3.72Å; I46-Y54 HydrophobicContact CD1-CE2 4.02Å; I46-Y54 HydrophobicContact CD1-CG 3.4Å |
| 47 | P | 77.4 | Confident | 69.3 | Low | 16 Ų | 16 | 88.7 Ų | 88.7 | 10% | 0.104 | 41% | 0.414 | C | S | . | . | trans | -58 | 147.5 | 171 | -21.7 | 33.5 | 0 | 0 | 0 | 112.1 | E49 F50 R51 Q199 K201 | P47-E49 VanDerWaalsContact C-N 3.25Å; P47-E49 VanDerWaalsContact CB-CD 3.42Å; P47-E49 HydrophobicContact CB-CG 4.46Å; P47-E49 WeakPolarHBondContact CB-OE1 3.45Å; P47-E49 WeakPolarHBondContact CB-OE2 3.48Å; P47-E49 PolarHBondContact O-N 3.38Å; P47-F50 HydrophobicContact CB-CD2 4.19Å; P47-F50 HydrophobicContact CG-CD2 4.26Å; P47-F50 PolarHBondContact O-N 3.23Å; P47-F50 VanDerWaalsContact O-N 3.15Å; P47-R51 WeakPolarHBondContact O-CG 3.34Å; P47-Q199 VanDerWaalsContact CD-O 3.26Å; P47-Q199 WeakPolarHBondContact CD-O 3.24Å; P47-K201 HydrophobicContact CG-CG 4.13Å | ||
| 48 | P | 72.8 | Confident | 69.2 | Low | 83 Ų | 83 | 85.7 Ų | 85.7 | 54% | 0.539 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -54.7 | -37.8 | -174 | 20.5 | -29.8 | 0 | 0 | 0 | 113.5 | F50 R51 | P48-F50 PolarHBondContact O-N 3.4Å; P48-F50 VanDerWaalsContact O-N 3.14Å; P48-R51 PolarHBondContact O-N 2.89Å |
| 49 | E | 73.2 | Confident | 69.2 | Low | 118 Ų | 118 | 83.5 Ų | 83.5 | 55% | 0.551 | 39% | 0.39 | S | S | * | . | G | 310 helix | trans | -66.7 | -12.2 | -177.9 | 65.7 | -86.1 | -171.8 | 0 | 0 | 115.5 | P47 | P47-E49 VanDerWaalsContact C-N 3.25Å; P47-E49 VanDerWaalsContact CB-CD 3.42Å; P47-E49 HydrophobicContact CB-CG 4.46Å; P47-E49 WeakPolarHBondContact CB-OE1 3.45Å; P47-E49 WeakPolarHBondContact CB-OE2 3.48Å; P47-E49 PolarHBondContact O-N 3.38Å |
| 50 | F | 70.9 | Confident | 69.1 | Low | 50 Ų | 50 | 80.1 Ų | 80.1 | 22% | 0.219 | 39% | 0.39 | C | S | . | . | G | 310 helix | trans | -114 | -3.9 | 180 | -61.7 | -67.7 | 0 | 0 | 0 | 113.9 | I46 P47 P48 R53 Y54 Q199 | I46-F50 HydrophobicContact CG2-CB 3.91Å; P47-F50 HydrophobicContact CB-CD2 4.19Å; P47-F50 HydrophobicContact CG-CD2 4.26Å; P47-F50 PolarHBondContact O-N 3.23Å; P47-F50 VanDerWaalsContact O-N 3.15Å; P48-F50 PolarHBondContact O-N 3.4Å; P48-F50 VanDerWaalsContact O-N 3.14Å; F50-R53 VanDerWaalsContact CD1-NH2 3.32Å; F50-Y54 WeakPolarHBondContact O-CB 3.33Å; F50-Y54 PolarHBondContact O-N 3.48Å; F50-Y54 VanDerWaalsContact O-N 3.12Å; F50-Q199 HydrophobicContact CD1-CG 4.01Å; F50-Q199 HydrophobicContact CD2-CB 4.36Å; F50-Q199 HydrophobicContact CE1-CG 4.14Å; F50-Q199 HydrophobicContact CG-CB 4.23Å; F50-Q199 HydrophobicContact CG-CG 4.23Å; F50-Q199 HydrophobicContact CZ-CG 4.48Å |
| 51 | R | 73.7 | Confident | 68.9 | Low | 66 Ų | 66 | 82 Ų | 82 | 25% | 0.249 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.7 | -52.4 | -171.6 | -72 | -179.4 | -168.9 | 157.8 | 3.5 | 112.8 | N43 I46 P47 P48 R53 Y54 M55 | N43-R51 PolarHBondContact O-NH2 2.99Å; N43-R51 PolarHBondContact OD1-NE 3.47Å; N43-R51 PolarHBondContact OD1-NH1 2.91Å; I46-R51 HydrophobicContact CB-CG 4.23Å; I46-R51 HydrophobicContact CG2-CG 4.01Å; I46-R51 PolarHBondContact O-NE 3.19Å; I46-R51 PolarHBondContact O-NH2 3.3Å; P47-R51 WeakPolarHBondContact O-CG 3.34Å; P48-R51 PolarHBondContact O-N 2.89Å; R51-R53 VanDerWaalsContact C-N 3.33Å; R51-R53 PolarHBondContact O-N 2.95Å; R51-Y54 WeakPolarHBondContact O-CA 3.46Å; R51-Y54 WeakPolarHBondContact O-CB 3.25Å; R51-Y54 PolarHBondContact O-N 2.94Å; R51-M55 VanDerWaalsContact O-CG 3.32Å; R51-M55 WeakPolarHBondContact O-CG 3.43Å; R51-M55 PolarHBondContact O-N 3.11Å |
| 52 | D | 66.8 | Low | 68.9 | Low | 123 Ų | 123 | 79.4 Ų | 79.4 | 66% | 0.658 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -64.4 | -40.2 | -172.7 | -58.3 | -36.5 | 0 | 0 | 0 | 111.9 | Y54 M55 Q56 | D52-Y54 VanDerWaalsContact C-N 3.33Å; D52-Y54 PolarHBondContact O-N 3.16Å; D52-M55 PolarHBondContact O-N 3.06Å; D52-Q56 WeakPolarHBondContact O-CG 3.46Å; D52-Q56 PolarHBondContact O-N 2.65Å |
| 53 | R | 68.4 | Low | 69.4 | Low | 125 Ų | 125 | 81.7 Ų | 81.7 | 47% | 0.472 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.7 | -35.8 | 173.1 | -75 | -172.3 | -71 | -176.4 | -7.4 | 112.9 | F50 R51 R57 | F50-R53 VanDerWaalsContact CD1-NH2 3.32Å; R51-R53 VanDerWaalsContact C-N 3.33Å; R51-R53 PolarHBondContact O-N 2.95Å; R53-R57 WeakPolarHBondContact O-CG 3.26Å |
| 54 | Y | 68.3 | Low | 70.2 | Confident | 100 Ų | 100 | 79.9 Ų | 79.9 | 39% | 0.392 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -68.9 | -44 | 174.4 | -176 | -89.5 | 0 | 0 | 0 | 111 | I46 F50 R51 D52 Q56 R57 A58 | I46-Y54 HydrophobicContact CD1-CD1 3.39Å; I46-Y54 HydrophobicContact CD1-CD2 3.73Å; I46-Y54 HydrophobicContact CD1-CE1 3.72Å; I46-Y54 HydrophobicContact CD1-CE2 4.02Å; I46-Y54 HydrophobicContact CD1-CG 3.4Å; F50-Y54 WeakPolarHBondContact O-CB 3.33Å; F50-Y54 PolarHBondContact O-N 3.48Å; F50-Y54 VanDerWaalsContact O-N 3.12Å; R51-Y54 WeakPolarHBondContact O-CA 3.46Å; R51-Y54 WeakPolarHBondContact O-CB 3.25Å; R51-Y54 PolarHBondContact O-N 2.94Å; D52-Y54 VanDerWaalsContact C-N 3.33Å; D52-Y54 PolarHBondContact O-N 3.16Å; Y54-Q56 PolarHBondContact O-N 2.86Å; Y54-R57 PolarHBondContact O-N 3.24Å; Y54-R57 VanDerWaalsContact O-N 3.14Å; Y54-A58 HydrophobicContact CD1-CB 4.09Å; Y54-A58 HydrophobicContact CE1-CB 3.75Å; Y54-A58 WeakPolarHBondContact O-CB 3.47Å; Y54-A58 PolarHBondContact O-N 3.03Å |
| 55 | M | 64 | Low | 71.1 | Confident | 59 Ų | 59 | 81 Ų | 81 | 29% | 0.291 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.7 | -42.9 | -179.4 | -68 | -56 | -72.5 | 0 | 0 | 112.8 | E34 Q42 R51 D52 R57 | E34-M55 VanDerWaalsContact OE1-CE 3.23Å; E34-M55 WeakPolarHBondContact OE1-CE 3.39Å; E34-M55 WeakPolarHBondContact OE2-CE 3.41Å; Q42-M55 PolarHBondContact NE2-SD 3.29Å; Q42-M55 VanDerWaalsContact NE2-SD 3.37Å; R51-M55 VanDerWaalsContact O-CG 3.32Å; R51-M55 WeakPolarHBondContact O-CG 3.43Å; R51-M55 PolarHBondContact O-N 3.11Å; D52-M55 PolarHBondContact O-N 3.06Å; M55-R57 PolarHBondContact O-N 3.03Å |
| 56 | Q | 62.7 | Low | 72 | Confident | 145 Ų | 145 | 81.8 Ų | 81.8 | 68% | 0.678 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -63.7 | -29 | 176.5 | -72.1 | 177.8 | 0.7 | 0 | 0 | 112.6 | D52 Y54 N59 | D52-Q56 WeakPolarHBondContact O-CG 3.46Å; D52-Q56 PolarHBondContact O-N 2.65Å; Y54-Q56 PolarHBondContact O-N 2.86Å; Q56-N59 VanDerWaalsContact O-CG 3.28Å; Q56-N59 PolarHBondContact O-ND2 2.87Å; Q56-N59 VanDerWaalsContact O-ND2 3.07Å |
| 57 | R | 65.5 | Low | 73 | Confident | 96 Ų | 96 | 81.3 Ų | 81.3 | 36% | 0.362 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -92.1 | -37.9 | -177.1 | -72 | -178.5 | 178.4 | 154 | 0.8 | 113.6 | R53 Y54 M55 N59 | R53-R57 WeakPolarHBondContact O-CG 3.26Å; Y54-R57 PolarHBondContact O-N 3.24Å; Y54-R57 VanDerWaalsContact O-N 3.14Å; M55-R57 PolarHBondContact O-N 3.03Å; R57-N59 PolarHBondContact O-N 2.93Å; R57-N59 PolarHBondContact O-OD1 3.49Å |
| 58 | A | 60.2 | Low | 73.9 | Confident | 40 Ų | 40 | 84 Ų | 84 | 33% | 0.331 | 41% | 0.414 | S | S | . | . | S | Bend | trans | -78 | 40.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y54 | Y54-A58 HydrophobicContact CD1-CB 4.09Å; Y54-A58 HydrophobicContact CE1-CB 3.75Å; Y54-A58 WeakPolarHBondContact O-CB 3.47Å; Y54-A58 PolarHBondContact O-N 3.03Å |
| 59 | N | 63.1 | Low | 75.1 | Confident | 63 Ų | 63 | 81.7 Ų | 81.7 | 34% | 0.337 | 41% | 0.406 | S | S | . | . | trans | -89.5 | 145.2 | 173.6 | 63.6 | 6.2 | 0 | 0 | 0 | 109.4 | Q56 R57 R61 K147 | Q56-N59 VanDerWaalsContact O-CG 3.28Å; Q56-N59 PolarHBondContact O-ND2 2.87Å; Q56-N59 VanDerWaalsContact O-ND2 3.07Å; R57-N59 PolarHBondContact O-N 2.93Å; R57-N59 PolarHBondContact O-OD1 3.49Å; N59-R61 PolarHBondContact O-N 2.83Å; N59-R61 PolarHBondContact OD1-O 2.95Å; N59-K147 PolarHBondContact OD1-NZ 2.95Å | ||
| 60 | C | 61.1 | Low | 76.3 | Confident | 92 Ų | 92 | 77 Ų | 77 | 62% | 0.622 | 38% | 0.384 | S | S | * | . | S | Bend | trans | -71.4 | 26.1 | 175.3 | -61.3 | 0 | 0 | 0 | 0 | 112.8 | P62 | C60-P62 CarbonylContact O-C 3.41Š|
| 61 | R | 62.2 | Low | 77.6 | Confident | 204 Ų | 204 | 75 Ų | 75 | 77% | 0.77 | 38% | 0.376 | S | S | * | . | S | Bend | trans | -129.9 | 113.5 | -173.7 | -68.7 | -171.2 | 178.5 | 159.7 | 2.4 | 110.4 | N59 K147 | N59-R61 PolarHBondContact O-N 2.83Å; N59-R61 PolarHBondContact OD1-O 2.95Å; R61-K147 PolarHBondContact O-NZ 3.41Å |
| 62 | P | 70.3 | Confident | 78.7 | Confident | 67 Ų | 67 | 77 Ų | 77 | 44% | 0.435 | 39% | 0.391 | S | S | . | . | S | Bend | cis | -69.4 | 156.2 | -7.9 | 32.3 | -30.8 | 0 | 0 | 0 | 111.4 | C60 K147 | C60-P62 CarbonylContact O-C 3.41Å; P62-K147 VanDerWaalsContact CD-CD 3.46Å; P62-K147 HydrophobicContact CG-CD 4.17Å |
| 63 | P | 78.6 | Confident | 80.2 | Confident | 70 Ų | 70 | 72.8 Ų | 72.8 | 46% | 0.455 | 37% | 0.374 | S | S | . | . | trans | -61.5 | 159.5 | 172.6 | 26.2 | -33.3 | 0 | 0 | 0 | 111.1 | I65 | P63-I65 VanDerWaalsContact C-N 3.31Å; P63-I65 HydrophobicContact CG-CD1 4.11Å; P63-I65 HydrophobicContact CG-CG1 4.06Å; P63-I65 PolarHBondContact O-N 3.4Å | ||
| 64 | P | 87.2 | Confident | 81.6 | Confident | 21 Ų | 21 | 66.9 Ų | 66.9 | 14% | 0.136 | 35% | 0.351 | C | S | . | . | trans | -74.9 | 79.9 | -177.8 | 31.6 | -36 | 0 | 0 | 0 | 111.6 | I68 I140 E143 M144 | P64-I68 HydrophobicContact CG-CD1 4.1Å; P64-I68 WeakPolarHBondContact O-CB 3.22Å; P64-I68 VanDerWaalsContact O-CD1 3.29Å; P64-I68 WeakPolarHBondContact O-CD1 3.24Å; P64-I68 VanDerWaalsContact O-CG1 3.27Å; P64-I68 WeakPolarHBondContact O-CG1 3.49Å; P64-I140 HydrophobicContact CB-CG2 4.35Å; P64-I140 HydrophobicContact CG-CG2 4.06Å; P64-E143 VanDerWaalsContact C-OE1 3.31Å; P64-E143 WeakPolarHBondContact CA-OE1 3.13Å; P64-E143 HydrophobicContact CB-CB 4.06Å; P64-E143 HydrophobicContact CB-CG 3.86Å; P64-M144 HydrophobicContact CG-CG 4.49Å | ||
| 65 | I | 92.9 | Very high | 83 | Confident | 118 Ų | 118 | 65.6 Ų | 65.6 | 61% | 0.605 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -80.9 | -37.8 | -174.3 | -64.4 | 166.5 | 0 | 0 | 0 | 111.3 | P63 G69 E143 | P63-I65 VanDerWaalsContact C-N 3.31Å; P63-I65 HydrophobicContact CG-CD1 4.11Å; P63-I65 HydrophobicContact CG-CG1 4.06Å; P63-I65 PolarHBondContact O-N 3.4Å; I65-G69 WeakPolarHBondContact O-CA 3.36Å; I65-G69 PolarHBondContact O-N 3.36Å; I65-E143 PolarHBondContact N-OE1 2.91Å |
| 66 | F | 96.1 | Very high | 84.5 | Confident | 51 Ų | 51 | 65.4 Ų | 65.4 | 22% | 0.224 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -66.3 | -54.8 | -173 | 175.2 | -92.3 | 0 | 0 | 0 | 111.4 | I68 G69 I70 E143 G152 Y155 L156 | F66-I68 PolarHBondContact O-N 2.84Å; F66-G69 PolarHBondContact O-N 3.4Å; F66-I70 HydrophobicContact CE1-CG2 4.2Å; F66-I70 WeakPolarHBondContact O-CG2 3.3Å; F66-I70 PolarHBondContact O-N 3.49Å; F66-E143 WeakPolarHBondContact CB-OE1 3.49Å; F66-E143 PolarHBondContact N-OE1 2.81Å; F66-E143 PolarHBondContact N-OE2 3.41Å; F66-G152 VanDerWaalsContact CZ-CA 3.42Å; F66-Y155 HydrophobicContact CE1-CD1 4.25Å; F66-Y155 HydrophobicContact CE1-CG 4.1Å; F66-Y155 HydrophobicContact CZ-CD1 4.15Å; F66-Y155 HydrophobicContact CZ-CG 4.41Å; F66-L156 HydrophobicContact CZ-CG 4.46Å |
| 67 | I | 97.1 | Very high | 86 | Confident | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64.5 | -41.3 | -176.4 | -69.1 | -67.1 | 0 | 0 | 0 | 111.1 | I70 S71 Q135 L136 I140 E143 V151 L185 | I67-I70 WeakPolarHBondContact O-CG2 3.27Å; I67-S71 VanDerWaalsContact O-CB 3.31Å; I67-S71 WeakPolarHBondContact O-CB 3.2Å; I67-S71 PolarHBondContact O-N 3.18Å; I67-S71 VanDerWaalsContact O-N 3.1Å; I67-S71 PolarHBondContact O-OG 2.9Å; I67-Q135 HydrophobicContact CD1-CG 4.44Å; I67-Q135 HydrophobicContact CG2-CG 4.22Å; I67-L136 HydrophobicContact CG2-CD2 4.13Å; I67-I140 HydrophobicContact CG2-CG1 4.03Å; I67-E143 WeakPolarHBondContact CB-OE2 3.3Å; I67-E143 HydrophobicContact CG1-CB 4.43Å; I67-E143 VanDerWaalsContact CG1-OE2 3.29Å; I67-E143 WeakPolarHBondContact CG1-OE2 3.27Å; I67-E143 PolarHBondContact N-OE2 3.41Å; I67-V151 HydrophobicContact CD1-CG1 3.89Å; I67-V151 HydrophobicContact CG1-CG1 4.01Å; I67-L185 HydrophobicContact CD1-CD1 4.04Å; I67-L185 HydrophobicContact CD1-CD2 4.41Å |
| 68 | I | 96.8 | Very high | 87.3 | Confident | 72 Ų | 72 | 56.6 Ų | 56.6 | 37% | 0.369 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65.6 | -45 | 175.6 | -65.2 | 178.8 | 0 | 0 | 0 | 110.3 | P64 F66 S71 I72 I140 | P64-I68 HydrophobicContact CG-CD1 4.1Å; P64-I68 WeakPolarHBondContact O-CB 3.22Å; P64-I68 VanDerWaalsContact O-CD1 3.29Å; P64-I68 WeakPolarHBondContact O-CD1 3.24Å; P64-I68 VanDerWaalsContact O-CG1 3.27Å; P64-I68 WeakPolarHBondContact O-CG1 3.49Å; F66-I68 PolarHBondContact O-N 2.84Å; I68-S71 PolarHBondContact O-N 3.2Å; I68-I72 HydrophobicContact CG2-CD1 3.77Å; I68-I72 HydrophobicContact CG2-CG1 4.44Å; I68-I72 VanDerWaalsContact O-CG1 3.31Å; I68-I72 WeakPolarHBondContact O-CG1 3.46Å; I68-I72 PolarHBondContact O-N 3.03Å; I68-I140 HydrophobicContact CG1-CD1 4.41Å |
| 69 | G | 97.8 | Very high | 88.7 | Confident | 36 Ų | 36 | 58.5 Ų | 58.5 | 37% | 0.371 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.6 | -46.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | I65 F66 I72 A73 | I65-G69 WeakPolarHBondContact O-CA 3.36Å; I65-G69 PolarHBondContact O-N 3.36Å; F66-G69 PolarHBondContact O-N 3.4Å; G69-I72 PolarHBondContact O-N 3.29Å; G69-A73 PolarHBondContact O-N 3.27Å |
| 70 | I | 98.1 | Very high | 90 | Very high | 18 Ų | 18 | 61.4 Ų | 61.4 | 9% | 0.092 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -68.1 | -39 | 179 | -165.4 | 76.7 | 0 | 0 | 0 | 111.6 | F66 I67 I72 A73 E74 M119 F120 Y155 | F66-I70 HydrophobicContact CE1-CG2 4.2Å; F66-I70 WeakPolarHBondContact O-CG2 3.3Å; F66-I70 PolarHBondContact O-N 3.49Å; I67-I70 WeakPolarHBondContact O-CG2 3.27Å; I70-I72 PolarHBondContact O-N 3.26Å; I70-A73 PolarHBondContact O-N 3.48Å; I70-E74 VanDerWaalsContact O-CG 3.31Å; I70-E74 WeakPolarHBondContact O-CG 3.16Å; I70-E74 PolarHBondContact O-N 3.47Å; I70-M119 HydrophobicContact CD1-CE 3.89Å; I70-M119 HydrophobicContact CD1-SD 4.45Å; I70-F120 HydrophobicContact CD1-CE1 3.52Å; I70-F120 HydrophobicContact CD1-CZ 3.77Å; I70-F120 HydrophobicContact CG1-CE1 4.47Å; I70-Y155 HydrophobicContact CG1-CE1 4.34Å |
| 71 | S | 98.3 | Very high | 91.2 | Very high | 8 Ų | 8 | 58.2 Ų | 58.2 | 6% | 0.056 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60 | -41.6 | 172.4 | -77.9 | 0 | 0 | 0 | 0 | 113.1 | I67 I68 L75 L132 Q135 | I67-S71 VanDerWaalsContact O-CB 3.31Å; I67-S71 WeakPolarHBondContact O-CB 3.2Å; I67-S71 PolarHBondContact O-N 3.18Å; I67-S71 VanDerWaalsContact O-N 3.1Å; I67-S71 PolarHBondContact O-OG 2.9Å; I68-S71 PolarHBondContact O-N 3.2Å; S71-L75 WeakPolarHBondContact O-CB 3.48Å; S71-L75 PolarHBondContact O-N 2.92Å; S71-L132 WeakPolarHBondContact OG-CD2 3.27Å; S71-Q135 PolarHBondContact OG-NE2 2.89Å |
| 72 | I | 98.2 | Very high | 92.2 | Very high | 108 Ų | 108 | 49.3 Ų | 49.3 | 55% | 0.554 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -64.6 | -42.5 | 175.3 | -70.5 | 168.3 | 0 | 0 | 0 | 110.4 | I68 G69 I70 L75 A76 | I68-I72 HydrophobicContact CG2-CD1 3.77Å; I68-I72 HydrophobicContact CG2-CG1 4.44Å; I68-I72 VanDerWaalsContact O-CG1 3.31Å; I68-I72 WeakPolarHBondContact O-CG1 3.46Å; I68-I72 PolarHBondContact O-N 3.03Å; G69-I72 PolarHBondContact O-N 3.29Å; I70-I72 PolarHBondContact O-N 3.26Å; I72-L75 PolarHBondContact O-N 3.39Å; I72-A76 VanDerWaalsContact O-CB 3.31Å; I72-A76 WeakPolarHBondContact O-CB 3.05Å; I72-A76 PolarHBondContact O-N 3.01Å |
| 73 | A | 98.1 | Very high | 92.7 | Very high | 36 Ų | 36 | 52 Ų | 52 | 30% | 0.298 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63 | -45.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | G69 I70 L75 A76 V77 F120 | G69-A73 PolarHBondContact O-N 3.27Å; I70-A73 PolarHBondContact O-N 3.48Å; A73-L75 PolarHBondContact O-N 2.91Å; A73-A76 PolarHBondContact O-N 3.35Å; A73-V77 WeakPolarHBondContact O-CG2 3.07Å; A73-V77 PolarHBondContact O-N 3.02Å; A73-F120 HydrophobicContact CB-CD1 4.23Å; A73-F120 HydrophobicContact CB-CE1 3.75Å |
| 74 | E | 97.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.2 | -46.7 | 174 | -70.2 | 160.3 | -160.3 | 0 | 0 | 111.7 | I70 V77 F78 F120 L132 Q135 Y155 | I70-E74 VanDerWaalsContact O-CG 3.31Å; I70-E74 WeakPolarHBondContact O-CG 3.16Å; I70-E74 PolarHBondContact O-N 3.47Å; E74-V77 PolarHBondContact O-N 2.97Å; E74-F78 WeakPolarHBondContact O-CB 3.3Å; E74-F78 PolarHBondContact O-N 3.36Å; E74-F120 HydrophobicContact CG-CD1 4.11Å; E74-L132 WeakPolarHBondContact OE2-CD2 3.4Å; E74-Q135 PolarHBondContact OE1-NE2 3.2Å; E74-Q135 PolarHBondContact OE1-OE1 2.98Å; E74-Q135 PolarHBondContact OE2-NE2 3.23Å; E74-Q135 VanDerWaalsContact OE2-NE2 3.11Å; E74-Y155 PolarHBondContact OE1-OH 3.4Å |
| 75 | L | 96.5 | Very high | 91.5 | Very high | 73 Ų | 73 | 61.9 Ų | 61.9 | 38% | 0.382 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -64.8 | -41.6 | 178.7 | -176 | 61.1 | 0 | 0 | 0 | 112 | S71 I72 A73 F78 I79 I128 L132 | S71-L75 WeakPolarHBondContact O-CB 3.48Å; S71-L75 PolarHBondContact O-N 2.92Å; I72-L75 PolarHBondContact O-N 3.39Å; A73-L75 PolarHBondContact O-N 2.91Å; L75-F78 PolarHBondContact O-N 3.46Å; L75-I79 HydrophobicContact CD1-CD1 4.13Å; L75-I79 HydrophobicContact CD1-CG1 4.31Å; L75-I79 HydrophobicContact CG-CD1 3.89Å; L75-I79 HydrophobicContact CG-CG1 4.48Å; L75-I79 WeakPolarHBondContact O-CB 3.39Å; L75-I79 VanDerWaalsContact O-CG1 3.27Å; L75-I79 WeakPolarHBondContact O-CG1 2.93Å; L75-I79 PolarHBondContact O-N 2.87Å; L75-I128 HydrophobicContact CB-CD1 4.47Å; L75-I128 HydrophobicContact CD1-CD1 4.13Å; L75-L132 HydrophobicContact CB-CD1 4.37Å; L75-L132 HydrophobicContact CD1-CD1 4.33Å |
| 76 | A | 95.9 | Very high | 89.9 | Confident | 55 Ų | 55 | 61.1 Ų | 61.1 | 46% | 0.455 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.1 | -44.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | I72 A73 I79 Y80 | I72-A76 VanDerWaalsContact O-CB 3.31Å; I72-A76 WeakPolarHBondContact O-CB 3.05Å; I72-A76 PolarHBondContact O-N 3.01Å; A73-A76 PolarHBondContact O-N 3.35Å; A76-I79 PolarHBondContact O-N 3.31Å; A76-Y80 WeakPolarHBondContact O-CB 3.28Å; A76-Y80 PolarHBondContact O-N 2.86Å |
| 77 | V | 94 | Very high | 88.2 | Confident | 35 Ų | 35 | 61.6 Ų | 61.6 | 21% | 0.212 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.3 | -43.3 | 175.5 | 173 | 0 | 0 | 0 | 0 | 110.5 | A73 E74 Y80 Y81 L102 F120 M121 | A73-V77 WeakPolarHBondContact O-CG2 3.07Å; A73-V77 PolarHBondContact O-N 3.02Å; E74-V77 PolarHBondContact O-N 2.97Å; V77-Y80 WeakPolarHBondContact O-CB 3.09Å; V77-Y80 PolarHBondContact O-N 3.12Å; V77-Y81 HydrophobicContact CG1-CD2 3.95Å; V77-Y81 HydrophobicContact CG1-CE2 4.08Å; V77-Y81 WeakPolarHBondContact O-CD2 3.32Å; V77-Y81 PolarHBondContact O-N 2.9Å; V77-L102 HydrophobicContact CG1-CD1 4.07Å; V77-F120 HydrophobicContact CB-CB 4.3Å; V77-F120 HydrophobicContact CG1-CB 4.16Å; V77-F120 WeakPolarHBondContact CG1-O 3.39Å; V77-F120 HydrophobicContact CG2-CB 4.19Å; V77-M121 HydrophobicContact CG1-SD 4.07Å |
| 78 | F | 92.2 | Very high | 86.2 | Confident | 22 Ų | 22 | 70 Ų | 70 | 10% | 0.096 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61 | -46.7 | 176.9 | -178.5 | -96.7 | 0 | 0 | 0 | 112.6 | E74 L75 Y80 Y81 A82 L93 H122 V125 I128 | E74-F78 WeakPolarHBondContact O-CB 3.3Å; E74-F78 PolarHBondContact O-N 3.36Å; L75-F78 PolarHBondContact O-N 3.46Å; F78-Y80 VanDerWaalsContact C-N 3.32Å; F78-Y80 PolarHBondContact O-N 3.34Å; F78-Y81 PolarHBondContact O-N 3.34Å; F78-A82 VanDerWaalsContact O-CB 3.31Å; F78-A82 WeakPolarHBondContact O-CB 3.35Å; F78-A82 PolarHBondContact O-N 3.48Å; F78-L93 HydrophobicContact CD2-CD1 3.59Å; F78-L93 HydrophobicContact CE2-CD1 3.27Å; F78-L93 HydrophobicContact CE2-CG 4.11Å; F78-L93 HydrophobicContact CZ-CD1 4.03Å; F78-H122 HydrophobicContact CD2-CB 3.83Å; F78-H122 HydrophobicContact CE2-CB 4.23Å; F78-V125 HydrophobicContact CE1-CG2 4.15Å; F78-V125 HydrophobicContact CZ-CB 4.47Å; F78-V125 HydrophobicContact CZ-CG2 3.85Å; F78-I128 HydrophobicContact CB-CD1 3.39Å; F78-I128 HydrophobicContact CD1-CD1 4.14Å; F78-I128 HydrophobicContact CD1-CG2 4.01Å; F78-I128 HydrophobicContact CD2-CB 4.29Å; F78-I128 HydrophobicContact CD2-CD1 4.2Å; F78-I128 HydrophobicContact CD2-CG2 4.02Å; F78-I128 HydrophobicContact CE1-CG2 3.9Å; F78-I128 HydrophobicContact CE2-CB 4.47Å; F78-I128 HydrophobicContact CE2-CG2 3.87Å; F78-I128 HydrophobicContact CG-CB 4.45Å; F78-I128 HydrophobicContact CG-CD1 3.65Å; F78-I128 HydrophobicContact CG-CG2 4.06Å; F78-I128 HydrophobicContact CZ-CG2 3.83Å |
| 79 | I | 90.8 | Very high | 84.3 | Confident | 80 Ų | 80 | 72.2 Ų | 72.2 | 41% | 0.41 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 176.7 | -70.4 | 168.2 | 0 | 0 | 0 | 110.5 | L75 A76 Y81 A82 L83 | L75-I79 HydrophobicContact CD1-CD1 4.13Å; L75-I79 HydrophobicContact CD1-CG1 4.31Å; L75-I79 HydrophobicContact CG-CD1 3.89Å; L75-I79 HydrophobicContact CG-CG1 4.48Å; L75-I79 WeakPolarHBondContact O-CB 3.39Å; L75-I79 VanDerWaalsContact O-CG1 3.27Å; L75-I79 WeakPolarHBondContact O-CG1 2.93Å; L75-I79 PolarHBondContact O-N 2.87Å; A76-I79 PolarHBondContact O-N 3.31Å; I79-Y81 PolarHBondContact O-N 3.46Å; I79-A82 PolarHBondContact O-N 3.29Å; I79-L83 HydrophobicContact CG2-CD1 3.59Å; I79-L83 HydrophobicContact CG2-CG 4.13Å; I79-L83 WeakPolarHBondContact O-CB 3.43Å; I79-L83 WeakPolarHBondContact O-CG 3.23Å; I79-L83 PolarHBondContact O-N 3.11Å |
| 80 | Y | 89.9 | Confident | 82.3 | Confident | 124 Ų | 124 | 79.3 Ų | 79.3 | 49% | 0.486 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -56.7 | -50.1 | 176.4 | 171.7 | -97.8 | 0 | 0 | 0 | 111.7 | A76 V77 F78 A82 L83 W84 | A76-Y80 WeakPolarHBondContact O-CB 3.28Å; A76-Y80 PolarHBondContact O-N 2.86Å; V77-Y80 WeakPolarHBondContact O-CB 3.09Å; V77-Y80 PolarHBondContact O-N 3.12Å; F78-Y80 VanDerWaalsContact C-N 3.32Å; F78-Y80 PolarHBondContact O-N 3.34Å; Y80-A82 VanDerWaalsContact C-N 3.34Å; Y80-A82 PolarHBondContact O-N 3.46Å; Y80-L83 PolarHBondContact O-N 2.96Å; Y80-W84 HydrophobicContact CE2-CG 4.35Å; Y80-W84 WeakPolarHBondContact O-CB 3.34Å; Y80-W84 PolarHBondContact O-N 2.98Å; Y80-W84 VanDerWaalsContact O-N 3.08Å |
| 81 | Y | 86.3 | Confident | 80.4 | Confident | 25 Ų | 25 | 82.7 Ų | 82.7 | 10% | 0.098 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -68.2 | -32 | 178.3 | -85.5 | -91.7 | 0 | 0 | 0 | 113.1 | V77 F78 I79 K85 I97 S100 M121 | V77-Y81 HydrophobicContact CG1-CD2 3.95Å; V77-Y81 HydrophobicContact CG1-CE2 4.08Å; V77-Y81 WeakPolarHBondContact O-CD2 3.32Å; V77-Y81 PolarHBondContact O-N 2.9Å; F78-Y81 PolarHBondContact O-N 3.34Å; I79-Y81 PolarHBondContact O-N 3.46Å; Y81-K85 HydrophobicContact CD1-CG 4.19Å; Y81-K85 PolarHBondContact O-N 3.45Å; Y81-I97 HydrophobicContact CD1-CG2 4.31Å; Y81-S100 WeakPolarHBondContact OH-CB 3.32Å; Y81-S100 PolarHBondContact OH-OG 2.83Å; Y81-M121 HydrophobicContact CD1-CE 4.08Å; Y81-M121 HydrophobicContact CD2-CE 4.11Å; Y81-M121 HydrophobicContact CD2-SD 4.22Å; Y81-M121 HydrophobicContact CE1-CE 3.92Å; Y81-M121 HydrophobicContact CE2-CE 3.97Å; Y81-M121 HydrophobicContact CE2-SD 3.81Å; Y81-M121 HydrophobicContact CG-CE 4.2Å |
| 82 | A | 83.2 | Confident | 78.6 | Confident | 16 Ų | 16 | 85.2 Ų | 85.2 | 13% | 0.132 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -70 | -37.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F78 I79 Y80 H87 L93 | F78-A82 VanDerWaalsContact O-CB 3.31Å; F78-A82 WeakPolarHBondContact O-CB 3.35Å; F78-A82 PolarHBondContact O-N 3.48Å; I79-A82 PolarHBondContact O-N 3.29Å; Y80-A82 VanDerWaalsContact C-N 3.34Å; Y80-A82 PolarHBondContact O-N 3.46Å; A82-H87 PolarHBondContact O-ND1 2.95Å; A82-L93 HydrophobicContact CB-CD2 4.05Å |
| 83 | L | 81.7 | Confident | 76.8 | Confident | 124 Ų | 124 | 81 Ų | 81 | 65% | 0.649 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -85.1 | -34.7 | -176.7 | -66.7 | 178 | 0 | 0 | 0 | 113.6 | I79 Y80 | I79-L83 HydrophobicContact CG2-CD1 3.59Å; I79-L83 HydrophobicContact CG2-CG 4.13Å; I79-L83 WeakPolarHBondContact O-CB 3.43Å; I79-L83 WeakPolarHBondContact O-CG 3.23Å; I79-L83 PolarHBondContact O-N 3.11Å; Y80-L83 PolarHBondContact O-N 2.96Å |
| 84 | W | 72 | Confident | 75.2 | Confident | 197 Ų | 197 | 81.4 Ų | 81.4 | 75% | 0.746 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -102.3 | -9.8 | -169.2 | -87 | 81.3 | 0 | 0 | 0 | 115.5 | Y80 | Y80-W84 HydrophobicContact CE2-CG 4.35Å; Y80-W84 WeakPolarHBondContact O-CB 3.34Å; Y80-W84 PolarHBondContact O-N 2.98Å; Y80-W84 VanDerWaalsContact O-N 3.08Å |
| 85 | K | 67.1 | Low | 73.5 | Confident | 101 Ų | 101 | 86.6 Ų | 86.6 | 44% | 0.439 | 42% | 0.421 | S | S | . | . | S | Bend | trans | -112.1 | 141.9 | 177.1 | -64.4 | -61.8 | -174.8 | -173.6 | 0 | 111 | Y81 H87 | Y81-K85 HydrophobicContact CD1-CG 4.19Å; Y81-K85 PolarHBondContact O-N 3.45Å; K85-H87 PolarHBondContact O-N 3.42Å; K85-H87 PolarHBondContact O-ND1 2.92Å |
| 86 | P | 60.7 | Low | 72.2 | Confident | 102 Ų | 102 | 84.2 Ų | 84.2 | 66% | 0.662 | 41% | 0.414 | S | S | * | . | trans | -57.3 | 133.9 | 173.9 | 24.7 | -32.3 | 0 | 0 | 0 | 108.8 | D94 | P86-D94 VanDerWaalsContact O-CB 3.26Å; P86-D94 WeakPolarHBondContact O-CB 3.08Å | ||
| 87 | H | 60.4 | Low | 71.4 | Confident | 61 Ų | 61 | 81.8 Ų | 81.8 | 28% | 0.282 | 39% | 0.393 | S | S | . | . | trans | -126.7 | 132.1 | 179.1 | 47.4 | -90 | 0 | 0 | 0 | 109.3 | A82 K85 W90 | A82-H87 PolarHBondContact O-ND1 2.95Å; K85-H87 PolarHBondContact O-N 3.42Å; K85-H87 PolarHBondContact O-ND1 2.92Å; H87-W90 AromaticContact NE2-CE2 3.66Å; H87-W90 AromaticContact NE2-CH2 3.78Å; H87-W90 AromaticContact NE2-CZ2 3.56Å | ||
| 88 | K | 54.4 | Low | 70.9 | Confident | 178 Ų | 178 | 83.9 Ų | 83.9 | 77% | 0.774 | 40% | 0.397 | S | S | * | . | S | Bend | trans | -73.3 | -29.3 | 176.2 | -69.3 | -178.1 | -180 | 173.5 | 0 | 112.3 | ||
| 89 | Q | 57.3 | Low | 70.6 | Confident | 117 Ų | 117 | 89.9 Ų | 89.9 | 55% | 0.547 | 42% | 0.423 | S | S | . | . | B | Isolated β-bridge | trans | -157.4 | 139.7 | -179.2 | -166.3 | 170.5 | -39.7 | 0 | 0 | 110.3 | V91 T92 | Q89-V91 HydrophobicContact CG-CB 4.35Å; Q89-V91 HydrophobicContact CG-CG2 4.31Å; Q89-V91 PolarHBondContact O-N 3.38Å; Q89-T92 PolarHBondContact O-N 3Å |
| 90 | W | 56.3 | Low | 70.6 | Confident | 186 Ų | 186 | 86.2 Ų | 86.2 | 71% | 0.705 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -16.9 | -179.9 | -65.9 | 93.7 | 0 | 0 | 0 | 114.5 | H87 V125 | H87-W90 AromaticContact NE2-CE2 3.66Å; H87-W90 AromaticContact NE2-CH2 3.78Å; H87-W90 AromaticContact NE2-CZ2 3.56Å; W90-V125 WeakPolarHBondContact O-CG2 3.49Å |
| 91 | V | 58.1 | Low | 70.8 | Confident | 88 Ų | 88 | 83.7 Ų | 83.7 | 53% | 0.533 | 40% | 0.404 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | -28.9 | -174.7 | -176.1 | 0 | 0 | 0 | 0 | 112.2 | Q89 G124 | Q89-V91 HydrophobicContact CG-CB 4.35Å; Q89-V91 HydrophobicContact CG-CG2 4.31Å; Q89-V91 PolarHBondContact O-N 3.38Å; V91-G124 VanDerWaalsContact O-CA 3.31Å; V91-G124 WeakPolarHBondContact O-CA 3.4Å |
| 92 | T | 59.8 | Low | 71.2 | Confident | 62 Ų | 62 | 84.9 Ų | 84.9 | 38% | 0.38 | 41% | 0.411 | S | S | . | . | B | Isolated β-bridge | trans | -136.7 | 118.2 | -177.6 | 47.8 | 0 | 0 | 0 | 0 | 110.1 | Q89 A123 | Q89-T92 PolarHBondContact O-N 3Å; T92-A123 WeakPolarHBondContact CA-O 3.27Å |
| 93 | L | 60.7 | Low | 71.8 | Confident | 20 Ų | 20 | 84.1 Ų | 84.1 | 11% | 0.105 | 41% | 0.405 | C | S | . | . | trans | -69.9 | 137.9 | 178.1 | -71.8 | 171 | 0 | 0 | 0 | 110.4 | F78 A82 I97 H122 A123 | F78-L93 HydrophobicContact CD2-CD1 3.59Å; F78-L93 HydrophobicContact CE2-CD1 3.27Å; F78-L93 HydrophobicContact CE2-CG 4.11Å; F78-L93 HydrophobicContact CZ-CD1 4.03Å; A82-L93 HydrophobicContact CB-CD2 4.05Å; L93-I97 HydrophobicContact CB-CD1 4.14Å; L93-I97 HydrophobicContact CB-CG2 3.55Å; L93-I97 HydrophobicContact CD1-CG2 4.01Å; L93-I97 HydrophobicContact CG-CG2 4.39Å; L93-H122 WeakPolarHBondContact CD1-O 3.25Å; L93-A123 PolarHBondContact N-O 2.78Å | ||
| 94 | D | 64.8 | Low | 72.4 | Confident | 43 Ų | 43 | 78.2 Ų | 78.2 | 23% | 0.23 | 37% | 0.374 | C | S | . | . | trans | -74 | -176.1 | -170.2 | -163.5 | 13.3 | 0 | 0 | 0 | 114 | P86 G96 I97 | P86-D94 VanDerWaalsContact O-CB 3.26Å; P86-D94 WeakPolarHBondContact O-CB 3.08Å; D94-G96 PolarHBondContact O-N 3.21Å; D94-I97 WeakPolarHBondContact O-CG1 2.8Å; D94-I97 PolarHBondContact O-N 3.19Å; D94-I97 VanDerWaalsContact O-N 3.1Å | ||
| 95 | E | 61.9 | Low | 73.5 | Confident | 109 Ų | 109 | 70.6 Ų | 70.6 | 51% | 0.509 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -38.2 | -30.1 | 177.4 | -80 | -165.7 | -157.8 | 0 | 0 | 116 | I97 W98 K99 | E95-I97 VanDerWaalsContact C-N 3.27Å; E95-I97 PolarHBondContact O-N 3.22Å; E95-W98 PolarHBondContact O-N 2.95Å; E95-W98 VanDerWaalsContact O-N 3.11Å; E95-K99 PolarHBondContact O-N 3.09Å; E95-K99 IonicContact OE2-NZ 2.77Å; E95-K99 PolarHBondContact OE2-NZ 3.14Å |
| 96 | G | 68.6 | Low | 74.6 | Confident | 23 Ų | 23 | 66.2 Ų | 66.2 | 24% | 0.237 | 33% | 0.33 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.5 | -31.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | D94 S100 | D94-G96 PolarHBondContact O-N 3.21Å; G96-S100 PolarHBondContact O-N 3.32Å |
| 97 | I | 80.1 | Confident | 76.1 | Confident | 4 Ų | 4 | 64.5 Ų | 64.5 | 2% | 0.021 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.1 | -35.1 | 176.9 | 68.8 | 177.3 | 0 | 0 | 0 | 111.4 | Y81 L93 D94 E95 K99 S100 T103 M121 A123 | Y81-I97 HydrophobicContact CD1-CG2 4.31Å; L93-I97 HydrophobicContact CB-CD1 4.14Å; L93-I97 HydrophobicContact CB-CG2 3.55Å; L93-I97 HydrophobicContact CD1-CG2 4.01Å; L93-I97 HydrophobicContact CG-CG2 4.39Å; D94-I97 WeakPolarHBondContact O-CG1 2.8Å; D94-I97 PolarHBondContact O-N 3.19Å; D94-I97 VanDerWaalsContact O-N 3.1Å; E95-I97 VanDerWaalsContact C-N 3.27Å; E95-I97 PolarHBondContact O-N 3.22Å; I97-K99 VanDerWaalsContact C-N 3.3Å; I97-K99 PolarHBondContact O-N 3.43Å; I97-S100 VanDerWaalsContact O-CB 3.27Å; I97-S100 WeakPolarHBondContact O-CB 3.16Å; I97-S100 PolarHBondContact O-N 3.33Å; I97-T103 PolarHBondContact O-OG1 3.37Å; I97-M121 HydrophobicContact CB-CE 3.84Å; I97-M121 HydrophobicContact CG2-CE 4.09Å; I97-A123 HydrophobicContact CD1-CB 4.22Å |
| 98 | W | 82.6 | Confident | 77.7 | Confident | 80 Ų | 80 | 64.9 Ų | 64.9 | 30% | 0.303 | 33% | 0.325 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.9 | -26.6 | -174.7 | -57.6 | 108.4 | 0 | 0 | 0 | 111.7 | E95 V174 V176 V235 | E95-W98 PolarHBondContact O-N 2.95Å; E95-W98 VanDerWaalsContact O-N 3.11Å; W98-V174 HydrophobicContact CE3-CB 4.2Å; W98-V174 HydrophobicContact CE3-CG1 3.61Å; W98-V174 HydrophobicContact CZ3-CB 4.22Å; W98-V174 HydrophobicContact CZ3-CG1 3.9Å; W98-V176 HydrophobicContact CH2-CG2 4.16Å; W98-V176 HydrophobicContact CZ3-CG1 4.31Å; W98-V176 HydrophobicContact CZ3-CG2 4.23Å; W98-V235 HydrophobicContact CH2-CG1 3.4Å; W98-V235 VanDerWaalsContact CH2-CG1 3.4Å; W98-V235 HydrophobicContact CZ2-CB 4.38Å; W98-V235 HydrophobicContact CZ2-CG1 3.59Å; W98-V235 HydrophobicContact CZ2-CG2 3.86Å |
| 99 | K | 85.2 | Confident | 79.4 | Confident | 148 Ų | 148 | 57.5 Ų | 57.5 | 64% | 0.643 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94 | 1 | 176.7 | -61.4 | 176.5 | -170.3 | 162.9 | 0 | 113.6 | E95 I97 | E95-K99 PolarHBondContact O-N 3.09Å; E95-K99 IonicContact OE2-NZ 2.77Å; E95-K99 PolarHBondContact OE2-NZ 3.14Å; I97-K99 VanDerWaalsContact C-N 3.3Å; I97-K99 PolarHBondContact O-N 3.43Å |
| 100 | S | 91.1 | Very high | 81 | Confident | 2 Ų | 2 | 58.7 Ų | 58.7 | 1% | 0.014 | 30% | 0.298 | C | S | . | . | trans | -59.9 | 145 | -178.9 | 168.7 | 0 | 0 | 0 | 0 | 112.3 | Y81 G96 I97 L102 T103 R114 M121 | Y81-S100 WeakPolarHBondContact OH-CB 3.32Å; Y81-S100 PolarHBondContact OH-OG 2.83Å; G96-S100 PolarHBondContact O-N 3.32Å; I97-S100 VanDerWaalsContact O-CB 3.27Å; I97-S100 WeakPolarHBondContact O-CB 3.16Å; I97-S100 PolarHBondContact O-N 3.33Å; S100-L102 PolarHBondContact O-N 2.99Å; S100-L102 PolarHBondContact OG-N 2.94Å; S100-T103 PolarHBondContact O-N 3.47Å; S100-R114 PolarHBondContact O-NH1 2.91Å; S100-M121 VanDerWaalsContact CB-CE 3.47Å; S100-M121 PolarHBondContact OG-SD 3.28Å; S100-M121 VanDerWaalsContact OG-SD 3.33Å | ||
| 101 | P | 93.6 | Very high | 82.8 | Confident | 72 Ų | 72 | 51.9 Ų | 51.9 | 47% | 0.468 | 27% | 0.274 | S | S | . | . | S | Bend | trans | -65 | -16.6 | 170.8 | 28 | -35 | 0 | 0 | 0 | 113.9 | W113 R114 | P101-W113 PolarHBondContact O-NE1 3.39Å; P101-W113 VanDerWaalsContact O-NE1 3.1Å; P101-R114 PolarHBondContact O-NH1 2.79Å |
| 102 | L | 95.6 | Very high | 84.6 | Confident | 49 Ų | 49 | 51 Ų | 51 | 26% | 0.257 | 28% | 0.275 | S | S | . | . | S | Bend | trans | -89.4 | -25.3 | -179.3 | -56.5 | 178.6 | 0 | 0 | 0 | 112.8 | V77 S100 S117 Y118 F120 M121 | V77-L102 HydrophobicContact CG1-CD1 4.07Å; S100-L102 PolarHBondContact O-N 2.99Å; S100-L102 PolarHBondContact OG-N 2.94Å; L102-S117 WeakPolarHBondContact CA-OG 3.25Å; L102-S117 CarbonylContact O-C 3.12Å; L102-S117 PolarHBondContact O-OG 2.77Å; L102-Y118 WeakPolarHBondContact O-CA 3.47Å; L102-Y118 PolarHBondContact O-N 2.93Å; L102-F120 HydrophobicContact CD1-CB 4.41Å; L102-M121 HydrophobicContact CB-CG 3.61Å; L102-M121 HydrophobicContact CB-SD 3.79Å; L102-M121 HydrophobicContact CD1-SD 3.95Å; L102-M121 HydrophobicContact CG-SD 4.37Å |
| 103 | T | 95.2 | Very high | 86.4 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -65.8 | 140.2 | -178.7 | -67.6 | 0 | 0 | 0 | 0 | 111.1 | I97 S100 D105 R114 V174 V176 | I97-T103 PolarHBondContact O-OG1 3.37Å; S100-T103 PolarHBondContact O-N 3.47Å; T103-D105 PolarHBondContact O-N 2.8Å; T103-R114 WeakPolarHBondContact O-CD 3.46Å; T103-R114 PolarHBondContact O-NH1 3.34Å; T103-V174 HydrophobicContact CG2-CG1 3.32Å; T103-V176 HydrophobicContact CG2-CG1 3.71Å |
| 104 | Y | 95.5 | Very high | 88.1 | Confident | 1 Ų | 1 | 54 Ų | 54 | 0% | 0.004 | 28% | 0.279 | C | S | . | . | B | Isolated β-bridge | trans | -74.5 | 114.5 | 170.7 | 173.7 | -95.5 | 0 | 0 | 0 | 109.7 | P106 R109 R114 F115 S167 V174 L175 | Y104-P106 HydrophobicContact CE1-CG 4.05Å; Y104-R109 HydrophobicContact CE2-CG 4.49Å; Y104-R109 PolarHBondContact OH-NE 3.4Å; Y104-R114 HydrophobicContact CD2-CB 4.47Å; Y104-F115 HydrophobicContact CD2-CD1 4.19Å; Y104-F115 HydrophobicContact CD2-CE1 4.3Å; Y104-F115 HydrophobicContact CD2-CG 4.35Å; Y104-F115 AromaticContact CE2-CD1 3.77Å; Y104-F115 HydrophobicContact CE2-CD1 3.77Å; Y104-F115 HydrophobicContact CE2-CD2 4.33Å; Y104-F115 AromaticContact CE2-CE1 3.44Å; Y104-F115 HydrophobicContact CE2-CE1 3.44Å; Y104-F115 VanDerWaalsContact CE2-CE1 3.44Å; Y104-F115 HydrophobicContact CE2-CE2 4.06Å; Y104-F115 HydrophobicContact CE2-CG 4.21Å; Y104-F115 AromaticContact CE2-CZ 3.62Å; Y104-F115 HydrophobicContact CE2-CZ 3.62Å; Y104-S167 WeakPolarHBondContact OH-CB 3.5Å; Y104-V174 WeakPolarHBondContact O-CA 3.46Å; Y104-V174 WeakPolarHBondContact O-CG1 3.47Å; Y104-L175 HydrophobicContact CD1-CB 4.04Å; Y104-L175 HydrophobicContact CD1-CD1 3.52Å; Y104-L175 HydrophobicContact CD1-CG 3.57Å; Y104-L175 HydrophobicContact CE1-CD1 4.06Å; Y104-L175 HydrophobicContact CE1-CG 4.31Å; Y104-L175 HydrophobicContact CG-CB 4.3Å; Y104-L175 HydrophobicContact CG-CD1 3.93Å; Y104-L175 HydrophobicContact CG-CG 4.22Å; Y104-L175 PolarHBondContact N-O 3.07Å; Y104-L175 PolarHBondContact O-N 2.96Å |
| 105 | D | 93.6 | Very high | 89.7 | Confident | 36 Ų | 36 | 52.7 Ų | 52.7 | 19% | 0.193 | 27% | 0.271 | C | S | . | . | trans | -115.4 | 118.3 | 179.3 | -176.3 | -13.2 | 0 | 0 | 0 | 109 | T103 A107 K108 | T103-D105 PolarHBondContact O-N 2.8Å; D105-A107 PolarHBondContact O-N 3.3Å; D105-A107 VanDerWaalsContact O-N 3.14Å; D105-A107 WeakPolarHBondContact OD1-CB 3.49Å; D105-A107 PolarHBondContact OD1-N 3.33Å; D105-K108 HydrophobicContact CB-CB 4.26Å; D105-K108 HydrophobicContact CB-CD 4.46Å; D105-K108 HydrophobicContact CB-CG 4.37Å; D105-K108 CarbonylContact O-C 3.59Å; D105-K108 PolarHBondContact O-N 3.46Å | ||
| 106 | P | 92.1 | Very high | 91.4 | Very high | 9 Ų | 9 | 50.8 Ų | 50.8 | 6% | 0.058 | 26% | 0.264 | C | S | . | . | G | 310 helix | trans | -53.9 | -29.1 | 176.9 | -29.2 | 36.5 | 0 | 0 | 0 | 115 | Y104 K108 R109 P171 T173 A294 | Y104-P106 HydrophobicContact CE1-CG 4.05Å; P106-K108 PolarHBondContact O-N 3.23Å; P106-R109 WeakPolarHBondContact O-CD 3.47Å; P106-R109 WeakPolarHBondContact O-CG 3.41Å; P106-R109 PolarHBondContact O-NE 3.23Å; P106-P171 VanDerWaalsContact CB-O 3.24Å; P106-P171 WeakPolarHBondContact CB-O 3.46Å; P106-P171 WeakPolarHBondContact CG-O 3.35Å; P106-T173 WeakPolarHBondContact CG-O 3.4Å; P106-A294 HydrophobicContact CB-CB 4.02Å |
| 107 | A | 91.9 | Very high | 92.8 | Very high | 66 Ų | 66 | 50.3 Ų | 50.3 | 55% | 0.545 | 26% | 0.257 | S | S | . | . | G | 310 helix | trans | -78.9 | -5.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | D105 | D105-A107 PolarHBondContact O-N 3.3Å; D105-A107 VanDerWaalsContact O-N 3.14Å; D105-A107 WeakPolarHBondContact OD1-CB 3.49Å; D105-A107 PolarHBondContact OD1-N 3.33Å |
| 108 | K | 93 | Very high | 93.6 | Very high | 70 Ų | 70 | 50.2 Ų | 50.2 | 30% | 0.304 | 26% | 0.256 | S | S | . | . | G | 310 helix | trans | -128.5 | 35.7 | -176.3 | -58.5 | -176.8 | -177.8 | -179.4 | 0 | 112.9 | D105 P106 Q110 E111 | D105-K108 HydrophobicContact CB-CB 4.26Å; D105-K108 HydrophobicContact CB-CD 4.46Å; D105-K108 HydrophobicContact CB-CG 4.37Å; D105-K108 CarbonylContact O-C 3.59Å; D105-K108 PolarHBondContact O-N 3.46Å; P106-K108 PolarHBondContact O-N 3.23Å; K108-Q110 PolarHBondContact O-N 3.01Å; K108-E111 HydrophobicContact CB-CG 4.31Å; K108-E111 VanDerWaalsContact O-CB 3.29Å; K108-E111 WeakPolarHBondContact O-CB 3.32Å; K108-E111 PolarHBondContact O-N 3.17Å |
| 109 | R | 90.5 | Very high | 94.3 | Very high | 22 Ų | 22 | 47 Ų | 47 | 8% | 0.083 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62 | -23 | -177.9 | -71.9 | 167.9 | -176.5 | -139.1 | 8.6 | 113.9 | Y104 P106 E111 F115 S167 P171 N288 S292 | Y104-R109 HydrophobicContact CE2-CG 4.49Å; Y104-R109 PolarHBondContact OH-NE 3.4Å; P106-R109 WeakPolarHBondContact O-CD 3.47Å; P106-R109 WeakPolarHBondContact O-CG 3.41Å; P106-R109 PolarHBondContact O-NE 3.23Å; R109-E111 PolarHBondContact O-N 3.16Å; R109-F115 HydrophobicContact CB-CE2 4.34Å; R109-F115 HydrophobicContact CB-CZ 4.28Å; R109-F115 HydrophobicContact CG-CZ 4.11Å; R109-S167 PolarHBondContact NH1-O 3.33Å; R109-S167 PolarHBondContact NH2-O 3.41Å; R109-P171 PolarHBondContact NH2-O 2.81Å; R109-N288 WeakPolarHBondContact CD-OD1 3.42Å; R109-N288 PolarHBondContact NH1-OD1 3.35Å; R109-S292 PolarHBondContact NH1-OG 3.3Å |
| 110 | Q | 90.6 | Very high | 94.9 | Very high | 143 Ų | 143 | 42.1 Ų | 42.1 | 67% | 0.668 | 22% | 0.224 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62 | -24.3 | 170.9 | 67.9 | -77.8 | 6.6 | 0 | 0 | 113 | K108 A112 | K108-Q110 PolarHBondContact O-N 3.01Å; Q110-A112 VanDerWaalsContact C-N 3.27Å; Q110-A112 PolarHBondContact O-N 2.83Å |
| 111 | E | 94.9 | Very high | 95.1 | Very high | 43 Ų | 43 | 42.2 Ų | 42.2 | 20% | 0.201 | 22% | 0.224 | C | C | . | . | S | Bend | trans | -82.4 | 72 | 175.6 | -62.5 | -174.4 | -159.3 | 0 | 0 | 109.6 | K108 R109 W113 R114 | K108-E111 HydrophobicContact CB-CG 4.31Å; K108-E111 VanDerWaalsContact O-CB 3.29Å; K108-E111 WeakPolarHBondContact O-CB 3.32Å; K108-E111 PolarHBondContact O-N 3.17Å; R109-E111 PolarHBondContact O-N 3.16Å; E111-W113 HydrophobicContact CB-CD2 4.11Å; E111-W113 HydrophobicContact CB-CE3 4.05Å; E111-W113 HydrophobicContact CB-CH2 3.42Å; E111-W113 VanDerWaalsContact CB-CH2 3.42Å; E111-W113 HydrophobicContact CB-CZ2 3.46Å; E111-W113 VanDerWaalsContact CB-CZ2 3.46Å; E111-W113 HydrophobicContact CB-CZ3 3.71Å; E111-W113 HydrophobicContact CG-CH2 3.38Å; E111-W113 HydrophobicContact CG-CZ2 3.64Å; E111-W113 HydrophobicContact CG-CZ3 4.03Å; E111-W113 PolarHBondContact O-N 3.29Å; E111-W113 WeakPolarHBondContact OE2-CZ2 3.45Å; E111-R114 HydrophobicContact CB-CG 4.02Å; E111-R114 VanDerWaalsContact O-CB 3.24Å; E111-R114 WeakPolarHBondContact O-CB 3.37Å; E111-R114 WeakPolarHBondContact O-CG 3.28Å; E111-R114 PolarHBondContact O-N 3.46Å; E111-R114 IonicContact OE2-CZ 3.37Å; E111-R114 IonicContact OE2-NE 2.72Å; E111-R114 PolarHBondContact OE2-NE 3.47Å; E111-R114 IonicContact OE2-NH2 3.4Å; E111-R114 PolarHBondContact OE2-NH2 3.48Å |
| 112 | A | 94.9 | Very high | 95 | Very high | 68 Ų | 68 | 38.9 Ų | 38.9 | 56% | 0.562 | 20% | 0.202 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53.2 | -27.6 | -167.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | Q110 R114 F115 | Q110-A112 VanDerWaalsContact C-N 3.27Å; Q110-A112 PolarHBondContact O-N 2.83Å; A112-R114 PolarHBondContact O-N 2.98Å; A112-F115 PolarHBondContact O-N 2.84Å |
| 113 | W | 97.3 | Very high | 94.6 | Very high | 136 Ų | 136 | 36.8 Ų | 36.8 | 52% | 0.515 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.7 | -26.6 | 176.2 | 64.3 | 87.7 | 0 | 0 | 0 | 112.9 | P101 E111 F115 L116 S117 | P101-W113 PolarHBondContact O-NE1 3.39Å; P101-W113 VanDerWaalsContact O-NE1 3.1Å; E111-W113 HydrophobicContact CB-CD2 4.11Å; E111-W113 HydrophobicContact CB-CE3 4.05Å; E111-W113 HydrophobicContact CB-CH2 3.42Å; E111-W113 VanDerWaalsContact CB-CH2 3.42Å; E111-W113 HydrophobicContact CB-CZ2 3.46Å; E111-W113 VanDerWaalsContact CB-CZ2 3.46Å; E111-W113 HydrophobicContact CB-CZ3 3.71Å; E111-W113 HydrophobicContact CG-CH2 3.38Å; E111-W113 HydrophobicContact CG-CZ2 3.64Å; E111-W113 HydrophobicContact CG-CZ3 4.03Å; E111-W113 PolarHBondContact O-N 3.29Å; E111-W113 WeakPolarHBondContact OE2-CZ2 3.45Å; W113-F115 PolarHBondContact O-N 3.48Å; W113-L116 PolarHBondContact O-N 2.82Å; W113-S117 PolarHBondContact O-N 3.05Å; W113-S117 PolarHBondContact O-OG 3.46Å; W113-S117 VanDerWaalsContact O-OG 3.14Å |
| 114 | R | 97.3 | Very high | 94.2 | Very high | 9 Ų | 9 | 37 Ų | 37 | 3% | 0.034 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.3 | -24.5 | 179.3 | -70 | -173.9 | -178.7 | -89.2 | -2.4 | 113.7 | S100 P101 T103 Y104 E111 A112 L116 S117 | S100-R114 PolarHBondContact O-NH1 2.91Å; P101-R114 PolarHBondContact O-NH1 2.79Å; T103-R114 WeakPolarHBondContact O-CD 3.46Å; T103-R114 PolarHBondContact O-NH1 3.34Å; Y104-R114 HydrophobicContact CD2-CB 4.47Å; E111-R114 HydrophobicContact CB-CG 4.02Å; E111-R114 VanDerWaalsContact O-CB 3.24Å; E111-R114 WeakPolarHBondContact O-CB 3.37Å; E111-R114 WeakPolarHBondContact O-CG 3.28Å; E111-R114 PolarHBondContact O-N 3.46Å; E111-R114 IonicContact OE2-CZ 3.37Å; E111-R114 IonicContact OE2-NE 2.72Å; E111-R114 PolarHBondContact OE2-NE 3.47Å; E111-R114 IonicContact OE2-NH2 3.4Å; E111-R114 PolarHBondContact OE2-NH2 3.48Å; A112-R114 PolarHBondContact O-N 2.98Å; R114-L116 PolarHBondContact O-N 3.47Å; R114-S117 WeakPolarHBondContact CA-OG 3.25Å |
| 115 | F | 97.4 | Very high | 93.9 | Very high | 16 Ų | 16 | 40.6 Ų | 40.6 | 7% | 0.07 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -69.8 | -15.3 | 173.8 | -72.2 | -91.6 | 0 | 0 | 0 | 113.2 | Y104 R109 A112 W113 Y118 L160 S163 L164 | Y104-F115 HydrophobicContact CD2-CD1 4.19Å; Y104-F115 HydrophobicContact CD2-CE1 4.3Å; Y104-F115 HydrophobicContact CD2-CG 4.35Å; Y104-F115 AromaticContact CE2-CD1 3.77Å; Y104-F115 HydrophobicContact CE2-CD1 3.77Å; Y104-F115 HydrophobicContact CE2-CD2 4.33Å; Y104-F115 AromaticContact CE2-CE1 3.44Å; Y104-F115 HydrophobicContact CE2-CE1 3.44Å; Y104-F115 VanDerWaalsContact CE2-CE1 3.44Å; Y104-F115 HydrophobicContact CE2-CE2 4.06Å; Y104-F115 HydrophobicContact CE2-CG 4.21Å; Y104-F115 AromaticContact CE2-CZ 3.62Å; Y104-F115 HydrophobicContact CE2-CZ 3.62Å; R109-F115 HydrophobicContact CB-CE2 4.34Å; R109-F115 HydrophobicContact CB-CZ 4.28Å; R109-F115 HydrophobicContact CG-CZ 4.11Å; A112-F115 PolarHBondContact O-N 2.84Å; W113-F115 PolarHBondContact O-N 3.48Å; F115-Y118 WeakPolarHBondContact O-CD1 3.28Å; F115-Y118 WeakPolarHBondContact O-CE1 3.23Å; F115-L160 HydrophobicContact CB-CD1 4.08Å; F115-S163 WeakPolarHBondContact O-CB 3.27Å; F115-S163 PolarHBondContact O-OG 3.33Å; F115-L164 HydrophobicContact CD1-CD2 3.72Å; F115-L164 HydrophobicContact CD1-CG 4.09Å; F115-L164 HydrophobicContact CE1-CD2 3.66Å; F115-L164 HydrophobicContact CE1-CG 4.43Å; F115-L164 HydrophobicContact CZ-CD2 4.46Å |
| 116 | L | 98.1 | Very high | 93.5 | Very high | 70 Ų | 70 | 41.6 Ų | 41.6 | 37% | 0.366 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -113.4 | -46.1 | 175.3 | -71.5 | 173.4 | 0 | 0 | 0 | 112.2 | W113 R114 Y118 M119 V159 L160 | W113-L116 PolarHBondContact O-N 2.82Å; R114-L116 PolarHBondContact O-N 3.47Å; L116-Y118 PolarHBondContact O-N 3.1Å; L116-M119 VanDerWaalsContact O-CG 3.25Å; L116-M119 WeakPolarHBondContact O-CG 3.49Å; L116-M119 PolarHBondContact O-N 3.43Å; L116-V159 HydrophobicContact CD2-CG1 4.11Å; L116-L160 HydrophobicContact CD2-CB 3.95Å; L116-L160 HydrophobicContact CD2-CD1 4.31Å; L116-L160 HydrophobicContact CG-CD1 4.47Å |
| 117 | S | 98.1 | Very high | 93.4 | Very high | 12 Ų | 12 | 42.7 Ų | 42.7 | 8% | 0.084 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.6 | -17.6 | -170.7 | 59.9 | 0 | 0 | 0 | 0 | 114.4 | L102 W113 R114 M119 F120 | L102-S117 WeakPolarHBondContact CA-OG 3.25Å; L102-S117 CarbonylContact O-C 3.12Å; L102-S117 PolarHBondContact O-OG 2.77Å; W113-S117 PolarHBondContact O-N 3.05Å; W113-S117 PolarHBondContact O-OG 3.46Å; W113-S117 VanDerWaalsContact O-OG 3.14Å; R114-S117 WeakPolarHBondContact CA-OG 3.25Å; S117-M119 PolarHBondContact O-N 3.5Å; S117-M119 VanDerWaalsContact O-N 3.11Å; S117-F120 WeakPolarHBondContact O-CD2 3.48Å; S117-F120 PolarHBondContact O-N 3.3Å; S117-F120 VanDerWaalsContact O-N 3.13Å |
| 118 | Y | 97.4 | Very high | 93.5 | Very high | 3 Ų | 3 | 39.8 Ų | 39.8 | 1% | 0.012 | 21% | 0.214 | C | C | . | . | G | 310 helix | trans | -60.7 | -22.5 | 179.4 | 84.2 | -86 | 0 | 0 | 0 | 112.6 | L102 F115 L116 F120 M121 V159 L175 G177 | L102-Y118 WeakPolarHBondContact O-CA 3.47Å; L102-Y118 PolarHBondContact O-N 2.93Å; F115-Y118 WeakPolarHBondContact O-CD1 3.28Å; F115-Y118 WeakPolarHBondContact O-CE1 3.23Å; L116-Y118 PolarHBondContact O-N 3.1Å; Y118-F120 PolarHBondContact O-N 3.04Å; Y118-M121 PolarHBondContact O-N 3.42Å; Y118-M121 VanDerWaalsContact O-N 3.12Å; Y118-V159 HydrophobicContact CD1-CG1 4.18Å; Y118-V159 HydrophobicContact CE1-CG1 3.41Å; Y118-V159 VanDerWaalsContact CE1-CG1 3.41Å; Y118-V159 WeakPolarHBondContact CE1-O 3.39Å; Y118-V159 PolarHBondContact OH-O 3.48Å; Y118-L175 WeakPolarHBondContact CB-O 3.45Å; Y118-L175 HydrophobicContact CD2-CB 3.81Å; Y118-L175 HydrophobicContact CE2-CB 4.23Å; Y118-L175 HydrophobicContact CG-CB 4.28Å; Y118-G177 WeakPolarHBondContact CD2-O 3.47Å; Y118-G177 WeakPolarHBondContact CE2-O 3.41Å; Y118-G177 PolarHBondContact O-N 3.14Å |
| 119 | M | 97.9 | Very high | 93.5 | Very high | 13 Ų | 13 | 43 Ų | 43 | 6% | 0.064 | 23% | 0.228 | C | C | . | . | G | 310 helix | trans | -59.3 | -27.8 | 176.5 | 72 | -172 | 173.5 | 0 | 0 | 113.4 | I70 L116 S117 H122 Y155 L156 V159 A178 | I70-M119 HydrophobicContact CD1-CE 3.89Å; I70-M119 HydrophobicContact CD1-SD 4.45Å; L116-M119 VanDerWaalsContact O-CG 3.25Å; L116-M119 WeakPolarHBondContact O-CG 3.49Å; L116-M119 PolarHBondContact O-N 3.43Å; S117-M119 PolarHBondContact O-N 3.5Å; S117-M119 VanDerWaalsContact O-N 3.11Å; M119-H122 PolarHBondContact O-CE1 2.79Å; M119-Y155 HydrophobicContact SD-CE1 4.01Å; M119-L156 HydrophobicContact CE-CD2 4.01Å; M119-L156 HydrophobicContact SD-CD2 4.17Å; M119-V159 HydrophobicContact CB-CG1 3.99Å; M119-V159 HydrophobicContact CB-CG2 4.12Å; M119-V159 HydrophobicContact CG-CG1 4.42Å; M119-V159 HydrophobicContact SD-CB 4.41Å; M119-V159 HydrophobicContact SD-CG1 3.97Å; M119-V159 HydrophobicContact SD-CG2 3.87Å; M119-A178 PolarHBondContact O-N 2.93Å |
| 120 | F | 97.4 | Very high | 93.6 | Very high | 45 Ų | 45 | 43.5 Ų | 43.5 | 20% | 0.197 | 24% | 0.24 | C | C | . | . | G | 310 helix | trans | -81.9 | -19.3 | 179.7 | -61.8 | -67 | 0 | 0 | 0 | 113.5 | I70 A73 E74 V77 L102 S117 Y118 H122 | I70-F120 HydrophobicContact CD1-CE1 3.52Å; I70-F120 HydrophobicContact CD1-CZ 3.77Å; I70-F120 HydrophobicContact CG1-CE1 4.47Å; A73-F120 HydrophobicContact CB-CD1 4.23Å; A73-F120 HydrophobicContact CB-CE1 3.75Å; E74-F120 HydrophobicContact CG-CD1 4.11Å; V77-F120 HydrophobicContact CB-CB 4.3Å; V77-F120 HydrophobicContact CG1-CB 4.16Å; V77-F120 WeakPolarHBondContact CG1-O 3.39Å; V77-F120 HydrophobicContact CG2-CB 4.19Å; L102-F120 HydrophobicContact CD1-CB 4.41Å; S117-F120 WeakPolarHBondContact O-CD2 3.48Å; S117-F120 PolarHBondContact O-N 3.3Å; S117-F120 VanDerWaalsContact O-N 3.13Å; Y118-F120 PolarHBondContact O-N 3.04Å; F120-H122 PolarHBondContact O-ND1 3.34Å |
| 121 | M | 94.4 | Very high | 93.9 | Very high | 3 Ų | 3 | 37.2 Ų | 37.2 | 2% | 0.015 | 21% | 0.211 | C | C | . | . | trans | -88.3 | 137.1 | -177.4 | -63.4 | -59.7 | -58.9 | 0 | 0 | 109.9 | V77 Y81 I97 S100 L102 Y118 V176 G177 | V77-M121 HydrophobicContact CG1-SD 4.07Å; Y81-M121 HydrophobicContact CD1-CE 4.08Å; Y81-M121 HydrophobicContact CD2-CE 4.11Å; Y81-M121 HydrophobicContact CD2-SD 4.22Å; Y81-M121 HydrophobicContact CE1-CE 3.92Å; Y81-M121 HydrophobicContact CE2-CE 3.97Å; Y81-M121 HydrophobicContact CE2-SD 3.81Å; Y81-M121 HydrophobicContact CG-CE 4.2Å; I97-M121 HydrophobicContact CB-CE 3.84Å; I97-M121 HydrophobicContact CG2-CE 4.09Å; S100-M121 VanDerWaalsContact CB-CE 3.47Å; S100-M121 PolarHBondContact OG-SD 3.28Å; S100-M121 VanDerWaalsContact OG-SD 3.33Å; L102-M121 HydrophobicContact CB-CG 3.61Å; L102-M121 HydrophobicContact CB-SD 3.79Å; L102-M121 HydrophobicContact CD1-SD 3.95Å; L102-M121 HydrophobicContact CG-SD 4.37Å; Y118-M121 PolarHBondContact O-N 3.42Å; Y118-M121 VanDerWaalsContact O-N 3.12Å; M121-V176 HydrophobicContact CB-CB 3.8Å; M121-V176 HydrophobicContact CB-CG1 3.66Å; M121-V176 CarbonylContact O-C 3.44Å; M121-V176 WeakPolarHBondContact O-CB 3.49Å; M121-G177 WeakPolarHBondContact O-CA 3.37Å; M121-G177 PolarHBondContact O-N 3.07Å | ||
| 122 | H | 92.3 | Very high | 94 | Very high | 3 Ų | 3 | 36.4 Ų | 36.4 | 1% | 0.014 | 21% | 0.208 | C | C | . | . | trans | -135.4 | 145.5 | 177.5 | -68.1 | 82.3 | 0 | 0 | 0 | 110.8 | F78 L93 M119 F120 I128 A178 | F78-H122 HydrophobicContact CD2-CB 3.83Å; F78-H122 HydrophobicContact CE2-CB 4.23Å; L93-H122 WeakPolarHBondContact CD1-O 3.25Å; M119-H122 PolarHBondContact O-CE1 2.79Å; F120-H122 PolarHBondContact O-ND1 3.34Å; H122-I128 HydrophobicContact CB-CB 3.91Å; H122-A178 PolarHBondContact NE2-N 3.05Å | ||
| 123 | A | 87.1 | Confident | 94.1 | Very high | 5 Ų | 5 | 36 Ų | 36 | 4% | 0.041 | 20% | 0.198 | C | C | . | . | S | Bend | trans | -80.9 | -13.4 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | T92 L93 I97 H127 V176 V235 | T92-A123 WeakPolarHBondContact CA-O 3.27Å; L93-A123 PolarHBondContact N-O 2.78Å; I97-A123 HydrophobicContact CD1-CB 4.22Å; A123-H127 PolarHBondContact N-ND1 2.97Å; A123-V176 HydrophobicContact CB-CG2 4.09Å; A123-V235 HydrophobicContact CB-CB 4.25Å; A123-V235 HydrophobicContact CB-CG1 3.94Å; A123-V235 HydrophobicContact CB-CG2 4.16Å |
| 124 | G | 87.1 | Confident | 94 | Very high | 4 Ų | 4 | 31.6 Ų | 31.6 | 4% | 0.041 | 18% | 0.184 | C | C | . | . | S | Bend | trans | 171.5 | 172.5 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V91 G126 H127 I128 | V91-G124 VanDerWaalsContact O-CA 3.31Å; V91-G124 WeakPolarHBondContact O-CA 3.4Å; G124-G126 PolarHBondContact O-N 3.4Å; G124-H127 WeakPolarHBondContact O-CB 3.28Å; G124-H127 PolarHBondContact O-N 2.83Å; G124-I128 PolarHBondContact O-N 3.09Å; G124-I128 VanDerWaalsContact O-N 3.09Å |
| 125 | V | 87.7 | Confident | 94 | Very high | 77 Ų | 77 | 31.1 Ų | 31.1 | 47% | 0.467 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -60 | -47.1 | -173.1 | 177 | 0 | 0 | 0 | 0 | 111.8 | F78 W90 H127 I128 F129 | F78-V125 HydrophobicContact CE1-CG2 4.15Å; F78-V125 HydrophobicContact CZ-CB 4.47Å; F78-V125 HydrophobicContact CZ-CG2 3.85Å; W90-V125 WeakPolarHBondContact O-CG2 3.49Å; V125-H127 PolarHBondContact O-N 3.4Å; V125-I128 VanDerWaalsContact O-CG2 3.27Å; V125-I128 WeakPolarHBondContact O-CG2 3.29Å; V125-I128 PolarHBondContact O-N 3.5Å; V125-F129 WeakPolarHBondContact O-CB 3.42Å; V125-F129 PolarHBondContact O-N 3.47Å |
| 126 | G | 86.4 | Confident | 94 | Very high | 56 Ų | 56 | 33.3 Ų | 33.3 | 58% | 0.577 | 19% | 0.194 | S | C | * | . | H | α-helix | trans | -63.1 | -29.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113 | G124 G130 | G124-G126 PolarHBondContact O-N 3.4Å; G126-G130 PolarHBondContact O-N 3.35Å; G126-G130 VanDerWaalsContact O-N 3.09Å |
| 127 | H | 89.8 | Confident | 93.8 | Very high | 32 Ų | 32 | 34.6 Ų | 34.6 | 15% | 0.148 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -72.2 | -50.1 | 178.6 | -172.1 | -165.9 | 0 | 0 | 0 | 111.4 | A123 G124 V125 N131 V176 | A123-H127 PolarHBondContact N-ND1 2.97Å; G124-H127 WeakPolarHBondContact O-CB 3.28Å; G124-H127 PolarHBondContact O-N 2.83Å; V125-H127 PolarHBondContact O-N 3.4Å; H127-N131 PolarHBondContact CD2-ND2 2.87Å; H127-N131 PolarHBondContact NE2-ND2 3.49Å; H127-N131 PolarHBondContact O-N 2.8Å; H127-N131 PolarHBondContact O-ND2 3.37Å; H127-V176 PolarHBondContact CE1-O 3.29Å |
| 128 | I | 93.5 | Very high | 93.6 | Very high | 6 Ų | 6 | 34.6 Ų | 34.6 | 3% | 0.031 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.1 | -40.8 | 176.1 | -175.5 | 164.3 | 0 | 0 | 0 | 111.7 | L75 F78 H122 G124 V125 G130 N131 L132 | L75-I128 HydrophobicContact CB-CD1 4.47Å; L75-I128 HydrophobicContact CD1-CD1 4.13Å; F78-I128 HydrophobicContact CB-CD1 3.39Å; F78-I128 HydrophobicContact CD1-CD1 4.14Å; F78-I128 HydrophobicContact CD1-CG2 4.01Å; F78-I128 HydrophobicContact CD2-CB 4.29Å; F78-I128 HydrophobicContact CD2-CD1 4.2Å; F78-I128 HydrophobicContact CD2-CG2 4.02Å; F78-I128 HydrophobicContact CE1-CG2 3.9Å; F78-I128 HydrophobicContact CE2-CB 4.47Å; F78-I128 HydrophobicContact CE2-CG2 3.87Å; F78-I128 HydrophobicContact CG-CB 4.45Å; F78-I128 HydrophobicContact CG-CD1 3.65Å; F78-I128 HydrophobicContact CG-CG2 4.06Å; F78-I128 HydrophobicContact CZ-CG2 3.83Å; H122-I128 HydrophobicContact CB-CB 3.91Å; G124-I128 PolarHBondContact O-N 3.09Å; G124-I128 VanDerWaalsContact O-N 3.09Å; V125-I128 VanDerWaalsContact O-CG2 3.27Å; V125-I128 WeakPolarHBondContact O-CG2 3.29Å; V125-I128 PolarHBondContact O-N 3.5Å; I128-G130 PolarHBondContact O-N 3Å; I128-N131 PolarHBondContact O-N 3.43Å; I128-L132 HydrophobicContact CD1-CD1 4.17Å; I128-L132 HydrophobicContact CG1-CD1 3.74Å; I128-L132 HydrophobicContact CG1-CG 3.87Å; I128-L132 WeakPolarHBondContact O-CB 3.4Å; I128-L132 WeakPolarHBondContact O-CG 3.11Å; I128-L132 PolarHBondContact O-N 2.83Å |
| 129 | F | 93.9 | Very high | 93.5 | Very high | 137 Ų | 137 | 34.4 Ų | 34.4 | 60% | 0.601 | 20% | 0.199 | S | C | * | . | H | α-helix | trans | -58 | -48.3 | 178.4 | 177.5 | -99.2 | 0 | 0 | 0 | 111.7 | V125 N131 L132 V133 | V125-F129 WeakPolarHBondContact O-CB 3.42Å; V125-F129 PolarHBondContact O-N 3.47Å; F129-N131 PolarHBondContact O-N 3.5Å; F129-L132 PolarHBondContact O-N 2.9Å; F129-V133 HydrophobicContact CD1-CG2 4.3Å; F129-V133 HydrophobicContact CD2-CG2 4.19Å; F129-V133 HydrophobicContact CE1-CG2 3.91Å; F129-V133 HydrophobicContact CE2-CG2 3.8Å; F129-V133 HydrophobicContact CG-CG2 4.43Å; F129-V133 HydrophobicContact CZ-CG2 3.65Å; F129-V133 WeakPolarHBondContact O-CB 3.31Å; F129-V133 VanDerWaalsContact O-CG2 3.3Å; F129-V133 WeakPolarHBondContact O-CG2 3.41Å; F129-V133 PolarHBondContact O-N 3.22Å |
| 130 | G | 92.6 | Very high | 93.3 | Very high | 32 Ų | 32 | 35.9 Ų | 35.9 | 33% | 0.33 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -60.1 | -43.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | G126 I128 M134 | G126-G130 PolarHBondContact O-N 3.35Å; G126-G130 VanDerWaalsContact O-N 3.09Å; I128-G130 PolarHBondContact O-N 3Å; G130-M134 PolarHBondContact O-N 3.27Å; G130-M134 VanDerWaalsContact O-N 3.15Å |
| 131 | N | 95.8 | Very high | 92.9 | Very high | 11 Ų | 11 | 35.8 Ų | 35.8 | 6% | 0.059 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.2 | -51.6 | 176.3 | -80.2 | -82.4 | 0 | 0 | 0 | 111.3 | H127 I128 F129 V133 M134 Q135 A178 S179 V182 | H127-N131 PolarHBondContact CD2-ND2 2.87Å; H127-N131 PolarHBondContact NE2-ND2 3.49Å; H127-N131 PolarHBondContact O-N 2.8Å; H127-N131 PolarHBondContact O-ND2 3.37Å; I128-N131 PolarHBondContact O-N 3.43Å; F129-N131 PolarHBondContact O-N 3.5Å; N131-V133 PolarHBondContact O-N 3.28Å; N131-M134 PolarHBondContact O-N 2.92Å; N131-Q135 WeakPolarHBondContact O-CB 3.39Å; N131-Q135 PolarHBondContact O-N 2.86Å; N131-A178 HydrophobicContact CB-CB 4.23Å; N131-S179 WeakPolarHBondContact OD1-CA 3.34Å; N131-S179 WeakPolarHBondContact OD1-CB 3.46Å; N131-S179 PolarHBondContact OD1-N 3.46Å; N131-V182 HydrophobicContact CB-CG2 4.37Å |
| 132 | L | 97.7 | Very high | 92.7 | Very high | 26 Ų | 26 | 35.8 Ų | 35.8 | 14% | 0.136 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61 | -43.6 | -178.9 | -68.9 | -179.4 | 0 | 0 | 0 | 112.2 | S71 E74 L75 I128 F129 L136 | S71-L132 WeakPolarHBondContact OG-CD2 3.27Å; E74-L132 WeakPolarHBondContact OE2-CD2 3.4Å; L75-L132 HydrophobicContact CB-CD1 4.37Å; L75-L132 HydrophobicContact CD1-CD1 4.33Å; I128-L132 HydrophobicContact CD1-CD1 4.17Å; I128-L132 HydrophobicContact CG1-CD1 3.74Å; I128-L132 HydrophobicContact CG1-CG 3.87Å; I128-L132 WeakPolarHBondContact O-CB 3.4Å; I128-L132 WeakPolarHBondContact O-CG 3.11Å; I128-L132 PolarHBondContact O-N 2.83Å; F129-L132 PolarHBondContact O-N 2.9Å; L132-L136 VanDerWaalsContact O-CB 3.3Å; L132-L136 WeakPolarHBondContact O-CB 3.18Å; L132-L136 WeakPolarHBondContact O-CD1 3.49Å; L132-L136 WeakPolarHBondContact O-CG 3.47Å; L132-L136 PolarHBondContact O-N 3.34Å |
| 133 | V | 96.6 | Very high | 92.7 | Very high | 60 Ų | 60 | 35.9 Ų | 35.9 | 36% | 0.364 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.9 | -51.7 | 178.5 | 167.7 | 0 | 0 | 0 | 0 | 110.7 | F129 N131 L137 | F129-V133 HydrophobicContact CD1-CG2 4.3Å; F129-V133 HydrophobicContact CD2-CG2 4.19Å; F129-V133 HydrophobicContact CE1-CG2 3.91Å; F129-V133 HydrophobicContact CE2-CG2 3.8Å; F129-V133 HydrophobicContact CG-CG2 4.43Å; F129-V133 HydrophobicContact CZ-CG2 3.65Å; F129-V133 WeakPolarHBondContact O-CB 3.31Å; F129-V133 VanDerWaalsContact O-CG2 3.3Å; F129-V133 WeakPolarHBondContact O-CG2 3.41Å; F129-V133 PolarHBondContact O-N 3.22Å; N131-V133 PolarHBondContact O-N 3.28Å; V133-L137 WeakPolarHBondContact O-CB 3.45Å; V133-L137 PolarHBondContact O-N 2.94Å |
| 134 | M | 95.6 | Very high | 92.7 | Very high | 43 Ų | 43 | 38.4 Ų | 38.4 | 21% | 0.212 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -71 | -36.9 | -177.9 | -66.9 | -57.2 | -179.3 | 0 | 0 | 112.3 | G130 N131 L137 L138 V182 Y186 I215 | G130-M134 PolarHBondContact O-N 3.27Å; G130-M134 VanDerWaalsContact O-N 3.15Å; N131-M134 PolarHBondContact O-N 2.92Å; M134-L137 PolarHBondContact O-N 3.49Å; M134-L137 HydrophobicContact SD-CD2 4.16Å; M134-L138 WeakPolarHBondContact O-CB 3.48Å; M134-L138 VanDerWaalsContact O-CG 3.31Å; M134-L138 WeakPolarHBondContact O-CG 3.34Å; M134-L138 PolarHBondContact O-N 2.9Å; M134-V182 HydrophobicContact CB-CG1 3.65Å; M134-Y186 VanDerWaalsContact CG-OH 3.27Å; M134-Y186 WeakPolarHBondContact CG-OH 3.04Å; M134-Y186 PolarHBondContact SD-OH 2.95Å; M134-I215 HydrophobicContact CE-CG2 4.1Å; M134-I215 HydrophobicContact SD-CG2 4.32Å |
| 135 | Q | 97.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.7 | -48.1 | 175.5 | -176.9 | 160.6 | -65.9 | 0 | 0 | 111.9 | I67 S71 E74 N131 G139 Y155 V182 L185 | I67-Q135 HydrophobicContact CD1-CG 4.44Å; I67-Q135 HydrophobicContact CG2-CG 4.22Å; S71-Q135 PolarHBondContact OG-NE2 2.89Å; E74-Q135 PolarHBondContact OE1-NE2 3.2Å; E74-Q135 PolarHBondContact OE1-OE1 2.98Å; E74-Q135 PolarHBondContact OE2-NE2 3.23Å; E74-Q135 VanDerWaalsContact OE2-NE2 3.11Å; N131-Q135 WeakPolarHBondContact O-CB 3.39Å; N131-Q135 PolarHBondContact O-N 2.86Å; Q135-G139 WeakPolarHBondContact O-CA 3.41Å; Q135-G139 PolarHBondContact O-N 3.48Å; Q135-Y155 HydrophobicContact CG-CE2 4.27Å; Q135-Y155 VanDerWaalsContact OE1-CZ 3.28Å; Q135-Y155 PolarHBondContact OE1-OH 2.83Å; Q135-V182 HydrophobicContact CB-CG2 4.11Å; Q135-L185 HydrophobicContact CG-CD1 4.28Å |
| 136 | L | 96.9 | Very high | 92.4 | Very high | 61 Ų | 61 | 36.5 Ų | 36.5 | 32% | 0.319 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -69.4 | -43.3 | 177.9 | -66.1 | 167.9 | 0 | 0 | 0 | 111 | I67 L132 L138 I140 | I67-L136 HydrophobicContact CG2-CD2 4.13Å; L132-L136 VanDerWaalsContact O-CB 3.3Å; L132-L136 WeakPolarHBondContact O-CB 3.18Å; L132-L136 WeakPolarHBondContact O-CD1 3.49Å; L132-L136 WeakPolarHBondContact O-CG 3.47Å; L132-L136 PolarHBondContact O-N 3.34Å; L136-L138 PolarHBondContact O-N 3.29Å; L136-I140 HydrophobicContact CB-CD1 4.13Å; L136-I140 HydrophobicContact CD2-CD1 3.87Å; L136-I140 HydrophobicContact CD2-CG1 4.44Å; L136-I140 WeakPolarHBondContact O-CB 3.46Å; L136-I140 WeakPolarHBondContact O-CG1 3.13Å; L136-I140 PolarHBondContact O-N 3.37Å |
| 137 | L | 94.4 | Very high | 92.4 | Very high | 98 Ų | 98 | 36 Ų | 36 | 51% | 0.513 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -61.6 | -41.7 | -178.4 | -178.8 | 65 | 0 | 0 | 0 | 112.7 | V133 M134 P141 | V133-L137 WeakPolarHBondContact O-CB 3.45Å; V133-L137 PolarHBondContact O-N 2.94Å; M134-L137 PolarHBondContact O-N 3.49Å; M134-L137 HydrophobicContact SD-CD2 4.16Å; L137-P141 WeakPolarHBondContact O-CD 3.42Å; L137-P141 WeakPolarHBondContact O-CG 3.39Å |
| 138 | L | 94.3 | Very high | 92.4 | Very high | 11 Ų | 11 | 35.1 Ų | 35.1 | 6% | 0.058 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -92.9 | -40.1 | -177.9 | -59.1 | 173.4 | 0 | 0 | 0 | 112.4 | M134 L136 L142 L185 Y186 Y189 | M134-L138 WeakPolarHBondContact O-CB 3.48Å; M134-L138 VanDerWaalsContact O-CG 3.31Å; M134-L138 WeakPolarHBondContact O-CG 3.34Å; M134-L138 PolarHBondContact O-N 2.9Å; L136-L138 PolarHBondContact O-N 3.29Å; L138-L142 WeakPolarHBondContact O-CG 3.34Å; L138-L142 PolarHBondContact O-N 3.48Å; L138-L185 HydrophobicContact CB-CB 4.12Å; L138-L185 HydrophobicContact CD1-CB 4.38Å; L138-Y186 HydrophobicContact CD1-CD1 3.38Å; L138-Y186 HydrophobicContact CD1-CD2 4.2Å; L138-Y186 HydrophobicContact CD1-CE1 3.44Å; L138-Y186 VanDerWaalsContact CD1-CE1 3.44Å; L138-Y186 HydrophobicContact CD1-CE2 4.23Å; L138-Y186 HydrophobicContact CD1-CG 3.78Å; L138-Y189 HydrophobicContact CB-CD2 4.44Å; L138-Y189 HydrophobicContact CD2-CD2 4.15Å; L138-Y189 HydrophobicContact CD2-CG 4.35Å |
| 139 | G | 94.5 | Very high | 92.3 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -71.5 | -44.7 | -173 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q135 L142 E143 | Q135-G139 WeakPolarHBondContact O-CA 3.41Å; Q135-G139 PolarHBondContact O-N 3.48Å; G139-L142 PolarHBondContact O-N 3.23Å; G139-E143 WeakPolarHBondContact O-CB 3.46Å; G139-E143 PolarHBondContact O-N 3.27Å |
| 140 | I | 93.6 | Very high | 92.2 | Very high | 44 Ų | 44 | 34.5 Ų | 34.5 | 23% | 0.226 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.8 | -50.3 | -178.5 | -69.6 | 170 | 0 | 0 | 0 | 111.4 | P64 I67 I68 L136 L142 E143 M144 | P64-I140 HydrophobicContact CB-CG2 4.35Å; P64-I140 HydrophobicContact CG-CG2 4.06Å; I67-I140 HydrophobicContact CG2-CG1 4.03Å; I68-I140 HydrophobicContact CG1-CD1 4.41Å; L136-I140 HydrophobicContact CB-CD1 4.13Å; L136-I140 HydrophobicContact CD2-CD1 3.87Å; L136-I140 HydrophobicContact CD2-CG1 4.44Å; L136-I140 WeakPolarHBondContact O-CB 3.46Å; L136-I140 WeakPolarHBondContact O-CG1 3.13Å; L136-I140 PolarHBondContact O-N 3.37Å; I140-L142 VanDerWaalsContact C-N 3.32Å; I140-L142 PolarHBondContact O-N 3.39Å; I140-E143 PolarHBondContact O-N 3.27Å; I140-M144 HydrophobicContact CG2-CE 3.99Å; I140-M144 HydrophobicContact CG2-CG 4.44Å; I140-M144 HydrophobicContact CG2-SD 4.28Å; I140-M144 WeakPolarHBondContact O-CG 3.22Å; I140-M144 PolarHBondContact O-N 3.32Å |
| 141 | P | 89.9 | Confident | 92.3 | Very high | 43 Ų | 43 | 33 Ų | 33 | 28% | 0.279 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -61 | -38.3 | 176.5 | -24.6 | 35.1 | 0 | 0 | 0 | 113.6 | L137 V145 Y189 | L137-P141 WeakPolarHBondContact O-CD 3.42Å; L137-P141 WeakPolarHBondContact O-CG 3.39Å; P141-V145 WeakPolarHBondContact O-CG2 3.33Å; P141-V145 PolarHBondContact O-N 3.47Å; P141-Y189 HydrophobicContact CB-CE2 4.26Å |
| 142 | L | 89.9 | Confident | 92.4 | Very high | 3 Ų | 3 | 32.7 Ų | 32.7 | 2% | 0.016 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.4 | -42.4 | 175.3 | -78.2 | 171.5 | 0 | 0 | 0 | 111.3 | L138 G139 I140 V145 H146 V151 L185 Y189 N192 F257 | L138-L142 WeakPolarHBondContact O-CG 3.34Å; L138-L142 PolarHBondContact O-N 3.48Å; G139-L142 PolarHBondContact O-N 3.23Å; I140-L142 VanDerWaalsContact C-N 3.32Å; I140-L142 PolarHBondContact O-N 3.39Å; L142-V145 PolarHBondContact O-N 3.03Å; L142-H146 WeakPolarHBondContact O-CB 3.38Å; L142-H146 PolarHBondContact O-N 3.43Å; L142-V151 HydrophobicContact CB-CG1 4.45Å; L142-V151 HydrophobicContact CB-CG2 3.83Å; L142-L185 HydrophobicContact CD1-CD2 4.11Å; L142-Y189 HydrophobicContact CD1-CD2 3.96Å; L142-Y189 HydrophobicContact CD2-CD2 4.14Å; L142-Y189 HydrophobicContact CG-CD2 3.74Å; L142-Y189 HydrophobicContact CG-CE2 4.41Å; L142-N192 HydrophobicContact CD2-CB 4.32Å; L142-F257 HydrophobicContact CD1-CE2 4.25Å; L142-F257 HydrophobicContact CD1-CZ 4.44Å; L142-F257 HydrophobicContact CD2-CD2 4.26Å; L142-F257 HydrophobicContact CD2-CE2 3.93Å; L142-F257 HydrophobicContact CD2-CZ 4.21Å |
| 143 | E | 92.4 | Very high | 92.3 | Very high | 4 Ų | 4 | 35.6 Ų | 35.6 | 2% | 0.019 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -70.6 | -35.5 | -176.6 | -177.4 | 167.2 | -177.8 | 0 | 0 | 112.1 | P64 I65 F66 I67 G139 I140 V145 K147 G148 V151 | P64-E143 VanDerWaalsContact C-OE1 3.31Å; P64-E143 WeakPolarHBondContact CA-OE1 3.13Å; P64-E143 HydrophobicContact CB-CB 4.06Å; P64-E143 HydrophobicContact CB-CG 3.86Å; I65-E143 PolarHBondContact N-OE1 2.91Å; F66-E143 WeakPolarHBondContact CB-OE1 3.49Å; F66-E143 PolarHBondContact N-OE1 2.81Å; F66-E143 PolarHBondContact N-OE2 3.41Å; I67-E143 WeakPolarHBondContact CB-OE2 3.3Å; I67-E143 HydrophobicContact CG1-CB 4.43Å; I67-E143 VanDerWaalsContact CG1-OE2 3.29Å; I67-E143 WeakPolarHBondContact CG1-OE2 3.27Å; I67-E143 PolarHBondContact N-OE2 3.41Å; G139-E143 WeakPolarHBondContact O-CB 3.46Å; G139-E143 PolarHBondContact O-N 3.27Å; I140-E143 PolarHBondContact O-N 3.27Å; E143-V145 VanDerWaalsContact C-N 3.26Å; E143-V145 PolarHBondContact O-N 3.07Å; E143-K147 WeakPolarHBondContact O-CA 3.4Å; E143-K147 PolarHBondContact O-N 2.91Å; E143-G148 WeakPolarHBondContact OE1-CA 3.39Å; E143-V151 HydrophobicContact CB-CB 4.42Å; E143-V151 HydrophobicContact CB-CG2 4.13Å |
| 144 | M | 86.1 | Confident | 92.4 | Very high | 58 Ų | 58 | 32.7 Ų | 32.7 | 29% | 0.286 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -61.9 | -36.5 | 173.7 | -70.7 | -171.5 | -61.5 | 0 | 0 | 112 | P64 I140 | P64-M144 HydrophobicContact CG-CG 4.49Å; I140-M144 HydrophobicContact CG2-CE 3.99Å; I140-M144 HydrophobicContact CG2-CG 4.44Å; I140-M144 HydrophobicContact CG2-SD 4.28Å; I140-M144 WeakPolarHBondContact O-CG 3.22Å; I140-M144 PolarHBondContact O-N 3.32Å |
| 145 | V | 83.8 | Confident | 92.5 | Very high | 38 Ų | 38 | 30.7 Ų | 30.7 | 23% | 0.23 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -84.9 | -43.9 | -178.1 | 178.6 | 0 | 0 | 0 | 0 | 112.2 | P141 L142 E143 | P141-V145 WeakPolarHBondContact O-CG2 3.33Å; P141-V145 PolarHBondContact O-N 3.47Å; L142-V145 PolarHBondContact O-N 3.03Å; E143-V145 VanDerWaalsContact C-N 3.26Å; E143-V145 PolarHBondContact O-N 3.07Å |
| 146 | H | 84.9 | Confident | 92.6 | Very high | 4 Ų | 4 | 33.7 Ų | 33.7 | 2% | 0.019 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -110.5 | 3.8 | -169.5 | -59.8 | -72 | 0 | 0 | 0 | 113.7 | L142 E150 V151 N192 F257 | L142-H146 WeakPolarHBondContact O-CB 3.38Å; L142-H146 PolarHBondContact O-N 3.43Å; H146-E150 HydrophobicContact CB-CB 4.35Å; H146-E150 VanDerWaalsContact O-CB 3.28Å; H146-E150 WeakPolarHBondContact O-CB 3.35Å; H146-E150 VanDerWaalsContact O-CD 3.3Å; H146-E150 WeakPolarHBondContact O-CG 3.39Å; H146-V151 HydrophobicContact CB-CG2 4.3Å; H146-N192 PolarHBondContact CE1-OD1 2.96Å; H146-N192 PolarHBondContact NE2-OD1 2.88Å; H146-F257 HydrophobicContact CB-CD1 3.62Å; H146-F257 HydrophobicContact CB-CE1 3.59Å; H146-F257 AromaticContact CD2-CD1 3.39Å; H146-F257 WeakPolarHBondContact CD2-CD1 3.44Å; H146-F257 AromaticContact CD2-CE1 3.79Å; H146-F257 AromaticContact CD2-CG 3.83Å; H146-F257 AromaticContact CE1-CD1 3.85Å; H146-F257 AromaticContact CE1-CG 3.99Å; H146-F257 PolarHBondContact CE1-O 2.66Å; H146-F257 AromaticContact CG-CD1 3.26Å; H146-F257 AromaticContact CG-CE1 3.7Å; H146-F257 AromaticContact ND1-CD1 3.59Å; H146-F257 AromaticContact NE2-CD1 3.75Å; H146-F257 AromaticContact NE2-CG 3.77Å |
| 147 | K | 87.9 | Confident | 92.6 | Very high | 46 Ų | 46 | 31.3 Ų | 31.3 | 20% | 0.2 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | 68.3 | 155.5 | 177.8 | -39.9 | -65.3 | 165.2 | -165 | 0 | 113 | N59 R61 P62 E143 H149 E150 V151 | N59-K147 PolarHBondContact OD1-NZ 2.95Å; R61-K147 PolarHBondContact O-NZ 3.41Å; P62-K147 VanDerWaalsContact CD-CD 3.46Å; P62-K147 HydrophobicContact CG-CD 4.17Å; E143-K147 WeakPolarHBondContact O-CA 3.4Å; E143-K147 PolarHBondContact O-N 2.91Å; K147-H149 PolarHBondContact O-N 2.95Å; K147-E150 PolarHBondContact O-N 3.28Å; K147-V151 PolarHBondContact O-N 2.92Å |
| 148 | G | 89.1 | Confident | 92.8 | Very high | 13 Ų | 13 | 26.7 Ų | 26.7 | 13% | 0.134 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62 | -36.1 | -169.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | E143 G152 | E143-G148 WeakPolarHBondContact OE1-CA 3.39Å; G148-G152 WeakPolarHBondContact O-CA 3.23Å; G148-G152 PolarHBondContact O-N 3.49Å |
| 149 | H | 90.5 | Very high | 93 | Very high | 120 Ų | 120 | 26.1 Ų | 26.1 | 56% | 0.556 | 14% | 0.14 | S | C | * | . | H | α-helix | trans | -68.9 | -36.7 | -178.2 | 63.7 | -82.9 | 0 | 0 | 0 | 112.6 | K147 L153 | K147-H149 PolarHBondContact O-N 2.95Å; H149-L153 WeakPolarHBondContact O-CB 3.34Å; H149-L153 VanDerWaalsContact O-CG 3.24Å; H149-L153 WeakPolarHBondContact O-CG 3.29Å; H149-L153 PolarHBondContact O-N 2.92Å |
| 150 | E | 92.4 | Very high | 93.2 | Very high | 10 Ų | 10 | 28.4 Ų | 28.4 | 5% | 0.047 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -71.9 | -46.7 | -179.5 | -55.7 | -162 | 128.1 | 0 | 0 | 111 | H146 K147 G152 L153 V154 F256 F257 K259 | H146-E150 HydrophobicContact CB-CB 4.35Å; H146-E150 VanDerWaalsContact O-CB 3.28Å; H146-E150 WeakPolarHBondContact O-CB 3.35Å; H146-E150 VanDerWaalsContact O-CD 3.3Å; H146-E150 WeakPolarHBondContact O-CG 3.39Å; K147-E150 PolarHBondContact O-N 3.28Å; E150-G152 VanDerWaalsContact C-N 3.29Å; E150-G152 PolarHBondContact O-N 3.5Å; E150-L153 PolarHBondContact O-N 3.29Å; E150-V154 WeakPolarHBondContact O-CG2 3.27Å; E150-V154 PolarHBondContact O-N 3.16Å; E150-V154 VanDerWaalsContact O-N 3.07Å; E150-F256 HydrophobicContact CB-CB 4.09Å; E150-F256 HydrophobicContact CB-CD1 4.17Å; E150-F256 HydrophobicContact CB-CG 4.27Å; E150-F256 HydrophobicContact CG-CD1 4.04Å; E150-F257 HydrophobicContact CB-CE1 4.35Å; E150-K259 WeakPolarHBondContact OE1-CE 3.26Å; E150-K259 IonicContact OE1-NZ 2.66Å; E150-K259 PolarHBondContact OE1-NZ 2.83Å; E150-K259 VanDerWaalsContact OE2-CE 3.28Å; E150-K259 WeakPolarHBondContact OE2-CE 3.23Å; E150-K259 IonicContact OE2-NZ 3.5Å; E150-K259 PolarHBondContact OE2-NZ 2.88Å |
| 151 | V | 95.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.6 | -39.2 | 175.1 | 180 | 0 | 0 | 0 | 0 | 110.8 | I67 L142 E143 H146 K147 V154 Y155 L185 F257 | I67-V151 HydrophobicContact CD1-CG1 3.89Å; I67-V151 HydrophobicContact CG1-CG1 4.01Å; L142-V151 HydrophobicContact CB-CG1 4.45Å; L142-V151 HydrophobicContact CB-CG2 3.83Å; E143-V151 HydrophobicContact CB-CB 4.42Å; E143-V151 HydrophobicContact CB-CG2 4.13Å; H146-V151 HydrophobicContact CB-CG2 4.3Å; K147-V151 PolarHBondContact O-N 2.92Å; V151-V154 PolarHBondContact O-N 3.2Å; V151-Y155 VanDerWaalsContact O-CB 3.31Å; V151-Y155 WeakPolarHBondContact O-CB 3.18Å; V151-Y155 PolarHBondContact O-N 3.41Å; V151-L185 HydrophobicContact CG1-CD2 3.74Å; V151-F257 HydrophobicContact CG2-CE1 4.05Å; V151-F257 HydrophobicContact CG2-CZ 4.08Å |
| 152 | G | 96.5 | Very high | 93.8 | Very high | 4 Ų | 4 | 24.4 Ų | 24.4 | 4% | 0.041 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.7 | -42.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | F66 G148 E150 Y155 L156 | F66-G152 VanDerWaalsContact CZ-CA 3.42Å; G148-G152 WeakPolarHBondContact O-CA 3.23Å; G148-G152 PolarHBondContact O-N 3.49Å; E150-G152 VanDerWaalsContact C-N 3.29Å; E150-G152 PolarHBondContact O-N 3.5Å; G152-Y155 PolarHBondContact O-N 2.82Å; G152-L156 WeakPolarHBondContact O-CB 3.33Å; G152-L156 VanDerWaalsContact O-CG 3.24Å; G152-L156 WeakPolarHBondContact O-CG 3.32Å; G152-L156 PolarHBondContact O-N 2.8Å |
| 153 | L | 96.7 | Very high | 94.2 | Very high | 87 Ų | 87 | 24.2 Ų | 24.2 | 46% | 0.455 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -64.2 | -42.4 | 175.1 | -73.1 | 171.1 | 0 | 0 | 0 | 112 | H149 E150 A157 F256 | H149-L153 WeakPolarHBondContact O-CB 3.34Å; H149-L153 VanDerWaalsContact O-CG 3.24Å; H149-L153 WeakPolarHBondContact O-CG 3.29Å; H149-L153 PolarHBondContact O-N 2.92Å; E150-L153 PolarHBondContact O-N 3.29Å; L153-A157 WeakPolarHBondContact O-CB 3.46Å; L153-A157 PolarHBondContact O-N 3.27Å; L153-F256 HydrophobicContact CB-CE2 3.99Å; L153-F256 HydrophobicContact CB-CZ 4.26Å; L153-F256 HydrophobicContact CD1-CE1 3.88Å; L153-F256 HydrophobicContact CD1-CE2 4.05Å; L153-F256 HydrophobicContact CD1-CZ 3.44Å; L153-F256 VanDerWaalsContact CD1-CZ 3.44Å; L153-F256 HydrophobicContact CG-CZ 4.48Å |
| 154 | V | 97.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62 | -46.3 | 175.2 | 173.7 | 0 | 0 | 0 | 0 | 111 | E150 V151 A157 G158 A184 I252 F256 F257 | E150-V154 WeakPolarHBondContact O-CG2 3.27Å; E150-V154 PolarHBondContact O-N 3.16Å; E150-V154 VanDerWaalsContact O-N 3.07Å; V151-V154 PolarHBondContact O-N 3.2Å; V154-A157 PolarHBondContact O-N 3.38Å; V154-G158 PolarHBondContact O-N 3.41Å; V154-A184 HydrophobicContact CG1-CB 4.25Å; V154-A184 WeakPolarHBondContact O-CB 3.21Å; V154-I252 HydrophobicContact CG2-CG2 3.95Å; V154-F256 HydrophobicContact CG2-CD2 4.21Å; V154-F257 HydrophobicContact CB-CZ 4.32Å; V154-F257 HydrophobicContact CG1-CE2 4.48Å; V154-F257 HydrophobicContact CG2-CE1 4.32Å; V154-F257 HydrophobicContact CG2-CE2 4.15Å; V154-F257 HydrophobicContact CG2-CZ 3.8Å |
| 155 | Y | 98.6 | Very high | 94.9 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.4 | -51.7 | 179.9 | -177.2 | -83.7 | 0 | 0 | 0 | 111.6 | F66 I70 E74 M119 Q135 V151 G152 A157 G158 V159 A178 G181 L185 | F66-Y155 HydrophobicContact CE1-CD1 4.25Å; F66-Y155 HydrophobicContact CE1-CG 4.1Å; F66-Y155 HydrophobicContact CZ-CD1 4.15Å; F66-Y155 HydrophobicContact CZ-CG 4.41Å; I70-Y155 HydrophobicContact CG1-CE1 4.34Å; E74-Y155 PolarHBondContact OE1-OH 3.4Å; M119-Y155 HydrophobicContact SD-CE1 4.01Å; Q135-Y155 HydrophobicContact CG-CE2 4.27Å; Q135-Y155 VanDerWaalsContact OE1-CZ 3.28Å; Q135-Y155 PolarHBondContact OE1-OH 2.83Å; V151-Y155 VanDerWaalsContact O-CB 3.31Å; V151-Y155 WeakPolarHBondContact O-CB 3.18Å; V151-Y155 PolarHBondContact O-N 3.41Å; G152-Y155 PolarHBondContact O-N 2.82Å; Y155-A157 VanDerWaalsContact C-N 3.34Å; Y155-A157 PolarHBondContact O-N 2.82Å; Y155-G158 WeakPolarHBondContact O-CA 3.15Å; Y155-G158 PolarHBondContact O-N 2.89Å; Y155-G158 VanDerWaalsContact O-N 3.09Å; Y155-V159 HydrophobicContact CD1-CG2 4.05Å; Y155-V159 HydrophobicContact CE1-CG2 3.69Å; Y155-V159 WeakPolarHBondContact O-CG2 3.28Å; Y155-V159 PolarHBondContact O-N 3.2Å; Y155-A178 VanDerWaalsContact OH-CB 3.25Å; Y155-A178 WeakPolarHBondContact OH-CB 3.39Å; Y155-G181 WeakPolarHBondContact O-CA 3.46Å; Y155-L185 HydrophobicContact CD2-CD1 3.96Å; Y155-L185 HydrophobicContact CD2-CD2 4.43Å; Y155-L185 HydrophobicContact CD2-CG 4.04Å; Y155-L185 HydrophobicContact CE2-CD1 4.34Å |
| 156 | L | 98.4 | Very high | 95.5 | Very high | 64 Ų | 64 | 20.2 Ų | 20.2 | 34% | 0.335 | 11% | 0.107 | S | C | . | . | H | α-helix | trans | -66.5 | -36 | -179.5 | -67.2 | 174 | 0 | 0 | 0 | 112 | F66 M119 G152 G158 V159 L160 | F66-L156 HydrophobicContact CZ-CG 4.46Å; M119-L156 HydrophobicContact CE-CD2 4.01Å; M119-L156 HydrophobicContact SD-CD2 4.17Å; G152-L156 WeakPolarHBondContact O-CB 3.33Å; G152-L156 VanDerWaalsContact O-CG 3.24Å; G152-L156 WeakPolarHBondContact O-CG 3.32Å; G152-L156 PolarHBondContact O-N 2.8Å; L156-G158 VanDerWaalsContact C-N 3.25Å; L156-G158 PolarHBondContact O-N 3.03Å; L156-V159 PolarHBondContact O-N 2.96Å; L156-L160 WeakPolarHBondContact O-CB 3.11Å; L156-L160 PolarHBondContact O-N 3.32Å |
| 157 | A | 98.3 | Very high | 96 | Very high | 11 Ų | 11 | 20 Ų | 20 | 9% | 0.091 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -61.7 | -36.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L153 V154 Y155 A161 I252 Y277 | L153-A157 WeakPolarHBondContact O-CB 3.46Å; L153-A157 PolarHBondContact O-N 3.27Å; V154-A157 PolarHBondContact O-N 3.38Å; Y155-A157 VanDerWaalsContact C-N 3.34Å; Y155-A157 PolarHBondContact O-N 2.82Å; A157-A161 WeakPolarHBondContact O-CB 3.35Å; A157-A161 PolarHBondContact O-N 3.42Å; A157-I252 HydrophobicContact CB-CB 4.41Å; A157-I252 HydrophobicContact CB-CG1 4Å; A157-I252 HydrophobicContact CB-CG2 4.31Å; A157-Y277 WeakPolarHBondContact CA-OH 3.31Å; A157-Y277 HydrophobicContact CB-CE1 4.37Å; A157-Y277 HydrophobicContact CB-CE2 4.27Å; A157-Y277 WeakPolarHBondContact CB-OH 3.44Å; A157-Y277 PolarHBondContact O-OH 3.3Å |
| 158 | G | 98.5 | Very high | 96.3 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63.9 | -49 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | V154 Y155 L156 L160 A161 G162 G180 | V154-G158 PolarHBondContact O-N 3.41Å; Y155-G158 WeakPolarHBondContact O-CA 3.15Å; Y155-G158 PolarHBondContact O-N 2.89Å; Y155-G158 VanDerWaalsContact O-N 3.09Å; L156-G158 VanDerWaalsContact C-N 3.25Å; L156-G158 PolarHBondContact O-N 3.03Å; G158-L160 PolarHBondContact O-N 2.81Å; G158-A161 PolarHBondContact O-N 3.09Å; G158-G162 PolarHBondContact O-N 3.02Å; G158-G180 CarbonylContact C-O 3.37Å; G158-G180 WeakPolarHBondContact CA-O 3.21Å |
| 159 | V | 98.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -57.1 | -50.4 | 175.5 | 173.7 | 0 | 0 | 0 | 0 | 110.4 | L116 Y118 M119 Y155 L156 G162 S163 | L116-V159 HydrophobicContact CD2-CG1 4.11Å; Y118-V159 HydrophobicContact CD1-CG1 4.18Å; Y118-V159 HydrophobicContact CE1-CG1 3.41Å; Y118-V159 VanDerWaalsContact CE1-CG1 3.41Å; Y118-V159 WeakPolarHBondContact CE1-O 3.39Å; Y118-V159 PolarHBondContact OH-O 3.48Å; M119-V159 HydrophobicContact CB-CG1 3.99Å; M119-V159 HydrophobicContact CB-CG2 4.12Å; M119-V159 HydrophobicContact CG-CG1 4.42Å; M119-V159 HydrophobicContact SD-CB 4.41Å; M119-V159 HydrophobicContact SD-CG1 3.97Å; M119-V159 HydrophobicContact SD-CG2 3.87Å; Y155-V159 HydrophobicContact CD1-CG2 4.05Å; Y155-V159 HydrophobicContact CE1-CG2 3.69Å; Y155-V159 WeakPolarHBondContact O-CG2 3.28Å; Y155-V159 PolarHBondContact O-N 3.2Å; L156-V159 PolarHBondContact O-N 2.96Å; V159-G162 PolarHBondContact O-N 3.47Å; V159-S163 PolarHBondContact O-N 3.34Å; V159-S163 VanDerWaalsContact O-N 3.13Å; V159-S163 PolarHBondContact O-OG 3.45Å |
| 160 | L | 98.5 | Very high | 96.6 | Very high | 47 Ų | 47 | 20.7 Ų | 20.7 | 25% | 0.246 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -64.2 | -44 | -179.8 | -174.8 | 60.2 | 0 | 0 | 0 | 112.2 | F115 L116 L156 G158 G162 S163 L164 L281 | F115-L160 HydrophobicContact CB-CD1 4.08Å; L116-L160 HydrophobicContact CD2-CB 3.95Å; L116-L160 HydrophobicContact CD2-CD1 4.31Å; L116-L160 HydrophobicContact CG-CD1 4.47Å; L156-L160 WeakPolarHBondContact O-CB 3.11Å; L156-L160 PolarHBondContact O-N 3.32Å; G158-L160 PolarHBondContact O-N 2.81Å; L160-G162 VanDerWaalsContact C-N 3.32Å; L160-G162 PolarHBondContact O-N 3.43Å; L160-S163 PolarHBondContact O-OG 2.7Å; L160-S163 VanDerWaalsContact O-OG 3.07Å; L160-L164 HydrophobicContact CD1-CD1 3.93Å; L160-L164 HydrophobicContact CD1-CG 4.27Å; L160-L164 HydrophobicContact CG-CD1 3.83Å; L160-L164 WeakPolarHBondContact O-CB 3.38Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.33Å; L160-L164 PolarHBondContact O-N 2.6Å; L160-L281 HydrophobicContact CD2-CD1 4.43Å; L160-L281 HydrophobicContact CD2-CD2 3.83Å; L160-L281 HydrophobicContact CG-CD2 4.12Å |
| 161 | A | 98.3 | Very high | 96.6 | Very high | 3 Ų | 3 | 21.7 Ų | 21.7 | 3% | 0.025 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -66.9 | -35.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | A157 G158 A165 A248 Y277 F280 | A157-A161 WeakPolarHBondContact O-CB 3.35Å; A157-A161 PolarHBondContact O-N 3.42Å; G158-A161 PolarHBondContact O-N 3.09Å; A161-A165 WeakPolarHBondContact O-CB 3.36Å; A161-A165 PolarHBondContact O-N 2.94Å; A161-A248 HydrophobicContact CB-CB 3.72Å; A161-Y277 HydrophobicContact CB-CE2 4.07Å; A161-F280 HydrophobicContact CB-CE1 3.87Å; A161-F280 HydrophobicContact CB-CZ 4.48Å |
| 162 | G | 97.8 | Very high | 96.3 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.7 | -46.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | G158 V159 L160 S166 A241 | G158-G162 PolarHBondContact O-N 3.02Å; V159-G162 PolarHBondContact O-N 3.47Å; L160-G162 VanDerWaalsContact C-N 3.32Å; L160-G162 PolarHBondContact O-N 3.43Å; G162-S166 VanDerWaalsContact O-CB 3.31Å; G162-S166 WeakPolarHBondContact O-CB 3.27Å; G162-S166 PolarHBondContact O-N 3.13Å; G162-S166 PolarHBondContact O-OG 3.42Å; G162-A241 WeakPolarHBondContact CA-O 3.25Å; G162-A241 WeakPolarHBondContact O-CA 3.13Å |
| 163 | S | 97.4 | Very high | 95.9 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -69.7 | -41.2 | 177.4 | 59.8 | 0 | 0 | 0 | 0 | 112.6 | F115 V159 L160 S166 S167 | F115-S163 WeakPolarHBondContact O-CB 3.27Å; F115-S163 PolarHBondContact O-OG 3.33Å; V159-S163 PolarHBondContact O-N 3.34Å; V159-S163 VanDerWaalsContact O-N 3.13Å; V159-S163 PolarHBondContact O-OG 3.45Å; L160-S163 PolarHBondContact O-OG 2.7Å; L160-S163 VanDerWaalsContact O-OG 3.07Å; S163-S166 PolarHBondContact O-N 3.07Å; S163-S167 WeakPolarHBondContact O-CB 3.43Å; S163-S167 PolarHBondContact O-N 3.35Å |
| 164 | L | 97.3 | Very high | 95.7 | Very high | 7 Ų | 7 | 27 Ų | 27 | 4% | 0.037 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -67.2 | -40.2 | 176.6 | -73 | 172.9 | 0 | 0 | 0 | 113 | F115 L160 S167 I168 F280 L281 A284 | F115-L164 HydrophobicContact CD1-CD2 3.72Å; F115-L164 HydrophobicContact CD1-CG 4.09Å; F115-L164 HydrophobicContact CE1-CD2 3.66Å; F115-L164 HydrophobicContact CE1-CG 4.43Å; F115-L164 HydrophobicContact CZ-CD2 4.46Å; L160-L164 HydrophobicContact CD1-CD1 3.93Å; L160-L164 HydrophobicContact CD1-CG 4.27Å; L160-L164 HydrophobicContact CG-CD1 3.83Å; L160-L164 WeakPolarHBondContact O-CB 3.38Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.33Å; L160-L164 PolarHBondContact O-N 2.6Å; L164-S167 PolarHBondContact O-N 2.72Å; L164-S167 PolarHBondContact O-OG 3.4Å; L164-I168 WeakPolarHBondContact O-CD1 3.28Å; L164-I168 WeakPolarHBondContact O-CG1 3.39Å; L164-I168 PolarHBondContact O-N 3.16Å; L164-F280 HydrophobicContact CB-CE1 4.32Å; L164-F280 HydrophobicContact CB-CZ 3.92Å; L164-L281 HydrophobicContact CD1-CD2 3.38Å; L164-A284 HydrophobicContact CB-CB 3.9Å; L164-A284 HydrophobicContact CD1-CB 4.11Å; L164-A284 HydrophobicContact CD2-CB 3.94Å; L164-A284 HydrophobicContact CG-CB 4.21Å |
| 165 | A | 97.1 | Very high | 95.5 | Very high | 8 Ų | 8 | 27.3 Ų | 27.3 | 7% | 0.066 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -66.2 | -43.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | A161 S167 I168 F169 V240 F280 | A161-A165 WeakPolarHBondContact O-CB 3.36Å; A161-A165 PolarHBondContact O-N 2.94Å; A165-S167 VanDerWaalsContact C-N 3.3Å; A165-S167 PolarHBondContact O-N 3.35Å; A165-I168 PolarHBondContact O-N 3.18Å; A165-F169 HydrophobicContact CB-CD2 4.46Å; A165-F169 VanDerWaalsContact O-CD2 3.28Å; A165-F169 WeakPolarHBondContact O-CD2 2.94Å; A165-F169 PolarHBondContact O-N 3.48Å; A165-V240 VanDerWaalsContact C-CG1 3.48Å; A165-V240 HydrophobicContact CB-CG1 3.91Å; A165-V240 WeakPolarHBondContact O-CG1 3.17Å; A165-F280 HydrophobicContact CB-CZ 4.33Å |
| 166 | S | 95.5 | Very high | 95.2 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.2 | -41.1 | 175.6 | -61.4 | 0 | 0 | 0 | 0 | 111.5 | G162 S163 I168 F169 D170 S238 A241 | G162-S166 VanDerWaalsContact O-CB 3.31Å; G162-S166 WeakPolarHBondContact O-CB 3.27Å; G162-S166 PolarHBondContact O-N 3.13Å; G162-S166 PolarHBondContact O-OG 3.42Å; S163-S166 PolarHBondContact O-N 3.07Å; S166-I168 PolarHBondContact O-N 3.08Å; S166-I168 VanDerWaalsContact O-N 3.16Å; S166-F169 PolarHBondContact O-N 3.41Å; S166-D170 CarbonylContact O-C 2.95Å; S166-D170 VanDerWaalsContact O-CA 3.25Å; S166-D170 WeakPolarHBondContact O-CA 3.18Å; S166-D170 PolarHBondContact O-N 3.39Å; S166-S238 PolarHBondContact OG-OG 2.97Å; S166-A241 WeakPolarHBondContact OG-CA 3.49Å; S166-A241 WeakPolarHBondContact OG-CB 3.43Å; S166-A241 PolarHBondContact OG-N 3.33Å |
| 167 | S | 95 | Very high | 95.1 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -65.3 | -20.2 | -179.4 | 77.6 | 0 | 0 | 0 | 0 | 114.2 | Y104 R109 S163 L164 A165 P171 N288 | Y104-S167 WeakPolarHBondContact OH-CB 3.5Å; R109-S167 PolarHBondContact NH1-O 3.33Å; R109-S167 PolarHBondContact NH2-O 3.41Å; S163-S167 WeakPolarHBondContact O-CB 3.43Å; S163-S167 PolarHBondContact O-N 3.35Å; L164-S167 PolarHBondContact O-N 2.72Å; L164-S167 PolarHBondContact O-OG 3.4Å; A165-S167 VanDerWaalsContact C-N 3.3Å; A165-S167 PolarHBondContact O-N 3.35Å; S167-P171 WeakPolarHBondContact O-CB 3.39Å; S167-N288 WeakPolarHBondContact CB-OD1 3.33Å; S167-N288 PolarHBondContact OG-ND2 2.99Å; S167-N288 PolarHBondContact OG-OD1 2.84Å |
| 168 | I | 95.1 | Very high | 95 | Very high | 22 Ų | 22 | 24.5 Ų | 24.5 | 11% | 0.113 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -93 | -51.6 | 176.8 | -62.1 | 162.9 | 0 | 0 | 0 | 110.9 | L164 A165 S166 F280 F283 A284 F287 | L164-I168 WeakPolarHBondContact O-CD1 3.28Å; L164-I168 WeakPolarHBondContact O-CG1 3.39Å; L164-I168 PolarHBondContact O-N 3.16Å; A165-I168 PolarHBondContact O-N 3.18Å; S166-I168 PolarHBondContact O-N 3.08Å; S166-I168 VanDerWaalsContact O-N 3.16Å; I168-F280 HydrophobicContact CD1-CE2 4.44Å; I168-F283 HydrophobicContact CD1-CD1 4.28Å; I168-F283 HydrophobicContact CD1-CE1 4.05Å; I168-A284 HydrophobicContact CD1-CB 3.73Å; I168-F287 HydrophobicContact CB-CD1 4.4Å; I168-F287 HydrophobicContact CB-CE1 4.29Å; I168-F287 HydrophobicContact CG1-CB 4.49Å; I168-F287 HydrophobicContact CG1-CD1 3.66Å; I168-F287 HydrophobicContact CG1-CE1 4.03Å; I168-F287 HydrophobicContact CG1-CG 4.05Å; I168-F287 HydrophobicContact CG2-CE1 4.44Å; I168-F287 HydrophobicContact CG2-CE2 4.48Å; I168-F287 HydrophobicContact CG2-CZ 4.36Å |
| 169 | F | 94.4 | Very high | 94.9 | Very high | 148 Ų | 148 | 25 Ų | 25 | 65% | 0.649 | 13% | 0.133 | S | C | * | . | H | α-helix | trans | -98.9 | -13.8 | -168.8 | -57.9 | -70.1 | 0 | 0 | 0 | 114.4 | A165 S166 V240 | A165-F169 HydrophobicContact CB-CD2 4.46Å; A165-F169 VanDerWaalsContact O-CD2 3.28Å; A165-F169 WeakPolarHBondContact O-CD2 2.94Å; A165-F169 PolarHBondContact O-N 3.48Å; S166-F169 PolarHBondContact O-N 3.41Å; F169-V240 HydrophobicContact CB-CG1 3.97Å; F169-V240 HydrophobicContact CB-CG2 4.39Å; F169-V240 HydrophobicContact CD2-CG1 4.27Å |
| 170 | D | 91.4 | Very high | 94.9 | Very high | 24 Ų | 24 | 25 Ų | 25 | 13% | 0.128 | 13% | 0.133 | C | C | . | . | S | Bend | trans | -138.6 | 59.3 | 172.7 | -167 | -2.8 | 0 | 0 | 0 | 109.9 | S166 L172 T173 R227 V240 | S166-D170 CarbonylContact O-C 2.95Å; S166-D170 VanDerWaalsContact O-CA 3.25Å; S166-D170 WeakPolarHBondContact O-CA 3.18Å; S166-D170 PolarHBondContact O-N 3.39Å; D170-L172 PolarHBondContact O-N 3.27Å; D170-T173 PolarHBondContact O-N 3.45Å; D170-T173 VanDerWaalsContact O-N 3.08Å; D170-T173 WeakPolarHBondContact OD1-CB 3.28Å; D170-T173 PolarHBondContact OD1-OG1 2.81Å; D170-T173 PolarHBondContact OD2-OG1 3.08Å; D170-R227 IonicContact OD1-NH2 2.68Å; D170-R227 PolarHBondContact OD1-NH2 2.91Å; D170-R227 IonicContact OD2-CZ 2.6Å; D170-R227 IonicContact OD2-NH1 3.08Å; D170-R227 PolarHBondContact OD2-NH1 2.8Å; D170-R227 IonicContact OD2-NH2 2.7Å; D170-R227 PolarHBondContact OD2-NH2 3.45Å; D170-V240 HydrophobicContact CB-CG2 4.12Å |
| 171 | P | 91.1 | Very high | 94.9 | Very high | 30 Ų | 30 | 22.8 Ų | 22.8 | 20% | 0.195 | 12% | 0.121 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -15.5 | -158.1 | 26 | -36.3 | 0 | 0 | 0 | 114.8 | P106 R109 S167 P293 | P106-P171 VanDerWaalsContact CB-O 3.24Å; P106-P171 WeakPolarHBondContact CB-O 3.46Å; P106-P171 WeakPolarHBondContact CG-O 3.35Å; R109-P171 PolarHBondContact NH2-O 2.81Å; S167-P171 WeakPolarHBondContact O-CB 3.39Å; P171-P293 HydrophobicContact CB-CG 4.12Å; P171-P293 HydrophobicContact CG-CG 4.09Å |
| 172 | L | 89.9 | Confident | 94.9 | Very high | 131 Ų | 131 | 22.9 Ų | 22.9 | 69% | 0.686 | 12% | 0.121 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -101.3 | 0.6 | -178.3 | -57.4 | 179.8 | 0 | 0 | 0 | 112.8 | D170 A294 | D170-L172 PolarHBondContact O-N 3.27Å; L172-A294 HydrophobicContact CD2-CB 4.17Å |
| 173 | T | 88.4 | Confident | 94.9 | Very high | 22 Ų | 22 | 23 Ų | 23 | 14% | 0.135 | 12% | 0.122 | C | C | . | . | trans | -86.9 | 126.6 | -177.4 | -71.9 | 0 | 0 | 0 | 0 | 111.6 | P106 D170 L175 | P106-T173 WeakPolarHBondContact CG-O 3.4Å; D170-T173 PolarHBondContact O-N 3.45Å; D170-T173 VanDerWaalsContact O-N 3.08Å; D170-T173 WeakPolarHBondContact OD1-CB 3.28Å; D170-T173 PolarHBondContact OD1-OG1 2.81Å; D170-T173 PolarHBondContact OD2-OG1 3.08Å; T173-L175 HydrophobicContact CG2-CD2 3.97Å | ||
| 174 | V | 91.4 | Very high | 94.9 | Very high | 49 Ų | 49 | 23 Ų | 23 | 30% | 0.297 | 12% | 0.122 | S | C | . | . | trans | -75.5 | 135.6 | 169.7 | -179 | 0 | 0 | 0 | 0 | 109.2 | W98 T103 Y104 | W98-V174 HydrophobicContact CE3-CB 4.2Å; W98-V174 HydrophobicContact CE3-CG1 3.61Å; W98-V174 HydrophobicContact CZ3-CB 4.22Å; W98-V174 HydrophobicContact CZ3-CG1 3.9Å; T103-V174 HydrophobicContact CG2-CG1 3.32Å; Y104-V174 WeakPolarHBondContact O-CA 3.46Å; Y104-V174 WeakPolarHBondContact O-CG1 3.47Å | ||
| 175 | L | 93.4 | Very high | 94.9 | Very high | 7 Ų | 7 | 22.7 Ų | 22.7 | 4% | 0.037 | 12% | 0.12 | C | C | . | . | B | Isolated β-bridge | trans | -114.6 | 137.8 | -177.6 | -46.7 | 163.7 | 0 | 0 | 0 | 111.8 | Y104 Y118 T173 A241 | Y104-L175 HydrophobicContact CD1-CB 4.04Å; Y104-L175 HydrophobicContact CD1-CD1 3.52Å; Y104-L175 HydrophobicContact CD1-CG 3.57Å; Y104-L175 HydrophobicContact CE1-CD1 4.06Å; Y104-L175 HydrophobicContact CE1-CG 4.31Å; Y104-L175 HydrophobicContact CG-CB 4.3Å; Y104-L175 HydrophobicContact CG-CD1 3.93Å; Y104-L175 HydrophobicContact CG-CG 4.22Å; Y104-L175 PolarHBondContact N-O 3.07Å; Y104-L175 PolarHBondContact O-N 2.96Å; Y118-L175 WeakPolarHBondContact CB-O 3.45Å; Y118-L175 HydrophobicContact CD2-CB 3.81Å; Y118-L175 HydrophobicContact CE2-CB 4.23Å; Y118-L175 HydrophobicContact CG-CB 4.28Å; T173-L175 HydrophobicContact CG2-CD2 3.97Å; L175-A241 HydrophobicContact CD2-CB 4.5Å |
| 176 | V | 94.2 | Very high | 94.9 | Very high | 17 Ų | 17 | 22.4 Ų | 22.4 | 10% | 0.103 | 12% | 0.117 | C | C | . | . | trans | -140.7 | 142.5 | 167.1 | -62.9 | 0 | 0 | 0 | 0 | 107.4 | W98 T103 M121 A123 H127 | W98-V176 HydrophobicContact CH2-CG2 4.16Å; W98-V176 HydrophobicContact CZ3-CG1 4.31Å; W98-V176 HydrophobicContact CZ3-CG2 4.23Å; T103-V176 HydrophobicContact CG2-CG1 3.71Å; M121-V176 HydrophobicContact CB-CB 3.8Å; M121-V176 HydrophobicContact CB-CG1 3.66Å; M121-V176 CarbonylContact O-C 3.44Å; M121-V176 WeakPolarHBondContact O-CB 3.49Å; A123-V176 HydrophobicContact CB-CG2 4.09Å; H127-V176 PolarHBondContact CE1-O 3.29Å | ||
| 177 | G | 94.9 | Very high | 95 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.119 | C | C | . | . | S | Bend | trans | 123.2 | 144.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y118 M121 S179 | Y118-G177 WeakPolarHBondContact CD2-O 3.47Å; Y118-G177 WeakPolarHBondContact CE2-O 3.41Å; Y118-G177 PolarHBondContact O-N 3.14Å; M121-G177 WeakPolarHBondContact O-CA 3.37Å; M121-G177 PolarHBondContact O-N 3.07Å; G177-S179 PolarHBondContact O-N 3.23Å; G177-S179 VanDerWaalsContact O-N 3.09Å |
| 178 | A | 97.3 | Very high | 95 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.119 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -4.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | M119 H122 N131 Y155 G180 G181 V182 | M119-A178 PolarHBondContact O-N 2.93Å; H122-A178 PolarHBondContact NE2-N 3.05Å; N131-A178 HydrophobicContact CB-CB 4.23Å; Y155-A178 VanDerWaalsContact OH-CB 3.25Å; Y155-A178 WeakPolarHBondContact OH-CB 3.39Å; A178-G180 VanDerWaalsContact C-N 3.28Å; A178-G180 PolarHBondContact O-N 3.34Å; A178-G180 VanDerWaalsContact O-N 3.12Å; A178-G181 WeakPolarHBondContact O-CA 3.44Å; A178-G181 PolarHBondContact O-N 2.95Å; A178-V182 PolarHBondContact O-N 3.22Å; A178-V182 VanDerWaalsContact O-N 3.14Å |
| 179 | S | 96.5 | Very high | 94.8 | Very high | 11 Ų | 11 | 23.7 Ų | 23.7 | 8% | 0.077 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -63.2 | -28.5 | -165 | 63.2 | 0 | 0 | 0 | 0 | 114 | N131 G177 G181 V182 Y183 H242 | N131-S179 WeakPolarHBondContact OD1-CA 3.34Å; N131-S179 WeakPolarHBondContact OD1-CB 3.46Å; N131-S179 PolarHBondContact OD1-N 3.46Å; G177-S179 PolarHBondContact O-N 3.23Å; G177-S179 VanDerWaalsContact O-N 3.09Å; S179-G181 PolarHBondContact O-N 3.36Å; S179-V182 PolarHBondContact O-N 3.39Å; S179-Y183 WeakPolarHBondContact O-CB 3.42Å; S179-Y183 VanDerWaalsContact O-CD2 3.23Å; S179-Y183 WeakPolarHBondContact O-CD2 3.32Å; S179-Y183 PolarHBondContact O-N 3.2Å; S179-H242 VanDerWaalsContact CB-NE2 3.33Å; S179-H242 WeakPolarHBondContact CB-NE2 3.5Å; S179-H242 PolarHBondContact OG-CD2 2.74Å; S179-H242 PolarHBondContact OG-NE2 2.55Å |
| 180 | G | 97.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -55.6 | -41.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | G158 A178 A184 G245 | G158-G180 CarbonylContact C-O 3.37Å; G158-G180 WeakPolarHBondContact CA-O 3.21Å; A178-G180 VanDerWaalsContact C-N 3.28Å; A178-G180 PolarHBondContact O-N 3.34Å; A178-G180 VanDerWaalsContact O-N 3.12Å; G180-A184 PolarHBondContact O-N 3.3Å; G180-G245 VanDerWaalsContact O-CA 3.27Å; G180-G245 WeakPolarHBondContact O-CA 3.46Å |
| 181 | G | 98.2 | Very high | 94.9 | Very high | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -73.2 | -41.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y155 A178 S179 Y183 A184 L185 | Y155-G181 WeakPolarHBondContact O-CA 3.46Å; A178-G181 WeakPolarHBondContact O-CA 3.44Å; A178-G181 PolarHBondContact O-N 2.95Å; S179-G181 PolarHBondContact O-N 3.36Å; G181-Y183 VanDerWaalsContact C-N 3.31Å; G181-Y183 PolarHBondContact O-N 2.81Å; G181-A184 CarbonylContact O-C 3.57Å; G181-A184 WeakPolarHBondContact O-CA 3.31Å; G181-A184 WeakPolarHBondContact O-CB 3.36Å; G181-A184 PolarHBondContact O-N 3.01Å; G181-A184 VanDerWaalsContact O-N 3.08Å; G181-L185 PolarHBondContact O-N 3.01Å |
| 182 | V | 98.1 | Very high | 94.8 | Very high | 4 Ų | 4 | 18.6 Ų | 18.6 | 2% | 0.024 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.7 | -42 | 176 | -178.7 | 0 | 0 | 0 | 0 | 111.6 | N131 M134 Q135 A178 S179 A184 L185 Y186 | N131-V182 HydrophobicContact CB-CG2 4.37Å; M134-V182 HydrophobicContact CB-CG1 3.65Å; Q135-V182 HydrophobicContact CB-CG2 4.11Å; A178-V182 PolarHBondContact O-N 3.22Å; A178-V182 VanDerWaalsContact O-N 3.14Å; S179-V182 PolarHBondContact O-N 3.39Å; V182-A184 VanDerWaalsContact C-N 3.32Å; V182-A184 PolarHBondContact O-N 3.26Å; V182-L185 WeakPolarHBondContact O-CA 3.41Å; V182-L185 WeakPolarHBondContact O-CB 3.22Å; V182-L185 PolarHBondContact O-N 3.39Å; V182-L185 VanDerWaalsContact O-N 3.08Å; V182-Y186 HydrophobicContact CG1-CD2 4.3Å; V182-Y186 HydrophobicContact CG1-CE2 3.99Å; V182-Y186 WeakPolarHBondContact O-CD2 3.39Å; V182-Y186 PolarHBondContact O-N 3.42Å |
| 183 | Y | 98.1 | Very high | 94.8 | Very high | 3 Ų | 3 | 12.4 Ų | 12.4 | 1% | 0.012 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -69.4 | -28.5 | 175.4 | -83.8 | -92.6 | 0 | 0 | 0 | 113.3 | S179 G181 Y186 G187 D219 F220 H242 I246 | S179-Y183 WeakPolarHBondContact O-CB 3.42Å; S179-Y183 VanDerWaalsContact O-CD2 3.23Å; S179-Y183 WeakPolarHBondContact O-CD2 3.32Å; S179-Y183 PolarHBondContact O-N 3.2Å; G181-Y183 VanDerWaalsContact C-N 3.31Å; G181-Y183 PolarHBondContact O-N 2.81Å; Y183-Y186 HydrophobicContact CD1-CD2 4.16Å; Y183-Y186 HydrophobicContact CG-CD2 4.28Å; Y183-Y186 WeakPolarHBondContact O-CB 3.46Å; Y183-Y186 PolarHBondContact O-N 2.97Å; Y183-G187 PolarHBondContact O-N 3.42Å; Y183-D219 WeakPolarHBondContact CE2-OD2 3.35Å; Y183-D219 PolarHBondContact OH-OD2 2.94Å; Y183-F220 HydrophobicContact CE1-CB 4.15Å; Y183-F220 AromaticContact CE1-CD2 3.7Å; Y183-F220 HydrophobicContact CE1-CD2 3.7Å; Y183-F220 HydrophobicContact CE1-CG 4.41Å; Y183-F220 VanDerWaalsContact OH-CA 3.3Å; Y183-F220 WeakPolarHBondContact OH-CA 3.17Å; Y183-F220 PolarHBondContact OH-N 2.85Å; Y183-H242 WeakPolarHBondContact CB-O 3.21Å; Y183-H242 HydrophobicContact CD1-CB 3.82Å; Y183-H242 HydrophobicContact CD2-CB 3.77Å; Y183-H242 AromaticContact CD2-CD2 3.77Å; Y183-H242 AromaticContact CD2-CG 3.6Å; Y183-H242 AromaticContact CD2-ND1 4Å; Y183-H242 HydrophobicContact CE1-CB 3.8Å; Y183-H242 HydrophobicContact CE2-CB 3.79Å; Y183-H242 AromaticContact CE2-CD2 3.7Å; Y183-H242 AromaticContact CE2-CE1 3.53Å; Y183-H242 AromaticContact CE2-CG 3.32Å; Y183-H242 AromaticContact CE2-ND1 3.22Å; Y183-H242 WeakPolarHBondContact CE2-ND1 3.49Å; Y183-H242 AromaticContact CE2-NE2 3.85Å; Y183-H242 HydrophobicContact CG-CB 3.76Å; Y183-H242 AromaticContact CZ-CE1 3.94Å; Y183-H242 AromaticContact CZ-CG 3.59Å; Y183-H242 AromaticContact CZ-ND1 3.27Å; Y183-H242 VanDerWaalsContact CZ-ND1 3.27Å; Y183-H242 PolarHBondContact OH-ND1 3.12Å; Y183-I246 HydrophobicContact CD1-CD1 3.71Å; Y183-I246 HydrophobicContact CD1-CG1 3.58Å; Y183-I246 HydrophobicContact CE1-CD1 4.2Å; Y183-I246 HydrophobicContact CG-CG1 4.31Å; Y183-I246 WeakPolarHBondContact O-CA 3.38Å |
| 184 | A | 98.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -68.8 | -34.2 | 166.1 | 0 | 0 | 0 | 0 | 0 | 113 | V154 G180 G181 V182 G187 G188 G245 G249 | V154-A184 HydrophobicContact CG1-CB 4.25Å; V154-A184 WeakPolarHBondContact O-CB 3.21Å; G180-A184 PolarHBondContact O-N 3.3Å; G181-A184 CarbonylContact O-C 3.57Å; G181-A184 WeakPolarHBondContact O-CA 3.31Å; G181-A184 WeakPolarHBondContact O-CB 3.36Å; G181-A184 PolarHBondContact O-N 3.01Å; G181-A184 VanDerWaalsContact O-N 3.08Å; V182-A184 VanDerWaalsContact C-N 3.32Å; V182-A184 PolarHBondContact O-N 3.26Å; A184-G187 PolarHBondContact O-N 2.92Å; A184-G188 PolarHBondContact O-N 2.96Å; A184-G245 WeakPolarHBondContact CA-O 3.25Å; A184-G245 WeakPolarHBondContact CB-O 3.4Å; A184-G245 PolarHBondContact N-O 2.88Å; A184-G249 VanDerWaalsContact O-CA 3.27Å; A184-G249 WeakPolarHBondContact O-CA 3.38Å |
| 185 | L | 97.7 | Very high | 94.5 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -65.1 | -39.7 | 171.1 | -62.8 | 175.7 | 0 | 0 | 0 | 111.5 | I67 Q135 L138 L142 V151 Y155 G181 V182 G188 Y189 | I67-L185 HydrophobicContact CD1-CD1 4.04Å; I67-L185 HydrophobicContact CD1-CD2 4.41Å; Q135-L185 HydrophobicContact CG-CD1 4.28Å; L138-L185 HydrophobicContact CB-CB 4.12Å; L138-L185 HydrophobicContact CD1-CB 4.38Å; L142-L185 HydrophobicContact CD1-CD2 4.11Å; V151-L185 HydrophobicContact CG1-CD2 3.74Å; Y155-L185 HydrophobicContact CD2-CD1 3.96Å; Y155-L185 HydrophobicContact CD2-CD2 4.43Å; Y155-L185 HydrophobicContact CD2-CG 4.04Å; Y155-L185 HydrophobicContact CE2-CD1 4.34Å; G181-L185 PolarHBondContact O-N 3.01Å; V182-L185 WeakPolarHBondContact O-CA 3.41Å; V182-L185 WeakPolarHBondContact O-CB 3.22Å; V182-L185 PolarHBondContact O-N 3.39Å; V182-L185 VanDerWaalsContact O-N 3.08Å; L185-G188 PolarHBondContact O-N 3.43Å; L185-Y189 VanDerWaalsContact O-CB 3.22Å; L185-Y189 WeakPolarHBondContact O-CB 3.48Å; L185-Y189 PolarHBondContact O-N 2.85Å |
| 186 | Y | 96.8 | Very high | 94 | Very high | 3 Ų | 3 | 14.4 Ų | 14.4 | 1% | 0.012 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -57.3 | -52.5 | 171.8 | -80.8 | -61.3 | 0 | 0 | 0 | 112 | M134 L138 V182 Y183 G188 Y189 F190 I215 V216 | M134-Y186 VanDerWaalsContact CG-OH 3.27Å; M134-Y186 WeakPolarHBondContact CG-OH 3.04Å; M134-Y186 PolarHBondContact SD-OH 2.95Å; L138-Y186 HydrophobicContact CD1-CD1 3.38Å; L138-Y186 HydrophobicContact CD1-CD2 4.2Å; L138-Y186 HydrophobicContact CD1-CE1 3.44Å; L138-Y186 VanDerWaalsContact CD1-CE1 3.44Å; L138-Y186 HydrophobicContact CD1-CE2 4.23Å; L138-Y186 HydrophobicContact CD1-CG 3.78Å; V182-Y186 HydrophobicContact CG1-CD2 4.3Å; V182-Y186 HydrophobicContact CG1-CE2 3.99Å; V182-Y186 WeakPolarHBondContact O-CD2 3.39Å; V182-Y186 PolarHBondContact O-N 3.42Å; Y183-Y186 HydrophobicContact CD1-CD2 4.16Å; Y183-Y186 HydrophobicContact CG-CD2 4.28Å; Y183-Y186 WeakPolarHBondContact O-CB 3.46Å; Y183-Y186 PolarHBondContact O-N 2.97Å; Y186-G188 VanDerWaalsContact C-N 3.35Å; Y186-G188 PolarHBondContact O-N 3.44Å; Y186-Y189 PolarHBondContact O-N 2.97Å; Y186-F190 WeakPolarHBondContact O-CB 3.27Å; Y186-F190 PolarHBondContact O-N 2.93Å; Y186-I215 HydrophobicContact CE1-CB 4.37Å; Y186-I215 HydrophobicContact CE1-CG2 3.54Å; Y186-I215 WeakPolarHBondContact OH-CG2 3.14Å; Y186-V216 HydrophobicContact CD1-CG2 3.23Å; Y186-V216 HydrophobicContact CD2-CG2 4.37Å; Y186-V216 HydrophobicContact CE1-CG2 3.84Å; Y186-V216 HydrophobicContact CG-CG2 3.56Å |
| 187 | G | 96.7 | Very high | 93.5 | Very high | 3 Ų | 3 | 16.2 Ų | 16.2 | 3% | 0.031 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.3 | -43.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y183 A184 F190 I191 | Y183-G187 PolarHBondContact O-N 3.42Å; A184-G187 PolarHBondContact O-N 2.92Å; G187-F190 PolarHBondContact O-N 3.15Å; G187-I191 WeakPolarHBondContact O-CG2 3.32Å; G187-I191 PolarHBondContact O-N 3.4Å |
| 188 | G | 94.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.4 | -43.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | A184 L185 Y186 I191 N192 G249 F257 | A184-G188 PolarHBondContact O-N 2.96Å; L185-G188 PolarHBondContact O-N 3.43Å; Y186-G188 VanDerWaalsContact C-N 3.35Å; Y186-G188 PolarHBondContact O-N 3.44Å; G188-I191 WeakPolarHBondContact O-CG2 3.34Å; G188-N192 WeakPolarHBondContact O-CB 3.33Å; G188-N192 PolarHBondContact O-N 3.25Å; G188-G249 PolarHBondContact N-O 3.11Å; G188-F257 WeakPolarHBondContact O-CD2 3.45Å |
| 189 | Y | 92.6 | Very high | 91.7 | Very high | 45 Ų | 45 | 26.9 Ų | 26.9 | 18% | 0.176 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -67.9 | -39.4 | 178.4 | -155.8 | -75.7 | 0 | 0 | 0 | 111.5 | L138 P141 L142 L185 Y186 A193 R208 I212 | L138-Y189 HydrophobicContact CB-CD2 4.44Å; L138-Y189 HydrophobicContact CD2-CD2 4.15Å; L138-Y189 HydrophobicContact CD2-CG 4.35Å; P141-Y189 HydrophobicContact CB-CE2 4.26Å; L142-Y189 HydrophobicContact CD1-CD2 3.96Å; L142-Y189 HydrophobicContact CD2-CD2 4.14Å; L142-Y189 HydrophobicContact CG-CD2 3.74Å; L142-Y189 HydrophobicContact CG-CE2 4.41Å; L185-Y189 VanDerWaalsContact O-CB 3.22Å; L185-Y189 WeakPolarHBondContact O-CB 3.48Å; L185-Y189 PolarHBondContact O-N 2.85Å; Y186-Y189 PolarHBondContact O-N 2.97Å; Y189-A193 WeakPolarHBondContact O-CB 3.4Å; Y189-A193 PolarHBondContact O-N 3.16Å; Y189-R208 HydrophobicContact CE1-CG 4.4Å; Y189-I212 HydrophobicContact CD1-CD1 3.31Å; Y189-I212 HydrophobicContact CD1-CG1 3.67Å; Y189-I212 HydrophobicContact CE1-CD1 3.62Å; Y189-I212 HydrophobicContact CE1-CG1 3.93Å |
| 190 | F | 94.5 | Very high | 90.7 | Very high | 65 Ų | 65 | 27.5 Ų | 27.5 | 29% | 0.285 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -62.5 | -53 | 174 | 177.8 | -92.8 | 0 | 0 | 0 | 111.5 | Y186 G187 N192 A193 V194 I209 I212 V213 L250 | Y186-F190 WeakPolarHBondContact O-CB 3.27Å; Y186-F190 PolarHBondContact O-N 2.93Å; G187-F190 PolarHBondContact O-N 3.15Å; F190-N192 VanDerWaalsContact C-N 3.28Å; F190-N192 PolarHBondContact O-N 3.23Å; F190-A193 WeakPolarHBondContact O-CB 3.22Å; F190-A193 PolarHBondContact O-N 3.04Å; F190-V194 HydrophobicContact CD1-CG2 4.14Å; F190-V194 HydrophobicContact CE1-CG2 3.73Å; F190-V194 HydrophobicContact CE2-CG2 4.35Å; F190-V194 HydrophobicContact CZ-CG2 3.85Å; F190-V194 WeakPolarHBondContact O-CG2 3.39Å; F190-V194 PolarHBondContact O-N 3.41Å; F190-I209 HydrophobicContact CD2-CG2 4.45Å; F190-I209 HydrophobicContact CE2-CG2 3.91Å; F190-I212 HydrophobicContact CB-CG2 4.28Å; F190-V213 HydrophobicContact CD2-CG2 4.13Å; F190-V213 HydrophobicContact CE2-CG2 3.87Å; F190-L250 HydrophobicContact CD1-CD2 3.59Å; F190-L250 HydrophobicContact CE1-CD2 4.29Å; F190-L250 HydrophobicContact CG-CD2 4.45Å |
| 191 | I | 92.3 | Very high | 89.9 | Confident | 22 Ų | 22 | 31.3 Ų | 31.3 | 11% | 0.113 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.7 | -37.2 | -178.3 | -163.7 | 59.5 | 0 | 0 | 0 | 111.1 | G187 G188 A193 V194 V195 L250 Y254 | G187-I191 WeakPolarHBondContact O-CG2 3.32Å; G187-I191 PolarHBondContact O-N 3.4Å; G188-I191 WeakPolarHBondContact O-CG2 3.34Å; I191-A193 VanDerWaalsContact C-N 3.31Å; I191-A193 PolarHBondContact O-N 3.21Å; I191-V194 HydrophobicContact CD1-CB 4.46Å; I191-V194 PolarHBondContact O-N 2.77Å; I191-V195 HydrophobicContact CD1-CG1 4.07Å; I191-V195 HydrophobicContact CG1-CG1 4.02Å; I191-V195 WeakPolarHBondContact O-CG1 3.24Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.48Å; I191-V195 PolarHBondContact O-N 2.75Å; I191-L250 HydrophobicContact CB-CD2 4.26Å; I191-Y254 HydrophobicContact CD1-CD2 4.03Å; I191-Y254 HydrophobicContact CG1-CD2 3.93Å |
| 192 | N | 90.2 | Very high | 89.2 | Confident | 9 Ų | 9 | 37 Ų | 37 | 5% | 0.048 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58.9 | -39.8 | 172 | 178.1 | 70.5 | 0 | 0 | 0 | 112.4 | L142 H146 G188 F190 N196 R208 F257 | L142-N192 HydrophobicContact CD2-CB 4.32Å; H146-N192 PolarHBondContact CE1-OD1 2.96Å; H146-N192 PolarHBondContact NE2-OD1 2.88Å; G188-N192 WeakPolarHBondContact O-CB 3.33Å; G188-N192 PolarHBondContact O-N 3.25Å; F190-N192 VanDerWaalsContact C-N 3.28Å; F190-N192 PolarHBondContact O-N 3.23Å; N192-N196 VanDerWaalsContact O-CB 3.27Å; N192-N196 WeakPolarHBondContact O-CB 3.42Å; N192-N196 PolarHBondContact O-N 3.24Å; N192-N196 PolarHBondContact O-ND2 3.4Å; N192-N196 PolarHBondContact OD1-ND2 2.93Å; N192-R208 PolarHBondContact ND2-NH2 3.34Å; N192-F257 HydrophobicContact CB-CB 4.16Å; N192-F257 HydrophobicContact CB-CD2 4.16Å |
| 193 | A | 88.5 | Confident | 88.6 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.008 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -68.6 | -38.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y189 F190 I191 F197 R208 I209 I212 | Y189-A193 WeakPolarHBondContact O-CB 3.4Å; Y189-A193 PolarHBondContact O-N 3.16Å; F190-A193 WeakPolarHBondContact O-CB 3.22Å; F190-A193 PolarHBondContact O-N 3.04Å; I191-A193 VanDerWaalsContact C-N 3.31Å; I191-A193 PolarHBondContact O-N 3.21Å; A193-F197 WeakPolarHBondContact O-CA 3.38Å; A193-F197 WeakPolarHBondContact O-CB 3.4Å; A193-F197 PolarHBondContact O-N 2.75Å; A193-F197 VanDerWaalsContact O-N 3.12Å; A193-R208 HydrophobicContact CB-CG 4.31Å; A193-I209 HydrophobicContact CB-CG1 3.86Å; A193-I212 HydrophobicContact CB-CD1 4.12Å |
| 194 | V | 89.4 | Confident | 87.8 | Confident | 63 Ų | 63 | 45.3 Ų | 45.3 | 38% | 0.382 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -68.4 | -50.3 | 178.8 | 171 | 0 | 0 | 0 | 0 | 111.6 | F190 I191 N196 F197 I209 | F190-V194 HydrophobicContact CD1-CG2 4.14Å; F190-V194 HydrophobicContact CE1-CG2 3.73Å; F190-V194 HydrophobicContact CE2-CG2 4.35Å; F190-V194 HydrophobicContact CZ-CG2 3.85Å; F190-V194 WeakPolarHBondContact O-CG2 3.39Å; F190-V194 PolarHBondContact O-N 3.41Å; I191-V194 HydrophobicContact CD1-CB 4.46Å; I191-V194 PolarHBondContact O-N 2.77Å; V194-N196 VanDerWaalsContact C-N 3.3Å; V194-N196 PolarHBondContact O-N 2.84Å; V194-F197 VanDerWaalsContact O-CB 3.25Å; V194-F197 WeakPolarHBondContact O-CB 3.46Å; V194-F197 PolarHBondContact O-N 2.95Å; V194-I209 HydrophobicContact CG2-CD1 4.13Å |
| 195 | V | 85 | Confident | 87.1 | Confident | 46 Ų | 46 | 45.3 Ų | 45.3 | 28% | 0.279 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -69.8 | -30.3 | -175.5 | -59.1 | 0 | 0 | 0 | 0 | 112.1 | I191 Y254 I258 | I191-V195 HydrophobicContact CD1-CG1 4.07Å; I191-V195 HydrophobicContact CG1-CG1 4.02Å; I191-V195 WeakPolarHBondContact O-CG1 3.24Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.48Å; I191-V195 PolarHBondContact O-N 2.75Å; V195-Y254 HydrophobicContact CG1-CD2 4.16Å; V195-Y254 HydrophobicContact CG1-CE2 4.16Å; V195-I258 HydrophobicContact CB-CD1 4.44Å; V195-I258 HydrophobicContact CB-CG1 3.9Å; V195-I258 HydrophobicContact CG1-CD1 3.87Å; V195-I258 HydrophobicContact CG1-CG1 3.79Å; V195-I258 HydrophobicContact CG2-CG1 3.84Å |
| 196 | N | 81.8 | Confident | 86.6 | Confident | 11 Ų | 11 | 48.1 Ų | 48.1 | 6% | 0.059 | 24% | 0.236 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -99.4 | 12.6 | 179.5 | -57.9 | -47.5 | 0 | 0 | 0 | 113.1 | N192 V194 K198 Q199 M200 F260 | N192-N196 VanDerWaalsContact O-CB 3.27Å; N192-N196 WeakPolarHBondContact O-CB 3.42Å; N192-N196 PolarHBondContact O-N 3.24Å; N192-N196 PolarHBondContact O-ND2 3.4Å; N192-N196 PolarHBondContact OD1-ND2 2.93Å; V194-N196 VanDerWaalsContact C-N 3.3Å; V194-N196 PolarHBondContact O-N 2.84Å; N196-K198 VanDerWaalsContact C-N 3.26Å; N196-K198 PolarHBondContact O-N 3.02Å; N196-Q199 WeakPolarHBondContact O-CB 3.37Å; N196-Q199 PolarHBondContact O-N 2.92Å; N196-M200 HydrophobicContact CB-CE 4.33Å; N196-M200 WeakPolarHBondContact O-CE 3Å; N196-F260 HydrophobicContact CB-CE2 4.43Å; N196-F260 VanDerWaalsContact CG-CE2 3.42Å; N196-F260 WeakPolarHBondContact OD1-CD2 3.28Å; N196-F260 WeakPolarHBondContact OD1-CE2 3.32Å |
| 197 | F | 84.1 | Confident | 86.1 | Confident | 55 Ų | 55 | 51 Ų | 51 | 24% | 0.241 | 25% | 0.254 | C | S | . | . | G | 310 helix | trans | -56.7 | -39.9 | -176 | -170.8 | -92.3 | 0 | 0 | 0 | 112.8 | A193 V194 Q199 M200 L202 V206 I209 | A193-F197 WeakPolarHBondContact O-CA 3.38Å; A193-F197 WeakPolarHBondContact O-CB 3.4Å; A193-F197 PolarHBondContact O-N 2.75Å; A193-F197 VanDerWaalsContact O-N 3.12Å; V194-F197 VanDerWaalsContact O-CB 3.25Å; V194-F197 WeakPolarHBondContact O-CB 3.46Å; V194-F197 PolarHBondContact O-N 2.95Å; F197-Q199 PolarHBondContact O-N 2.89Å; F197-Q199 VanDerWaalsContact O-N 3.15Å; F197-M200 PolarHBondContact O-N 3.44Å; F197-M200 VanDerWaalsContact O-N 3.12Å; F197-L202 HydrophobicContact CE1-CD1 3.76Å; F197-L202 HydrophobicContact CZ-CD1 3.72Å; F197-V206 HydrophobicContact CE2-CG2 4.1Å; F197-V206 HydrophobicContact CZ-CG2 3.78Å; F197-I209 HydrophobicContact CD2-CD1 3.67Å; F197-I209 HydrophobicContact CE2-CD1 3.87Å |
| 198 | K | 80 | Confident | 85.6 | Confident | 189 Ų | 189 | 53.6 Ų | 53.6 | 82% | 0.822 | 26% | 0.263 | S | S | * | . | G | 310 helix | trans | -65.3 | -15.7 | -179.8 | -66.3 | -171.2 | 177.3 | -174.1 | 0 | 114.2 | N196 | N196-K198 VanDerWaalsContact C-N 3.26Å; N196-K198 PolarHBondContact O-N 3.02Å |
| 199 | Q | 75.1 | Confident | 85.4 | Confident | 34 Ų | 34 | 55.2 Ų | 55.2 | 16% | 0.159 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -92.7 | -1.6 | 179.3 | -61.7 | 166.6 | 7.5 | 0 | 0 | 112.6 | P47 F50 N196 F197 | P47-Q199 VanDerWaalsContact CD-O 3.26Å; P47-Q199 WeakPolarHBondContact CD-O 3.24Å; F50-Q199 HydrophobicContact CD1-CG 4.01Å; F50-Q199 HydrophobicContact CD2-CB 4.36Å; F50-Q199 HydrophobicContact CE1-CG 4.14Å; F50-Q199 HydrophobicContact CG-CB 4.23Å; F50-Q199 HydrophobicContact CG-CG 4.23Å; F50-Q199 HydrophobicContact CZ-CG 4.48Å; N196-Q199 WeakPolarHBondContact O-CB 3.37Å; N196-Q199 PolarHBondContact O-N 2.92Å; F197-Q199 PolarHBondContact O-N 2.89Å; F197-Q199 VanDerWaalsContact O-N 3.15Å |
| 200 | M | 75.3 | Confident | 85.4 | Confident | 25 Ų | 25 | 57.8 Ų | 57.8 | 12% | 0.123 | 29% | 0.288 | C | S | . | . | S | Bend | trans | -115.1 | 148.3 | 176.9 | -68.7 | 176.8 | -93.6 | 0 | 0 | 108.7 | N196 F197 | N196-M200 HydrophobicContact CB-CE 4.33Å; N196-M200 WeakPolarHBondContact O-CE 3Å; F197-M200 PolarHBondContact O-N 3.44Å; F197-M200 VanDerWaalsContact O-N 3.12Å |
| 201 | K | 80.4 | Confident | 85.2 | Confident | 80 Ų | 80 | 59 Ų | 59 | 35% | 0.348 | 30% | 0.296 | S | S | . | . | trans | -61.9 | 142.8 | 169.4 | -65.5 | -175.2 | -162 | 161 | 0 | 109.6 | N43 L44 I45 P47 I203 F204 G205 | N43-K201 PolarHBondContact O-NZ 3.4Å; L44-K201 VanDerWaalsContact O-CD 3.27Å; L44-K201 WeakPolarHBondContact O-CD 3.49Å; L44-K201 VanDerWaalsContact O-CE 3.3Å; L44-K201 WeakPolarHBondContact O-CE 3.48Å; L44-K201 PolarHBondContact O-NZ 2.89Å; I45-K201 PolarHBondContact O-N 3.07Å; P47-K201 HydrophobicContact CG-CG 4.13Å; K201-I203 VanDerWaalsContact C-N 3.33Å; K201-I203 PolarHBondContact O-N 2.71Å; K201-I203 VanDerWaalsContact O-N 3.16Å; K201-F204 HydrophobicContact CB-CD2 4.18Å; K201-F204 PolarHBondContact O-N 3.34Å; K201-G205 PolarHBondContact O-N 3.08Å | ||
| 202 | L | 83.5 | Confident | 85.2 | Confident | 120 Ų | 120 | 58.4 Ų | 58.4 | 63% | 0.628 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -46.1 | -52.1 | -171.9 | -179.9 | 65.1 | 0 | 0 | 0 | 113.4 | F197 F204 G205 V206 | F197-L202 HydrophobicContact CE1-CD1 3.76Å; F197-L202 HydrophobicContact CZ-CD1 3.72Å; L202-F204 VanDerWaalsContact C-N 3.32Å; L202-F204 PolarHBondContact O-N 3.48Å; L202-G205 PolarHBondContact O-N 3.02Å; L202-V206 HydrophobicContact CD1-CG2 4.09Å; L202-V206 HydrophobicContact CG-CG2 4.49Å; L202-V206 WeakPolarHBondContact O-CG2 3.31Å; L202-V206 PolarHBondContact O-N 3.5Å |
| 203 | I | 85.1 | Confident | 85.3 | Confident | 123 Ų | 123 | 60.7 Ų | 60.7 | 63% | 0.631 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -56.4 | -44.4 | -179.6 | -85.2 | 165.6 | 0 | 0 | 0 | 112 | K201 T207 | K201-I203 VanDerWaalsContact C-N 3.33Å; K201-I203 PolarHBondContact O-N 2.71Å; K201-I203 VanDerWaalsContact O-N 3.16Å; I203-T207 VanDerWaalsContact O-CB 3.24Å; I203-T207 WeakPolarHBondContact O-CB 3.39Å; I203-T207 PolarHBondContact O-N 3Å; I203-T207 PolarHBondContact O-OG1 2.93Å |
| 204 | F | 81.5 | Confident | 85.6 | Confident | 57 Ų | 57 | 66.4 Ų | 66.4 | 25% | 0.25 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -73.8 | -38.1 | -179.2 | -70.1 | -76 | 0 | 0 | 0 | 112.6 | L44 I45 K201 L202 T207 R208 | L44-F204 HydrophobicContact CB-CZ 4.41Å; L44-F204 HydrophobicContact CD1-CZ 4.49Å; L44-F204 HydrophobicContact CD2-CE1 4.36Å; L44-F204 HydrophobicContact CD2-CE2 4.39Å; L44-F204 HydrophobicContact CD2-CZ 3.59Å; L44-F204 HydrophobicContact CG-CE2 3.8Å; L44-F204 HydrophobicContact CG-CZ 3.5Å; L44-F204 VanDerWaalsContact CG-CZ 3.5Å; L44-F204 WeakPolarHBondContact O-CE2 3.44Å; I45-F204 HydrophobicContact CB-CG 4.33Å; I45-F204 HydrophobicContact CG1-CD1 3.72Å; I45-F204 HydrophobicContact CG1-CD2 4.33Å; I45-F204 HydrophobicContact CG1-CE1 3.92Å; I45-F204 HydrophobicContact CG1-CG 3.94Å; I45-F204 HydrophobicContact CG1-CZ 4.33Å; I45-F204 HydrophobicContact CG2-CB 4.15Å; I45-F204 HydrophobicContact CG2-CG 4.32Å; K201-F204 HydrophobicContact CB-CD2 4.18Å; K201-F204 PolarHBondContact O-N 3.34Å; L202-F204 VanDerWaalsContact C-N 3.32Å; L202-F204 PolarHBondContact O-N 3.48Å; F204-T207 PolarHBondContact O-N 3.49Å; F204-R208 WeakPolarHBondContact O-CB 3.38Å; F204-R208 PolarHBondContact O-N 2.68Å |
| 205 | G | 83.4 | Confident | 85.8 | Confident | 1 Ų | 1 | 66 Ų | 66 | 1% | 0.01 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59.3 | -49.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | K201 L202 R208 I209 | K201-G205 PolarHBondContact O-N 3.08Å; L202-G205 PolarHBondContact O-N 3.02Å; G205-R208 PolarHBondContact O-N 2.77Å; G205-I209 WeakPolarHBondContact O-CG1 3.5Å; G205-I209 PolarHBondContact O-N 3Å; G205-I209 VanDerWaalsContact O-N 3.11Å |
| 206 | V | 86.8 | Confident | 86.1 | Confident | 58 Ų | 58 | 65.1 Ų | 65.1 | 35% | 0.352 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.4 | -47 | 178.2 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | F197 L202 R208 I209 L210 | F197-V206 HydrophobicContact CE2-CG2 4.1Å; F197-V206 HydrophobicContact CZ-CG2 3.78Å; L202-V206 HydrophobicContact CD1-CG2 4.09Å; L202-V206 HydrophobicContact CG-CG2 4.49Å; L202-V206 WeakPolarHBondContact O-CG2 3.31Å; L202-V206 PolarHBondContact O-N 3.5Å; V206-R208 VanDerWaalsContact C-N 3.33Å; V206-R208 PolarHBondContact O-N 3.19Å; V206-I209 PolarHBondContact O-N 3.13Å; V206-L210 HydrophobicContact CG1-CD1 3.79Å; V206-L210 HydrophobicContact CG1-CG 4.18Å; V206-L210 WeakPolarHBondContact O-CB 3.44Å; V206-L210 WeakPolarHBondContact O-CG 3.46Å; V206-L210 PolarHBondContact O-N 2.99Å |
| 207 | T | 86.5 | Confident | 86.7 | Confident | 63 Ų | 63 | 69.1 Ų | 69.1 | 39% | 0.387 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.6 | -43.9 | -179.1 | -58.7 | 0 | 0 | 0 | 0 | 111.1 | I203 F204 L210 I211 | I203-T207 VanDerWaalsContact O-CB 3.24Å; I203-T207 WeakPolarHBondContact O-CB 3.39Å; I203-T207 PolarHBondContact O-N 3Å; I203-T207 PolarHBondContact O-OG1 2.93Å; F204-T207 PolarHBondContact O-N 3.49Å; T207-L210 PolarHBondContact O-N 3.46Å; T207-I211 HydrophobicContact CG2-CD1 3.76Å; T207-I211 HydrophobicContact CG2-CG1 4.41Å; T207-I211 WeakPolarHBondContact O-CB 3.31Å; T207-I211 VanDerWaalsContact O-CG1 3.27Å; T207-I211 WeakPolarHBondContact O-CG1 3.47Å; T207-I211 PolarHBondContact O-N 2.89Å |
| 208 | R | 87.3 | Confident | 87.1 | Confident | 58 Ų | 58 | 69.7 Ų | 69.7 | 22% | 0.219 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -57.9 | -50.4 | 175.8 | 179.5 | 180 | -179.2 | 178.4 | 5.6 | 111.4 | Y189 N192 A193 F204 G205 V206 I211 I212 | Y189-R208 HydrophobicContact CE1-CG 4.4Å; N192-R208 PolarHBondContact ND2-NH2 3.34Å; A193-R208 HydrophobicContact CB-CG 4.31Å; F204-R208 WeakPolarHBondContact O-CB 3.38Å; F204-R208 PolarHBondContact O-N 2.68Å; G205-R208 PolarHBondContact O-N 2.77Å; V206-R208 VanDerWaalsContact C-N 3.33Å; V206-R208 PolarHBondContact O-N 3.19Å; R208-I211 PolarHBondContact O-N 3.38Å; R208-I212 HydrophobicContact CG-CD1 3.86Å; R208-I212 WeakPolarHBondContact O-CD1 3.23Å; R208-I212 VanDerWaalsContact O-CG1 3.23Å; R208-I212 WeakPolarHBondContact O-CG1 3.44Å; R208-I212 PolarHBondContact O-N 2.82Å; R208-I212 VanDerWaalsContact O-N 3.11Å |
| 209 | I | 90.3 | Very high | 87.7 | Confident | 34 Ų | 34 | 63 Ų | 63 | 17% | 0.174 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61 | -46.9 | 179.2 | -69.7 | 174.6 | 0 | 0 | 0 | 110.9 | F190 A193 V194 F197 G205 V206 I211 I212 V213 | F190-I209 HydrophobicContact CD2-CG2 4.45Å; F190-I209 HydrophobicContact CE2-CG2 3.91Å; A193-I209 HydrophobicContact CB-CG1 3.86Å; V194-I209 HydrophobicContact CG2-CD1 4.13Å; F197-I209 HydrophobicContact CD2-CD1 3.67Å; F197-I209 HydrophobicContact CE2-CD1 3.87Å; G205-I209 WeakPolarHBondContact O-CG1 3.5Å; G205-I209 PolarHBondContact O-N 3Å; G205-I209 VanDerWaalsContact O-N 3.11Å; V206-I209 PolarHBondContact O-N 3.13Å; I209-I211 PolarHBondContact O-N 2.87Å; I209-I212 PolarHBondContact O-N 3.36Å; I209-V213 HydrophobicContact CG2-CG2 4.3Å; I209-V213 WeakPolarHBondContact O-CG2 3.29Å; I209-V213 PolarHBondContact O-N 3.35Å |
| 210 | L | 91.9 | Very high | 88.4 | Confident | 100 Ų | 100 | 63.6 Ų | 63.6 | 52% | 0.524 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.6 | -45.9 | 179.2 | -73.5 | 175.8 | 0 | 0 | 0 | 111.9 | V206 T207 I212 V213 L214 | V206-L210 HydrophobicContact CG1-CD1 3.79Å; V206-L210 HydrophobicContact CG1-CG 4.18Å; V206-L210 WeakPolarHBondContact O-CB 3.44Å; V206-L210 WeakPolarHBondContact O-CG 3.46Å; V206-L210 PolarHBondContact O-N 2.99Å; T207-L210 PolarHBondContact O-N 3.46Å; L210-I212 PolarHBondContact O-N 2.9Å; L210-V213 PolarHBondContact O-N 3.31Å; L210-L214 WeakPolarHBondContact O-CB 3.35Å; L210-L214 VanDerWaalsContact O-CG 3.28Å; L210-L214 WeakPolarHBondContact O-CG 3.24Å; L210-L214 PolarHBondContact O-N 2.99Å |
| 211 | I | 91.5 | Very high | 89.1 | Confident | 90 Ų | 90 | 64 Ų | 64 | 46% | 0.462 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.7 | -47 | 178.2 | -71 | 168.9 | 0 | 0 | 0 | 110.8 | T207 R208 I209 V213 L214 I215 | T207-I211 HydrophobicContact CG2-CD1 3.76Å; T207-I211 HydrophobicContact CG2-CG1 4.41Å; T207-I211 WeakPolarHBondContact O-CB 3.31Å; T207-I211 VanDerWaalsContact O-CG1 3.27Å; T207-I211 WeakPolarHBondContact O-CG1 3.47Å; T207-I211 PolarHBondContact O-N 2.89Å; R208-I211 PolarHBondContact O-N 3.38Å; I209-I211 PolarHBondContact O-N 2.87Å; I211-V213 VanDerWaalsContact C-N 3.35Å; I211-V213 PolarHBondContact O-N 3.33Å; I211-L214 PolarHBondContact O-N 3.21Å; I211-I215 HydrophobicContact CG2-CD1 3.74Å; I211-I215 HydrophobicContact CG2-CG1 4.44Å; I211-I215 VanDerWaalsContact O-CG1 3.28Å; I211-I215 WeakPolarHBondContact O-CG1 3.49Å; I211-I215 PolarHBondContact O-N 2.95Å |
| 212 | I | 91.7 | Very high | 89.5 | Confident | 9 Ų | 9 | 66.7 Ų | 66.7 | 5% | 0.046 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61 | -46.6 | 179.1 | -62.2 | 150.1 | 0 | 0 | 0 | 110.4 | Y189 F190 A193 R208 I209 L210 L214 I215 V216 | Y189-I212 HydrophobicContact CD1-CD1 3.31Å; Y189-I212 HydrophobicContact CD1-CG1 3.67Å; Y189-I212 HydrophobicContact CE1-CD1 3.62Å; Y189-I212 HydrophobicContact CE1-CG1 3.93Å; F190-I212 HydrophobicContact CB-CG2 4.28Å; A193-I212 HydrophobicContact CB-CD1 4.12Å; R208-I212 HydrophobicContact CG-CD1 3.86Å; R208-I212 WeakPolarHBondContact O-CD1 3.23Å; R208-I212 VanDerWaalsContact O-CG1 3.23Å; R208-I212 WeakPolarHBondContact O-CG1 3.44Å; R208-I212 PolarHBondContact O-N 2.82Å; R208-I212 VanDerWaalsContact O-N 3.11Å; I209-I212 PolarHBondContact O-N 3.36Å; L210-I212 PolarHBondContact O-N 2.9Å; I212-L214 VanDerWaalsContact C-N 3.34Å; I212-L214 PolarHBondContact O-N 3.14Å; I212-I215 PolarHBondContact O-N 3.3Å; I212-V216 HydrophobicContact CG2-CG2 4.24Å; I212-V216 VanDerWaalsContact O-CG2 3.27Å; I212-V216 WeakPolarHBondContact O-CG2 3.33Å; I212-V216 PolarHBondContact O-N 2.9Å |
| 213 | V | 92.4 | Very high | 89.7 | Confident | 58 Ų | 58 | 61.2 Ų | 61.2 | 35% | 0.352 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.2 | -44.3 | 179.8 | 169.9 | 0 | 0 | 0 | 0 | 110.9 | F190 I209 L210 I211 I215 V216 V217 | F190-V213 HydrophobicContact CD2-CG2 4.13Å; F190-V213 HydrophobicContact CE2-CG2 3.87Å; I209-V213 HydrophobicContact CG2-CG2 4.3Å; I209-V213 WeakPolarHBondContact O-CG2 3.29Å; I209-V213 PolarHBondContact O-N 3.35Å; L210-V213 PolarHBondContact O-N 3.31Å; I211-V213 VanDerWaalsContact C-N 3.35Å; I211-V213 PolarHBondContact O-N 3.33Å; V213-I215 PolarHBondContact O-N 3.12Å; V213-V216 PolarHBondContact O-N 2.87Å; V213-V217 HydrophobicContact CG1-CG2 4.21Å; V213-V217 WeakPolarHBondContact O-CB 3.33Å; V213-V217 VanDerWaalsContact O-CG2 3.25Å; V213-V217 WeakPolarHBondContact O-CG2 3.41Å; V213-V217 PolarHBondContact O-N 3.09Å |
| 214 | L | 94.3 | Very high | 89.9 | Confident | 121 Ų | 121 | 58 Ų | 58 | 63% | 0.634 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -61.8 | -43.7 | 177.5 | -72.6 | 172.2 | 0 | 0 | 0 | 111.9 | L210 I211 I212 A218 | L210-L214 WeakPolarHBondContact O-CB 3.35Å; L210-L214 VanDerWaalsContact O-CG 3.28Å; L210-L214 WeakPolarHBondContact O-CG 3.24Å; L210-L214 PolarHBondContact O-N 2.99Å; I211-L214 PolarHBondContact O-N 3.21Å; I212-L214 VanDerWaalsContact C-N 3.34Å; I212-L214 PolarHBondContact O-N 3.14Å; L214-A218 VanDerWaalsContact O-CB 3.26Å; L214-A218 WeakPolarHBondContact O-CB 3.34Å; L214-A218 PolarHBondContact O-N 3.38Å |
| 215 | I | 92.9 | Very high | 90.2 | Very high | 53 Ų | 53 | 61.5 Ų | 61.5 | 27% | 0.272 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63 | -47.4 | 176.9 | -65.4 | 167.5 | 0 | 0 | 0 | 110.3 | M134 Y186 I211 I212 V213 V217 A218 D219 | M134-I215 HydrophobicContact CE-CG2 4.1Å; M134-I215 HydrophobicContact SD-CG2 4.32Å; Y186-I215 HydrophobicContact CE1-CB 4.37Å; Y186-I215 HydrophobicContact CE1-CG2 3.54Å; Y186-I215 WeakPolarHBondContact OH-CG2 3.14Å; I211-I215 HydrophobicContact CG2-CD1 3.74Å; I211-I215 HydrophobicContact CG2-CG1 4.44Å; I211-I215 VanDerWaalsContact O-CG1 3.28Å; I211-I215 WeakPolarHBondContact O-CG1 3.49Å; I211-I215 PolarHBondContact O-N 2.95Å; I212-I215 PolarHBondContact O-N 3.3Å; V213-I215 PolarHBondContact O-N 3.12Å; I215-V217 PolarHBondContact O-N 2.85Å; I215-A218 PolarHBondContact O-N 3.37Å; I215-D219 WeakPolarHBondContact O-CB 3.13Å; I215-D219 PolarHBondContact O-N 2.86Å |
| 216 | V | 92.9 | Very high | 90.1 | Very high | 28 Ų | 28 | 64.7 Ų | 64.7 | 17% | 0.17 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61 | -46.3 | 179.4 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | Y186 I212 V213 D219 F220 I246 | Y186-V216 HydrophobicContact CD1-CG2 3.23Å; Y186-V216 HydrophobicContact CD2-CG2 4.37Å; Y186-V216 HydrophobicContact CE1-CG2 3.84Å; Y186-V216 HydrophobicContact CG-CG2 3.56Å; I212-V216 HydrophobicContact CG2-CG2 4.24Å; I212-V216 VanDerWaalsContact O-CG2 3.27Å; I212-V216 WeakPolarHBondContact O-CG2 3.33Å; I212-V216 PolarHBondContact O-N 2.9Å; V213-V216 PolarHBondContact O-N 2.87Å; V216-D219 PolarHBondContact O-N 2.97Å; V216-F220 WeakPolarHBondContact O-CB 3.02Å; V216-F220 PolarHBondContact O-N 2.87Å; V216-I246 HydrophobicContact CG1-CD1 4.29Å |
| 217 | V | 93.3 | Very high | 89.9 | Confident | 96 Ų | 96 | 63.9 Ų | 63.9 | 58% | 0.582 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -64.6 | -41.5 | 179.8 | 169.1 | 0 | 0 | 0 | 0 | 110.8 | V213 I215 G221 | V213-V217 HydrophobicContact CG1-CG2 4.21Å; V213-V217 WeakPolarHBondContact O-CB 3.33Å; V213-V217 VanDerWaalsContact O-CG2 3.25Å; V213-V217 WeakPolarHBondContact O-CG2 3.41Å; V213-V217 PolarHBondContact O-N 3.09Å; I215-V217 PolarHBondContact O-N 2.85Å; V217-G221 WeakPolarHBondContact O-CA 3.43Å; V217-G221 PolarHBondContact O-N 3.12Å |
| 218 | A | 93.4 | Very high | 89.9 | Confident | 67 Ų | 67 | 67.1 Ų | 67.1 | 55% | 0.554 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -64.9 | -48.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L214 I215 G221 Y222 | L214-A218 VanDerWaalsContact O-CB 3.26Å; L214-A218 WeakPolarHBondContact O-CB 3.34Å; L214-A218 PolarHBondContact O-N 3.38Å; I215-A218 PolarHBondContact O-N 3.37Å; A218-G221 PolarHBondContact O-N 2.79Å; A218-Y222 WeakPolarHBondContact O-CB 3.17Å; A218-Y222 PolarHBondContact O-N 2.97Å |
| 219 | D | 91.3 | Very high | 89.6 | Confident | 47 Ų | 47 | 66.3 Ų | 66.3 | 25% | 0.251 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -66.3 | -46.2 | -179.5 | -170.7 | 79.6 | 0 | 0 | 0 | 111.8 | Y183 I215 V216 Y222 A223 | Y183-D219 WeakPolarHBondContact CE2-OD2 3.35Å; Y183-D219 PolarHBondContact OH-OD2 2.94Å; I215-D219 WeakPolarHBondContact O-CB 3.13Å; I215-D219 PolarHBondContact O-N 2.86Å; V216-D219 PolarHBondContact O-N 2.97Å; D219-Y222 PolarHBondContact O-N 2.81Å; D219-A223 PolarHBondContact O-N 2.98Å |
| 220 | F | 90.3 | Very high | 88.2 | Confident | 47 Ų | 47 | 71.6 Ų | 71.6 | 21% | 0.206 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -66.9 | -39 | 177.3 | -168.5 | -100.6 | 0 | 0 | 0 | 112 | Y183 V216 Y222 A223 L224 F239 H242 | Y183-F220 HydrophobicContact CE1-CB 4.15Å; Y183-F220 AromaticContact CE1-CD2 3.7Å; Y183-F220 HydrophobicContact CE1-CD2 3.7Å; Y183-F220 HydrophobicContact CE1-CG 4.41Å; Y183-F220 VanDerWaalsContact OH-CA 3.3Å; Y183-F220 WeakPolarHBondContact OH-CA 3.17Å; Y183-F220 PolarHBondContact OH-N 2.85Å; V216-F220 WeakPolarHBondContact O-CB 3.02Å; V216-F220 PolarHBondContact O-N 2.87Å; F220-Y222 VanDerWaalsContact C-N 3.33Å; F220-Y222 PolarHBondContact O-N 3.01Å; F220-A223 WeakPolarHBondContact O-CB 3.33Å; F220-A223 PolarHBondContact O-N 3.4Å; F220-L224 HydrophobicContact CD1-CD1 3.77Å; F220-L224 HydrophobicContact CD1-CG 4.12Å; F220-L224 HydrophobicContact CE1-CD1 3.56Å; F220-L224 HydrophobicContact CE1-CD2 4.29Å; F220-L224 HydrophobicContact CE1-CG 3.9Å; F220-L224 HydrophobicContact CZ-CD2 4.5Å; F220-L224 HydrophobicContact CZ-CG 4.46Å; F220-L224 WeakPolarHBondContact O-CG 3.4Å; F220-L224 PolarHBondContact O-N 3.3Å; F220-F239 HydrophobicContact CE2-CB 4.38Å; F220-F239 HydrophobicContact CZ-CB 4.34Å; F220-F239 HydrophobicContact CZ-CD2 4.37Å; F220-H242 HydrophobicContact CD2-CB 4.06Å; F220-H242 HydrophobicContact CE2-CB 3.89Å |
| 221 | G | 91.3 | Very high | 86.8 | Confident | 33 Ų | 33 | 71.2 Ų | 71.2 | 34% | 0.34 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V217 A218 L224 Y225 | V217-G221 WeakPolarHBondContact O-CA 3.43Å; V217-G221 PolarHBondContact O-N 3.12Å; A218-G221 PolarHBondContact O-N 2.79Å; G221-L224 PolarHBondContact O-N 2.8Å; G221-Y225 WeakPolarHBondContact O-CB 3.37Å; G221-Y225 PolarHBondContact O-N 3.19Å |
| 222 | Y | 88.6 | Confident | 84.9 | Confident | 138 Ų | 138 | 76.4 Ų | 76.4 | 54% | 0.541 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -64.7 | -39.2 | 173.6 | -178.6 | -113.1 | 0 | 0 | 0 | 112.4 | A218 D219 F220 Y225 R226 | A218-Y222 WeakPolarHBondContact O-CB 3.17Å; A218-Y222 PolarHBondContact O-N 2.97Å; D219-Y222 PolarHBondContact O-N 2.81Å; F220-Y222 VanDerWaalsContact C-N 3.33Å; F220-Y222 PolarHBondContact O-N 3.01Å; Y222-Y225 HydrophobicContact CD2-CD1 4.5Å; Y222-Y225 PolarHBondContact O-N 3.42Å; Y222-R226 HydrophobicContact CE1-CG 4.35Å; Y222-R226 HydrophobicContact CE2-CG 4.26Å; Y222-R226 WeakPolarHBondContact O-CB 3.1Å; Y222-R226 PolarHBondContact O-N 3.36Å |
| 223 | A | 87.1 | Confident | 83.1 | Confident | 5 Ų | 5 | 79.8 Ų | 79.8 | 4% | 0.041 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | D219 F220 R226 R227 V237 | D219-A223 PolarHBondContact O-N 2.98Å; F220-A223 WeakPolarHBondContact O-CB 3.33Å; F220-A223 PolarHBondContact O-N 3.4Å; A223-R226 PolarHBondContact O-N 3.27Å; A223-R227 PolarHBondContact O-N 2.99Å; A223-V237 HydrophobicContact CB-CG1 4Å |
| 224 | L | 88.9 | Confident | 81.4 | Confident | 54 Ų | 54 | 79.3 Ų | 79.3 | 28% | 0.283 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.8 | -45.7 | 174.6 | -73.9 | 175 | 0 | 0 | 0 | 111.8 | F220 G221 R226 R227 F228 F239 | F220-L224 HydrophobicContact CD1-CD1 3.77Å; F220-L224 HydrophobicContact CD1-CG 4.12Å; F220-L224 HydrophobicContact CE1-CD1 3.56Å; F220-L224 HydrophobicContact CE1-CD2 4.29Å; F220-L224 HydrophobicContact CE1-CG 3.9Å; F220-L224 HydrophobicContact CZ-CD2 4.5Å; F220-L224 HydrophobicContact CZ-CG 4.46Å; F220-L224 WeakPolarHBondContact O-CG 3.4Å; F220-L224 PolarHBondContact O-N 3.3Å; G221-L224 PolarHBondContact O-N 2.8Å; L224-R226 VanDerWaalsContact C-N 3.31Å; L224-R226 PolarHBondContact O-N 3.46Å; L224-R227 WeakPolarHBondContact O-CB 3.33Å; L224-R227 PolarHBondContact O-N 3.25Å; L224-F228 HydrophobicContact CD2-CD2 4.4Å; L224-F228 HydrophobicContact CD2-CE2 3.87Å; L224-F228 WeakPolarHBondContact O-CD2 3.48Å; L224-F228 PolarHBondContact O-N 2.93Å; L224-F239 HydrophobicContact CD2-CB 3.84Å; L224-F239 HydrophobicContact CD2-CD2 4.18Å; L224-F239 HydrophobicContact CD2-CG 3.94Å |
| 225 | Y | 87.3 | Confident | 80 | Confident | 132 Ų | 132 | 75.2 Ų | 75.2 | 52% | 0.518 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -54.2 | -50.1 | 175.3 | 172.8 | -101.6 | 0 | 0 | 0 | 110.5 | G221 Y222 R227 F228 A229 L231 | G221-Y225 WeakPolarHBondContact O-CB 3.37Å; G221-Y225 PolarHBondContact O-N 3.19Å; Y222-Y225 HydrophobicContact CD2-CD1 4.5Å; Y222-Y225 PolarHBondContact O-N 3.42Å; Y225-R227 VanDerWaalsContact C-N 3.25Å; Y225-R227 PolarHBondContact O-N 3.21Å; Y225-F228 PolarHBondContact O-N 2.91Å; Y225-A229 HydrophobicContact CD2-CB 3.79Å; Y225-A229 HydrophobicContact CE1-CB 4.34Å; Y225-A229 HydrophobicContact CE2-CB 3.55Å; Y225-A229 HydrophobicContact CG-CB 4.28Å; Y225-A229 WeakPolarHBondContact O-CB 3.45Å; Y225-A229 PolarHBondContact O-N 3.04Å; Y225-L231 HydrophobicContact CE1-CD1 4.17Å |
| 226 | R | 82.2 | Confident | 78.9 | Confident | 68 Ų | 68 | 79.5 Ų | 79.5 | 26% | 0.257 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.1 | -28.6 | 176.2 | -80.8 | -173.8 | 49 | -163.1 | -9.6 | 114.4 | Y222 A223 L224 V235 V237 | Y222-R226 HydrophobicContact CE1-CG 4.35Å; Y222-R226 HydrophobicContact CE2-CG 4.26Å; Y222-R226 WeakPolarHBondContact O-CB 3.1Å; Y222-R226 PolarHBondContact O-N 3.36Å; A223-R226 PolarHBondContact O-N 3.27Å; L224-R226 VanDerWaalsContact C-N 3.31Å; L224-R226 PolarHBondContact O-N 3.46Å; R226-V235 PolarHBondContact NH2-O 2.98Å; R226-V235 VanDerWaalsContact NH2-O 3.12Å; R226-V237 HydrophobicContact CB-CG2 4.12Å |
| 227 | R | 82.9 | Confident | 78.3 | Confident | 40 Ų | 40 | 78.9 Ų | 78.9 | 15% | 0.151 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -75.5 | -38.5 | 178.4 | 177.8 | 57.6 | 172.6 | -142 | 2.6 | 112.2 | D170 A223 L224 Y225 V237 F239 | D170-R227 IonicContact OD1-NH2 2.68Å; D170-R227 PolarHBondContact OD1-NH2 2.91Å; D170-R227 IonicContact OD2-CZ 2.6Å; D170-R227 IonicContact OD2-NH1 3.08Å; D170-R227 PolarHBondContact OD2-NH1 2.8Å; D170-R227 IonicContact OD2-NH2 2.7Å; D170-R227 PolarHBondContact OD2-NH2 3.45Å; A223-R227 PolarHBondContact O-N 2.99Å; L224-R227 WeakPolarHBondContact O-CB 3.33Å; L224-R227 PolarHBondContact O-N 3.25Å; Y225-R227 VanDerWaalsContact C-N 3.25Å; Y225-R227 PolarHBondContact O-N 3.21Å; R227-V237 WeakPolarHBondContact CD-O 3.33Å; R227-V237 PolarHBondContact NH1-O 3.15Å; R227-F239 HydrophobicContact CG-CD1 4.36Å |
| 228 | F | 85.6 | Confident | 77.9 | Confident | 132 Ų | 132 | 74.8 Ų | 74.8 | 58% | 0.579 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -109.3 | -20.4 | -169.4 | -66.5 | -68.7 | 0 | 0 | 0 | 115.3 | L224 Y225 N230 F239 | L224-F228 HydrophobicContact CD2-CD2 4.4Å; L224-F228 HydrophobicContact CD2-CE2 3.87Å; L224-F228 WeakPolarHBondContact O-CD2 3.48Å; L224-F228 PolarHBondContact O-N 2.93Å; Y225-F228 PolarHBondContact O-N 2.91Å; F228-N230 PolarHBondContact O-N 3.3Å; F228-F239 HydrophobicContact CZ-CE1 4.45Å |
| 229 | A | 82.1 | Confident | 77.7 | Confident | 41 Ų | 41 | 74.4 Ų | 74.4 | 34% | 0.339 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -72.9 | 12.8 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | Y225 L231 | Y225-A229 HydrophobicContact CD2-CB 3.79Å; Y225-A229 HydrophobicContact CE1-CB 4.34Å; Y225-A229 HydrophobicContact CE2-CB 3.55Å; Y225-A229 HydrophobicContact CG-CB 4.28Å; Y225-A229 WeakPolarHBondContact O-CB 3.45Å; Y225-A229 PolarHBondContact O-N 3.04Å; A229-L231 HydrophobicContact CB-CG 4.35Å; A229-L231 PolarHBondContact O-N 3.3Å |
| 230 | N | 60.9 | Low | 77.8 | Confident | 144 Ų | 144 | 72.7 Ų | 72.7 | 77% | 0.77 | 39% | 0.385 | S | S | * | . | trans | 41.6 | 42.3 | 177.4 | -71.3 | -30.8 | 0 | 0 | 0 | 113.8 | F228 E232 | F228-N230 PolarHBondContact O-N 3.3Å; N230-E232 PolarHBondContact O-N 3.35Å | ||
| 231 | L | 62.8 | Low | 78.1 | Confident | 92 Ų | 92 | 70.6 Ų | 70.6 | 48% | 0.482 | 38% | 0.376 | S | S | . | . | trans | -66.7 | 106.9 | 174.1 | -62.6 | 174.1 | 0 | 0 | 0 | 107.6 | Y225 A229 G233 G234 | Y225-L231 HydrophobicContact CE1-CD1 4.17Å; A229-L231 HydrophobicContact CB-CG 4.35Å; A229-L231 PolarHBondContact O-N 3.3Å; L231-G233 PolarHBondContact O-N 3.32Å; L231-G234 PolarHBondContact O-N 3.22Å | ||
| 232 | E | 50.5 | Low | 78.3 | Confident | 199 Ų | 199 | 69.5 Ų | 69.5 | 93% | 0.93 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51 | 126.8 | 177.8 | -69.3 | -174.8 | 160 | 0 | 0 | 110 | N230 G234 | N230-E232 PolarHBondContact O-N 3.35Å; E232-G234 VanDerWaalsContact C-N 3.33Å; E232-G234 PolarHBondContact O-N 3.14Å |
| 233 | G | 54.7 | Low | 78.7 | Confident | 81 Ų | 81 | 67 Ų | 67 | 84% | 0.835 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.2 | -0.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | L231 | L231-G233 PolarHBondContact O-N 3.32Š|
| 234 | G | 56.4 | Low | 79.2 | Confident | 47 Ų | 47 | 67.2 Ų | 67.2 | 49% | 0.485 | 36% | 0.361 | S | S | . | . | P | Polyproline II helix | trans | -78.2 | 132.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | L231 E232 K236 | L231-G234 PolarHBondContact O-N 3.22Å; E232-G234 VanDerWaalsContact C-N 3.33Å; E232-G234 PolarHBondContact O-N 3.14Å; G234-K236 PolarHBondContact O-N 3.41Å |
| 235 | V | 64.2 | Low | 79.6 | Confident | 36 Ų | 36 | 64.7 Ų | 64.7 | 22% | 0.218 | 35% | 0.347 | C | S | . | . | P | Polyproline II helix | trans | -67.9 | 120.5 | 171.4 | 177.5 | 0 | 0 | 0 | 0 | 110.1 | W98 A123 R226 V237 | W98-V235 HydrophobicContact CH2-CG1 3.4Å; W98-V235 VanDerWaalsContact CH2-CG1 3.4Å; W98-V235 HydrophobicContact CZ2-CB 4.38Å; W98-V235 HydrophobicContact CZ2-CG1 3.59Å; W98-V235 HydrophobicContact CZ2-CG2 3.86Å; A123-V235 HydrophobicContact CB-CB 4.25Å; A123-V235 HydrophobicContact CB-CG1 3.94Å; A123-V235 HydrophobicContact CB-CG2 4.16Å; R226-V235 PolarHBondContact NH2-O 2.98Å; R226-V235 VanDerWaalsContact NH2-O 3.12Å; V235-V237 PolarHBondContact O-N 2.94Å |
| 236 | K | 71.1 | Confident | 80.1 | Confident | 143 Ų | 143 | 59.9 Ų | 59.9 | 62% | 0.622 | 33% | 0.33 | S | S | * | . | P | Polyproline II helix | trans | -63.9 | 125.6 | 179.1 | -67.2 | -176.1 | 179.7 | 178.9 | 0 | 110.6 | G234 | G234-K236 PolarHBondContact O-N 3.41Š|
| 237 | V | 78.5 | Confident | 80.8 | Confident | 15 Ų | 15 | 60.4 Ų | 60.4 | 9% | 0.091 | 34% | 0.341 | C | S | . | . | P | Polyproline II helix | trans | -82.6 | 139.4 | 175.5 | -176.4 | 0 | 0 | 0 | 0 | 109.5 | A223 R226 R227 V235 F239 H242 | A223-V237 HydrophobicContact CB-CG1 4Å; R226-V237 HydrophobicContact CB-CG2 4.12Å; R227-V237 WeakPolarHBondContact CD-O 3.33Å; R227-V237 PolarHBondContact NH1-O 3.15Å; V235-V237 PolarHBondContact O-N 2.94Å; V237-F239 PolarHBondContact O-N 3.2Å; V237-H242 WeakPolarHBondContact CG1-CE1 3.25Å |
| 238 | S | 84.8 | Confident | 81.5 | Confident | 10 Ų | 10 | 58.6 Ų | 58.6 | 7% | 0.07 | 33% | 0.334 | C | S | . | . | trans | -85.5 | 98.5 | 171.4 | 179.6 | 0 | 0 | 0 | 0 | 110.3 | S166 V240 A241 H242 | S166-S238 PolarHBondContact OG-OG 2.97Å; S238-V240 PolarHBondContact O-N 3.05Å; S238-A241 PolarHBondContact O-N 3.22Å; S238-A241 WeakPolarHBondContact OG-CB 3.39Å; S238-A241 PolarHBondContact OG-N 2.95Å; S238-A241 VanDerWaalsContact OG-N 3.13Å; S238-H242 PolarHBondContact O-CD2 3.25Å; S238-H242 PolarHBondContact O-N 3.34Å | ||
| 239 | F | 90.1 | Very high | 82 | Confident | 59 Ų | 59 | 52.3 Ų | 52.3 | 26% | 0.259 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -67.3 | -26.2 | 173.6 | 79.2 | -84.8 | 0 | 0 | 0 | 111.9 | F220 L224 R227 F228 V237 H242 L243 | F220-F239 HydrophobicContact CE2-CB 4.38Å; F220-F239 HydrophobicContact CZ-CB 4.34Å; F220-F239 HydrophobicContact CZ-CD2 4.37Å; L224-F239 HydrophobicContact CD2-CB 3.84Å; L224-F239 HydrophobicContact CD2-CD2 4.18Å; L224-F239 HydrophobicContact CD2-CG 3.94Å; R227-F239 HydrophobicContact CG-CD1 4.36Å; F228-F239 HydrophobicContact CZ-CE1 4.45Å; V237-F239 PolarHBondContact O-N 3.2Å; F239-H242 WeakPolarHBondContact O-CB 3.35Å; F239-H242 PolarHBondContact O-N 3.2Å; F239-L243 PolarHBondContact O-N 2.99Å |
| 240 | V | 94.4 | Very high | 82.7 | Confident | 11 Ų | 11 | 53 Ų | 53 | 7% | 0.067 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.8 | -40.8 | 176 | -178.4 | 0 | 0 | 0 | 0 | 110.5 | A165 F169 D170 S238 H242 L243 G244 | A165-V240 VanDerWaalsContact C-CG1 3.48Å; A165-V240 HydrophobicContact CB-CG1 3.91Å; A165-V240 WeakPolarHBondContact O-CG1 3.17Å; F169-V240 HydrophobicContact CB-CG1 3.97Å; F169-V240 HydrophobicContact CB-CG2 4.39Å; F169-V240 HydrophobicContact CD2-CG1 4.27Å; D170-V240 HydrophobicContact CB-CG2 4.12Å; S238-V240 PolarHBondContact O-N 3.05Å; V240-H242 VanDerWaalsContact C-N 3.28Å; V240-H242 PolarHBondContact O-N 3.26Å; V240-L243 PolarHBondContact O-N 3.42Å; V240-G244 PolarHBondContact O-N 3.39Å |
| 241 | A | 95.6 | Very high | 84.3 | Confident | 3 Ų | 3 | 47.8 Ų | 47.8 | 3% | 0.025 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.3 | -41.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | G162 S166 L175 S238 G244 G245 | G162-A241 WeakPolarHBondContact CA-O 3.25Å; G162-A241 WeakPolarHBondContact O-CA 3.13Å; S166-A241 WeakPolarHBondContact OG-CA 3.49Å; S166-A241 WeakPolarHBondContact OG-CB 3.43Å; S166-A241 PolarHBondContact OG-N 3.33Å; L175-A241 HydrophobicContact CD2-CB 4.5Å; S238-A241 PolarHBondContact O-N 3.22Å; S238-A241 WeakPolarHBondContact OG-CB 3.39Å; S238-A241 PolarHBondContact OG-N 2.95Å; S238-A241 VanDerWaalsContact OG-N 3.13Å; A241-G244 PolarHBondContact O-N 3.19Å; A241-G245 PolarHBondContact O-N 3.31Å |
| 242 | H | 96.3 | Very high | 85.8 | Confident | 9 Ų | 9 | 44.2 Ų | 44.2 | 4% | 0.042 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.5 | -46 | 177 | -62.5 | -176.3 | 0 | 0 | 0 | 111.2 | S179 Y183 F220 V237 S238 F239 V240 G245 I246 | S179-H242 VanDerWaalsContact CB-NE2 3.33Å; S179-H242 WeakPolarHBondContact CB-NE2 3.5Å; S179-H242 PolarHBondContact OG-CD2 2.74Å; S179-H242 PolarHBondContact OG-NE2 2.55Å; Y183-H242 WeakPolarHBondContact CB-O 3.21Å; Y183-H242 HydrophobicContact CD1-CB 3.82Å; Y183-H242 HydrophobicContact CD2-CB 3.77Å; Y183-H242 AromaticContact CD2-CD2 3.77Å; Y183-H242 AromaticContact CD2-CG 3.6Å; Y183-H242 AromaticContact CD2-ND1 4Å; Y183-H242 HydrophobicContact CE1-CB 3.8Å; Y183-H242 HydrophobicContact CE2-CB 3.79Å; Y183-H242 AromaticContact CE2-CD2 3.7Å; Y183-H242 AromaticContact CE2-CE1 3.53Å; Y183-H242 AromaticContact CE2-CG 3.32Å; Y183-H242 AromaticContact CE2-ND1 3.22Å; Y183-H242 WeakPolarHBondContact CE2-ND1 3.49Å; Y183-H242 AromaticContact CE2-NE2 3.85Å; Y183-H242 HydrophobicContact CG-CB 3.76Å; Y183-H242 AromaticContact CZ-CE1 3.94Å; Y183-H242 AromaticContact CZ-CG 3.59Å; Y183-H242 AromaticContact CZ-ND1 3.27Å; Y183-H242 VanDerWaalsContact CZ-ND1 3.27Å; Y183-H242 PolarHBondContact OH-ND1 3.12Å; F220-H242 HydrophobicContact CD2-CB 4.06Å; F220-H242 HydrophobicContact CE2-CB 3.89Å; V237-H242 WeakPolarHBondContact CG1-CE1 3.25Å; S238-H242 PolarHBondContact O-CD2 3.25Å; S238-H242 PolarHBondContact O-N 3.34Å; F239-H242 WeakPolarHBondContact O-CB 3.35Å; F239-H242 PolarHBondContact O-N 3.2Å; V240-H242 VanDerWaalsContact C-N 3.28Å; V240-H242 PolarHBondContact O-N 3.26Å; H242-G245 WeakPolarHBondContact O-CA 3.14Å; H242-G245 PolarHBondContact O-N 2.95Å; H242-I246 WeakPolarHBondContact O-CG1 3.42Å; H242-I246 PolarHBondContact O-N 3.22Å |
| 243 | L | 96.4 | Very high | 87.8 | Confident | 86 Ų | 86 | 34.7 Ų | 34.7 | 45% | 0.45 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -63 | -44.2 | 178.2 | -175.7 | 62.1 | 0 | 0 | 0 | 112.1 | F239 V240 G245 I246 V247 | F239-L243 PolarHBondContact O-N 2.99Å; V240-L243 PolarHBondContact O-N 3.42Å; L243-G245 VanDerWaalsContact C-N 3.27Å; L243-G245 PolarHBondContact O-N 3.23Å; L243-I246 PolarHBondContact O-N 3.02Å; L243-V247 WeakPolarHBondContact O-CG2 3.43Å; L243-V247 PolarHBondContact O-N 2.77Å |
| 244 | G | 97.3 | Very high | 89.6 | Confident | 10 Ų | 10 | 32.1 Ų | 32.1 | 10% | 0.103 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -57.7 | -41.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | V240 A241 V247 A248 | V240-G244 PolarHBondContact O-N 3.39Å; A241-G244 PolarHBondContact O-N 3.19Å; G244-V247 PolarHBondContact O-N 3.45Å; G244-A248 WeakPolarHBondContact O-CB 3.1Å; G244-A248 PolarHBondContact O-N 2.87Å |
| 245 | G | 97.8 | Very high | 91.1 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57.7 | -52.5 | 172 | 0 | 0 | 0 | 0 | 0 | 113 | G180 A184 A241 H242 L243 V247 A248 G249 | G180-G245 VanDerWaalsContact O-CA 3.27Å; G180-G245 WeakPolarHBondContact O-CA 3.46Å; A184-G245 WeakPolarHBondContact CA-O 3.25Å; A184-G245 WeakPolarHBondContact CB-O 3.4Å; A184-G245 PolarHBondContact N-O 2.88Å; A241-G245 PolarHBondContact O-N 3.31Å; H242-G245 WeakPolarHBondContact O-CA 3.14Å; H242-G245 PolarHBondContact O-N 2.95Å; L243-G245 VanDerWaalsContact C-N 3.27Å; L243-G245 PolarHBondContact O-N 3.23Å; G245-V247 VanDerWaalsContact C-N 3.35Å; G245-V247 PolarHBondContact O-N 2.84Å; G245-A248 PolarHBondContact O-N 3.36Å; G245-G249 PolarHBondContact O-N 3.08Å |
| 246 | I | 97.2 | Very high | 92.2 | Very high | 32 Ų | 32 | 31.5 Ų | 31.5 | 16% | 0.164 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -55.6 | -49.8 | 177.9 | -66 | 175.9 | 0 | 0 | 0 | 110.8 | Y183 V216 H242 L243 A248 G249 L250 | Y183-I246 HydrophobicContact CD1-CD1 3.71Å; Y183-I246 HydrophobicContact CD1-CG1 3.58Å; Y183-I246 HydrophobicContact CE1-CD1 4.2Å; Y183-I246 HydrophobicContact CG-CG1 4.31Å; Y183-I246 WeakPolarHBondContact O-CA 3.38Å; V216-I246 HydrophobicContact CG1-CD1 4.29Å; H242-I246 WeakPolarHBondContact O-CG1 3.42Å; H242-I246 PolarHBondContact O-N 3.22Å; L243-I246 PolarHBondContact O-N 3.02Å; I246-A248 VanDerWaalsContact C-N 3.35Å; I246-A248 PolarHBondContact O-N 3.28Å; I246-G249 PolarHBondContact O-N 2.81Å; I246-L250 HydrophobicContact CG2-CD1 3.79Å; I246-L250 HydrophobicContact CG2-CG 4.19Å; I246-L250 WeakPolarHBondContact O-CG 3.31Å; I246-L250 PolarHBondContact O-N 2.87Å |
| 247 | V | 97.1 | Very high | 92.8 | Very high | 78 Ų | 78 | 24.8 Ų | 24.8 | 47% | 0.473 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -63.4 | -41.7 | -177.1 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | L243 G244 G245 L250 T251 | L243-V247 WeakPolarHBondContact O-CG2 3.43Å; L243-V247 PolarHBondContact O-N 2.77Å; G244-V247 PolarHBondContact O-N 3.45Å; G245-V247 VanDerWaalsContact C-N 3.35Å; G245-V247 PolarHBondContact O-N 2.84Å; V247-L250 PolarHBondContact O-N 2.82Å; V247-T251 WeakPolarHBondContact O-CG2 3.5Å; V247-T251 PolarHBondContact O-N 2.94Å; V247-T251 PolarHBondContact O-OG1 3.27Å |
| 248 | A | 97.6 | Very high | 92.5 | Very high | 2 Ų | 2 | 24.9 Ų | 24.9 | 2% | 0.017 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63.8 | -42.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | A161 G244 G245 I246 L250 T251 I252 Y277 | A161-A248 HydrophobicContact CB-CB 3.72Å; G244-A248 WeakPolarHBondContact O-CB 3.1Å; G244-A248 PolarHBondContact O-N 2.87Å; G245-A248 PolarHBondContact O-N 3.36Å; I246-A248 VanDerWaalsContact C-N 3.35Å; I246-A248 PolarHBondContact O-N 3.28Å; A248-L250 PolarHBondContact O-N 3.16Å; A248-T251 PolarHBondContact O-N 3.44Å; A248-T251 PolarHBondContact O-OG1 3.06Å; A248-I252 VanDerWaalsContact O-CB 3.28Å; A248-I252 WeakPolarHBondContact O-CB 3.29Å; A248-I252 PolarHBondContact O-N 3.09Å; A248-Y277 HydrophobicContact CB-CE2 3.9Å |
| 249 | G | 96.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61 | -42.6 | 176 | 0 | 0 | 0 | 0 | 0 | 113.4 | A184 G188 G245 I246 G253 | A184-G249 VanDerWaalsContact O-CA 3.27Å; A184-G249 WeakPolarHBondContact O-CA 3.38Å; G188-G249 PolarHBondContact N-O 3.11Å; G245-G249 PolarHBondContact O-N 3.08Å; I246-G249 PolarHBondContact O-N 2.81Å; G249-G253 WeakPolarHBondContact O-CA 3.33Å; G249-G253 PolarHBondContact O-N 2.88Å |
| 250 | L | 95.5 | Very high | 89.6 | Confident | 57 Ų | 57 | 29.4 Ų | 29.4 | 30% | 0.298 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -65.9 | -41.7 | 176.9 | -70.5 | 172.2 | 0 | 0 | 0 | 111.8 | F190 I191 I246 V247 A248 Y254 | F190-L250 HydrophobicContact CD1-CD2 3.59Å; F190-L250 HydrophobicContact CE1-CD2 4.29Å; F190-L250 HydrophobicContact CG-CD2 4.45Å; I191-L250 HydrophobicContact CB-CD2 4.26Å; I246-L250 HydrophobicContact CG2-CD1 3.79Å; I246-L250 HydrophobicContact CG2-CG 4.19Å; I246-L250 WeakPolarHBondContact O-CG 3.31Å; I246-L250 PolarHBondContact O-N 2.87Å; V247-L250 PolarHBondContact O-N 2.82Å; A248-L250 PolarHBondContact O-N 3.16Å; L250-Y254 VanDerWaalsContact O-CB 3.28Å; L250-Y254 WeakPolarHBondContact O-CB 3.48Å; L250-Y254 PolarHBondContact O-N 3.1Å |
| 251 | T | 95.1 | Very high | 87.5 | Confident | 34 Ų | 34 | 33 Ų | 33 | 21% | 0.209 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -82 | -53.4 | -175.9 | 51.9 | 0 | 0 | 0 | 0 | 112.6 | V247 A248 Y254 V255 | V247-T251 WeakPolarHBondContact O-CG2 3.5Å; V247-T251 PolarHBondContact O-N 2.94Å; V247-T251 PolarHBondContact O-OG1 3.27Å; A248-T251 PolarHBondContact O-N 3.44Å; A248-T251 PolarHBondContact O-OG1 3.06Å; T251-Y254 VanDerWaalsContact O-CB 3.31Å; T251-Y254 WeakPolarHBondContact O-CB 3.27Å; T251-Y254 PolarHBondContact O-N 3.42Å; T251-V255 PolarHBondContact O-N 3.09Å |
| 252 | I | 94.9 | Very high | 85.5 | Confident | 16 Ų | 16 | 40 Ų | 40 | 8% | 0.082 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -72.6 | -35.1 | 179.3 | -56.5 | -55.7 | 0 | 0 | 0 | 110.9 | V154 A157 A248 Y254 V255 F256 Y277 | V154-I252 HydrophobicContact CG2-CG2 3.95Å; A157-I252 HydrophobicContact CB-CB 4.41Å; A157-I252 HydrophobicContact CB-CG1 4Å; A157-I252 HydrophobicContact CB-CG2 4.31Å; A248-I252 VanDerWaalsContact O-CB 3.28Å; A248-I252 WeakPolarHBondContact O-CB 3.29Å; A248-I252 PolarHBondContact O-N 3.09Å; I252-Y254 VanDerWaalsContact C-N 3.3Å; I252-Y254 PolarHBondContact O-N 2.94Å; I252-V255 WeakPolarHBondContact O-CB 3.48Å; I252-V255 PolarHBondContact O-N 3.42Å; I252-V255 VanDerWaalsContact O-N 3.16Å; I252-F256 HydrophobicContact CG2-CD2 3.63Å; I252-F256 HydrophobicContact CG2-CE2 3.64Å; I252-F256 WeakPolarHBondContact O-CD2 3.3Å; I252-F256 PolarHBondContact O-N 3.02Å; I252-F256 VanDerWaalsContact O-N 3.1Å; I252-Y277 HydrophobicContact CD1-CD1 3.9Å; I252-Y277 HydrophobicContact CD1-CD2 4.11Å; I252-Y277 HydrophobicContact CD1-CE1 4.48Å; I252-Y277 HydrophobicContact CD1-CG 3.7Å; I252-Y277 HydrophobicContact CG1-CD1 4.42Å; I252-Y277 HydrophobicContact CG1-CD2 4.03Å; I252-Y277 HydrophobicContact CG1-CE2 4.27Å; I252-Y277 HydrophobicContact CG1-CG 4.13Å |
| 253 | G | 92.4 | Very high | 83.7 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.5 | -34.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G249 V255 F256 F257 | G249-G253 WeakPolarHBondContact O-CA 3.33Å; G249-G253 PolarHBondContact O-N 2.88Å; G253-V255 VanDerWaalsContact C-N 3.32Å; G253-V255 PolarHBondContact O-N 2.93Å; G253-F256 PolarHBondContact O-N 3.18Å; G253-F257 WeakPolarHBondContact O-CA 3.39Å; G253-F257 WeakPolarHBondContact O-CB 3.27Å; G253-F257 WeakPolarHBondContact O-CG 3.18Å; G253-F257 PolarHBondContact O-N 2.93Å |
| 254 | Y | 91 | Very high | 82.3 | Confident | 27 Ų | 27 | 43.1 Ų | 43.1 | 11% | 0.106 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.5 | -45.9 | 171.3 | -175.4 | -87 | 0 | 0 | 0 | 111 | I191 V195 L250 T251 I252 F256 I258 N267 L269 | I191-Y254 HydrophobicContact CD1-CD2 4.03Å; I191-Y254 HydrophobicContact CG1-CD2 3.93Å; V195-Y254 HydrophobicContact CG1-CD2 4.16Å; V195-Y254 HydrophobicContact CG1-CE2 4.16Å; L250-Y254 VanDerWaalsContact O-CB 3.28Å; L250-Y254 WeakPolarHBondContact O-CB 3.48Å; L250-Y254 PolarHBondContact O-N 3.1Å; T251-Y254 VanDerWaalsContact O-CB 3.31Å; T251-Y254 WeakPolarHBondContact O-CB 3.27Å; T251-Y254 PolarHBondContact O-N 3.42Å; I252-Y254 VanDerWaalsContact C-N 3.3Å; I252-Y254 PolarHBondContact O-N 2.94Å; Y254-F256 PolarHBondContact O-N 3.39Å; Y254-I258 HydrophobicContact CD1-CD1 3.45Å; Y254-I258 VanDerWaalsContact CD1-CD1 3.45Å; Y254-I258 HydrophobicContact CD2-CD1 3.37Å; Y254-I258 HydrophobicContact CD2-CG1 4.46Å; Y254-I258 HydrophobicContact CE1-CD1 3.27Å; Y254-I258 HydrophobicContact CE2-CD1 3.19Å; Y254-I258 HydrophobicContact CG-CD1 3.46Å; Y254-I258 VanDerWaalsContact CG-CD1 3.46Å; Y254-I258 WeakPolarHBondContact O-CB 3.35Å; Y254-I258 WeakPolarHBondContact O-CD1 3.3Å; Y254-I258 WeakPolarHBondContact O-CG1 3.17Å; Y254-I258 PolarHBondContact O-N 2.87Å; Y254-N267 PolarHBondContact OH-ND2 2.96Å; Y254-L269 HydrophobicContact CD1-CG 4.37Å; Y254-L269 HydrophobicContact CD2-CD2 4.27Å; Y254-L269 HydrophobicContact CE1-CB 3.97Å; Y254-L269 HydrophobicContact CE1-CD2 4.13Å; Y254-L269 HydrophobicContact CE1-CG 3.75Å; Y254-L269 HydrophobicContact CE2-CD2 3.48Å; Y254-L269 VanDerWaalsContact CE2-CD2 3.48Å; Y254-L269 HydrophobicContact CE2-CG 4.02Å; Y254-L269 VanDerWaalsContact CZ-CD2 3.43Å; Y254-L269 WeakPolarHBondContact OH-CD2 3.49Å |
| 255 | V | 89.7 | Confident | 80.8 | Confident | 19 Ų | 19 | 46.7 Ų | 46.7 | 12% | 0.115 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.2 | -45.9 | -179.1 | 171 | 0 | 0 | 0 | 0 | 111.7 | T251 I252 G253 F270 C273 I274 | T251-V255 PolarHBondContact O-N 3.09Å; I252-V255 WeakPolarHBondContact O-CB 3.48Å; I252-V255 PolarHBondContact O-N 3.42Å; I252-V255 VanDerWaalsContact O-N 3.16Å; G253-V255 VanDerWaalsContact C-N 3.32Å; G253-V255 PolarHBondContact O-N 2.93Å; V255-F270 HydrophobicContact CB-CD2 4.46Å; V255-F270 HydrophobicContact CB-CE2 4.31Å; V255-F270 HydrophobicContact CG1-CD2 4.21Å; V255-F270 HydrophobicContact CG1-CE2 3.61Å; V255-F270 HydrophobicContact CG1-CZ 4.2Å; V255-F270 HydrophobicContact CG2-CD2 4.3Å; V255-F270 HydrophobicContact CG2-CE2 4.46Å; V255-C273 HydrophobicContact CG2-CB 3.95Å; V255-I274 HydrophobicContact CG1-CD1 4.17Å; V255-I274 HydrophobicContact CG1-CG1 4.28Å; V255-I274 HydrophobicContact CG2-CD1 4.28Å; V255-I274 HydrophobicContact CG2-CG1 3.69Å |
| 256 | F | 86.1 | Confident | 79.7 | Confident | 51 Ų | 51 | 54.7 Ų | 54.7 | 22% | 0.224 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -90.9 | -33.6 | -173.1 | -74 | -70.1 | 0 | 0 | 0 | 114.7 | E150 L153 V154 I252 G253 Y254 | E150-F256 HydrophobicContact CB-CB 4.09Å; E150-F256 HydrophobicContact CB-CD1 4.17Å; E150-F256 HydrophobicContact CB-CG 4.27Å; E150-F256 HydrophobicContact CG-CD1 4.04Å; L153-F256 HydrophobicContact CB-CE2 3.99Å; L153-F256 HydrophobicContact CB-CZ 4.26Å; L153-F256 HydrophobicContact CD1-CE1 3.88Å; L153-F256 HydrophobicContact CD1-CE2 4.05Å; L153-F256 HydrophobicContact CD1-CZ 3.44Å; L153-F256 VanDerWaalsContact CD1-CZ 3.44Å; L153-F256 HydrophobicContact CG-CZ 4.48Å; V154-F256 HydrophobicContact CG2-CD2 4.21Å; I252-F256 HydrophobicContact CG2-CD2 3.63Å; I252-F256 HydrophobicContact CG2-CE2 3.64Å; I252-F256 WeakPolarHBondContact O-CD2 3.3Å; I252-F256 PolarHBondContact O-N 3.02Å; I252-F256 VanDerWaalsContact O-N 3.1Å; G253-F256 PolarHBondContact O-N 3.18Å; Y254-F256 PolarHBondContact O-N 3.39Å |
| 257 | F | 83.9 | Confident | 79 | Confident | 1 Ų | 1 | 55.7 Ų | 55.7 | 0% | 0.004 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -92.4 | -2.2 | -173.1 | -55.4 | -27.8 | 0 | 0 | 0 | 114 | L142 H146 E150 V151 V154 G188 N192 G253 K259 | L142-F257 HydrophobicContact CD1-CE2 4.25Å; L142-F257 HydrophobicContact CD1-CZ 4.44Å; L142-F257 HydrophobicContact CD2-CD2 4.26Å; L142-F257 HydrophobicContact CD2-CE2 3.93Å; L142-F257 HydrophobicContact CD2-CZ 4.21Å; H146-F257 HydrophobicContact CB-CD1 3.62Å; H146-F257 HydrophobicContact CB-CE1 3.59Å; H146-F257 AromaticContact CD2-CD1 3.39Å; H146-F257 WeakPolarHBondContact CD2-CD1 3.44Å; H146-F257 AromaticContact CD2-CE1 3.79Å; H146-F257 AromaticContact CD2-CG 3.83Å; H146-F257 AromaticContact CE1-CD1 3.85Å; H146-F257 AromaticContact CE1-CG 3.99Å; H146-F257 PolarHBondContact CE1-O 2.66Å; H146-F257 AromaticContact CG-CD1 3.26Å; H146-F257 AromaticContact CG-CE1 3.7Å; H146-F257 AromaticContact ND1-CD1 3.59Å; H146-F257 AromaticContact NE2-CD1 3.75Å; H146-F257 AromaticContact NE2-CG 3.77Å; E150-F257 HydrophobicContact CB-CE1 4.35Å; V151-F257 HydrophobicContact CG2-CE1 4.05Å; V151-F257 HydrophobicContact CG2-CZ 4.08Å; V154-F257 HydrophobicContact CB-CZ 4.32Å; V154-F257 HydrophobicContact CG1-CE2 4.48Å; V154-F257 HydrophobicContact CG2-CE1 4.32Å; V154-F257 HydrophobicContact CG2-CE2 4.15Å; V154-F257 HydrophobicContact CG2-CZ 3.8Å; G188-F257 WeakPolarHBondContact O-CD2 3.45Å; N192-F257 HydrophobicContact CB-CB 4.16Å; N192-F257 HydrophobicContact CB-CD2 4.16Å; G253-F257 WeakPolarHBondContact O-CA 3.39Å; G253-F257 WeakPolarHBondContact O-CB 3.27Å; G253-F257 WeakPolarHBondContact O-CG 3.18Å; G253-F257 PolarHBondContact O-N 2.93Å; F257-K259 VanDerWaalsContact C-N 3.35Å; F257-K259 PolarHBondContact O-N 2.89Å |
| 258 | I | 72.8 | Confident | 78.5 | Confident | 18 Ų | 18 | 56.2 Ų | 56.2 | 9% | 0.092 | 29% | 0.292 | C | S | . | . | trans | -86 | 81.9 | 166.9 | -64.5 | 173.3 | 0 | 0 | 0 | 107.3 | V195 Y254 L264 | V195-I258 HydrophobicContact CB-CD1 4.44Å; V195-I258 HydrophobicContact CB-CG1 3.9Å; V195-I258 HydrophobicContact CG1-CD1 3.87Å; V195-I258 HydrophobicContact CG1-CG1 3.79Å; V195-I258 HydrophobicContact CG2-CG1 3.84Å; Y254-I258 HydrophobicContact CD1-CD1 3.45Å; Y254-I258 VanDerWaalsContact CD1-CD1 3.45Å; Y254-I258 HydrophobicContact CD2-CD1 3.37Å; Y254-I258 HydrophobicContact CD2-CG1 4.46Å; Y254-I258 HydrophobicContact CE1-CD1 3.27Å; Y254-I258 HydrophobicContact CE2-CD1 3.19Å; Y254-I258 HydrophobicContact CG-CD1 3.46Å; Y254-I258 VanDerWaalsContact CG-CD1 3.46Å; Y254-I258 WeakPolarHBondContact O-CB 3.35Å; Y254-I258 WeakPolarHBondContact O-CD1 3.3Å; Y254-I258 WeakPolarHBondContact O-CG1 3.17Å; Y254-I258 PolarHBondContact O-N 2.87Å; I258-L264 HydrophobicContact CB-CD2 3.8Å; I258-L264 HydrophobicContact CB-CG 4.44Å; I258-L264 HydrophobicContact CG2-CD1 4.06Å; I258-L264 HydrophobicContact CG2-CD2 3.67Å; I258-L264 HydrophobicContact CG2-CG 3.79Å; I258-L264 WeakPolarHBondContact O-CD1 3.46Å; I258-L264 WeakPolarHBondContact O-CD2 3.37Å | ||
| 259 | K | 59.1 | Low | 78.1 | Confident | 97 Ų | 97 | 59.6 Ų | 59.6 | 42% | 0.422 | 31% | 0.31 | S | S | . | . | trans | -108.3 | 13.1 | 175 | -88.7 | -172.6 | 170.4 | 175 | 0 | 114.5 | E150 F257 | E150-K259 WeakPolarHBondContact OE1-CE 3.26Å; E150-K259 IonicContact OE1-NZ 2.66Å; E150-K259 PolarHBondContact OE1-NZ 2.83Å; E150-K259 VanDerWaalsContact OE2-CE 3.28Å; E150-K259 WeakPolarHBondContact OE2-CE 3.23Å; E150-K259 IonicContact OE2-NZ 3.5Å; E150-K259 PolarHBondContact OE2-NZ 2.88Å; F257-K259 VanDerWaalsContact C-N 3.35Å; F257-K259 PolarHBondContact O-N 2.89Å | ||
| 260 | F | 54.1 | Low | 77.7 | Confident | 66 Ų | 66 | 61 Ų | 61 | 29% | 0.289 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -104 | 6.2 | -176.7 | -62.6 | -91.4 | 0 | 0 | 0 | 114.5 | N196 | N196-F260 HydrophobicContact CB-CE2 4.43Å; N196-F260 VanDerWaalsContact CG-CE2 3.42Å; N196-F260 WeakPolarHBondContact OD1-CD2 3.28Å; N196-F260 WeakPolarHBondContact OD1-CE2 3.32Å |
| 261 | N | 50 | Low | 77.4 | Confident | 87 Ų | 87 | 65.1 Ų | 65.1 | 47% | 0.465 | 33% | 0.327 | S | S | . | . | trans | -134.5 | 110.3 | -178.1 | -160.3 | -12.1 | 0 | 0 | 0 | 111 | K263 L264 | N261-K263 PolarHBondContact O-N 2.95Å; N261-K263 PolarHBondContact OD1-N 3.14Å; N261-L264 WeakPolarHBondContact O-CD1 3.39Å; N261-L264 PolarHBondContact O-N 2.75Å | ||
| 262 | T | 53.6 | Low | 77.3 | Confident | 150 Ų | 150 | 68.6 Ų | 68.6 | 92% | 0.92 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | 2 | 178.1 | 42.2 | 0 | 0 | 0 | 0 | 114.1 | ||
| 263 | K | 60.2 | Low | 77.2 | Confident | 126 Ų | 126 | 68.4 Ų | 68.4 | 55% | 0.548 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.7 | 23.6 | 178.3 | -60.3 | -177.4 | -176.3 | 176 | 0 | 114 | N261 C265 K266 N267 | N261-K263 PolarHBondContact O-N 2.95Å; N261-K263 PolarHBondContact OD1-N 3.14Å; K263-C265 PolarHBondContact O-N 2.84Å; K263-K266 HydrophobicContact CB-CB 4.31Å; K263-K266 HydrophobicContact CB-CD 4.25Å; K263-K266 HydrophobicContact CB-CG 4.46Å; K263-K266 HydrophobicContact CD-CD 4.46Å; K263-K266 HydrophobicContact CG-CD 4.27Å; K263-K266 WeakPolarHBondContact O-CA 3.24Å; K263-K266 WeakPolarHBondContact O-CB 3.38Å; K263-K266 PolarHBondContact O-N 3.37Å; K263-N267 PolarHBondContact O-N 3.29Å |
| 264 | L | 65.6 | Low | 77.2 | Confident | 34 Ų | 34 | 71.3 Ų | 71.3 | 18% | 0.178 | 36% | 0.359 | C | S | . | . | G | 310 helix | trans | -50.9 | -49.4 | 179.9 | -91.4 | 116.7 | 0 | 0 | 0 | 114.3 | I258 N261 K266 N267 F270 | I258-L264 HydrophobicContact CB-CD2 3.8Å; I258-L264 HydrophobicContact CB-CG 4.44Å; I258-L264 HydrophobicContact CG2-CD1 4.06Å; I258-L264 HydrophobicContact CG2-CD2 3.67Å; I258-L264 HydrophobicContact CG2-CG 3.79Å; I258-L264 WeakPolarHBondContact O-CD1 3.46Å; I258-L264 WeakPolarHBondContact O-CD2 3.37Å; N261-L264 WeakPolarHBondContact O-CD1 3.39Å; N261-L264 PolarHBondContact O-N 2.75Å; L264-K266 PolarHBondContact O-N 2.82Å; L264-K266 VanDerWaalsContact O-N 3.1Å; L264-N267 VanDerWaalsContact O-CB 3.3Å; L264-N267 WeakPolarHBondContact O-CB 3.29Å; L264-N267 PolarHBondContact O-N 3.06Å; L264-F270 HydrophobicContact CB-CD2 4.47Å; L264-F270 HydrophobicContact CD2-CD2 3.7Å; L264-F270 HydrophobicContact CD2-CE2 4.06Å |
| 265 | C | 66.8 | Low | 77.3 | Confident | 86 Ų | 86 | 75.5 Ų | 75.5 | 58% | 0.581 | 38% | 0.382 | S | S | * | . | G | 310 helix | trans | -64.8 | -17.3 | -179.4 | -57.9 | 0 | 0 | 0 | 0 | 112.8 | K263 W271 | K263-C265 PolarHBondContact O-N 2.84Å; C265-W271 PolarHBondContact O-NE1 3.33Å |
| 266 | K | 74 | Confident | 77.6 | Confident | 168 Ų | 168 | 76.6 Ų | 76.6 | 73% | 0.73 | 40% | 0.397 | S | S | * | . | G | 310 helix | trans | -85.9 | -14 | 173.7 | -56.8 | -174 | 176.7 | -177.1 | 0 | 112.4 | K263 L264 P268 | K263-K266 HydrophobicContact CB-CB 4.31Å; K263-K266 HydrophobicContact CB-CD 4.25Å; K263-K266 HydrophobicContact CB-CG 4.46Å; K263-K266 HydrophobicContact CD-CD 4.46Å; K263-K266 HydrophobicContact CG-CD 4.27Å; K263-K266 WeakPolarHBondContact O-CA 3.24Å; K263-K266 WeakPolarHBondContact O-CB 3.38Å; K263-K266 PolarHBondContact O-N 3.37Å; L264-K266 PolarHBondContact O-N 2.82Å; L264-K266 VanDerWaalsContact O-N 3.1Å; K266-P268 WeakPolarHBondContact O-CD 3.37Å |
| 267 | N | 83.1 | Confident | 78 | Confident | 52 Ų | 52 | 75.6 Ų | 75.6 | 28% | 0.278 | 39% | 0.392 | S | S | . | . | trans | -81.3 | 117.7 | 177.1 | -172.4 | -21.9 | 0 | 0 | 0 | 109.4 | Y254 K263 L264 L269 F270 | Y254-N267 PolarHBondContact OH-ND2 2.96Å; K263-N267 PolarHBondContact O-N 3.29Å; L264-N267 VanDerWaalsContact O-CB 3.3Å; L264-N267 WeakPolarHBondContact O-CB 3.29Å; L264-N267 PolarHBondContact O-N 3.06Å; N267-L269 PolarHBondContact O-N 2.66Å; N267-L269 WeakPolarHBondContact OD1-CB 3.46Å; N267-L269 PolarHBondContact OD1-N 3.4Å; N267-F270 WeakPolarHBondContact O-CB 3.19Å; N267-F270 PolarHBondContact O-N 3.41Å | ||
| 268 | P | 86.3 | Confident | 78.6 | Confident | 89 Ų | 89 | 77.3 Ų | 77.3 | 58% | 0.578 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -60.5 | -29.5 | -179.6 | 25 | -34.6 | 0 | 0 | 0 | 112.5 | K266 F270 W271 I272 | K266-P268 WeakPolarHBondContact O-CD 3.37Å; P268-F270 VanDerWaalsContact C-N 3.26Å; P268-F270 PolarHBondContact O-N 2.72Å; P268-W271 PolarHBondContact O-N 3.11Å; P268-I272 VanDerWaalsContact O-CG1 3.32Å; P268-I272 WeakPolarHBondContact O-CG1 3.44Å; P268-I272 PolarHBondContact O-N 3.13Å |
| 269 | L | 88.2 | Confident | 79.7 | Confident | 73 Ų | 73 | 80.4 Ų | 80.4 | 38% | 0.382 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.3 | -31.6 | -179.3 | -172.3 | 54.1 | 0 | 0 | 0 | 112.5 | Y254 N267 W271 I272 C273 | Y254-L269 HydrophobicContact CD1-CG 4.37Å; Y254-L269 HydrophobicContact CD2-CD2 4.27Å; Y254-L269 HydrophobicContact CE1-CB 3.97Å; Y254-L269 HydrophobicContact CE1-CD2 4.13Å; Y254-L269 HydrophobicContact CE1-CG 3.75Å; Y254-L269 HydrophobicContact CE2-CD2 3.48Å; Y254-L269 VanDerWaalsContact CE2-CD2 3.48Å; Y254-L269 HydrophobicContact CE2-CG 4.02Å; Y254-L269 VanDerWaalsContact CZ-CD2 3.43Å; Y254-L269 WeakPolarHBondContact OH-CD2 3.49Å; N267-L269 PolarHBondContact O-N 2.66Å; N267-L269 WeakPolarHBondContact OD1-CB 3.46Å; N267-L269 PolarHBondContact OD1-N 3.4Å; L269-W271 PolarHBondContact O-N 3.43Å; L269-I272 HydrophobicContact CD1-CB 4.45Å; L269-I272 HydrophobicContact CD1-CG2 4.5Å; L269-I272 PolarHBondContact O-N 3.49Å; L269-C273 PolarHBondContact O-N 3.35Å; L269-C273 PolarHBondContact O-SG 2.93Å |
| 270 | F | 88.8 | Confident | 81.5 | Confident | 29 Ų | 29 | 78.4 Ų | 78.4 | 13% | 0.127 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -57.8 | -50 | 173.9 | 174.2 | -91.8 | 0 | 0 | 0 | 111.3 | V255 L264 N267 P268 C273 I274 | V255-F270 HydrophobicContact CB-CD2 4.46Å; V255-F270 HydrophobicContact CB-CE2 4.31Å; V255-F270 HydrophobicContact CG1-CD2 4.21Å; V255-F270 HydrophobicContact CG1-CE2 3.61Å; V255-F270 HydrophobicContact CG1-CZ 4.2Å; V255-F270 HydrophobicContact CG2-CD2 4.3Å; V255-F270 HydrophobicContact CG2-CE2 4.46Å; L264-F270 HydrophobicContact CB-CD2 4.47Å; L264-F270 HydrophobicContact CD2-CD2 3.7Å; L264-F270 HydrophobicContact CD2-CE2 4.06Å; N267-F270 WeakPolarHBondContact O-CB 3.19Å; N267-F270 PolarHBondContact O-N 3.41Å; P268-F270 VanDerWaalsContact C-N 3.26Å; P268-F270 PolarHBondContact O-N 2.72Å; F270-C273 PolarHBondContact O-N 3.04Å; F270-I274 HydrophobicContact CD1-CD1 3.89Å; F270-I274 HydrophobicContact CE1-CD1 3.34Å; F270-I274 HydrophobicContact CE2-CD1 4.14Å; F270-I274 HydrophobicContact CG-CD1 4.48Å; F270-I274 HydrophobicContact CZ-CD1 3.49Å; F270-I274 VanDerWaalsContact CZ-CD1 3.49Å; F270-I274 WeakPolarHBondContact O-CG1 3.31Å; F270-I274 PolarHBondContact O-N 3.18Å |
| 271 | W | 89.9 | Confident | 83.5 | Confident | 144 Ų | 144 | 77.4 Ų | 77.4 | 55% | 0.545 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -69.9 | -36.4 | 179.6 | -66.6 | 107.8 | 0 | 0 | 0 | 112.4 | C265 P268 L269 C273 I274 L275 | C265-W271 PolarHBondContact O-NE1 3.33Å; P268-W271 PolarHBondContact O-N 3.11Å; L269-W271 PolarHBondContact O-N 3.43Å; W271-C273 VanDerWaalsContact C-N 3.35Å; W271-I274 PolarHBondContact O-N 2.92Å; W271-L275 WeakPolarHBondContact O-CB 3.38Å; W271-L275 PolarHBondContact O-N 3Å |
| 272 | I | 92.9 | Very high | 85.7 | Confident | 108 Ų | 108 | 79.1 Ų | 79.1 | 55% | 0.554 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.2 | -43.8 | 174.9 | -68.5 | 166.1 | 0 | 0 | 0 | 110.7 | P268 L269 G276 | P268-I272 VanDerWaalsContact O-CG1 3.32Å; P268-I272 WeakPolarHBondContact O-CG1 3.44Å; P268-I272 PolarHBondContact O-N 3.13Å; L269-I272 HydrophobicContact CD1-CB 4.45Å; L269-I272 HydrophobicContact CD1-CG2 4.5Å; L269-I272 PolarHBondContact O-N 3.49Å; I272-G276 WeakPolarHBondContact O-CA 3.39Å; I272-G276 PolarHBondContact O-N 3.45Å |
| 273 | C | 93.4 | Very high | 87.8 | Confident | 12 Ų | 12 | 77 Ų | 77 | 8% | 0.081 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -62.9 | -46.5 | 177.3 | -70.9 | 0 | 0 | 0 | 0 | 112.1 | V255 L269 F270 W271 Y277 | V255-C273 HydrophobicContact CG2-CB 3.95Å; L269-C273 PolarHBondContact O-N 3.35Å; L269-C273 PolarHBondContact O-SG 2.93Å; F270-C273 PolarHBondContact O-N 3.04Å; W271-C273 VanDerWaalsContact C-N 3.35Å; C273-Y277 WeakPolarHBondContact O-CB 3.45Å; C273-Y277 PolarHBondContact O-N 3.4Å |
| 274 | I | 91.3 | Very high | 89.4 | Confident | 61 Ų | 61 | 71 Ų | 71 | 31% | 0.313 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64 | -50.6 | 179 | -67.2 | 174.8 | 0 | 0 | 0 | 110.9 | V255 F270 W271 G276 Y277 A278 | V255-I274 HydrophobicContact CG1-CD1 4.17Å; V255-I274 HydrophobicContact CG1-CG1 4.28Å; V255-I274 HydrophobicContact CG2-CD1 4.28Å; V255-I274 HydrophobicContact CG2-CG1 3.69Å; F270-I274 HydrophobicContact CD1-CD1 3.89Å; F270-I274 HydrophobicContact CE1-CD1 3.34Å; F270-I274 HydrophobicContact CE2-CD1 4.14Å; F270-I274 HydrophobicContact CG-CD1 4.48Å; F270-I274 HydrophobicContact CZ-CD1 3.49Å; F270-I274 VanDerWaalsContact CZ-CD1 3.49Å; F270-I274 WeakPolarHBondContact O-CG1 3.31Å; F270-I274 PolarHBondContact O-N 3.18Å; W271-I274 PolarHBondContact O-N 2.92Å; I274-G276 VanDerWaalsContact C-N 3.35Å; I274-G276 PolarHBondContact O-N 2.95Å; I274-Y277 PolarHBondContact O-N 2.91Å; I274-A278 WeakPolarHBondContact O-CB 3.31Å; I274-A278 PolarHBondContact O-N 3.02Å |
| 275 | L | 94.6 | Very high | 90.8 | Very high | 115 Ų | 115 | 72.9 Ų | 72.9 | 60% | 0.602 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -64.3 | -42.2 | -178.7 | -177.5 | 62.5 | 0 | 0 | 0 | 111 | W271 Y277 A278 V279 | W271-L275 WeakPolarHBondContact O-CB 3.38Å; W271-L275 PolarHBondContact O-N 3Å; L275-Y277 PolarHBondContact O-N 3.43Å; L275-A278 PolarHBondContact O-N 2.68Å; L275-V279 HydrophobicContact CD1-CG2 4.07Å; L275-V279 HydrophobicContact CG-CG2 4.24Å; L275-V279 WeakPolarHBondContact O-CB 3.36Å; L275-V279 VanDerWaalsContact O-CG2 3.25Å; L275-V279 WeakPolarHBondContact O-CG2 3.09Å; L275-V279 PolarHBondContact O-N 3.04Å |
| 276 | G | 95.1 | Very high | 92.1 | Very high | 41 Ų | 41 | 73.8 Ų | 73.8 | 42% | 0.423 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.2 | -45.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | I272 I274 F280 | I272-G276 WeakPolarHBondContact O-CA 3.39Å; I272-G276 PolarHBondContact O-N 3.45Å; I274-G276 VanDerWaalsContact C-N 3.35Å; I274-G276 PolarHBondContact O-N 2.95Å; G276-F280 WeakPolarHBondContact O-CB 3.27Å; G276-F280 PolarHBondContact O-N 2.77Å |
| 277 | Y | 95.1 | Very high | 93.1 | Very high | 30 Ų | 30 | 67.1 Ų | 67.1 | 12% | 0.118 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.9 | -41.8 | 176.3 | -169.7 | -99.5 | 0 | 0 | 0 | 112.1 | A157 A161 A248 I252 C273 I274 L275 F280 L281 | A157-Y277 WeakPolarHBondContact CA-OH 3.31Å; A157-Y277 HydrophobicContact CB-CE1 4.37Å; A157-Y277 HydrophobicContact CB-CE2 4.27Å; A157-Y277 WeakPolarHBondContact CB-OH 3.44Å; A157-Y277 PolarHBondContact O-OH 3.3Å; A161-Y277 HydrophobicContact CB-CE2 4.07Å; A248-Y277 HydrophobicContact CB-CE2 3.9Å; I252-Y277 HydrophobicContact CD1-CD1 3.9Å; I252-Y277 HydrophobicContact CD1-CD2 4.11Å; I252-Y277 HydrophobicContact CD1-CE1 4.48Å; I252-Y277 HydrophobicContact CD1-CG 3.7Å; I252-Y277 HydrophobicContact CG1-CD1 4.42Å; I252-Y277 HydrophobicContact CG1-CD2 4.03Å; I252-Y277 HydrophobicContact CG1-CE2 4.27Å; I252-Y277 HydrophobicContact CG1-CG 4.13Å; C273-Y277 WeakPolarHBondContact O-CB 3.45Å; C273-Y277 PolarHBondContact O-N 3.4Å; I274-Y277 PolarHBondContact O-N 2.91Å; L275-Y277 PolarHBondContact O-N 3.43Å; Y277-F280 PolarHBondContact O-N 3.36Å; Y277-L281 HydrophobicContact CD1-CD1 3.92Å; Y277-L281 HydrophobicContact CD1-CG 4.1Å; Y277-L281 HydrophobicContact CE1-CD1 3.47Å; Y277-L281 VanDerWaalsContact CE1-CD1 3.47Å; Y277-L281 HydrophobicContact CE1-CD2 4.17Å; Y277-L281 HydrophobicContact CE1-CG 3.78Å; Y277-L281 WeakPolarHBondContact O-CG 3.38Å; Y277-L281 PolarHBondContact O-N 3.43Å |
| 278 | A | 95.3 | Very high | 93.6 | Very high | 38 Ų | 38 | 65.7 Ų | 65.7 | 31% | 0.314 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.2 | -44.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I274 L275 F280 L281 I282 | I274-A278 WeakPolarHBondContact O-CB 3.31Å; I274-A278 PolarHBondContact O-N 3.02Å; L275-A278 PolarHBondContact O-N 2.68Å; A278-F280 VanDerWaalsContact C-N 3.34Å; A278-F280 PolarHBondContact O-N 3.1Å; A278-L281 PolarHBondContact O-N 3.25Å; A278-I282 VanDerWaalsContact O-CG1 3.29Å; A278-I282 WeakPolarHBondContact O-CG1 3.36Å; A278-I282 PolarHBondContact O-N 3.28Å |
| 279 | V | 96.6 | Very high | 93.8 | Very high | 82 Ų | 82 | 66.8 Ų | 66.8 | 50% | 0.497 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -61.2 | -44.3 | 175.6 | 168.8 | 0 | 0 | 0 | 0 | 110.5 | L275 I282 F283 | L275-V279 HydrophobicContact CD1-CG2 4.07Å; L275-V279 HydrophobicContact CG-CG2 4.24Å; L275-V279 WeakPolarHBondContact O-CB 3.36Å; L275-V279 VanDerWaalsContact O-CG2 3.25Å; L275-V279 WeakPolarHBondContact O-CG2 3.09Å; L275-V279 PolarHBondContact O-N 3.04Å; V279-I282 PolarHBondContact O-N 3.33Å; V279-F283 VanDerWaalsContact O-CB 3.29Å; V279-F283 WeakPolarHBondContact O-CB 3.31Å; V279-F283 PolarHBondContact O-N 3.3Å |
| 280 | F | 97 | Very high | 94 | Very high | 55 Ų | 55 | 70 Ų | 70 | 24% | 0.241 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -58.8 | -46.9 | 174.8 | 165.1 | -105.5 | 0 | 0 | 0 | 112 | A161 L164 A165 I168 G276 Y277 A278 F283 A284 | A161-F280 HydrophobicContact CB-CE1 3.87Å; A161-F280 HydrophobicContact CB-CZ 4.48Å; L164-F280 HydrophobicContact CB-CE1 4.32Å; L164-F280 HydrophobicContact CB-CZ 3.92Å; A165-F280 HydrophobicContact CB-CZ 4.33Å; I168-F280 HydrophobicContact CD1-CE2 4.44Å; G276-F280 WeakPolarHBondContact O-CB 3.27Å; G276-F280 PolarHBondContact O-N 2.77Å; Y277-F280 PolarHBondContact O-N 3.36Å; A278-F280 VanDerWaalsContact C-N 3.34Å; A278-F280 PolarHBondContact O-N 3.1Å; F280-F283 PolarHBondContact O-N 3.42Å; F280-A284 HydrophobicContact CE2-CB 4.35Å; F280-A284 HydrophobicContact CZ-CB 4.46Å; F280-A284 WeakPolarHBondContact O-CB 3.45Å; F280-A284 PolarHBondContact O-N 3.29Å |
| 281 | L | 95.9 | Very high | 94 | Very high | 45 Ų | 45 | 73 Ų | 73 | 24% | 0.236 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.1 | -48 | 177.9 | -74.2 | -173.4 | 0 | 0 | 0 | 112 | L160 L164 Y277 A278 F283 A284 V285 | L160-L281 HydrophobicContact CD2-CD1 4.43Å; L160-L281 HydrophobicContact CD2-CD2 3.83Å; L160-L281 HydrophobicContact CG-CD2 4.12Å; L164-L281 HydrophobicContact CD1-CD2 3.38Å; Y277-L281 HydrophobicContact CD1-CD1 3.92Å; Y277-L281 HydrophobicContact CD1-CG 4.1Å; Y277-L281 HydrophobicContact CE1-CD1 3.47Å; Y277-L281 VanDerWaalsContact CE1-CD1 3.47Å; Y277-L281 HydrophobicContact CE1-CD2 4.17Å; Y277-L281 HydrophobicContact CE1-CG 3.78Å; Y277-L281 WeakPolarHBondContact O-CG 3.38Å; Y277-L281 PolarHBondContact O-N 3.43Å; A278-L281 PolarHBondContact O-N 3.25Å; L281-F283 VanDerWaalsContact C-N 3.34Å; L281-F283 PolarHBondContact O-N 3.1Å; L281-A284 PolarHBondContact O-N 2.87Å; L281-V285 WeakPolarHBondContact O-CB 3.27Å; L281-V285 VanDerWaalsContact O-CG2 3.27Å; L281-V285 WeakPolarHBondContact O-CG2 3.39Å; L281-V285 PolarHBondContact O-N 3.11Å |
| 282 | I | 96.5 | Very high | 93.5 | Very high | 124 Ų | 124 | 66.6 Ų | 66.6 | 64% | 0.636 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -60.3 | -47.6 | 179.8 | -68.1 | 164.9 | 0 | 0 | 0 | 110.1 | A278 V279 F286 | A278-I282 VanDerWaalsContact O-CG1 3.29Å; A278-I282 WeakPolarHBondContact O-CG1 3.36Å; A278-I282 PolarHBondContact O-N 3.28Å; V279-I282 PolarHBondContact O-N 3.33Å; I282-F286 WeakPolarHBondContact O-CB 3.31Å; I282-F286 PolarHBondContact O-N 2.91Å |
| 283 | F | 96.8 | Very high | 92.6 | Very high | 105 Ų | 105 | 65.7 Ų | 65.7 | 46% | 0.461 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.2 | -47.1 | 176.9 | 171.7 | -100.6 | 0 | 0 | 0 | 111.7 | I168 V279 F280 L281 F286 F287 | I168-F283 HydrophobicContact CD1-CD1 4.28Å; I168-F283 HydrophobicContact CD1-CE1 4.05Å; V279-F283 VanDerWaalsContact O-CB 3.29Å; V279-F283 WeakPolarHBondContact O-CB 3.31Å; V279-F283 PolarHBondContact O-N 3.3Å; F280-F283 PolarHBondContact O-N 3.42Å; L281-F283 VanDerWaalsContact C-N 3.34Å; L281-F283 PolarHBondContact O-N 3.1Å; F283-F286 PolarHBondContact O-N 2.81Å; F283-F287 HydrophobicContact CZ-CD2 4.43Å; F283-F287 WeakPolarHBondContact O-CB 3.48Å; F283-F287 PolarHBondContact O-N 3.3Å |
| 284 | A | 95.4 | Very high | 91.5 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -66.1 | -41.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L164 I168 F280 L281 F287 N288 | L164-A284 HydrophobicContact CB-CB 3.9Å; L164-A284 HydrophobicContact CD1-CB 4.11Å; L164-A284 HydrophobicContact CD2-CB 3.94Å; L164-A284 HydrophobicContact CG-CB 4.21Å; I168-A284 HydrophobicContact CD1-CB 3.73Å; F280-A284 HydrophobicContact CE2-CB 4.35Å; F280-A284 HydrophobicContact CZ-CB 4.46Å; F280-A284 WeakPolarHBondContact O-CB 3.45Å; F280-A284 PolarHBondContact O-N 3.29Å; L281-A284 PolarHBondContact O-N 2.87Å; A284-F287 PolarHBondContact O-N 3.42Å; A284-N288 WeakPolarHBondContact O-CB 3.26Å; A284-N288 PolarHBondContact O-N 3.31Å; A284-N288 PolarHBondContact O-ND2 2.96Å |
| 285 | V | 94 | Very high | 89.8 | Confident | 74 Ų | 74 | 70.9 Ų | 70.9 | 45% | 0.448 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.7 | -47.8 | 174.2 | 170.9 | 0 | 0 | 0 | 0 | 110.2 | L281 F287 N288 I289 | L281-V285 WeakPolarHBondContact O-CB 3.27Å; L281-V285 VanDerWaalsContact O-CG2 3.27Å; L281-V285 WeakPolarHBondContact O-CG2 3.39Å; L281-V285 PolarHBondContact O-N 3.11Å; V285-F287 VanDerWaalsContact C-N 3.34Å; V285-F287 PolarHBondContact O-N 2.88Å; V285-N288 PolarHBondContact O-N 3.45Å; V285-I289 HydrophobicContact CG1-CD1 3.7Å; V285-I289 HydrophobicContact CG1-CG1 4.49Å; V285-I289 WeakPolarHBondContact O-CG1 3.48Å; V285-I289 PolarHBondContact O-N 3.43Å |
| 286 | F | 95.1 | Very high | 89.6 | Confident | 105 Ų | 105 | 68.7 Ų | 68.7 | 46% | 0.461 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -57.5 | -46.8 | 176.1 | -178.4 | -91.1 | 0 | 0 | 0 | 111.7 | I282 F283 N288 I289 F290 I291 | I282-F286 WeakPolarHBondContact O-CB 3.31Å; I282-F286 PolarHBondContact O-N 2.91Å; F283-F286 PolarHBondContact O-N 2.81Å; F286-N288 VanDerWaalsContact C-N 3.33Å; F286-N288 PolarHBondContact O-N 3.04Å; F286-I289 PolarHBondContact O-N 3.08Å; F286-F290 HydrophobicContact CD1-CD2 4.4Å; F286-F290 AromaticContact CD2-CD2 3.34Å; F286-F290 HydrophobicContact CD2-CD2 3.34Å; F286-F290 AromaticContact CD2-CE2 3.63Å; F286-F290 HydrophobicContact CD2-CE2 3.63Å; F286-F290 HydrophobicContact CD2-CG 4.41Å; F286-F290 HydrophobicContact CE1-CB 4.38Å; F286-F290 HydrophobicContact CE1-CD2 4.42Å; F286-F290 AromaticContact CE2-CD2 3.36Å; F286-F290 HydrophobicContact CE2-CD2 3.36Å; F286-F290 AromaticContact CE2-CE2 3.74Å; F286-F290 HydrophobicContact CE2-CE2 3.74Å; F286-F290 HydrophobicContact CE2-CG 4.09Å; F286-F290 AromaticContact CG-CD2 3.88Å; F286-F290 HydrophobicContact CG-CD2 3.88Å; F286-F290 HydrophobicContact CG-CE2 4.49Å; F286-F290 HydrophobicContact CZ-CB 4.25Å; F286-F290 AromaticContact CZ-CD2 3.94Å; F286-F290 HydrophobicContact CZ-CD2 3.94Å; F286-F290 HydrophobicContact CZ-CG 4.29Å; F286-F290 WeakPolarHBondContact O-CD2 3.46Å; F286-F290 PolarHBondContact O-N 3.46Å; F286-I291 HydrophobicContact CD1-CD1 4.12Å; F286-I291 HydrophobicContact CE1-CD1 3.9Å; F286-I291 HydrophobicContact CE1-CG1 4.3Å |
| 287 | F | 94.1 | Very high | 89.3 | Confident | 28 Ų | 28 | 70.2 Ų | 70.2 | 12% | 0.123 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -57.9 | -45.6 | 177.2 | -179.5 | -85.7 | 0 | 0 | 0 | 111.8 | I168 F283 A284 V285 I289 I291 S292 | I168-F287 HydrophobicContact CB-CD1 4.4Å; I168-F287 HydrophobicContact CB-CE1 4.29Å; I168-F287 HydrophobicContact CG1-CB 4.49Å; I168-F287 HydrophobicContact CG1-CD1 3.66Å; I168-F287 HydrophobicContact CG1-CE1 4.03Å; I168-F287 HydrophobicContact CG1-CG 4.05Å; I168-F287 HydrophobicContact CG2-CE1 4.44Å; I168-F287 HydrophobicContact CG2-CE2 4.48Å; I168-F287 HydrophobicContact CG2-CZ 4.36Å; F283-F287 HydrophobicContact CZ-CD2 4.43Å; F283-F287 WeakPolarHBondContact O-CB 3.48Å; F283-F287 PolarHBondContact O-N 3.3Å; A284-F287 PolarHBondContact O-N 3.42Å; V285-F287 VanDerWaalsContact C-N 3.34Å; V285-F287 PolarHBondContact O-N 2.88Å; F287-I289 VanDerWaalsContact C-N 3.3Å; F287-I289 PolarHBondContact O-N 3.46Å; F287-I291 HydrophobicContact CD2-CB 3.78Å; F287-I291 HydrophobicContact CD2-CD1 4.07Å; F287-I291 HydrophobicContact CD2-CG1 4.49Å; F287-I291 HydrophobicContact CD2-CG2 3.75Å; F287-I291 HydrophobicContact CE2-CB 4.05Å; F287-I291 HydrophobicContact CE2-CG2 3.55Å; F287-I291 HydrophobicContact CG-CB 4.26Å; F287-I291 HydrophobicContact CZ-CG2 4.3Å; F287-I291 PolarHBondContact O-N 3.47Å; F287-S292 PolarHBondContact O-N 3.34Å |
| 288 | N | 92.9 | Very high | 89 | Confident | 21 Ų | 21 | 72.4 Ų | 72.4 | 11% | 0.112 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -67.2 | -30.3 | -179.3 | -83.9 | -88.4 | 0 | 0 | 0 | 113.2 | R109 S167 A284 V285 F286 | R109-N288 WeakPolarHBondContact CD-OD1 3.42Å; R109-N288 PolarHBondContact NH1-OD1 3.35Å; S167-N288 WeakPolarHBondContact CB-OD1 3.33Å; S167-N288 PolarHBondContact OG-ND2 2.99Å; S167-N288 PolarHBondContact OG-OD1 2.84Å; A284-N288 WeakPolarHBondContact O-CB 3.26Å; A284-N288 PolarHBondContact O-N 3.31Å; A284-N288 PolarHBondContact O-ND2 2.96Å; V285-N288 PolarHBondContact O-N 3.45Å; F286-N288 VanDerWaalsContact C-N 3.33Å; F286-N288 PolarHBondContact O-N 3.04Å |
| 289 | I | 91.4 | Very high | 88.6 | Confident | 112 Ų | 112 | 74.4 Ų | 74.4 | 57% | 0.574 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -82.6 | -41.3 | 179.4 | -64.3 | 169.8 | 0 | 0 | 0 | 111.6 | V285 F286 F287 | V285-I289 HydrophobicContact CG1-CD1 3.7Å; V285-I289 HydrophobicContact CG1-CG1 4.49Å; V285-I289 WeakPolarHBondContact O-CG1 3.48Å; V285-I289 PolarHBondContact O-N 3.43Å; F286-I289 PolarHBondContact O-N 3.08Å; F287-I289 VanDerWaalsContact C-N 3.3Å; F287-I289 PolarHBondContact O-N 3.46Å |
| 290 | F | 91.5 | Very high | 88.1 | Confident | 141 Ų | 141 | 73.9 Ų | 73.9 | 62% | 0.618 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -116.2 | -20.6 | -164.2 | -60.8 | -71.7 | 0 | 0 | 0 | 115.6 | F286 | F286-F290 HydrophobicContact CD1-CD2 4.4Å; F286-F290 AromaticContact CD2-CD2 3.34Å; F286-F290 HydrophobicContact CD2-CD2 3.34Å; F286-F290 AromaticContact CD2-CE2 3.63Å; F286-F290 HydrophobicContact CD2-CE2 3.63Å; F286-F290 HydrophobicContact CD2-CG 4.41Å; F286-F290 HydrophobicContact CE1-CB 4.38Å; F286-F290 HydrophobicContact CE1-CD2 4.42Å; F286-F290 AromaticContact CE2-CD2 3.36Å; F286-F290 HydrophobicContact CE2-CD2 3.36Å; F286-F290 AromaticContact CE2-CE2 3.74Å; F286-F290 HydrophobicContact CE2-CE2 3.74Å; F286-F290 HydrophobicContact CE2-CG 4.09Å; F286-F290 AromaticContact CG-CD2 3.88Å; F286-F290 HydrophobicContact CG-CD2 3.88Å; F286-F290 HydrophobicContact CG-CE2 4.49Å; F286-F290 HydrophobicContact CZ-CB 4.25Å; F286-F290 AromaticContact CZ-CD2 3.94Å; F286-F290 HydrophobicContact CZ-CD2 3.94Å; F286-F290 HydrophobicContact CZ-CG 4.29Å; F286-F290 WeakPolarHBondContact O-CD2 3.46Å; F286-F290 PolarHBondContact O-N 3.46Å |
| 291 | I | 88.5 | Confident | 87.5 | Confident | 93 Ų | 93 | 75.2 Ų | 75.2 | 48% | 0.477 | 41% | 0.405 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -118.4 | -32.4 | -169.3 | -57.1 | 177.6 | 0 | 0 | 0 | 112.3 | F286 F287 | F286-I291 HydrophobicContact CD1-CD1 4.12Å; F286-I291 HydrophobicContact CE1-CD1 3.9Å; F286-I291 HydrophobicContact CE1-CG1 4.3Å; F287-I291 HydrophobicContact CD2-CB 3.78Å; F287-I291 HydrophobicContact CD2-CD1 4.07Å; F287-I291 HydrophobicContact CD2-CG1 4.49Å; F287-I291 HydrophobicContact CD2-CG2 3.75Å; F287-I291 HydrophobicContact CE2-CB 4.05Å; F287-I291 HydrophobicContact CE2-CG2 3.55Å; F287-I291 HydrophobicContact CG-CB 4.26Å; F287-I291 HydrophobicContact CZ-CG2 4.3Å; F287-I291 PolarHBondContact O-N 3.47Å |
| 292 | S | 79.5 | Confident | 86.9 | Confident | 9 Ų | 9 | 77.4 Ų | 77.4 | 6% | 0.063 | 42% | 0.418 | C | S | . | . | trans | -46 | 127.4 | -167.1 | 167.6 | 0 | 0 | 0 | 0 | 113.7 | R109 F287 A294 S295 | R109-S292 PolarHBondContact NH1-OG 3.3Å; F287-S292 PolarHBondContact O-N 3.34Å; S292-A294 PolarHBondContact O-N 2.94Å; S292-A294 PolarHBondContact OG-N 3.24Å; S292-S295 PolarHBondContact O-OG 3.24Å | ||
| 293 | P | 75.6 | Confident | 86.1 | Confident | 89 Ų | 89 | 73.8 Ų | 73.8 | 58% | 0.578 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.3 | -5.6 | 177.8 | 32.1 | -36.2 | 0 | 0 | 0 | 113.5 | P171 S295 | P171-P293 HydrophobicContact CB-CG 4.12Å; P171-P293 HydrophobicContact CG-CG 4.09Å; P293-S295 VanDerWaalsContact C-N 3.3Å |
| 294 | A | 68.8 | Low | 85.3 | Confident | 17 Ų | 17 | 71.2 Ų | 71.2 | 14% | 0.14 | 40% | 0.396 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.2 | 14.6 | -179 | 0 | 0 | 0 | 0 | 0 | 113.8 | P106 L172 S292 | P106-A294 HydrophobicContact CB-CB 4.02Å; L172-A294 HydrophobicContact CD2-CB 4.17Å; S292-A294 PolarHBondContact O-N 2.94Å; S292-A294 PolarHBondContact OG-N 3.24Å |
| 295 | S | 56.3 | Low | 84.3 | Confident | 165 Ų | 165 | 77.6 Ų | 77.6 | 100% | 1.154 | 43% | 0.432 | S | S | * | . | trans | -81.4 | 0 | 178.7 | 60.7 | 0 | 0 | 0 | 0 | 113.2 | S292 P293 | S292-S295 PolarHBondContact O-OG 3.24Å; P293-S295 VanDerWaalsContact C-N 3.3Å |
Retrieved 295 of 295 residues in 138.9 ms
(Link to these results)