| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33.5 | Very low | 28.2 | Very low | 207 Ų | 207 | 169.4 Ų | 169.4 | 100% | 1.02 | 84% | 0.841 | S | S | * | * | 0 | 57.5 | 0 | -168 | -176.7 | 86.1 | 0 | 0 | 107.6 | |||||
| 2 | E | 34.5 | Very low | 28.3 | Very low | 182 Ų | 182 | 171.2 Ų | 171.2 | 85% | 0.85 | 84% | 0.841 | S | S | * | * | cis | 68.6 | 1 | 36.5 | -74.6 | 173.8 | 148.1 | 0 | 0 | 117.9 | ||||
| 3 | D | 31.8 | Very low | 28.3 | Very low | 137 Ų | 137 | 171.4 Ų | 171.4 | 73% | 0.733 | 84% | 0.839 | S | S | * | * | trans | -137.3 | 29.2 | -177.8 | -68.7 | -59.5 | 0 | 0 | 0 | 115.5 | ||||
| 4 | V | 28.3 | Very low | 28.5 | Very low | 130 Ų | 130 | 166.4 Ų | 166.4 | 79% | 0.788 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -137.7 | -8.9 | 177.8 | -168.9 | 0 | 0 | 0 | 0 | 114.7 | ||
| 5 | E | 27.2 | Very low | 29.1 | Very low | 184 Ų | 184 | 164.1 Ų | 164.1 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -98.6 | -3.3 | -176 | -135.9 | 166.5 | -171 | 0 | 0 | 113.8 | ||
| 6 | E | 27.5 | Very low | 29.5 | Very low | 167 Ų | 167 | 155.1 Ų | 155.1 | 78% | 0.78 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -95.8 | -4 | -171.6 | -145.9 | 167.3 | -156.6 | 0 | 0 | 114.4 | ||
| 7 | T | 26.3 | Very low | 30.1 | Very low | 130 Ų | 130 | 151.5 Ų | 151.5 | 80% | 0.798 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -107.8 | 12.8 | -175.2 | 43.6 | 0 | 0 | 0 | 0 | 115.7 | ||
| 8 | L | 24.4 | Very low | 30.6 | Very low | 160 Ų | 160 | 145 Ų | 145 | 84% | 0.838 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -123.2 | 8.5 | -177.9 | -128.4 | 134.3 | 0 | 0 | 0 | 114.6 | ||
| 9 | F | 24.4 | Very low | 31 | Very low | 192 Ų | 192 | 140.7 Ų | 140.7 | 84% | 0.842 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -115.4 | 6.2 | -175.9 | -98.7 | -83.7 | 0 | 0 | 0 | 115.5 | ||
| 10 | E | 25.1 | Very low | 31.5 | Very low | 195 Ų | 195 | 137.1 Ų | 137.1 | 91% | 0.911 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -94.6 | 1.2 | -177.8 | -85.6 | -168.1 | 155.7 | 0 | 0 | 116 | ||
| 11 | E | 27.5 | Very low | 32.1 | Very low | 179 Ų | 179 | 133.9 Ų | 133.9 | 84% | 0.836 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -108.1 | 9.7 | -171.1 | -133.9 | 175.1 | -165 | 0 | 0 | 116.1 | ||
| 12 | F | 29.4 | Very low | 32.5 | Very low | 191 Ų | 191 | 125.9 Ų | 125.9 | 84% | 0.838 | 61% | 0.612 | S | S | * | * | trans | -138.5 | 67.8 | -176.4 | -92.3 | -88.7 | 0 | 0 | 0 | 113.5 | ||||
| 13 | E | 27.8 | Very low | 32.4 | Very low | 174 Ų | 174 | 119.5 Ų | 119.5 | 81% | 0.813 | 59% | 0.588 | S | S | * | * | trans | -122.2 | 120.7 | 160.4 | -74.9 | -164.3 | 153.8 | 0 | 0 | 112.7 | ||||
| 14 | N | 30.8 | Very low | 32.9 | Very low | 101 Ų | 101 | 117.9 Ų | 117.9 | 54% | 0.54 | 58% | 0.579 | S | S | . | * | trans | 59.9 | 85.4 | 151.5 | -77.1 | -18.1 | 0 | 0 | 0 | 120.4 | S16 D20 | N14-S16 VanDerWaalsContact C-N 3.28Å; N14-S16 PolarHBondContact O-N 3.49Å; N14-S16 VanDerWaalsContact O-N 3.17Å; N14-D20 WeakPolarHBondContact CB-OD2 3.49Å | ||
| 15 | Y | 38.1 | Very low | 33.5 | Very low | 132 Ų | 132 | 117.4 Ų | 117.4 | 52% | 0.518 | 57% | 0.568 | S | S | . | * | trans | -83.4 | 76.7 | 146.5 | -83 | -85.6 | 0 | 0 | 0 | 111.1 | Y17 V200 | Y15-Y17 HydrophobicContact CD1-CD2 4.35Å; Y15-Y17 HydrophobicContact CE1-CD2 4.48Å; Y15-Y17 HydrophobicContact CE1-CE2 4.26Å; Y15-V200 HydrophobicContact CD1-CG2 3.77Å; Y15-V200 HydrophobicContact CE1-CG2 3.72Å; Y15-V200 HydrophobicContact CG-CG2 4.29Å | ||
| 16 | S | 36 | Very low | 33.9 | Very low | 20 Ų | 20 | 113 Ų | 113 | 14% | 0.14 | 56% | 0.558 | C | S | . | * | trans | -135.5 | 78.9 | 151.1 | -162.9 | 0 | 0 | 0 | 0 | 108.4 | N14 A18 L19 D20 | N14-S16 VanDerWaalsContact C-N 3.28Å; N14-S16 PolarHBondContact O-N 3.49Å; N14-S16 VanDerWaalsContact O-N 3.17Å; S16-A18 CarbonylContact O-C 3.59Å; S16-A18 PolarHBondContact O-N 3.01Å; S16-L19 PolarHBondContact O-N 3.24Å; S16-D20 PolarHBondContact O-N 3.4Å | ||
| 17 | Y | 38.7 | Very low | 34.3 | Very low | 95 Ų | 95 | 111.6 Ų | 111.6 | 37% | 0.373 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -46.9 | -28.7 | 178.7 | -114.3 | -100.9 | 0 | 0 | 0 | 113.9 | Y15 Y21 E269 I272 | Y15-Y17 HydrophobicContact CD1-CD2 4.35Å; Y15-Y17 HydrophobicContact CE1-CD2 4.48Å; Y15-Y17 HydrophobicContact CE1-CE2 4.26Å; Y17-Y21 WeakPolarHBondContact O-CB 3.38Å; Y17-E269 HydrophobicContact CD1-CG 4.38Å; Y17-E269 HydrophobicContact CE1-CG 4Å; Y17-E269 PolarHBondContact OH-O 3.3Å; Y17-I272 PolarHBondContact OH-O 3.49Å; Y17-I272 VanDerWaalsContact OH-O 3.08Å |
| 18 | A | 39.9 | Very low | 34.8 | Very low | 34 Ų | 34 | 111 Ų | 111 | 28% | 0.281 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -82.1 | -36 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | S16 Y22 Y188 | S16-A18 CarbonylContact O-C 3.59Å; S16-A18 PolarHBondContact O-N 3.01Å; A18-Y22 WeakPolarHBondContact O-CD2 3.37Å; A18-Y188 HydrophobicContact CB-CD2 4.45Å |
| 19 | L | 38.6 | Very low | 35.6 | Very low | 64 Ų | 64 | 112.6 Ų | 112.6 | 34% | 0.335 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -76.8 | -34.9 | -178.3 | -145.2 | 83.8 | 0 | 0 | 0 | 111.6 | S16 Y22 S23 | S16-L19 PolarHBondContact O-N 3.24Å; L19-Y22 CarbonylContact O-C 3.58Å; L19-Y22 PolarHBondContact O-N 3.48Å; L19-S23 VanDerWaalsContact O-CB 3.3Å; L19-S23 WeakPolarHBondContact O-CB 3.41Å; L19-S23 PolarHBondContact O-N 3.21Å; L19-S23 PolarHBondContact O-OG 2.96Å |
| 20 | D | 41 | Very low | 36.3 | Very low | 67 Ų | 67 | 110 Ų | 110 | 36% | 0.358 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -74.9 | -25.2 | 176.2 | -82.5 | -21.1 | 0 | 0 | 0 | 114 | N14 S16 Y22 S23 L24 | N14-D20 WeakPolarHBondContact CB-OD2 3.49Å; S16-D20 PolarHBondContact O-N 3.4Å; D20-Y22 PolarHBondContact O-N 3.22Å; D20-S23 VanDerWaalsContact CA-OG 3.31Å; D20-S23 WeakPolarHBondContact CA-OG 3.5Å; D20-S23 PolarHBondContact OD1-OG 3.35Å; D20-L24 WeakPolarHBondContact O-CB 3.48Å; D20-L24 PolarHBondContact O-N 3.03Å |
| 21 | Y | 42.5 | Very low | 37.2 | Very low | 71 Ų | 71 | 109.7 Ų | 109.7 | 28% | 0.278 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.5 | -30.2 | 169.4 | -172.1 | -88.8 | 0 | 0 | 0 | 112.4 | Y17 Q283 | Y17-Y21 WeakPolarHBondContact O-CB 3.38Å; Y21-Q283 HydrophobicContact CD2-CG 4.15Å; Y21-Q283 HydrophobicContact CE2-CB 4.31Å; Y21-Q283 HydrophobicContact CE2-CG 3.32Å |
| 22 | Y | 41.6 | Very low | 37.9 | Very low | 38 Ų | 38 | 107.4 Ų | 107.4 | 15% | 0.149 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -101.4 | -26.8 | 177.6 | -71.6 | -74.3 | 0 | 0 | 0 | 114 | A18 L19 D20 L24 E25 Y96 F101 L186 | A18-Y22 WeakPolarHBondContact O-CD2 3.37Å; L19-Y22 CarbonylContact O-C 3.58Å; L19-Y22 PolarHBondContact O-N 3.48Å; D20-Y22 PolarHBondContact O-N 3.22Å; Y22-L24 VanDerWaalsContact C-N 3.32Å; Y22-E25 WeakPolarHBondContact CD1-OE2 3.41Å; Y22-E25 WeakPolarHBondContact O-CB 3.46Å; Y22-E25 PolarHBondContact O-N 3.21Å; Y22-E25 VanDerWaalsContact O-N 3.14Å; Y22-Y96 PolarHBondContact OH-OH 3.05Å; Y22-F101 HydrophobicContact CE1-CB 3.75Å; Y22-F101 AromaticContact CE1-CD2 3.78Å; Y22-F101 HydrophobicContact CE1-CD2 3.78Å; Y22-F101 HydrophobicContact CE1-CG 4.02Å; Y22-F101 AromaticContact CZ-CG 3.94Å; Y22-F101 WeakPolarHBondContact OH-CB 3.23Å; Y22-F101 WeakPolarHBondContact OH-CG 3.26Å; Y22-L186 HydrophobicContact CD1-CD2 4.37Å; Y22-L186 HydrophobicContact CD2-CD1 3.54Å; Y22-L186 HydrophobicContact CD2-CD2 4.06Å; Y22-L186 HydrophobicContact CD2-CG 4.46Å; Y22-L186 HydrophobicContact CE1-CD2 4Å; Y22-L186 HydrophobicContact CE2-CD1 3.88Å; Y22-L186 HydrophobicContact CE2-CD2 3.7Å; Y22-L186 HydrophobicContact CE2-CG 4.4Å; Y22-L186 HydrophobicContact CG-CD1 4.1Å; Y22-L186 HydrophobicContact CG-CD2 4.43Å |
| 23 | S | 34.3 | Very low | 38.7 | Very low | 48 Ų | 48 | 106.7 Ų | 106.7 | 34% | 0.336 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -68.2 | -35.6 | 178 | 72.3 | 0 | 0 | 0 | 0 | 110.7 | L19 D20 E25 S26 | L19-S23 VanDerWaalsContact O-CB 3.3Å; L19-S23 WeakPolarHBondContact O-CB 3.41Å; L19-S23 PolarHBondContact O-N 3.21Å; L19-S23 PolarHBondContact O-OG 2.96Å; D20-S23 VanDerWaalsContact CA-OG 3.31Å; D20-S23 WeakPolarHBondContact CA-OG 3.5Å; D20-S23 PolarHBondContact OD1-OG 3.35Å; S23-E25 PolarHBondContact O-N 3.49Å; S23-S26 PolarHBondContact O-N 3.48Å; S23-S26 VanDerWaalsContact O-N 3.14Å; S23-S26 PolarHBondContact O-OG 3.29Å |
| 24 | L | 40.5 | Very low | 40 | Very low | 104 Ų | 104 | 101.9 Ų | 101.9 | 55% | 0.545 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -14.5 | 173.3 | -152.2 | 80.8 | 0 | 0 | 0 | 113.2 | D20 Y22 S26 | D20-L24 WeakPolarHBondContact O-CB 3.48Å; D20-L24 PolarHBondContact O-N 3.03Å; Y22-L24 VanDerWaalsContact C-N 3.32Å; L24-S26 PolarHBondContact O-N 3.18Å |
| 25 | E | 42.2 | Very low | 41.7 | Very low | 119 Ų | 119 | 98.7 Ų | 98.7 | 56% | 0.556 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -13.3 | 175.3 | -149.8 | 170.2 | -159.1 | 0 | 0 | 111.9 | Y22 S23 | Y22-E25 WeakPolarHBondContact CD1-OE2 3.41Å; Y22-E25 WeakPolarHBondContact O-CB 3.46Å; Y22-E25 PolarHBondContact O-N 3.21Å; Y22-E25 VanDerWaalsContact O-N 3.14Å; S23-E25 PolarHBondContact O-N 3.49Å |
| 26 | S | 34.9 | Very low | 43.8 | Very low | 93 Ų | 93 | 97.4 Ų | 97.4 | 65% | 0.65 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.5 | -20.9 | 177.1 | 65.2 | 0 | 0 | 0 | 0 | 114.8 | S23 L24 | S23-S26 PolarHBondContact O-N 3.48Å; S23-S26 VanDerWaalsContact O-N 3.14Å; S23-S26 PolarHBondContact O-OG 3.29Å; L24-S26 PolarHBondContact O-N 3.18Å |
| 27 | D | 36.6 | Very low | 46 | Very low | 137 Ų | 137 | 98.2 Ų | 98.2 | 73% | 0.733 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.4 | -4.6 | -168.5 | -77.8 | -26.4 | 0 | 0 | 0 | 116.2 | ||
| 28 | L | 37 | Very low | 48.1 | Very low | 116 Ų | 116 | 95.6 Ų | 95.6 | 61% | 0.607 | 50% | 0.504 | S | S | * | . | trans | -138.2 | 102.8 | 176.1 | -146.4 | 76.4 | 0 | 0 | 0 | 114.4 | E30 | L28-E30 HydrophobicContact CD2-CB 4.21Å; L28-E30 HydrophobicContact CG-CB 4.39Å; L28-E30 PolarHBondContact O-N 2.98Å | ||
| 29 | E | 40.3 | Very low | 50.4 | Low | 195 Ų | 195 | 102 Ų | 102 | 91% | 0.911 | 52% | 0.522 | S | S | * | . | trans | -67 | 63 | 168.7 | -158.9 | 170.6 | -154.1 | 0 | 0 | 111.4 | ||||
| 30 | E | 39.7 | Very low | 52.9 | Low | 138 Ų | 138 | 102.2 Ų | 102.2 | 65% | 0.645 | 53% | 0.525 | S | S | * | . | trans | -117.4 | 78.8 | 176.2 | -150.6 | 175.4 | -164.7 | 0 | 0 | 111.8 | L28 V32 | L28-E30 HydrophobicContact CD2-CB 4.21Å; L28-E30 HydrophobicContact CG-CB 4.39Å; L28-E30 PolarHBondContact O-N 2.98Å; E30-V32 PolarHBondContact O-N 3.45Å | ||
| 31 | K | 42.9 | Very low | 55.2 | Low | 187 Ų | 187 | 99 Ų | 99 | 81% | 0.813 | 51% | 0.508 | S | S | * | . | trans | -85.3 | 11.7 | -165.4 | -113.9 | 174.9 | -175 | 168.3 | 0 | 117.4 | ||||
| 32 | V | 43.9 | Very low | 57.6 | Low | 131 Ų | 131 | 96.6 Ų | 96.6 | 79% | 0.794 | 50% | 0.5 | S | S | * | . | S | Bend | trans | -108.8 | -14.5 | -155.8 | -177.1 | 0 | 0 | 0 | 0 | 117.7 | E30 | E30-V32 PolarHBondContact O-N 3.45Š|
| 33 | Q | 46.4 | Very low | 60.1 | Low | 176 Ų | 176 | 98.8 Ų | 98.8 | 82% | 0.822 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -114 | -19.7 | 171.6 | -73.2 | -164.6 | -8.7 | 0 | 0 | 115.2 | ||
| 34 | L | 53.9 | Low | 63 | Low | 74 Ų | 74 | 97.7 Ų | 97.7 | 39% | 0.387 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -72.8 | -29.9 | -176 | -165 | 63.2 | 0 | 0 | 0 | 113 | H38 Q283 | L34-H38 WeakPolarHBondContact O-CB 3.42Å; L34-H38 PolarHBondContact O-N 2.67Å; L34-Q283 HydrophobicContact CD1-CB 3.89Å |
| 35 | G | 67.6 | Low | 65.6 | Low | 33 Ų | 33 | 92.8 Ų | 92.8 | 34% | 0.34 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.2 | -48.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | V37 H38 W39 | G35-V37 PolarHBondContact O-N 2.92Å; G35-H38 PolarHBondContact O-N 2.99Å; G35-W39 PolarHBondContact O-N 3.44Å |
| 36 | V | 82.1 | Confident | 68.1 | Low | 105 Ų | 105 | 89.7 Ų | 89.7 | 64% | 0.636 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -64.2 | -44.3 | -173.9 | 179.5 | 0 | 0 | 0 | 0 | 111.3 | W39 V40 | V36-W39 PolarHBondContact O-N 3.43Å; V36-V40 HydrophobicContact CG1-CG2 4.47Å; V36-V40 VanDerWaalsContact O-CG2 3.29Å; V36-V40 WeakPolarHBondContact O-CG2 3.41Å; V36-V40 PolarHBondContact O-N 3.18Å |
| 37 | V | 82.1 | Confident | 71 | Confident | 38 Ų | 38 | 88.9 Ų | 88.9 | 23% | 0.23 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -66.7 | -41 | -179.8 | -177.1 | 0 | 0 | 0 | 0 | 110.9 | G35 W39 V40 S41 A284 L288 | G35-V37 PolarHBondContact O-N 2.92Å; V37-W39 VanDerWaalsContact C-N 3.35Å; V37-W39 PolarHBondContact O-N 2.95Å; V37-V40 PolarHBondContact O-N 3.46Å; V37-S41 PolarHBondContact O-N 3.29Å; V37-S41 PolarHBondContact O-OG 2.92Å; V37-A284 HydrophobicContact CB-CB 4.25Å; V37-A284 HydrophobicContact CG1-CB 4.01Å; V37-A284 VanDerWaalsContact CG1-O 3.28Å; V37-A284 WeakPolarHBondContact CG1-O 3.38Å; V37-A284 HydrophobicContact CG2-CB 4.21Å; V37-L288 HydrophobicContact CG1-CB 4.03Å; V37-L288 HydrophobicContact CG1-CD2 4.49Å |
| 38 | H | 81.4 | Confident | 73.8 | Confident | 40 Ų | 40 | 82.3 Ų | 82.3 | 19% | 0.185 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -59.1 | -44.7 | 174.8 | -165.6 | 97.9 | 0 | 0 | 0 | 112 | L34 G35 S41 L42 V97 F101 | L34-H38 WeakPolarHBondContact O-CB 3.42Å; L34-H38 PolarHBondContact O-N 2.67Å; G35-H38 PolarHBondContact O-N 2.99Å; H38-S41 PolarHBondContact O-N 3.47Å; H38-L42 WeakPolarHBondContact O-CB 3.44Å; H38-L42 PolarHBondContact O-N 3.05Å; H38-V97 VanDerWaalsContact CE1-CG1 3.5Å; H38-V97 WeakPolarHBondContact CE1-CG1 3.39Å; H38-V97 VanDerWaalsContact NE2-CG1 3.32Å; H38-V97 WeakPolarHBondContact NE2-CG1 3.4Å; H38-V97 PolarHBondContact NE2-O 2.96Å; H38-V97 VanDerWaalsContact NE2-O 3.14Å; H38-F101 AromaticContact CE1-CZ 3.86Å |
| 39 | W | 88.7 | Confident | 76.7 | Confident | 169 Ų | 169 | 80.1 Ų | 80.1 | 64% | 0.64 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -63 | -41.4 | 174.8 | -74.6 | 117.9 | 0 | 0 | 0 | 112.4 | G35 V36 V37 L42 V43 | G35-W39 PolarHBondContact O-N 3.44Å; V36-W39 PolarHBondContact O-N 3.43Å; V37-W39 VanDerWaalsContact C-N 3.35Å; V37-W39 PolarHBondContact O-N 2.95Å; W39-L42 HydrophobicContact CE3-CD2 3.82Å; W39-L42 HydrophobicContact CZ3-CD2 3.71Å; W39-L42 PolarHBondContact O-N 3.29Å; W39-V43 WeakPolarHBondContact O-CG2 3.18Å; W39-V43 PolarHBondContact O-N 2.94Å |
| 40 | V | 91 | Very high | 79.3 | Confident | 67 Ų | 67 | 75.3 Ų | 75.3 | 41% | 0.406 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.7 | -48.3 | 175.5 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | V36 V37 L42 V43 L44 L288 | V36-V40 HydrophobicContact CG1-CG2 4.47Å; V36-V40 VanDerWaalsContact O-CG2 3.29Å; V36-V40 WeakPolarHBondContact O-CG2 3.41Å; V36-V40 PolarHBondContact O-N 3.18Å; V37-V40 PolarHBondContact O-N 3.46Å; V40-L42 VanDerWaalsContact C-N 3.31Å; V40-L42 PolarHBondContact O-N 3.42Å; V40-V43 WeakPolarHBondContact O-CB 3.49Å; V40-V43 PolarHBondContact O-N 3.41Å; V40-V43 VanDerWaalsContact O-N 3.15Å; V40-L44 HydrophobicContact CG1-CD1 4.43Å; V40-L44 WeakPolarHBondContact O-CG 3.49Å; V40-L44 PolarHBondContact O-N 3.07Å; V40-L288 HydrophobicContact CG1-CD1 3.81Å |
| 41 | S | 89.6 | Confident | 81.9 | Confident | 1 Ų | 1 | 72.4 Ų | 72.4 | 1% | 0.007 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -56.5 | -44.6 | 175.7 | -64.8 | 0 | 0 | 0 | 0 | 112.1 | V37 H38 V43 L44 Y45 P287 L288 | V37-S41 PolarHBondContact O-N 3.29Å; V37-S41 PolarHBondContact O-OG 2.92Å; H38-S41 PolarHBondContact O-N 3.47Å; S41-V43 VanDerWaalsContact C-N 3.33Å; S41-V43 PolarHBondContact O-N 3.01Å; S41-L44 WeakPolarHBondContact O-CB 3.39Å; S41-L44 PolarHBondContact O-N 3.43Å; S41-L44 VanDerWaalsContact O-N 3.13Å; S41-Y45 VanDerWaalsContact O-CD2 3.24Å; S41-Y45 WeakPolarHBondContact O-CD2 3.32Å; S41-Y45 PolarHBondContact O-N 3.05Å; S41-P287 PolarHBondContact OG-O 3.36Å; S41-L288 WeakPolarHBondContact OG-CA 3.26Å; S41-L288 PolarHBondContact OG-N 2.97Å |
| 42 | L | 91.9 | Very high | 84.4 | Confident | 20 Ų | 20 | 63.5 Ų | 63.5 | 11% | 0.105 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.2 | -43.3 | 176.9 | -173.1 | 67.7 | 0 | 0 | 0 | 111.9 | H38 W39 V40 L44 Y45 C46 I94 V97 V98 | H38-L42 WeakPolarHBondContact O-CB 3.44Å; H38-L42 PolarHBondContact O-N 3.05Å; W39-L42 HydrophobicContact CE3-CD2 3.82Å; W39-L42 HydrophobicContact CZ3-CD2 3.71Å; W39-L42 PolarHBondContact O-N 3.29Å; V40-L42 VanDerWaalsContact C-N 3.31Å; V40-L42 PolarHBondContact O-N 3.42Å; L42-L44 VanDerWaalsContact C-N 3.32Å; L42-L44 PolarHBondContact O-N 3.48Å; L42-Y45 PolarHBondContact O-N 3.46Å; L42-C46 PolarHBondContact O-N 3Å; L42-C46 PolarHBondContact O-SG 3.08Å; L42-C46 VanDerWaalsContact O-SG 3.37Å; L42-I94 HydrophobicContact CD1-CG2 3.85Å; L42-V97 HydrophobicContact CD1-CG1 4.41Å; L42-V98 HydrophobicContact CD1-CG2 3.63Å; L42-V98 HydrophobicContact CD2-CG2 3.92Å; L42-V98 HydrophobicContact CG-CG2 4.44Å |
| 43 | V | 94.8 | Very high | 86.9 | Confident | 83 Ų | 83 | 59 Ų | 59 | 50% | 0.503 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60 | -43 | 174.5 | 169.4 | 0 | 0 | 0 | 0 | 110.8 | W39 V40 S41 Y45 C46 L47 | W39-V43 WeakPolarHBondContact O-CG2 3.18Å; W39-V43 PolarHBondContact O-N 2.94Å; V40-V43 WeakPolarHBondContact O-CB 3.49Å; V40-V43 PolarHBondContact O-N 3.41Å; V40-V43 VanDerWaalsContact O-N 3.15Å; S41-V43 VanDerWaalsContact C-N 3.33Å; S41-V43 PolarHBondContact O-N 3.01Å; V43-Y45 PolarHBondContact O-N 3.19Å; V43-C46 PolarHBondContact O-N 2.7Å; V43-L47 HydrophobicContact CG1-CD1 3.78Å; V43-L47 HydrophobicContact CG1-CG 4.2Å; V43-L47 WeakPolarHBondContact O-CB 3.22Å; V43-L47 VanDerWaalsContact O-CG 3.23Å; V43-L47 WeakPolarHBondContact O-CG 3.47Å; V43-L47 PolarHBondContact O-N 3.3Å |
| 44 | L | 95.1 | Very high | 89.1 | Confident | 26 Ų | 26 | 53.7 Ų | 53.7 | 14% | 0.136 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62.2 | -41.3 | 176.8 | -60.6 | 172.8 | 0 | 0 | 0 | 112 | V40 S41 L42 L47 S48 L288 L292 L295 | V40-L44 HydrophobicContact CG1-CD1 4.43Å; V40-L44 WeakPolarHBondContact O-CG 3.49Å; V40-L44 PolarHBondContact O-N 3.07Å; S41-L44 WeakPolarHBondContact O-CB 3.39Å; S41-L44 PolarHBondContact O-N 3.43Å; S41-L44 VanDerWaalsContact O-N 3.13Å; L42-L44 VanDerWaalsContact C-N 3.32Å; L42-L44 PolarHBondContact O-N 3.48Å; L44-L47 PolarHBondContact O-N 3.5Å; L44-S48 WeakPolarHBondContact O-CB 3.24Å; L44-S48 PolarHBondContact O-N 2.91Å; L44-S48 PolarHBondContact O-OG 2.9Å; L44-L288 HydrophobicContact CD1-CD1 3.86Å; L44-L292 HydrophobicContact CD1-CD2 4.4Å; L44-L295 HydrophobicContact CD2-CD1 3.65Å; L44-L295 HydrophobicContact CD2-CG 4.5Å |
| 45 | Y | 94.8 | Very high | 91 | Very high | 1 Ų | 1 | 50.9 Ų | 50.9 | 0% | 0.004 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64 | -46.6 | 176.2 | -54.8 | -35.9 | 0 | 0 | 0 | 111.8 | S41 L42 V43 L47 S48 F49 L90 Y93 V97 P287 T290 F294 | S41-Y45 VanDerWaalsContact O-CD2 3.24Å; S41-Y45 WeakPolarHBondContact O-CD2 3.32Å; S41-Y45 PolarHBondContact O-N 3.05Å; L42-Y45 PolarHBondContact O-N 3.46Å; V43-Y45 PolarHBondContact O-N 3.19Å; Y45-L47 PolarHBondContact O-N 2.91Å; Y45-S48 WeakPolarHBondContact O-CB 3.29Å; Y45-S48 PolarHBondContact O-N 3.4Å; Y45-F49 PolarHBondContact O-N 3.22Å; Y45-L90 WeakPolarHBondContact O-CD2 3.16Å; Y45-Y93 HydrophobicContact CD2-CD1 4.45Å; Y45-Y93 HydrophobicContact CD2-CE1 4.22Å; Y45-Y93 AromaticContact CE1-CE1 3.98Å; Y45-Y93 HydrophobicContact CE1-CE1 3.98Å; Y45-Y93 HydrophobicContact CE2-CD1 4.37Å; Y45-Y93 AromaticContact CE2-CE1 3.7Å; Y45-Y93 HydrophobicContact CE2-CE1 3.7Å; Y45-Y93 AromaticContact CZ-CE1 3.57Å; Y45-V97 HydrophobicContact CE2-CG1 4.42Å; Y45-V97 HydrophobicContact CE2-CG2 4.13Å; Y45-P287 PolarHBondContact OH-O 2.72Å; Y45-T290 HydrophobicContact CE1-CG2 4.22Å; Y45-F294 AromaticContact CD1-CD2 3.48Å; Y45-F294 HydrophobicContact CD1-CD2 3.48Å; Y45-F294 VanDerWaalsContact CD1-CD2 3.48Å; Y45-F294 HydrophobicContact CD1-CE2 4.06Å; Y45-F294 HydrophobicContact CD1-CG 4.38Å; Y45-F294 AromaticContact CE1-CD2 3.64Å; Y45-F294 HydrophobicContact CE1-CD2 3.64Å; Y45-F294 AromaticContact CE1-CE2 3.93Å; Y45-F294 HydrophobicContact CE1-CE2 3.93Å; Y45-F294 HydrophobicContact CE1-CG 4.47Å; Y45-F294 HydrophobicContact CG-CD2 4.49Å |
| 46 | C | 96.3 | Very high | 92.3 | Very high | 53 Ų | 53 | 49.3 Ų | 49.3 | 36% | 0.358 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 177 | -71.5 | 0 | 0 | 0 | 0 | 111.8 | L42 V43 S48 F49 V50 | L42-C46 PolarHBondContact O-N 3Å; L42-C46 PolarHBondContact O-SG 3.08Å; L42-C46 VanDerWaalsContact O-SG 3.37Å; V43-C46 PolarHBondContact O-N 2.7Å; C46-S48 VanDerWaalsContact C-N 3.34Å; C46-S48 PolarHBondContact O-N 3.42Å; C46-F49 PolarHBondContact O-N 2.9Å; C46-V50 WeakPolarHBondContact O-CB 3.24Å; C46-V50 WeakPolarHBondContact O-CG2 3.33Å; C46-V50 PolarHBondContact O-N 2.87Å |
| 47 | L | 95.6 | Very high | 92.8 | Very high | 76 Ų | 76 | 46.2 Ų | 46.2 | 40% | 0.398 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.7 | -44.1 | 174.3 | -75.4 | 171.8 | 0 | 0 | 0 | 111.4 | V43 L44 Y45 F49 V50 L51 L295 | V43-L47 HydrophobicContact CG1-CD1 3.78Å; V43-L47 HydrophobicContact CG1-CG 4.2Å; V43-L47 WeakPolarHBondContact O-CB 3.22Å; V43-L47 VanDerWaalsContact O-CG 3.23Å; V43-L47 WeakPolarHBondContact O-CG 3.47Å; V43-L47 PolarHBondContact O-N 3.3Å; L44-L47 PolarHBondContact O-N 3.5Å; Y45-L47 PolarHBondContact O-N 2.91Å; L47-F49 VanDerWaalsContact C-N 3.3Å; L47-F49 PolarHBondContact O-N 3.34Å; L47-V50 PolarHBondContact O-N 2.9Å; L47-L51 HydrophobicContact CD2-CD1 4.47Å; L47-L51 VanDerWaalsContact O-CB 3.26Å; L47-L51 WeakPolarHBondContact O-CB 3.19Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.2Å; L47-L51 PolarHBondContact O-N 3.34Å; L47-L295 HydrophobicContact CB-CD2 4.33Å |
| 48 | S | 95.5 | Very high | 93.3 | Very high | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -57.6 | -44.6 | 176.8 | -58.1 | 0 | 0 | 0 | 0 | 111.2 | L44 Y45 C46 G52 L87 L295 | L44-S48 WeakPolarHBondContact O-CB 3.24Å; L44-S48 PolarHBondContact O-N 2.91Å; L44-S48 PolarHBondContact O-OG 2.9Å; Y45-S48 WeakPolarHBondContact O-CB 3.29Å; Y45-S48 PolarHBondContact O-N 3.4Å; C46-S48 VanDerWaalsContact C-N 3.34Å; C46-S48 PolarHBondContact O-N 3.42Å; S48-G52 WeakPolarHBondContact O-CA 3.26Å; S48-G52 PolarHBondContact O-N 2.89Å; S48-L87 WeakPolarHBondContact O-CD2 3.26Å; S48-L295 WeakPolarHBondContact OG-CA 3.46Å; S48-L295 WeakPolarHBondContact OG-CD2 3.4Å; S48-L295 PolarHBondContact OG-N 2.85Å |
| 49 | F | 96.3 | Very high | 93.7 | Very high | 70 Ų | 70 | 45.6 Ų | 45.6 | 31% | 0.307 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.9 | -56.4 | 176.8 | 179.1 | -104.9 | 0 | 0 | 0 | 112.5 | Y45 C46 L47 L51 G52 I53 L87 L90 P91 I94 | Y45-F49 PolarHBondContact O-N 3.22Å; C46-F49 PolarHBondContact O-N 2.9Å; L47-F49 VanDerWaalsContact C-N 3.3Å; L47-F49 PolarHBondContact O-N 3.34Å; F49-L51 VanDerWaalsContact C-N 3.33Å; F49-L51 PolarHBondContact O-N 3.49Å; F49-G52 PolarHBondContact O-N 2.88Å; F49-I53 HydrophobicContact CD2-CG1 3.79Å; F49-I53 HydrophobicContact CE2-CD1 4.25Å; F49-I53 HydrophobicContact CE2-CG1 3.66Å; F49-I53 HydrophobicContact CZ-CG1 4.3Å; F49-I53 WeakPolarHBondContact O-CB 3.4Å; F49-I53 WeakPolarHBondContact O-CG1 3.43Å; F49-I53 PolarHBondContact O-N 3.08Å; F49-L87 VanDerWaalsContact CD2-O 3.32Å; F49-L87 WeakPolarHBondContact CD2-O 3.36Å; F49-L90 HydrophobicContact CB-CD2 4.08Å; F49-P91 HydrophobicContact CD2-CG 3.77Å; F49-P91 HydrophobicContact CE2-CG 3.44Å; F49-P91 VanDerWaalsContact CE2-CG 3.44Å; F49-P91 HydrophobicContact CZ-CG 3.95Å; F49-I94 HydrophobicContact CB-CD1 4.44Å |
| 50 | V | 95.9 | Very high | 94 | Very high | 93 Ų | 93 | 39.2 Ų | 39.2 | 56% | 0.564 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -64.2 | -37 | -173.2 | 171.4 | 0 | 0 | 0 | 0 | 111.9 | C46 L47 P54 | C46-V50 WeakPolarHBondContact O-CB 3.24Å; C46-V50 WeakPolarHBondContact O-CG2 3.33Å; C46-V50 PolarHBondContact O-N 2.87Å; L47-V50 PolarHBondContact O-N 2.9Å; V50-P54 WeakPolarHBondContact O-CD 3.32Å; V50-P54 WeakPolarHBondContact O-CG 3.25Å |
| 51 | L | 94.1 | Very high | 93.9 | Very high | 77 Ų | 77 | 41.6 Ų | 41.6 | 40% | 0.403 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -85.3 | -39.1 | 178.1 | -60.3 | 177.3 | 0 | 0 | 0 | 111.8 | L47 F49 G55 C298 I302 | L47-L51 HydrophobicContact CD2-CD1 4.47Å; L47-L51 VanDerWaalsContact O-CB 3.26Å; L47-L51 WeakPolarHBondContact O-CB 3.19Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.2Å; L47-L51 PolarHBondContact O-N 3.34Å; F49-L51 VanDerWaalsContact C-N 3.33Å; F49-L51 PolarHBondContact O-N 3.49Å; L51-G55 PolarHBondContact O-N 3.29Å; L51-G55 VanDerWaalsContact O-N 3.13Å; L51-C298 HydrophobicContact CB-CB 4.04Å; L51-I302 HydrophobicContact CD1-CD1 4.45Å |
| 52 | G | 95.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -73.7 | -41.5 | -171.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | S48 F49 N56 L87 C298 | S48-G52 WeakPolarHBondContact O-CA 3.26Å; S48-G52 PolarHBondContact O-N 2.89Å; F49-G52 PolarHBondContact O-N 2.88Å; G52-N56 VanDerWaalsContact O-CB 3.29Å; G52-N56 WeakPolarHBondContact O-CB 3.38Å; G52-N56 PolarHBondContact O-N 2.89Å; G52-N56 PolarHBondContact O-ND2 3.48Å; G52-L87 VanDerWaalsContact CA-CD1 3.44Å; G52-C298 VanDerWaalsContact CA-CB 3.49Å |
| 53 | I | 95.9 | Very high | 93.6 | Very high | 36 Ų | 36 | 41.4 Ų | 41.4 | 19% | 0.185 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.2 | -58.3 | 179.3 | -70.7 | -66.8 | 0 | 0 | 0 | 111.7 | F49 G55 A57 F84 L87 L88 | F49-I53 HydrophobicContact CD2-CG1 3.79Å; F49-I53 HydrophobicContact CE2-CD1 4.25Å; F49-I53 HydrophobicContact CE2-CG1 3.66Å; F49-I53 HydrophobicContact CZ-CG1 4.3Å; F49-I53 WeakPolarHBondContact O-CB 3.4Å; F49-I53 WeakPolarHBondContact O-CG1 3.43Å; F49-I53 PolarHBondContact O-N 3.08Å; I53-G55 VanDerWaalsContact C-N 3.35Å; I53-G55 PolarHBondContact O-N 3.3Å; I53-A57 WeakPolarHBondContact O-CB 3.04Å; I53-A57 PolarHBondContact O-N 3.31Å; I53-F84 HydrophobicContact CD1-CD2 4.14Å; I53-F84 HydrophobicContact CD1-CE2 4.03Å; I53-F84 HydrophobicContact CG2-CE2 4.13Å; I53-L87 HydrophobicContact CD1-CB 3.52Å; I53-L87 HydrophobicContact CG1-CB 4.02Å; I53-L88 HydrophobicContact CD1-CD2 3.88Å; I53-L88 HydrophobicContact CD1-CG 4.23Å |
| 54 | P | 93.9 | Very high | 93.3 | Very high | 65 Ų | 65 | 38.1 Ų | 38.1 | 42% | 0.422 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -65.6 | -39 | 179.6 | 25.4 | -33.6 | 0 | 0 | 0 | 111.8 | V50 A57 I58 | V50-P54 WeakPolarHBondContact O-CD 3.32Å; V50-P54 WeakPolarHBondContact O-CG 3.25Å; P54-A57 PolarHBondContact O-N 3.45Å; P54-I58 WeakPolarHBondContact O-CB 3.32Å; P54-I58 WeakPolarHBondContact O-CD1 3.26Å; P54-I58 VanDerWaalsContact O-CG1 3.23Å; P54-I58 WeakPolarHBondContact O-CG1 3.46Å; P54-I58 PolarHBondContact O-N 2.88Å |
| 55 | G | 92.4 | Very high | 92.8 | Very high | 16 Ų | 16 | 44 Ų | 44 | 17% | 0.165 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.7 | -51.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L51 I53 I58 V59 | L51-G55 PolarHBondContact O-N 3.29Å; L51-G55 VanDerWaalsContact O-N 3.13Å; I53-G55 VanDerWaalsContact C-N 3.35Å; I53-G55 PolarHBondContact O-N 3.3Å; G55-I58 PolarHBondContact O-N 3Å; G55-V59 WeakPolarHBondContact O-CG2 3.34Å; G55-V59 PolarHBondContact O-N 3.39Å; G55-V59 VanDerWaalsContact O-N 3.15Å |
| 56 | N | 95 | Very high | 92.3 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -71.4 | -35.4 | 179.6 | -72.5 | -63.2 | 0 | 0 | 0 | 112.1 | G52 I58 V59 I60 A80 F84 S297 P301 | G52-N56 VanDerWaalsContact O-CB 3.29Å; G52-N56 WeakPolarHBondContact O-CB 3.38Å; G52-N56 PolarHBondContact O-N 2.89Å; G52-N56 PolarHBondContact O-ND2 3.48Å; N56-I58 VanDerWaalsContact C-N 3.32Å; N56-I58 PolarHBondContact O-N 2.75Å; N56-V59 PolarHBondContact O-N 2.91Å; N56-I60 WeakPolarHBondContact O-CB 3.24Å; N56-I60 VanDerWaalsContact O-CG1 3.26Å; N56-I60 WeakPolarHBondContact O-CG1 3.09Å; N56-I60 PolarHBondContact O-N 2.85Å; N56-A80 HydrophobicContact CB-CB 4.43Å; N56-F84 HydrophobicContact CB-CB 4.1Å; N56-F84 HydrophobicContact CB-CD2 4.3Å; N56-S297 PolarHBondContact ND2-O 2.82Å; N56-P301 HydrophobicContact CB-CG 4.44Å; N56-P301 VanDerWaalsContact OD1-CG 3.23Å; N56-P301 WeakPolarHBondContact OD1-CG 3.36Å |
| 57 | A | 94.2 | Very high | 91.7 | Very high | 40 Ų | 40 | 48.8 Ų | 48.8 | 33% | 0.331 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -59.3 | -42.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | I53 P54 I60 W61 F84 | I53-A57 WeakPolarHBondContact O-CB 3.04Å; I53-A57 PolarHBondContact O-N 3.31Å; P54-A57 PolarHBondContact O-N 3.45Å; A57-I60 PolarHBondContact O-N 3.43Å; A57-W61 WeakPolarHBondContact O-CB 3.42Å; A57-W61 PolarHBondContact O-N 3.14Å; A57-F84 HydrophobicContact CB-CD2 4.49Å; A57-F84 HydrophobicContact CB-CE2 4.03Å |
| 58 | I | 90.8 | Very high | 91.3 | Very high | 63 Ų | 63 | 54.1 Ų | 54.1 | 32% | 0.323 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.8 | -46.5 | 174.6 | -74.2 | 167.6 | 0 | 0 | 0 | 110.6 | P54 G55 N56 I60 W61 F62 F315 | P54-I58 WeakPolarHBondContact O-CB 3.32Å; P54-I58 WeakPolarHBondContact O-CD1 3.26Å; P54-I58 VanDerWaalsContact O-CG1 3.23Å; P54-I58 WeakPolarHBondContact O-CG1 3.46Å; P54-I58 PolarHBondContact O-N 2.88Å; G55-I58 PolarHBondContact O-N 3Å; N56-I58 VanDerWaalsContact C-N 3.32Å; N56-I58 PolarHBondContact O-N 2.75Å; I58-I60 PolarHBondContact O-N 2.99Å; I58-W61 PolarHBondContact O-N 3.35Å; I58-F62 HydrophobicContact CG2-CD2 3.66Å; I58-F62 HydrophobicContact CG2-CE2 3.81Å; I58-F62 VanDerWaalsContact O-CD2 3.26Å; I58-F62 WeakPolarHBondContact O-CD2 2.99Å; I58-F62 PolarHBondContact O-N 2.83Å; I58-F315 HydrophobicContact CD1-CE2 4.3Å; I58-F315 HydrophobicContact CG2-CD2 4.09Å; I58-F315 HydrophobicContact CG2-CE2 3.67Å |
| 59 | V | 90.9 | Very high | 90.9 | Very high | 1 Ų | 1 | 58.6 Ų | 58.6 | 1% | 0.006 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.2 | -45.5 | 178.2 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | G55 N56 W61 F62 M63 A80 P301 Y304 | G55-V59 WeakPolarHBondContact O-CG2 3.34Å; G55-V59 PolarHBondContact O-N 3.39Å; G55-V59 VanDerWaalsContact O-N 3.15Å; N56-V59 PolarHBondContact O-N 2.91Å; V59-W61 VanDerWaalsContact C-N 3.33Å; V59-W61 PolarHBondContact O-N 2.74Å; V59-F62 PolarHBondContact O-N 2.83Å; V59-M63 HydrophobicContact CG1-CG 3.92Å; V59-M63 VanDerWaalsContact O-CB 3.29Å; V59-M63 WeakPolarHBondContact O-CB 3.36Å; V59-M63 WeakPolarHBondContact O-CG 3.41Å; V59-M63 PolarHBondContact O-N 2.74Å; V59-A80 HydrophobicContact CB-CB 3.98Å; V59-A80 HydrophobicContact CG1-CB 3.63Å; V59-P301 HydrophobicContact CG2-CB 3.88Å; V59-P301 HydrophobicContact CG2-CG 4.08Å; V59-Y304 HydrophobicContact CG2-CD2 4.29Å |
| 60 | I | 94.1 | Very high | 90.6 | Very high | 35 Ų | 35 | 58.4 Ų | 58.4 | 18% | 0.179 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.6 | -44.6 | 175.9 | -68.1 | 166.3 | 0 | 0 | 0 | 110.5 | N56 A57 I58 G64 L77 A80 I81 F84 | N56-I60 WeakPolarHBondContact O-CB 3.24Å; N56-I60 VanDerWaalsContact O-CG1 3.26Å; N56-I60 WeakPolarHBondContact O-CG1 3.09Å; N56-I60 PolarHBondContact O-N 2.85Å; A57-I60 PolarHBondContact O-N 3.43Å; I58-I60 PolarHBondContact O-N 2.99Å; I60-G64 WeakPolarHBondContact O-CA 3.26Å; I60-G64 PolarHBondContact O-N 2.79Å; I60-L77 HydrophobicContact CB-CD1 4.29Å; I60-L77 HydrophobicContact CG1-CD1 4.24Å; I60-L77 HydrophobicContact CG2-CD1 4.17Å; I60-A80 HydrophobicContact CG1-CB 3.88Å; I60-I81 HydrophobicContact CD1-CG1 4.08Å; I60-I81 HydrophobicContact CG1-CG1 4.12Å; I60-F84 HydrophobicContact CD1-CB 3.83Å; I60-F84 HydrophobicContact CD1-CD1 4.4Å; I60-F84 HydrophobicContact CD1-CD2 4.46Å; I60-F84 HydrophobicContact CD1-CG 4Å |
| 61 | W | 90.3 | Very high | 90.4 | Very high | 118 Ų | 118 | 54.6 Ų | 54.6 | 45% | 0.447 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.1 | -50 | 178.2 | -179.9 | -112.3 | 0 | 0 | 0 | 112.3 | A57 I58 V59 F65 K66 | A57-W61 WeakPolarHBondContact O-CB 3.42Å; A57-W61 PolarHBondContact O-N 3.14Å; I58-W61 PolarHBondContact O-N 3.35Å; V59-W61 VanDerWaalsContact C-N 3.33Å; V59-W61 PolarHBondContact O-N 2.74Å; W61-F65 HydrophobicContact CD2-CD2 4.46Å; W61-F65 HydrophobicContact CE3-CB 4.36Å; W61-F65 AromaticContact CE3-CD2 3.68Å; W61-F65 HydrophobicContact CE3-CD2 3.68Å; W61-F65 HydrophobicContact CE3-CE2 4.29Å; W61-F65 HydrophobicContact CE3-CG 4.2Å; W61-F65 HydrophobicContact CZ3-CB 4.43Å; W61-F65 HydrophobicContact CZ3-CD2 4.1Å; W61-F65 HydrophobicContact CZ3-CG 4.26Å; W61-F65 PolarHBondContact O-N 3.01Å; W61-K66 PolarHBondContact O-N 3.47Å |
| 62 | F | 85.9 | Confident | 90.1 | Very high | 7 Ų | 7 | 52 Ų | 52 | 3% | 0.031 | 26% | 0.259 | C | S | . | . | I | π-helix | trans | -68.1 | -50.3 | -177.6 | -83 | -66.6 | 0 | 0 | 0 | 112.9 | I58 V59 G64 K66 W67 F315 S318 | I58-F62 HydrophobicContact CG2-CD2 3.66Å; I58-F62 HydrophobicContact CG2-CE2 3.81Å; I58-F62 VanDerWaalsContact O-CD2 3.26Å; I58-F62 WeakPolarHBondContact O-CD2 2.99Å; I58-F62 PolarHBondContact O-N 2.83Å; V59-F62 PolarHBondContact O-N 2.83Å; F62-G64 VanDerWaalsContact C-N 3.34Å; F62-K66 HydrophobicContact CD1-CB 3.93Å; F62-K66 HydrophobicContact CD1-CG 4.2Å; F62-K66 HydrophobicContact CE1-CB 4.45Å; F62-K66 HydrophobicContact CE1-CG 4.38Å; F62-K66 PolarHBondContact O-N 3.29Å; F62-W67 HydrophobicContact CB-CD2 4.41Å; F62-W67 HydrophobicContact CB-CZ2 4.39Å; F62-W67 HydrophobicContact CD1-CZ2 4.31Å; F62-W67 AromaticContact CD1-NE1 3.57Å; F62-W67 HydrophobicContact CG-CZ2 4.46Å; F62-W67 WeakPolarHBondContact O-CB 3.36Å; F62-W67 PolarHBondContact O-N 3.34Å; F62-F315 HydrophobicContact CD2-CD2 4.2Å; F62-F315 AromaticContact CE2-CD2 3.41Å; F62-F315 HydrophobicContact CE2-CD2 3.41Å; F62-F315 VanDerWaalsContact CE2-CD2 3.41Å; F62-F315 AromaticContact CE2-CE2 3.83Å; F62-F315 HydrophobicContact CE2-CE2 3.83Å; F62-F315 AromaticContact CZ-CD2 3.93Å; F62-F315 HydrophobicContact CZ-CD2 3.93Å; F62-S318 WeakPolarHBondContact CE1-OG 3.16Å |
| 63 | M | 88.1 | Confident | 89.8 | Confident | 10 Ų | 10 | 52.8 Ų | 52.8 | 5% | 0.049 | 26% | 0.264 | C | S | . | . | I | π-helix | trans | -75.3 | -28.1 | -177.7 | -56.8 | -68.2 | -178.9 | 0 | 0 | 112 | V59 W67 K69 T73 F76 L77 F311 | V59-M63 HydrophobicContact CG1-CG 3.92Å; V59-M63 VanDerWaalsContact O-CB 3.29Å; V59-M63 WeakPolarHBondContact O-CB 3.36Å; V59-M63 WeakPolarHBondContact O-CG 3.41Å; V59-M63 PolarHBondContact O-N 2.74Å; M63-W67 HydrophobicContact CE-CE3 3.88Å; M63-W67 HydrophobicContact CE-CH2 4.24Å; M63-W67 HydrophobicContact CE-CZ3 3.37Å; M63-W67 HydrophobicContact SD-CE3 3.43Å; M63-W67 HydrophobicContact SD-CZ3 3.62Å; M63-K69 PolarHBondContact O-NZ 3.27Å; M63-T73 HydrophobicContact SD-CG2 3.72Å; M63-F76 HydrophobicContact CE-CB 4.39Å; M63-L77 HydrophobicContact CB-CB 4.02Å; M63-L77 HydrophobicContact CB-CD1 4.25Å; M63-F311 HydrophobicContact CE-CD2 4.18Å; M63-F311 HydrophobicContact CE-CE2 3.96Å |
| 64 | G | 88.4 | Confident | 89.7 | Confident | 13 Ų | 13 | 51.9 Ų | 51.9 | 13% | 0.134 | 26% | 0.26 | C | S | . | . | I | π-helix | trans | -77.8 | -48.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | I60 F62 K69 | I60-G64 WeakPolarHBondContact O-CA 3.26Å; I60-G64 PolarHBondContact O-N 2.79Å; F62-G64 VanDerWaalsContact C-N 3.34Å; G64-K69 VanDerWaalsContact C-NZ 3.25Å; G64-K69 WeakPolarHBondContact O-CE 3.45Å; G64-K69 PolarHBondContact O-NZ 3.32Å |
| 65 | F | 86.3 | Confident | 89.6 | Confident | 149 Ų | 149 | 49.3 Ų | 49.3 | 65% | 0.654 | 24% | 0.241 | S | C | * | . | I | π-helix | trans | -124.6 | -36 | -165.2 | -57.6 | -82.9 | 0 | 0 | 0 | 113.6 | W61 | W61-F65 HydrophobicContact CD2-CD2 4.46Å; W61-F65 HydrophobicContact CE3-CB 4.36Å; W61-F65 AromaticContact CE3-CD2 3.68Å; W61-F65 HydrophobicContact CE3-CD2 3.68Å; W61-F65 HydrophobicContact CE3-CE2 4.29Å; W61-F65 HydrophobicContact CE3-CG 4.2Å; W61-F65 HydrophobicContact CZ3-CB 4.43Å; W61-F65 HydrophobicContact CZ3-CD2 4.1Å; W61-F65 HydrophobicContact CZ3-CG 4.26Å; W61-F65 PolarHBondContact O-N 3.01Å |
| 66 | K | 83.3 | Confident | 89.6 | Confident | 108 Ų | 108 | 49.6 Ų | 49.6 | 47% | 0.47 | 24% | 0.238 | S | C | . | . | I | π-helix | trans | -88.5 | -34.8 | -173.5 | -67.1 | -67 | -173.5 | 176.6 | 0 | 114.2 | W61 F62 | W61-K66 PolarHBondContact O-N 3.47Å; F62-K66 HydrophobicContact CD1-CB 3.93Å; F62-K66 HydrophobicContact CD1-CG 4.2Å; F62-K66 HydrophobicContact CE1-CB 4.45Å; F62-K66 HydrophobicContact CE1-CG 4.38Å; F62-K66 PolarHBondContact O-N 3.29Å |
| 67 | W | 84.3 | Confident | 89.5 | Confident | 47 Ų | 47 | 50.5 Ų | 50.5 | 18% | 0.178 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -99.7 | 150.2 | -173.4 | -66.4 | -0.1 | 0 | 0 | 0 | 112.5 | F62 M63 K69 T73 F311 R314 | F62-W67 HydrophobicContact CB-CD2 4.41Å; F62-W67 HydrophobicContact CB-CZ2 4.39Å; F62-W67 HydrophobicContact CD1-CZ2 4.31Å; F62-W67 AromaticContact CD1-NE1 3.57Å; F62-W67 HydrophobicContact CG-CZ2 4.46Å; F62-W67 WeakPolarHBondContact O-CB 3.36Å; F62-W67 PolarHBondContact O-N 3.34Å; M63-W67 HydrophobicContact CE-CE3 3.88Å; M63-W67 HydrophobicContact CE-CH2 4.24Å; M63-W67 HydrophobicContact CE-CZ3 3.37Å; M63-W67 HydrophobicContact SD-CE3 3.43Å; M63-W67 HydrophobicContact SD-CZ3 3.62Å; W67-K69 PolarHBondContact O-N 3.45Å; W67-T73 HydrophobicContact CE3-CG2 4.46Å; W67-F311 HydrophobicContact CH2-CB 4.32Å; W67-F311 AromaticContact CH2-CD2 3.29Å; W67-F311 HydrophobicContact CH2-CD2 3.29Å; W67-F311 AromaticContact CH2-CE2 3.7Å; W67-F311 HydrophobicContact CH2-CE2 3.7Å; W67-F311 AromaticContact CH2-CG 3.97Å; W67-F311 HydrophobicContact CH2-CG 3.97Å; W67-F311 HydrophobicContact CZ2-CD2 4.22Å; W67-F311 HydrophobicContact CZ2-CE2 4.41Å; W67-F311 AromaticContact CZ3-CD2 3.93Å; W67-F311 HydrophobicContact CZ3-CD2 3.93Å; W67-F311 HydrophobicContact CZ3-CE2 4.25Å; W67-R314 HydrophobicContact CH2-CB 4.37Å; W67-R314 HydrophobicContact CZ2-CB 3.48Å; W67-R314 VanDerWaalsContact CZ2-CB 3.48Å; W67-R314 HydrophobicContact CZ2-CG 4.11Å |
| 68 | K | 85.9 | Confident | 89.7 | Confident | 188 Ų | 188 | 49.6 Ų | 49.6 | 82% | 0.817 | 23% | 0.232 | S | C | * | . | trans | -59.7 | 135.4 | 174.1 | -69.2 | -170.5 | 176.8 | -173.5 | 0 | 109.8 | T70 | K68-T70 PolarHBondContact O-N 3.06Š| ||
| 69 | K | 88.2 | Confident | 89.9 | Confident | 95 Ų | 95 | 46.6 Ų | 46.6 | 41% | 0.413 | 22% | 0.217 | S | C | . | . | trans | -67.9 | 115.6 | 178.4 | -59.1 | -60.3 | -177.2 | 174.7 | 0 | 110.5 | M63 G64 W67 | M63-K69 PolarHBondContact O-NZ 3.27Å; G64-K69 VanDerWaalsContact C-NZ 3.25Å; G64-K69 WeakPolarHBondContact O-CE 3.45Å; G64-K69 PolarHBondContact O-NZ 3.32Å; W67-K69 PolarHBondContact O-N 3.45Å | ||
| 70 | T | 90.3 | Very high | 90.1 | Very high | 66 Ų | 66 | 46.6 Ų | 46.6 | 41% | 0.405 | 22% | 0.217 | S | C | . | . | trans | -127.3 | 163.1 | 172.7 | 67.3 | 0 | 0 | 0 | 0 | 109.6 | K68 S72 T73 L74 | K68-T70 PolarHBondContact O-N 3.06Å; T70-S72 VanDerWaalsContact C-N 3.34Å; T70-S72 PolarHBondContact O-N 3.44Å; T70-T73 WeakPolarHBondContact CA-OG1 3.49Å; T70-T73 PolarHBondContact N-OG1 2.99Å; T70-T73 PolarHBondContact O-N 2.82Å; T70-T73 PolarHBondContact O-OG1 3.17Å; T70-T73 VanDerWaalsContact OG1-CG2 3.23Å; T70-T73 WeakPolarHBondContact OG1-CG2 3.05Å; T70-T73 PolarHBondContact OG1-N 2.84Å; T70-T73 PolarHBondContact OG1-OG1 2.79Å; T70-L74 WeakPolarHBondContact O-CG 3.23Å; T70-L74 PolarHBondContact O-N 3.01Å | ||
| 71 | V | 91.3 | Very high | 90.3 | Very high | 12 Ų | 12 | 47.4 Ų | 47.4 | 7% | 0.073 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -55.2 | -48 | 177.6 | 171 | 0 | 0 | 0 | 0 | 111.6 | T73 L74 W75 R149 L151 S154 | V71-T73 PolarHBondContact O-N 3.38Å; V71-L74 WeakPolarHBondContact O-CB 3.05Å; V71-L74 PolarHBondContact O-N 3.37Å; V71-L74 VanDerWaalsContact O-N 3.15Å; V71-W75 HydrophobicContact CG1-CZ2 3.86Å; V71-W75 VanDerWaalsContact O-CD1 3.3Å; V71-W75 PolarHBondContact O-N 2.95Å; V71-R149 HydrophobicContact CB-CG 3.97Å; V71-R149 HydrophobicContact CG1-CG 3.79Å; V71-R149 HydrophobicContact CG2-CG 3.91Å; V71-L151 HydrophobicContact CG2-CD2 4.27Å; V71-S154 WeakPolarHBondContact CG1-OG 3.47Å; V71-S154 WeakPolarHBondContact CG2-OG 3.08Å |
| 72 | S | 87.1 | Confident | 90.6 | Very high | 24 Ų | 24 | 42 Ų | 42 | 17% | 0.168 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.9 | -42 | 177.4 | -55.2 | 0 | 0 | 0 | 0 | 113.1 | T70 L74 W75 F76 R149 | T70-S72 VanDerWaalsContact C-N 3.34Å; T70-S72 PolarHBondContact O-N 3.44Å; S72-L74 PolarHBondContact O-N 2.74Å; S72-W75 PolarHBondContact O-N 3.19Å; S72-F76 WeakPolarHBondContact O-CD2 3.2Å; S72-F76 PolarHBondContact O-N 2.62Å; S72-R149 PolarHBondContact OG-NH2 3.4Å |
| 73 | T | 89.4 | Confident | 91.2 | Very high | 15 Ų | 15 | 41.6 Ų | 41.6 | 9% | 0.092 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.5 | -28.9 | 178 | 55.6 | 0 | 0 | 0 | 0 | 112.3 | M63 W67 T70 V71 L77 | M63-T73 HydrophobicContact SD-CG2 3.72Å; W67-T73 HydrophobicContact CE3-CG2 4.46Å; T70-T73 WeakPolarHBondContact CA-OG1 3.49Å; T70-T73 PolarHBondContact N-OG1 2.99Å; T70-T73 PolarHBondContact O-N 2.82Å; T70-T73 PolarHBondContact O-OG1 3.17Å; T70-T73 VanDerWaalsContact OG1-CG2 3.23Å; T70-T73 WeakPolarHBondContact OG1-CG2 3.05Å; T70-T73 PolarHBondContact OG1-N 2.84Å; T70-T73 PolarHBondContact OG1-OG1 2.79Å; V71-T73 PolarHBondContact O-N 3.38Å; T73-L77 WeakPolarHBondContact O-CB 3.23Å; T73-L77 PolarHBondContact O-N 3.44Å |
| 74 | L | 93.3 | Very high | 91.6 | Very high | 18 Ų | 18 | 43.7 Ų | 43.7 | 9% | 0.094 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -70.3 | -39.5 | 176.3 | -71.1 | 177.7 | 0 | 0 | 0 | 112.2 | T70 V71 S72 L77 N78 L151 I158 | T70-L74 WeakPolarHBondContact O-CG 3.23Å; T70-L74 PolarHBondContact O-N 3.01Å; V71-L74 WeakPolarHBondContact O-CB 3.05Å; V71-L74 PolarHBondContact O-N 3.37Å; V71-L74 VanDerWaalsContact O-N 3.15Å; S72-L74 PolarHBondContact O-N 2.74Å; L74-L77 PolarHBondContact O-N 2.96Å; L74-N78 PolarHBondContact O-N 3.15Å; L74-N78 PolarHBondContact O-ND2 2.73Å; L74-L151 HydrophobicContact CD1-CD2 3.79Å; L74-I158 HydrophobicContact CB-CD1 3.98Å; L74-I158 HydrophobicContact CD1-CD1 4.45Å |
| 75 | W | 93.1 | Very high | 92.1 | Very high | 11 Ų | 11 | 46 Ų | 46 | 4% | 0.042 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.3 | -51.2 | 176.2 | -53.9 | 138.9 | 0 | 0 | 0 | 111.7 | V71 S72 L77 N78 L79 F127 V130 I131 V157 I158 | V71-W75 HydrophobicContact CG1-CZ2 3.86Å; V71-W75 VanDerWaalsContact O-CD1 3.3Å; V71-W75 PolarHBondContact O-N 2.95Å; S72-W75 PolarHBondContact O-N 3.19Å; W75-L77 VanDerWaalsContact C-N 3.3Å; W75-L77 PolarHBondContact O-N 3.46Å; W75-N78 PolarHBondContact O-N 3.18Å; W75-L79 WeakPolarHBondContact O-CB 3.2Å; W75-L79 PolarHBondContact O-N 3.26Å; W75-F127 HydrophobicContact CE3-CD1 4.18Å; W75-F127 HydrophobicContact CE3-CE1 4.28Å; W75-V130 HydrophobicContact CD2-CG1 3.85Å; W75-V130 HydrophobicContact CE3-CG1 3.91Å; W75-V130 HydrophobicContact CH2-CG1 3.78Å; W75-V130 HydrophobicContact CZ2-CG1 3.71Å; W75-V130 HydrophobicContact CZ3-CG1 3.85Å; W75-I131 HydrophobicContact CB-CD1 4.03Å; W75-I131 HydrophobicContact CB-CG1 3.54Å; W75-I131 HydrophobicContact CG-CG1 4.18Å; W75-V157 HydrophobicContact CH2-CB 3.84Å; W75-V157 HydrophobicContact CH2-CG1 3.69Å; W75-V157 HydrophobicContact CZ3-CB 4.27Å; W75-V157 HydrophobicContact CZ3-CG1 3.9Å; W75-I158 HydrophobicContact CE3-CD1 4.35Å; W75-I158 HydrophobicContact CE3-CG1 3.95Å; W75-I158 HydrophobicContact CH2-CG1 4.49Å; W75-I158 HydrophobicContact CZ3-CD1 4.15Å; W75-I158 HydrophobicContact CZ3-CG1 3.54Å |
| 76 | F | 91.3 | Very high | 92.6 | Very high | 22 Ų | 22 | 39.2 Ų | 39.2 | 10% | 0.096 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.1 | -34.8 | 178.2 | -68.4 | -61.1 | 0 | 0 | 0 | 112.7 | M63 S72 A80 I131 Y304 | M63-F76 HydrophobicContact CE-CB 4.39Å; S72-F76 WeakPolarHBondContact O-CD2 3.2Å; S72-F76 PolarHBondContact O-N 2.62Å; F76-A80 WeakPolarHBondContact O-CB 3.49Å; F76-A80 PolarHBondContact O-N 3.14Å; F76-I131 HydrophobicContact CD1-CD1 3.94Å; F76-I131 HydrophobicContact CE1-CD1 3.84Å; F76-I131 HydrophobicContact CE1-CG2 4.26Å; F76-I131 HydrophobicContact CZ-CD1 4.49Å; F76-I131 HydrophobicContact CZ-CG2 4.07Å; F76-Y304 AromaticContact CD1-CE1 3.79Å; F76-Y304 HydrophobicContact CD1-CE1 3.79Å; F76-Y304 AromaticContact CD1-CE2 3.81Å; F76-Y304 HydrophobicContact CD1-CE2 3.81Å; F76-Y304 AromaticContact CD1-CZ 3.4Å; F76-Y304 VanDerWaalsContact CD1-CZ 3.4Å; F76-Y304 WeakPolarHBondContact CD1-OH 3.14Å; F76-Y304 HydrophobicContact CE1-CD1 4.21Å; F76-Y304 AromaticContact CE1-CE1 3.47Å; F76-Y304 HydrophobicContact CE1-CE1 3.47Å; F76-Y304 VanDerWaalsContact CE1-CE1 3.47Å; F76-Y304 HydrophobicContact CE1-CE2 4.36Å; F76-Y304 AromaticContact CE1-CZ 3.59Å; F76-Y304 HydrophobicContact CZ-CE1 4.45Å |
| 77 | L | 94 | Very high | 93.3 | Very high | 19 Ų | 19 | 34.1 Ų | 34.1 | 10% | 0.099 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.3 | -47.5 | 175.6 | 176.7 | 61.1 | 0 | 0 | 0 | 111.6 | I60 M63 T73 L74 W75 A80 I81 | I60-L77 HydrophobicContact CB-CD1 4.29Å; I60-L77 HydrophobicContact CG1-CD1 4.24Å; I60-L77 HydrophobicContact CG2-CD1 4.17Å; M63-L77 HydrophobicContact CB-CB 4.02Å; M63-L77 HydrophobicContact CB-CD1 4.25Å; T73-L77 WeakPolarHBondContact O-CB 3.23Å; T73-L77 PolarHBondContact O-N 3.44Å; L74-L77 PolarHBondContact O-N 2.96Å; W75-L77 VanDerWaalsContact C-N 3.3Å; W75-L77 PolarHBondContact O-N 3.46Å; L77-A80 PolarHBondContact O-N 2.97Å; L77-I81 HydrophobicContact CD1-CD1 4.11Å; L77-I81 HydrophobicContact CD1-CG1 4.42Å; L77-I81 HydrophobicContact CG-CD1 3.98Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.44Å; L77-I81 PolarHBondContact O-N 2.96Å |
| 78 | N | 96.6 | Very high | 93.9 | Very high | 20 Ų | 20 | 36.4 Ų | 36.4 | 11% | 0.107 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -70.2 | -35.8 | -179 | -78.6 | -90.9 | 0 | 0 | 0 | 112.6 | L74 W75 I81 A82 F127 I158 W162 | L74-N78 PolarHBondContact O-N 3.15Å; L74-N78 PolarHBondContact O-ND2 2.73Å; W75-N78 PolarHBondContact O-N 3.18Å; N78-I81 PolarHBondContact O-N 3.42Å; N78-A82 PolarHBondContact O-N 2.85Å; N78-F127 HydrophobicContact CB-CD1 4.24Å; N78-F127 HydrophobicContact CB-CD2 4.23Å; N78-F127 HydrophobicContact CB-CE1 3.66Å; N78-F127 HydrophobicContact CB-CE2 3.65Å; N78-F127 HydrophobicContact CB-CZ 3.35Å; N78-I158 WeakPolarHBondContact ND2-CD1 3.42Å; N78-I158 VanDerWaalsContact OD1-CG2 3.25Å; N78-I158 WeakPolarHBondContact OD1-CG2 3.08Å; N78-W162 PolarHBondContact OD1-NE1 2.97Å; N78-W162 VanDerWaalsContact OD1-NE1 3.09Å |
| 79 | L | 95.6 | Very high | 94.4 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.8 | -47.9 | 170.9 | 178.9 | 58.2 | 0 | 0 | 0 | 111.2 | W75 I81 A82 D83 S124 F127 L128 I131 Y304 | W75-L79 WeakPolarHBondContact O-CB 3.2Å; W75-L79 PolarHBondContact O-N 3.26Å; L79-I81 VanDerWaalsContact C-N 3.3Å; L79-I81 PolarHBondContact O-N 3.41Å; L79-A82 PolarHBondContact O-N 3.45Å; L79-D83 PolarHBondContact O-N 3.37Å; L79-S124 VanDerWaalsContact CD1-CA 3.48Å; L79-S124 WeakPolarHBondContact CD1-OG 3.29Å; L79-F127 HydrophobicContact CB-CB 4.14Å; L79-F127 HydrophobicContact CD1-CB 4.33Å; L79-L128 HydrophobicContact CD2-CD2 3.66Å; L79-L128 HydrophobicContact CD2-CG 4.29Å; L79-I131 HydrophobicContact CD2-CD1 4.02Å; L79-Y304 WeakPolarHBondContact CD2-OH 3.38Å |
| 80 | A | 95.8 | Very high | 94.8 | Very high | 1 Ų | 1 | 25.5 Ų | 25.5 | 1% | 0.008 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -64.2 | -33.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | N56 V59 I60 F76 L77 F84 | N56-A80 HydrophobicContact CB-CB 4.43Å; V59-A80 HydrophobicContact CB-CB 3.98Å; V59-A80 HydrophobicContact CG1-CB 3.63Å; I60-A80 HydrophobicContact CG1-CB 3.88Å; F76-A80 WeakPolarHBondContact O-CB 3.49Å; F76-A80 PolarHBondContact O-N 3.14Å; L77-A80 PolarHBondContact O-N 2.97Å; A80-F84 WeakPolarHBondContact O-CB 3.06Å; A80-F84 PolarHBondContact O-N 3.49Å |
| 81 | I | 97.6 | Very high | 95.1 | Very high | 52 Ų | 52 | 24.5 Ų | 24.5 | 27% | 0.267 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -66 | -45.2 | 174.1 | -70.9 | 165.3 | 0 | 0 | 0 | 110.8 | I60 L77 N78 L79 F84 I85 W162 | I60-I81 HydrophobicContact CD1-CG1 4.08Å; I60-I81 HydrophobicContact CG1-CG1 4.12Å; L77-I81 HydrophobicContact CD1-CD1 4.11Å; L77-I81 HydrophobicContact CD1-CG1 4.42Å; L77-I81 HydrophobicContact CG-CD1 3.98Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.44Å; L77-I81 PolarHBondContact O-N 2.96Å; N78-I81 PolarHBondContact O-N 3.42Å; L79-I81 VanDerWaalsContact C-N 3.3Å; L79-I81 PolarHBondContact O-N 3.41Å; I81-F84 PolarHBondContact O-N 3.24Å; I81-I85 HydrophobicContact CG2-CD1 3.72Å; I81-I85 HydrophobicContact CG2-CG1 4.4Å; I81-I85 VanDerWaalsContact O-CG1 3.26Å; I81-I85 WeakPolarHBondContact O-CG1 3.23Å; I81-I85 PolarHBondContact O-N 2.84Å; I81-W162 HydrophobicContact CG2-CH2 4.43Å; I81-W162 HydrophobicContact CG2-CZ2 4.15Å |
| 82 | A | 97.6 | Very high | 95.3 | Very high | 3 Ų | 3 | 25.5 Ų | 25.5 | 3% | 0.025 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.5 | -49.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | N78 L79 F84 I85 F86 N120 A123 W162 | N78-A82 PolarHBondContact O-N 2.85Å; L79-A82 PolarHBondContact O-N 3.45Å; A82-F84 VanDerWaalsContact C-N 3.35Å; A82-F84 PolarHBondContact O-N 3.26Å; A82-I85 PolarHBondContact O-N 3.41Å; A82-F86 PolarHBondContact O-N 3.05Å; A82-F86 VanDerWaalsContact O-N 3.11Å; A82-N120 VanDerWaalsContact C-OD1 3.27Å; A82-N120 PolarHBondContact O-OD1 2.76Å; A82-A123 HydrophobicContact CB-CB 4.05Å; A82-W162 HydrophobicContact CB-CH2 3.79Å; A82-W162 HydrophobicContact CB-CZ2 4.28Å |
| 83 | D | 97.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -59.8 | -44.9 | 177.3 | -73.4 | -31 | 0 | 0 | 0 | 111 | L79 F86 L87 N120 S124 S297 N300 | L79-D83 PolarHBondContact O-N 3.37Å; D83-F86 PolarHBondContact O-N 3.5Å; D83-L87 WeakPolarHBondContact O-CB 3.46Å; D83-L87 WeakPolarHBondContact O-CD1 3.34Å; D83-L87 WeakPolarHBondContact O-CG 3.3Å; D83-L87 PolarHBondContact O-N 3.03Å; D83-N120 WeakPolarHBondContact CA-OD1 3.19Å; D83-N120 PolarHBondContact N-OD1 2.9Å; D83-N120 PolarHBondContact OD1-OD1 2.72Å; D83-S124 PolarHBondContact OD1-OG 2.82Å; D83-S297 WeakPolarHBondContact OD1-CA 3.27Å; D83-S297 VanDerWaalsContact OD1-CB 3.24Å; D83-S297 WeakPolarHBondContact OD1-CB 3.48Å; D83-S297 PolarHBondContact OD1-OG 3.03Å; D83-N300 PolarHBondContact OD2-ND2 3.48Å |
| 84 | F | 97.5 | Very high | 95.7 | Very high | 54 Ų | 54 | 26.9 Ų | 26.9 | 24% | 0.237 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.4 | -46.4 | 179.9 | -174 | -98.8 | 0 | 0 | 0 | 112.7 | I53 N56 A57 I60 A80 I81 A82 F86 L87 L88 | I53-F84 HydrophobicContact CD1-CD2 4.14Å; I53-F84 HydrophobicContact CD1-CE2 4.03Å; I53-F84 HydrophobicContact CG2-CE2 4.13Å; N56-F84 HydrophobicContact CB-CB 4.1Å; N56-F84 HydrophobicContact CB-CD2 4.3Å; A57-F84 HydrophobicContact CB-CD2 4.49Å; A57-F84 HydrophobicContact CB-CE2 4.03Å; I60-F84 HydrophobicContact CD1-CB 3.83Å; I60-F84 HydrophobicContact CD1-CD1 4.4Å; I60-F84 HydrophobicContact CD1-CD2 4.46Å; I60-F84 HydrophobicContact CD1-CG 4Å; A80-F84 WeakPolarHBondContact O-CB 3.06Å; A80-F84 PolarHBondContact O-N 3.49Å; I81-F84 PolarHBondContact O-N 3.24Å; A82-F84 VanDerWaalsContact C-N 3.35Å; A82-F84 PolarHBondContact O-N 3.26Å; F84-F86 VanDerWaalsContact C-N 3.29Å; F84-F86 PolarHBondContact O-N 2.66Å; F84-L87 PolarHBondContact O-N 3.5Å; F84-L88 HydrophobicContact CD1-CD1 3.98Å; F84-L88 HydrophobicContact CD1-CG 4.31Å; F84-L88 HydrophobicContact CE1-CD1 3.63Å; F84-L88 HydrophobicContact CE1-CD2 4.27Å; F84-L88 HydrophobicContact CE1-CG 4.05Å; F84-L88 HydrophobicContact CZ-CD1 4.36Å; F84-L88 HydrophobicContact CZ-CD2 4.19Å; F84-L88 HydrophobicContact CZ-CG 4.41Å; F84-L88 WeakPolarHBondContact O-CG 3.31Å; F84-L88 PolarHBondContact O-N 2.87Å; F84-L88 VanDerWaalsContact O-N 3.07Å |
| 85 | I | 97.8 | Very high | 95.7 | Very high | 62 Ų | 62 | 27.9 Ų | 27.9 | 32% | 0.318 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -59.1 | -44.3 | 177.7 | -68.7 | 167.1 | 0 | 0 | 0 | 110 | I81 A82 L88 F89 T116 | I81-I85 HydrophobicContact CG2-CD1 3.72Å; I81-I85 HydrophobicContact CG2-CG1 4.4Å; I81-I85 VanDerWaalsContact O-CG1 3.26Å; I81-I85 WeakPolarHBondContact O-CG1 3.23Å; I81-I85 PolarHBondContact O-N 2.84Å; A82-I85 PolarHBondContact O-N 3.41Å; I85-L88 PolarHBondContact O-N 3.27Å; I85-F89 WeakPolarHBondContact O-CD2 3.3Å; I85-T116 HydrophobicContact CG2-CG2 3.92Å |
| 86 | F | 97.8 | Very high | 95.4 | Very high | 6 Ų | 6 | 28.7 Ų | 28.7 | 3% | 0.026 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.7 | -46.7 | 176.3 | 161.9 | -108.4 | 0 | 0 | 0 | 113.3 | A82 D83 F84 L88 F89 L90 T116 A117 N120 F294 | A82-F86 PolarHBondContact O-N 3.05Å; A82-F86 VanDerWaalsContact O-N 3.11Å; D83-F86 PolarHBondContact O-N 3.5Å; F84-F86 VanDerWaalsContact C-N 3.29Å; F84-F86 PolarHBondContact O-N 2.66Å; F86-L88 PolarHBondContact O-N 3.42Å; F86-F89 PolarHBondContact O-N 3.25Å; F86-L90 HydrophobicContact CZ-CD1 4.19Å; F86-L90 PolarHBondContact O-N 3.26Å; F86-L90 VanDerWaalsContact O-N 3.08Å; F86-T116 HydrophobicContact CB-CG2 4.26Å; F86-A117 HydrophobicContact CD2-CB 4.21Å; F86-A117 HydrophobicContact CE2-CB 4.07Å; F86-N120 HydrophobicContact CB-CB 3.53Å; F86-N120 WeakPolarHBondContact CD1-ND2 3.41Å; F86-N120 HydrophobicContact CD2-CB 4.45Å; F86-N120 HydrophobicContact CG-CB 4.01Å; F86-N120 WeakPolarHBondContact CG-ND2 3.45Å; F86-F294 HydrophobicContact CE1-CB 4.25Å; F86-F294 HydrophobicContact CE1-CD1 4.14Å; F86-F294 HydrophobicContact CE1-CG 4.12Å; F86-F294 HydrophobicContact CE2-CD1 4.24Å; F86-F294 AromaticContact CE2-CE1 3.98Å; F86-F294 HydrophobicContact CE2-CE1 3.98Å; F86-F294 HydrophobicContact CE2-CE2 4.46Å; F86-F294 HydrophobicContact CE2-CZ 4.1Å; F86-F294 HydrophobicContact CZ-CB 4.16Å; F86-F294 AromaticContact CZ-CD1 3.43Å; F86-F294 HydrophobicContact CZ-CD1 3.43Å; F86-F294 VanDerWaalsContact CZ-CD1 3.43Å; F86-F294 AromaticContact CZ-CD2 3.8Å; F86-F294 HydrophobicContact CZ-CD2 3.8Å; F86-F294 AromaticContact CZ-CE1 3.62Å; F86-F294 HydrophobicContact CZ-CE1 3.62Å; F86-F294 AromaticContact CZ-CE2 3.98Å; F86-F294 HydrophobicContact CZ-CE2 3.98Å; F86-F294 AromaticContact CZ-CG 3.53Å; F86-F294 HydrophobicContact CZ-CG 3.53Å; F86-F294 AromaticContact CZ-CZ 3.89Å; F86-F294 HydrophobicContact CZ-CZ 3.89Å |
| 87 | L | 97.7 | Very high | 95.2 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.6 | -25.1 | -179.2 | -68.1 | 166.6 | 0 | 0 | 0 | 112.9 | S48 F49 G52 I53 D83 F84 F89 L90 P91 | S48-L87 WeakPolarHBondContact O-CD2 3.26Å; F49-L87 VanDerWaalsContact CD2-O 3.32Å; F49-L87 WeakPolarHBondContact CD2-O 3.36Å; G52-L87 VanDerWaalsContact CA-CD1 3.44Å; I53-L87 HydrophobicContact CD1-CB 3.52Å; I53-L87 HydrophobicContact CG1-CB 4.02Å; D83-L87 WeakPolarHBondContact O-CB 3.46Å; D83-L87 WeakPolarHBondContact O-CD1 3.34Å; D83-L87 WeakPolarHBondContact O-CG 3.3Å; D83-L87 PolarHBondContact O-N 3.03Å; F84-L87 PolarHBondContact O-N 3.5Å; L87-F89 VanDerWaalsContact C-N 3.32Å; L87-L90 HydrophobicContact CD2-CD2 3.8Å; L87-L90 WeakPolarHBondContact O-CB 3.21Å; L87-L90 PolarHBondContact O-N 3.31Å; L87-P91 WeakPolarHBondContact O-CD 3.08Å |
| 88 | L | 97.5 | Very high | 94.9 | Very high | 95 Ų | 95 | 30.8 Ų | 30.8 | 50% | 0.497 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -68.3 | -29.6 | 172.4 | -70.5 | 176.6 | 0 | 0 | 0 | 113.2 | I53 F84 I85 F86 P91 | I53-L88 HydrophobicContact CD1-CD2 3.88Å; I53-L88 HydrophobicContact CD1-CG 4.23Å; F84-L88 HydrophobicContact CD1-CD1 3.98Å; F84-L88 HydrophobicContact CD1-CG 4.31Å; F84-L88 HydrophobicContact CE1-CD1 3.63Å; F84-L88 HydrophobicContact CE1-CD2 4.27Å; F84-L88 HydrophobicContact CE1-CG 4.05Å; F84-L88 HydrophobicContact CZ-CD1 4.36Å; F84-L88 HydrophobicContact CZ-CD2 4.19Å; F84-L88 HydrophobicContact CZ-CG 4.41Å; F84-L88 WeakPolarHBondContact O-CG 3.31Å; F84-L88 PolarHBondContact O-N 2.87Å; F84-L88 VanDerWaalsContact O-N 3.07Å; I85-L88 PolarHBondContact O-N 3.27Å; F86-L88 PolarHBondContact O-N 3.42Å; L88-P91 WeakPolarHBondContact O-CD 3.31Å |
| 89 | F | 96.6 | Very high | 94.5 | Very high | 54 Ų | 54 | 34 Ų | 34 | 24% | 0.237 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -88.6 | -20.9 | 177.2 | -78.2 | -101.2 | 0 | 0 | 0 | 112.5 | I85 F86 L87 P91 L92 A112 N113 T116 | I85-F89 WeakPolarHBondContact O-CD2 3.3Å; F86-F89 PolarHBondContact O-N 3.25Å; L87-F89 VanDerWaalsContact C-N 3.32Å; F89-P91 VanDerWaalsContact C-N 3.32Å; F89-L92 HydrophobicContact CD1-CD1 4.07Å; F89-L92 WeakPolarHBondContact O-CB 3.14Å; F89-L92 PolarHBondContact O-N 2.98Å; F89-A112 HydrophobicContact CE1-CB 3.96Å; F89-N113 HydrophobicContact CD1-CB 4.42Å; F89-N113 PolarHBondContact O-OD1 3.3Å; F89-T116 HydrophobicContact CB-CG2 4.25Å; F89-T116 HydrophobicContact CD2-CG2 3.83Å; F89-T116 HydrophobicContact CE2-CG2 4.44Å; F89-T116 HydrophobicContact CG-CG2 4.11Å |
| 90 | L | 96.1 | Very high | 93.9 | Very high | 1 Ų | 1 | 39 Ų | 39 | 1% | 0.005 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -51.2 | -37.2 | -179.3 | -176.3 | 58.2 | 0 | 0 | 0 | 114.9 | Y45 F49 F86 L87 L92 Y93 I94 F294 | Y45-L90 WeakPolarHBondContact O-CD2 3.16Å; F49-L90 HydrophobicContact CB-CD2 4.08Å; F86-L90 HydrophobicContact CZ-CD1 4.19Å; F86-L90 PolarHBondContact O-N 3.26Å; F86-L90 VanDerWaalsContact O-N 3.08Å; L87-L90 HydrophobicContact CD2-CD2 3.8Å; L87-L90 WeakPolarHBondContact O-CB 3.21Å; L87-L90 PolarHBondContact O-N 3.31Å; L90-L92 PolarHBondContact O-N 3.13Å; L90-Y93 HydrophobicContact CD1-CD1 4.31Å; L90-Y93 WeakPolarHBondContact O-CB 3.32Å; L90-Y93 PolarHBondContact O-N 3.47Å; L90-I94 HydrophobicContact CD1-CG1 4.42Å; L90-I94 HydrophobicContact CG-CD1 4.02Å; L90-I94 HydrophobicContact CG-CG1 4.28Å; L90-I94 WeakPolarHBondContact O-CG1 3.45Å; L90-I94 PolarHBondContact O-N 3.05Å; L90-F294 HydrophobicContact CD1-CD2 3.47Å; L90-F294 VanDerWaalsContact CD1-CD2 3.47Å; L90-F294 HydrophobicContact CD1-CE2 3.56Å |
| 91 | P | 96.9 | Very high | 93.3 | Very high | 44 Ų | 44 | 40.2 Ų | 40.2 | 29% | 0.286 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -57.8 | -30.2 | 175 | -28.2 | 36.9 | 0 | 0 | 0 | 114.8 | F49 L87 L88 F89 I94 S95 | F49-P91 HydrophobicContact CD2-CG 3.77Å; F49-P91 HydrophobicContact CE2-CG 3.44Å; F49-P91 VanDerWaalsContact CE2-CG 3.44Å; F49-P91 HydrophobicContact CZ-CG 3.95Å; L87-P91 WeakPolarHBondContact O-CD 3.08Å; L88-P91 WeakPolarHBondContact O-CD 3.31Å; F89-P91 VanDerWaalsContact C-N 3.32Å; P91-I94 PolarHBondContact O-N 3.46Å; P91-S95 WeakPolarHBondContact O-CB 3.29Å; P91-S95 PolarHBondContact O-N 2.9Å; P91-S95 PolarHBondContact O-OG 2.94Å |
| 92 | L | 95.6 | Very high | 92.7 | Very high | 34 Ų | 34 | 39.8 Ų | 39.8 | 18% | 0.178 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -67.3 | -41.9 | 175.2 | -59.3 | 176.4 | 0 | 0 | 0 | 110.6 | F89 L90 S95 Y96 W103 F105 L109 | F89-L92 HydrophobicContact CD1-CD1 4.07Å; F89-L92 WeakPolarHBondContact O-CB 3.14Å; F89-L92 PolarHBondContact O-N 2.98Å; L90-L92 PolarHBondContact O-N 3.13Å; L92-S95 PolarHBondContact O-N 3.12Å; L92-Y96 WeakPolarHBondContact O-CB 3.47Å; L92-Y96 PolarHBondContact O-N 3.45Å; L92-W103 HydrophobicContact CB-CH2 3.8Å; L92-W103 HydrophobicContact CB-CZ3 4.24Å; L92-W103 HydrophobicContact CD1-CH2 4.4Å; L92-F105 HydrophobicContact CB-CD2 4.5Å; L92-F105 HydrophobicContact CB-CE2 4.4Å; L92-F105 HydrophobicContact CD2-CD1 3.97Å; L92-F105 HydrophobicContact CD2-CD2 4.15Å; L92-F105 HydrophobicContact CD2-CE1 3.95Å; L92-F105 HydrophobicContact CD2-CE2 4.14Å; L92-F105 HydrophobicContact CD2-CG 4.07Å; L92-F105 HydrophobicContact CD2-CZ 4.04Å; L92-L109 HydrophobicContact CD1-CB 4.42Å; L92-L109 HydrophobicContact CD1-CD2 4.08Å |
| 93 | Y | 91.6 | Very high | 92.4 | Very high | 46 Ų | 46 | 39.8 Ų | 39.8 | 18% | 0.18 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -68.8 | -39 | 175.6 | -175.3 | -98.1 | 0 | 0 | 0 | 112.3 | Y45 L90 S95 Y96 V97 F294 | Y45-Y93 HydrophobicContact CD2-CD1 4.45Å; Y45-Y93 HydrophobicContact CD2-CE1 4.22Å; Y45-Y93 AromaticContact CE1-CE1 3.98Å; Y45-Y93 HydrophobicContact CE1-CE1 3.98Å; Y45-Y93 HydrophobicContact CE2-CD1 4.37Å; Y45-Y93 AromaticContact CE2-CE1 3.7Å; Y45-Y93 HydrophobicContact CE2-CE1 3.7Å; Y45-Y93 AromaticContact CZ-CE1 3.57Å; L90-Y93 HydrophobicContact CD1-CD1 4.31Å; L90-Y93 WeakPolarHBondContact O-CB 3.32Å; L90-Y93 PolarHBondContact O-N 3.47Å; Y93-S95 VanDerWaalsContact C-N 3.33Å; Y93-S95 PolarHBondContact O-N 3.37Å; Y93-Y96 HydrophobicContact CD2-CD1 4.18Å; Y93-Y96 HydrophobicContact CE2-CD1 4.14Å; Y93-Y96 HydrophobicContact CE2-CE1 4.42Å; Y93-Y96 WeakPolarHBondContact O-CB 3.44Å; Y93-Y96 PolarHBondContact O-N 2.89Å; Y93-V97 HydrophobicContact CD1-CG2 4.28Å; Y93-V97 HydrophobicContact CE1-CG2 3.88Å; Y93-V97 WeakPolarHBondContact O-CG2 3.26Å; Y93-V97 PolarHBondContact O-N 3.39Å; Y93-F294 AromaticContact CD1-CE2 3.67Å; Y93-F294 HydrophobicContact CD1-CE2 3.67Å; Y93-F294 HydrophobicContact CD1-CZ 4.4Å; Y93-F294 AromaticContact CE1-CE2 3.73Å; Y93-F294 HydrophobicContact CE1-CE2 3.73Å; Y93-F294 HydrophobicContact CE1-CZ 4.32Å; Y93-F294 HydrophobicContact CG-CE2 4.39Å |
| 94 | I | 92.6 | Very high | 92.2 | Very high | 22 Ų | 22 | 42.8 Ų | 42.8 | 11% | 0.113 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59 | -47.5 | 172.4 | -69.2 | 170.7 | 0 | 0 | 0 | 110.1 | L42 F49 L90 P91 Y96 V97 V98 | L42-I94 HydrophobicContact CD1-CG2 3.85Å; F49-I94 HydrophobicContact CB-CD1 4.44Å; L90-I94 HydrophobicContact CD1-CG1 4.42Å; L90-I94 HydrophobicContact CG-CD1 4.02Å; L90-I94 HydrophobicContact CG-CG1 4.28Å; L90-I94 WeakPolarHBondContact O-CG1 3.45Å; L90-I94 PolarHBondContact O-N 3.05Å; P91-I94 PolarHBondContact O-N 3.46Å; I94-Y96 VanDerWaalsContact C-N 3.32Å; I94-Y96 PolarHBondContact O-N 3.21Å; I94-V97 PolarHBondContact O-N 2.96Å; I94-V98 HydrophobicContact CG2-CG2 4.33Å; I94-V98 WeakPolarHBondContact O-CG2 3.38Å; I94-V98 PolarHBondContact O-N 3.13Å |
| 95 | S | 92.7 | Very high | 92.1 | Very high | 38 Ų | 38 | 43.2 Ų | 43.2 | 27% | 0.266 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -61.1 | -42.5 | 178.6 | -57.4 | 0 | 0 | 0 | 0 | 111.6 | P91 L92 Y93 V97 V98 M99 | P91-S95 WeakPolarHBondContact O-CB 3.29Å; P91-S95 PolarHBondContact O-N 2.9Å; P91-S95 PolarHBondContact O-OG 2.94Å; L92-S95 PolarHBondContact O-N 3.12Å; Y93-S95 VanDerWaalsContact C-N 3.33Å; Y93-S95 PolarHBondContact O-N 3.37Å; S95-V97 VanDerWaalsContact C-N 3.34Å; S95-V97 PolarHBondContact O-N 2.86Å; S95-V98 PolarHBondContact O-N 3.17Å; S95-M99 WeakPolarHBondContact O-CB 3.44Å; S95-M99 VanDerWaalsContact O-CG 3.27Å; S95-M99 WeakPolarHBondContact O-CG 3.32Å; S95-M99 PolarHBondContact O-N 2.95Å |
| 96 | Y | 88.1 | Confident | 91.9 | Very high | 28 Ų | 28 | 41.9 Ų | 41.9 | 11% | 0.11 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -55.1 | -47.9 | 173.4 | 170.7 | -107.3 | 0 | 0 | 0 | 111.7 | Y22 L92 Y93 I94 M99 F101 W103 | Y22-Y96 PolarHBondContact OH-OH 3.05Å; L92-Y96 WeakPolarHBondContact O-CB 3.47Å; L92-Y96 PolarHBondContact O-N 3.45Å; Y93-Y96 HydrophobicContact CD2-CD1 4.18Å; Y93-Y96 HydrophobicContact CE2-CD1 4.14Å; Y93-Y96 HydrophobicContact CE2-CE1 4.42Å; Y93-Y96 WeakPolarHBondContact O-CB 3.44Å; Y93-Y96 PolarHBondContact O-N 2.89Å; I94-Y96 VanDerWaalsContact C-N 3.32Å; I94-Y96 PolarHBondContact O-N 3.21Å; Y96-M99 PolarHBondContact O-N 3.23Å; Y96-F101 HydrophobicContact CD1-CD1 4.1Å; Y96-F101 HydrophobicContact CD2-CB 4.46Å; Y96-F101 WeakPolarHBondContact CD2-O 3.49Å; Y96-F101 HydrophobicContact CE1-CB 4.25Å; Y96-F101 AromaticContact CE1-CD1 3.49Å; Y96-F101 HydrophobicContact CE1-CD1 3.49Å; Y96-F101 VanDerWaalsContact CE1-CD1 3.49Å; Y96-F101 HydrophobicContact CE1-CE1 4.36Å; Y96-F101 HydrophobicContact CE1-CG 4.36Å; Y96-F101 VanDerWaalsContact CE2-C 3.41Å; Y96-F101 HydrophobicContact CE2-CB 3.83Å; Y96-F101 WeakPolarHBondContact CE2-O 3.21Å; Y96-F101 AromaticContact CZ-CD1 3.77Å; Y96-F101 WeakPolarHBondContact O-CA 3.29Å; Y96-F101 PolarHBondContact O-N 2.85Å; Y96-W103 HydrophobicContact CD2-CB 4.09Å; Y96-W103 AromaticContact CD2-CE3 3.87Å; Y96-W103 HydrophobicContact CD2-CE3 3.87Å; Y96-W103 HydrophobicContact CE2-CB 4.37Å; Y96-W103 HydrophobicContact CG-CE3 4.08Å |
| 97 | V | 86.4 | Confident | 91.8 | Very high | 3 Ų | 3 | 44.5 Ų | 44.5 | 2% | 0.018 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -68 | -36 | 178.7 | 174.7 | 0 | 0 | 0 | 0 | 112.7 | H38 L42 Y45 Y93 I94 S95 F101 | H38-V97 VanDerWaalsContact CE1-CG1 3.5Å; H38-V97 WeakPolarHBondContact CE1-CG1 3.39Å; H38-V97 VanDerWaalsContact NE2-CG1 3.32Å; H38-V97 WeakPolarHBondContact NE2-CG1 3.4Å; H38-V97 PolarHBondContact NE2-O 2.96Å; H38-V97 VanDerWaalsContact NE2-O 3.14Å; L42-V97 HydrophobicContact CD1-CG1 4.41Å; Y45-V97 HydrophobicContact CE2-CG1 4.42Å; Y45-V97 HydrophobicContact CE2-CG2 4.13Å; Y93-V97 HydrophobicContact CD1-CG2 4.28Å; Y93-V97 HydrophobicContact CE1-CG2 3.88Å; Y93-V97 WeakPolarHBondContact O-CG2 3.26Å; Y93-V97 PolarHBondContact O-N 3.39Å; I94-V97 PolarHBondContact O-N 2.96Å; S95-V97 VanDerWaalsContact C-N 3.34Å; S95-V97 PolarHBondContact O-N 2.86Å; V97-F101 HydrophobicContact CG2-CE1 4.4Å |
| 98 | V | 88.4 | Confident | 91.7 | Very high | 83 Ų | 83 | 54.8 Ų | 54.8 | 50% | 0.503 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -70.7 | -35.4 | 178.4 | 169.9 | 0 | 0 | 0 | 0 | 112 | L42 I94 S95 N100 | L42-V98 HydrophobicContact CD1-CG2 3.63Å; L42-V98 HydrophobicContact CD2-CG2 3.92Å; L42-V98 HydrophobicContact CG-CG2 4.44Å; I94-V98 HydrophobicContact CG2-CG2 4.33Å; I94-V98 WeakPolarHBondContact O-CG2 3.38Å; I94-V98 PolarHBondContact O-N 3.13Å; S95-V98 PolarHBondContact O-N 3.17Å; V98-N100 PolarHBondContact O-N 3.34Å |
| 99 | M | 86.6 | Confident | 91.7 | Very high | 86 Ų | 86 | 53.4 Ų | 53.4 | 42% | 0.424 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.3 | 28.7 | 179.1 | -61.2 | 176.7 | -179 | 0 | 0 | 112.5 | S95 Y96 F101 H102 P104 | S95-M99 WeakPolarHBondContact O-CB 3.44Å; S95-M99 VanDerWaalsContact O-CG 3.27Å; S95-M99 WeakPolarHBondContact O-CG 3.32Å; S95-M99 PolarHBondContact O-N 2.95Å; Y96-M99 PolarHBondContact O-N 3.23Å; M99-F101 VanDerWaalsContact C-N 3.26Å; M99-F101 PolarHBondContact O-N 2.95Å; M99-H102 HydrophobicContact CB-CB 3.8Å; M99-H102 VanDerWaalsContact O-CB 3.23Å; M99-H102 WeakPolarHBondContact O-CB 3.22Å; M99-H102 PolarHBondContact O-N 3.09Å; M99-H102 VanDerWaalsContact O-N 3.07Å; M99-P104 HydrophobicContact SD-CG 3.96Å |
| 100 | N | 82.9 | Confident | 91.6 | Very high | 108 Ų | 108 | 50.9 Ų | 50.9 | 58% | 0.578 | 26% | 0.262 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 46.4 | -176.6 | -56.9 | -48.6 | 0 | 0 | 0 | 112.8 | V98 H102 H184 | V98-N100 PolarHBondContact O-N 3.34Å; N100-H102 VanDerWaalsContact C-N 3.3Å; N100-H102 PolarHBondContact O-N 2.91Å; N100-H184 PolarHBondContact O-CE1 2.87Å; N100-H184 PolarHBondContact O-NE2 2.87Å |
| 101 | F | 83.4 | Confident | 91.6 | Very high | 25 Ų | 25 | 52.8 Ų | 52.8 | 11% | 0.11 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 67.8 | 23.3 | 179.8 | -47.7 | -77.4 | 0 | 0 | 0 | 115.3 | Y22 H38 Y96 V97 M99 H184 L186 | Y22-F101 HydrophobicContact CE1-CB 3.75Å; Y22-F101 AromaticContact CE1-CD2 3.78Å; Y22-F101 HydrophobicContact CE1-CD2 3.78Å; Y22-F101 HydrophobicContact CE1-CG 4.02Å; Y22-F101 AromaticContact CZ-CG 3.94Å; Y22-F101 WeakPolarHBondContact OH-CB 3.23Å; Y22-F101 WeakPolarHBondContact OH-CG 3.26Å; H38-F101 AromaticContact CE1-CZ 3.86Å; Y96-F101 HydrophobicContact CD1-CD1 4.1Å; Y96-F101 HydrophobicContact CD2-CB 4.46Å; Y96-F101 WeakPolarHBondContact CD2-O 3.49Å; Y96-F101 HydrophobicContact CE1-CB 4.25Å; Y96-F101 AromaticContact CE1-CD1 3.49Å; Y96-F101 HydrophobicContact CE1-CD1 3.49Å; Y96-F101 VanDerWaalsContact CE1-CD1 3.49Å; Y96-F101 HydrophobicContact CE1-CE1 4.36Å; Y96-F101 HydrophobicContact CE1-CG 4.36Å; Y96-F101 VanDerWaalsContact CE2-C 3.41Å; Y96-F101 HydrophobicContact CE2-CB 3.83Å; Y96-F101 WeakPolarHBondContact CE2-O 3.21Å; Y96-F101 AromaticContact CZ-CD1 3.77Å; Y96-F101 WeakPolarHBondContact O-CA 3.29Å; Y96-F101 PolarHBondContact O-N 2.85Å; V97-F101 HydrophobicContact CG2-CE1 4.4Å; M99-F101 VanDerWaalsContact C-N 3.26Å; M99-F101 PolarHBondContact O-N 2.95Å; F101-H184 VanDerWaalsContact C-CE1 3.41Å; F101-H184 PolarHBondContact O-CE1 3.39Å; F101-L186 WeakPolarHBondContact O-CD2 3.17Å |
| 102 | H | 85.6 | Confident | 91.6 | Very high | 43 Ų | 43 | 52 Ų | 52 | 20% | 0.199 | 27% | 0.267 | C | S | . | . | trans | -76.8 | 131.5 | 167.2 | -171.9 | 64.1 | 0 | 0 | 0 | 111.6 | M99 N100 P104 H184 T185 | M99-H102 HydrophobicContact CB-CB 3.8Å; M99-H102 VanDerWaalsContact O-CB 3.23Å; M99-H102 WeakPolarHBondContact O-CB 3.22Å; M99-H102 PolarHBondContact O-N 3.09Å; M99-H102 VanDerWaalsContact O-N 3.07Å; N100-H102 VanDerWaalsContact C-N 3.3Å; N100-H102 PolarHBondContact O-N 2.91Å; H102-P104 VanDerWaalsContact O-CD 3.27Å; H102-P104 WeakPolarHBondContact O-CD 3.42Å; H102-H184 WeakPolarHBondContact CA-NE2 3.5Å; H102-H184 VanDerWaalsContact CB-NE2 3.33Å; H102-H184 WeakPolarHBondContact CB-NE2 3.09Å; H102-H184 PolarHBondContact N-CE1 3.37Å; H102-H184 PolarHBondContact N-NE2 3.27Å; H102-H184 AromaticContact ND1-CD2 3.58Å; H102-H184 AromaticContact ND1-CG 3.94Å; H102-T185 CarbonylContact C-O 3.57Å; H102-T185 PolarHBondContact CE1-N 3.34Å; H102-T185 PolarHBondContact ND1-N 2.89Å; H102-T185 VanDerWaalsContact ND1-N 3.2Å | ||
| 103 | W | 90.4 | Very high | 91.6 | Very high | 3 Ų | 3 | 51 Ų | 51 | 1% | 0.011 | 26% | 0.262 | C | S | . | . | trans | -112.1 | 90 | 176.8 | -172.9 | -90 | 0 | 0 | 0 | 112.1 | L92 Y96 F105 G106 L109 C110 N113 T185 C187 | L92-W103 HydrophobicContact CB-CH2 3.8Å; L92-W103 HydrophobicContact CB-CZ3 4.24Å; L92-W103 HydrophobicContact CD1-CH2 4.4Å; Y96-W103 HydrophobicContact CD2-CB 4.09Å; Y96-W103 AromaticContact CD2-CE3 3.87Å; Y96-W103 HydrophobicContact CD2-CE3 3.87Å; Y96-W103 HydrophobicContact CE2-CB 4.37Å; Y96-W103 HydrophobicContact CG-CE3 4.08Å; W103-F105 VanDerWaalsContact C-N 3.34Å; W103-F105 AromaticContact CD2-CD2 3.91Å; W103-F105 HydrophobicContact CD2-CD2 3.91Å; W103-F105 AromaticContact CE2-CD2 3.8Å; W103-F105 HydrophobicContact CE3-CD2 4Å; W103-F105 AromaticContact CH2-CD2 3.9Å; W103-F105 HydrophobicContact CH2-CD2 3.9Å; W103-F105 HydrophobicContact CZ2-CB 3.77Å; W103-F105 AromaticContact CZ2-CD2 3.77Å; W103-F105 HydrophobicContact CZ2-CD2 3.77Å; W103-F105 HydrophobicContact CZ2-CG 4.22Å; W103-F105 HydrophobicContact CZ3-CD2 4Å; W103-F105 HydrophobicContact CZ3-CE2 4.47Å; W103-F105 PolarHBondContact O-N 3.06Å; W103-G106 PolarHBondContact NE1-O 3.44Å; W103-L109 HydrophobicContact CZ2-CB 3.8Å; W103-L109 WeakPolarHBondContact CZ2-O 3.11Å; W103-C110 HydrophobicContact CD2-CB 4.42Å; W103-C110 VanDerWaalsContact CZ2-CA 3.49Å; W103-C110 HydrophobicContact CZ2-CB 4.18Å; W103-C110 VanDerWaalsContact CZ2-N 3.27Å; W103-N113 HydrophobicContact CH2-CB 3.84Å; W103-T185 PolarHBondContact N-O 3.31Å; W103-T185 WeakPolarHBondContact O-CB 3.38Å; W103-T185 WeakPolarHBondContact O-CG2 3.42Å; W103-C187 HydrophobicContact CB-CB 3.98Å; W103-C187 HydrophobicContact CD2-CB 3.87Å; W103-C187 HydrophobicContact CE3-CB 4.17Å; W103-C187 HydrophobicContact CG-CB 3.75Å | ||
| 104 | P | 94 | Very high | 91.7 | Very high | 64 Ų | 64 | 49.2 Ų | 49.2 | 42% | 0.416 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | -3.4 | -178.4 | 33.7 | -36.5 | 0 | 0 | 0 | 114 | M99 H102 G106 | M99-P104 HydrophobicContact SD-CG 3.96Å; H102-P104 VanDerWaalsContact O-CD 3.27Å; H102-P104 WeakPolarHBondContact O-CD 3.42Å; P104-G106 VanDerWaalsContact C-N 3.31Å; P104-G106 PolarHBondContact O-N 3.4Å |
| 105 | F | 95 | Very high | 91.8 | Very high | 62 Ų | 62 | 50 Ų | 50 | 27% | 0.272 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87 | 2.5 | -167.8 | -50.7 | -69.3 | 0 | 0 | 0 | 114.5 | L92 W103 L109 | L92-F105 HydrophobicContact CB-CD2 4.5Å; L92-F105 HydrophobicContact CB-CE2 4.4Å; L92-F105 HydrophobicContact CD2-CD1 3.97Å; L92-F105 HydrophobicContact CD2-CD2 4.15Å; L92-F105 HydrophobicContact CD2-CE1 3.95Å; L92-F105 HydrophobicContact CD2-CE2 4.14Å; L92-F105 HydrophobicContact CD2-CG 4.07Å; L92-F105 HydrophobicContact CD2-CZ 4.04Å; W103-F105 VanDerWaalsContact C-N 3.34Å; W103-F105 AromaticContact CD2-CD2 3.91Å; W103-F105 HydrophobicContact CD2-CD2 3.91Å; W103-F105 AromaticContact CE2-CD2 3.8Å; W103-F105 HydrophobicContact CE3-CD2 4Å; W103-F105 AromaticContact CH2-CD2 3.9Å; W103-F105 HydrophobicContact CH2-CD2 3.9Å; W103-F105 HydrophobicContact CZ2-CB 3.77Å; W103-F105 AromaticContact CZ2-CD2 3.77Å; W103-F105 HydrophobicContact CZ2-CD2 3.77Å; W103-F105 HydrophobicContact CZ2-CG 4.22Å; W103-F105 HydrophobicContact CZ3-CD2 4Å; W103-F105 HydrophobicContact CZ3-CE2 4.47Å; W103-F105 PolarHBondContact O-N 3.06Å; F105-L109 HydrophobicContact CB-CB 3.9Å; F105-L109 HydrophobicContact CB-CD1 3.75Å; F105-L109 HydrophobicContact CB-CG 4.46Å |
| 106 | G | 94.6 | Very high | 92.1 | Very high | 34 Ų | 34 | 48.7 Ų | 48.7 | 35% | 0.351 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | 75.2 | 171.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | W103 P104 W108 L109 C110 | W103-G106 PolarHBondContact NE1-O 3.44Å; P104-G106 VanDerWaalsContact C-N 3.31Å; P104-G106 PolarHBondContact O-N 3.4Å; G106-W108 PolarHBondContact O-N 2.99Å; G106-L109 PolarHBondContact O-N 3.24Å; G106-C110 PolarHBondContact O-N 3.3Å |
| 107 | I | 94.6 | Very high | 92.4 | Very high | 61 Ų | 61 | 48.5 Ų | 48.5 | 31% | 0.313 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64 | -38 | -170.8 | -170.6 | 168 | 0 | 0 | 0 | 114 | L109 C110 K111 D177 T178 | I107-L109 PolarHBondContact O-N 3.42Å; I107-C110 WeakPolarHBondContact O-CB 3.37Å; I107-C110 PolarHBondContact O-N 3.34Å; I107-K111 HydrophobicContact CG1-CD 4.13Å; I107-K111 PolarHBondContact O-N 3Å; I107-D177 WeakPolarHBondContact CD1-OD1 3.44Å; I107-T178 HydrophobicContact CB-CG2 4.37Å |
| 108 | W | 96.3 | Very high | 92.8 | Very high | 216 Ų | 216 | 49.6 Ų | 49.6 | 82% | 0.818 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -60.8 | -47.6 | -179 | -74.8 | 107.8 | 0 | 0 | 0 | 111.7 | G106 K111 A112 | G106-W108 PolarHBondContact O-N 2.99Å; W108-K111 PolarHBondContact O-N 3.26Å; W108-A112 VanDerWaalsContact O-CB 3.28Å; W108-A112 WeakPolarHBondContact O-CB 3.15Å; W108-A112 PolarHBondContact O-N 2.79Å |
| 109 | L | 96.3 | Very high | 93.2 | Very high | 67 Ų | 67 | 46.6 Ų | 46.6 | 35% | 0.351 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -71.5 | -30.7 | 178.3 | -72.1 | 172.7 | 0 | 0 | 0 | 111.7 | L92 W103 F105 G106 I107 A112 N113 | L92-L109 HydrophobicContact CD1-CB 4.42Å; L92-L109 HydrophobicContact CD1-CD2 4.08Å; W103-L109 HydrophobicContact CZ2-CB 3.8Å; W103-L109 WeakPolarHBondContact CZ2-O 3.11Å; F105-L109 HydrophobicContact CB-CB 3.9Å; F105-L109 HydrophobicContact CB-CD1 3.75Å; F105-L109 HydrophobicContact CB-CG 4.46Å; G106-L109 PolarHBondContact O-N 3.24Å; I107-L109 PolarHBondContact O-N 3.42Å; L109-A112 PolarHBondContact O-N 3.19Å; L109-N113 WeakPolarHBondContact O-CB 3.48Å; L109-N113 PolarHBondContact O-N 2.88Å |
| 110 | C | 94.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.7 | -48.6 | 173.7 | 167.7 | 0 | 0 | 0 | 0 | 111.2 | W103 G106 I107 S114 D177 T178 C187 | W103-C110 HydrophobicContact CD2-CB 4.42Å; W103-C110 VanDerWaalsContact CZ2-CA 3.49Å; W103-C110 HydrophobicContact CZ2-CB 4.18Å; W103-C110 VanDerWaalsContact CZ2-N 3.27Å; G106-C110 PolarHBondContact O-N 3.3Å; I107-C110 WeakPolarHBondContact O-CB 3.37Å; I107-C110 PolarHBondContact O-N 3.34Å; C110-S114 WeakPolarHBondContact O-CB 3.45Å; C110-S114 PolarHBondContact O-N 3.38Å; C110-S114 PolarHBondContact O-OG 3.19Å; C110-D177 PolarHBondContact SG-O 3.33Å; C110-T178 HydrophobicContact CB-CG2 3.85Å; C110-C187 VanDerWaalsContact CA-SG 3.54Å; C110-C187 HydrophobicContact CB-CB 3.88Å; C110-C187 WeakPolarHBondContact CB-SG 3.44Å; C110-C187 WeakPolarHBondContact SG-CB 3.34Å; C110-C187 CovalentContact SG-SG 2.03Å; C110-C187 PolarHBondContact SG-SG 2.9Å |
| 111 | K | 96 | Very high | 94.3 | Very high | 42 Ų | 42 | 37.8 Ų | 37.8 | 18% | 0.183 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.1 | -47.8 | 175.4 | -72.4 | 170.5 | -178.2 | -88.8 | 0 | 111.4 | I107 W108 S114 F115 L173 Y174 R176 | I107-K111 HydrophobicContact CG1-CD 4.13Å; I107-K111 PolarHBondContact O-N 3Å; W108-K111 PolarHBondContact O-N 3.26Å; K111-S114 PolarHBondContact O-N 2.99Å; K111-F115 VanDerWaalsContact O-CB 3.26Å; K111-F115 WeakPolarHBondContact O-CB 3.27Å; K111-F115 PolarHBondContact O-N 3.15Å; K111-L173 HydrophobicContact CB-CD2 4.27Å; K111-L173 WeakPolarHBondContact CD-O 3.44Å; K111-L173 PolarHBondContact NZ-O 2.92Å; K111-Y174 PolarHBondContact NZ-O 2.89Å; K111-R176 WeakPolarHBondContact CE-O 3.34Å; K111-R176 HydrophobicContact CG-CB 4.01Å; K111-R176 WeakPolarHBondContact CG-O 3.26Å; K111-R176 PolarHBondContact NZ-O 3.43Å |
| 112 | A | 96.7 | Very high | 94.9 | Very high | 26 Ų | 26 | 36.6 Ų | 36.6 | 22% | 0.215 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -65 | -45.5 | -178 | 0 | 0 | 0 | 0 | 0 | 112.7 | F89 W108 L109 S114 F115 T116 | F89-A112 HydrophobicContact CE1-CB 3.96Å; W108-A112 VanDerWaalsContact O-CB 3.28Å; W108-A112 WeakPolarHBondContact O-CB 3.15Å; W108-A112 PolarHBondContact O-N 2.79Å; L109-A112 PolarHBondContact O-N 3.19Å; A112-S114 VanDerWaalsContact C-N 3.34Å; A112-S114 PolarHBondContact O-N 2.81Å; A112-F115 PolarHBondContact O-N 3.38Å; A112-T116 VanDerWaalsContact O-CB 3.28Å; A112-T116 WeakPolarHBondContact O-CB 3.33Å; A112-T116 PolarHBondContact O-N 3.19Å; A112-T116 PolarHBondContact O-OG1 2.85Å |
| 113 | N | 95.4 | Very high | 95.5 | Very high | 13 Ų | 13 | 34.6 Ų | 34.6 | 7% | 0.07 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -58.8 | -47.1 | 177.4 | 179.8 | 68.4 | 0 | 0 | 0 | 111.2 | F89 W103 L109 T116 A117 | F89-N113 HydrophobicContact CD1-CB 4.42Å; F89-N113 PolarHBondContact O-OD1 3.3Å; W103-N113 HydrophobicContact CH2-CB 3.84Å; L109-N113 WeakPolarHBondContact O-CB 3.48Å; L109-N113 PolarHBondContact O-N 2.88Å; N113-T116 PolarHBondContact O-N 3.04Å; N113-A117 PolarHBondContact O-N 3.48Å |
| 114 | S | 93.8 | Very high | 95.7 | Very high | 10 Ų | 10 | 34.4 Ų | 34.4 | 7% | 0.07 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -66.3 | -44 | 178.6 | -59.8 | 0 | 0 | 0 | 0 | 112.4 | C110 K111 A112 A117 Q118 R176 | C110-S114 WeakPolarHBondContact O-CB 3.45Å; C110-S114 PolarHBondContact O-N 3.38Å; C110-S114 PolarHBondContact O-OG 3.19Å; K111-S114 PolarHBondContact O-N 2.99Å; A112-S114 VanDerWaalsContact C-N 3.34Å; A112-S114 PolarHBondContact O-N 2.81Å; S114-A117 PolarHBondContact O-N 3.49Å; S114-Q118 VanDerWaalsContact O-CG 3.23Å; S114-Q118 WeakPolarHBondContact O-CG 3.34Å; S114-Q118 PolarHBondContact O-N 3.1Å; S114-Q118 VanDerWaalsContact O-N 3.11Å; S114-R176 PolarHBondContact OG-NE 3.31Å; S114-R176 VanDerWaalsContact OG-NE 3.15Å |
| 115 | F | 96.7 | Very high | 95.8 | Very high | 39 Ų | 39 | 31.4 Ų | 31.4 | 17% | 0.171 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.1 | -46.1 | 176.1 | 170.6 | -105 | 0 | 0 | 0 | 111.6 | K111 A112 A117 Q118 L119 L173 | K111-F115 VanDerWaalsContact O-CB 3.26Å; K111-F115 WeakPolarHBondContact O-CB 3.27Å; K111-F115 PolarHBondContact O-N 3.15Å; A112-F115 PolarHBondContact O-N 3.38Å; F115-A117 VanDerWaalsContact C-N 3.34Å; F115-A117 PolarHBondContact O-N 2.74Å; F115-Q118 PolarHBondContact O-N 2.9Å; F115-L119 HydrophobicContact CE1-CB 4.49Å; F115-L119 HydrophobicContact CE1-CD2 3.95Å; F115-L119 HydrophobicContact CZ-CB 4.43Å; F115-L119 HydrophobicContact CZ-CD1 4.35Å; F115-L119 HydrophobicContact CZ-CD2 4.16Å; F115-L119 VanDerWaalsContact O-CB 3.28Å; F115-L119 WeakPolarHBondContact O-CB 3.45Å; F115-L119 PolarHBondContact O-N 2.94Å; F115-L173 HydrophobicContact CB-CD2 3.48Å; F115-L173 VanDerWaalsContact CB-CD2 3.48Å; F115-L173 HydrophobicContact CB-CG 3.77Å; F115-L173 HydrophobicContact CD1-CD1 4.46Å; F115-L173 HydrophobicContact CD1-CD2 4.26Å; F115-L173 HydrophobicContact CD1-CG 4.49Å; F115-L173 HydrophobicContact CD2-CD1 3.79Å; F115-L173 HydrophobicContact CD2-CD2 4.24Å; F115-L173 HydrophobicContact CD2-CG 3.67Å; F115-L173 HydrophobicContact CE2-CD1 4.03Å; F115-L173 HydrophobicContact CE2-CG 4.41Å; F115-L173 HydrophobicContact CG-CD1 4.01Å; F115-L173 HydrophobicContact CG-CD2 3.73Å; F115-L173 HydrophobicContact CG-CG 3.71Å; F115-L173 HydrophobicContact CZ-CD1 4.46Å |
| 116 | T | 97.2 | Very high | 95.9 | Very high | 10 Ų | 10 | 29.3 Ų | 29.3 | 6% | 0.061 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.9 | -42 | 178.8 | -68 | 0 | 0 | 0 | 0 | 111.9 | I85 F86 F89 A112 N113 Q118 L119 N120 | I85-T116 HydrophobicContact CG2-CG2 3.92Å; F86-T116 HydrophobicContact CB-CG2 4.26Å; F89-T116 HydrophobicContact CB-CG2 4.25Å; F89-T116 HydrophobicContact CD2-CG2 3.83Å; F89-T116 HydrophobicContact CE2-CG2 4.44Å; F89-T116 HydrophobicContact CG-CG2 4.11Å; A112-T116 VanDerWaalsContact O-CB 3.28Å; A112-T116 WeakPolarHBondContact O-CB 3.33Å; A112-T116 PolarHBondContact O-N 3.19Å; A112-T116 PolarHBondContact O-OG1 2.85Å; N113-T116 PolarHBondContact O-N 3.04Å; T116-Q118 VanDerWaalsContact C-N 3.34Å; T116-Q118 PolarHBondContact O-N 3.37Å; T116-L119 PolarHBondContact O-N 3.47Å; T116-N120 WeakPolarHBondContact O-CB 3.34Å; T116-N120 PolarHBondContact O-N 2.88Å |
| 117 | A | 95.1 | Very high | 96 | Very high | 24 Ų | 24 | 27.7 Ų | 27.7 | 20% | 0.198 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.6 | -44 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | F86 N113 S114 F115 N120 M121 | F86-A117 HydrophobicContact CD2-CB 4.21Å; F86-A117 HydrophobicContact CE2-CB 4.07Å; N113-A117 PolarHBondContact O-N 3.48Å; S114-A117 PolarHBondContact O-N 3.49Å; F115-A117 VanDerWaalsContact C-N 3.34Å; F115-A117 PolarHBondContact O-N 2.74Å; A117-N120 PolarHBondContact O-N 2.9Å; A117-M121 PolarHBondContact O-N 3.29Å |
| 118 | Q | 95 | Very high | 96 | Very high | 26 Ų | 26 | 25 Ų | 25 | 12% | 0.121 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -68.8 | -40.4 | 178.3 | -65.6 | -66.7 | 97 | 0 | 0 | 112.5 | S114 F115 T116 N120 M121 F122 A172 | S114-Q118 VanDerWaalsContact O-CG 3.23Å; S114-Q118 WeakPolarHBondContact O-CG 3.34Å; S114-Q118 PolarHBondContact O-N 3.1Å; S114-Q118 VanDerWaalsContact O-N 3.11Å; F115-Q118 PolarHBondContact O-N 2.9Å; T116-Q118 VanDerWaalsContact C-N 3.34Å; T116-Q118 PolarHBondContact O-N 3.37Å; Q118-N120 VanDerWaalsContact C-N 3.35Å; Q118-M121 PolarHBondContact O-N 3.5Å; Q118-F122 WeakPolarHBondContact O-CD2 3.33Å; Q118-F122 PolarHBondContact O-N 3.47Å; Q118-F122 VanDerWaalsContact O-N 3.14Å; Q118-A172 HydrophobicContact CG-CB 4.14Å |
| 119 | L | 97.1 | Very high | 95.9 | Very high | 19 Ų | 19 | 15 Ų | 15 | 10% | 0.099 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -59.8 | -47 | 175.6 | -179.3 | 66.2 | 0 | 0 | 0 | 110.5 | F115 T116 F122 A123 W162 A165 S166 | F115-L119 HydrophobicContact CE1-CB 4.49Å; F115-L119 HydrophobicContact CE1-CD2 3.95Å; F115-L119 HydrophobicContact CZ-CB 4.43Å; F115-L119 HydrophobicContact CZ-CD1 4.35Å; F115-L119 HydrophobicContact CZ-CD2 4.16Å; F115-L119 VanDerWaalsContact O-CB 3.28Å; F115-L119 WeakPolarHBondContact O-CB 3.45Å; F115-L119 PolarHBondContact O-N 2.94Å; T116-L119 PolarHBondContact O-N 3.47Å; L119-F122 PolarHBondContact O-N 3.39Å; L119-A123 WeakPolarHBondContact O-CB 3.37Å; L119-A123 PolarHBondContact O-N 3.3Å; L119-W162 HydrophobicContact CD1-CE3 4.14Å; L119-W162 HydrophobicContact CD1-CZ3 4.19Å; L119-W162 HydrophobicContact CD2-CE3 4.48Å; L119-W162 HydrophobicContact CD2-CZ3 3.92Å; L119-W162 HydrophobicContact CG-CE3 4.45Å; L119-W162 HydrophobicContact CG-CZ3 3.98Å; L119-A165 HydrophobicContact CD1-CB 3.92Å; L119-S166 WeakPolarHBondContact CD1-OG 3.23Å |
| 120 | N | 96.6 | Very high | 95.9 | Very high | 7 Ų | 7 | 13.2 Ų | 13.2 | 4% | 0.037 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -62 | -46.2 | 176.5 | 177.6 | 57.4 | 0 | 0 | 0 | 112.2 | A82 D83 F86 T116 A117 Q118 F122 A123 S124 S297 | A82-N120 VanDerWaalsContact C-OD1 3.27Å; A82-N120 PolarHBondContact O-OD1 2.76Å; D83-N120 WeakPolarHBondContact CA-OD1 3.19Å; D83-N120 PolarHBondContact N-OD1 2.9Å; D83-N120 PolarHBondContact OD1-OD1 2.72Å; F86-N120 HydrophobicContact CB-CB 3.53Å; F86-N120 WeakPolarHBondContact CD1-ND2 3.41Å; F86-N120 HydrophobicContact CD2-CB 4.45Å; F86-N120 HydrophobicContact CG-CB 4.01Å; F86-N120 WeakPolarHBondContact CG-ND2 3.45Å; T116-N120 WeakPolarHBondContact O-CB 3.34Å; T116-N120 PolarHBondContact O-N 2.88Å; A117-N120 PolarHBondContact O-N 2.9Å; Q118-N120 VanDerWaalsContact C-N 3.35Å; N120-F122 PolarHBondContact O-N 3.41Å; N120-A123 PolarHBondContact O-N 2.97Å; N120-S124 WeakPolarHBondContact O-CB 3.46Å; N120-S124 PolarHBondContact O-N 3.15Å; N120-S124 PolarHBondContact O-OG 3.02Å; N120-S124 PolarHBondContact OD1-OG 3.09Å; N120-S297 PolarHBondContact ND2-OG 2.94Å; N120-S297 VanDerWaalsContact ND2-OG 3.1Å |
| 121 | M | 95.3 | Very high | 95.8 | Very high | 2 Ų | 2 | 13.5 Ų | 13.5 | 1% | 0.01 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -51.3 | -54.6 | 176.1 | 179.9 | -179.1 | 91.3 | 0 | 0 | 111.4 | A117 Q118 V125 K210 W259 Y262 | A117-M121 PolarHBondContact O-N 3.29Å; Q118-M121 PolarHBondContact O-N 3.5Å; M121-V125 WeakPolarHBondContact O-CB 3.24Å; M121-V125 WeakPolarHBondContact O-CG2 3.46Å; M121-V125 PolarHBondContact O-N 3.44Å; M121-K210 HydrophobicContact CE-CB 3.93Å; M121-K210 HydrophobicContact CE-CD 4.49Å; M121-K210 HydrophobicContact CE-CG 3.88Å; M121-W259 HydrophobicContact CB-CH2 3.59Å; M121-W259 HydrophobicContact CB-CZ2 4.34Å; M121-W259 HydrophobicContact CB-CZ3 4.1Å; M121-W259 HydrophobicContact CG-CE3 4.24Å; M121-W259 HydrophobicContact CG-CH2 3.37Å; M121-W259 HydrophobicContact CG-CZ2 4.14Å; M121-W259 HydrophobicContact CG-CZ3 3.42Å; M121-W259 VanDerWaalsContact CG-CZ3 3.42Å; M121-W259 HydrophobicContact SD-CE3 4.37Å; M121-W259 HydrophobicContact SD-CH2 4.09Å; M121-W259 HydrophobicContact SD-CZ3 3.58Å; M121-W259 VanDerWaalsContact SD-CZ3 3.58Å; M121-Y262 HydrophobicContact SD-CE1 4.48Å |
| 122 | F | 97.1 | Very high | 95.6 | Very high | 1 Ų | 1 | 11.6 Ų | 11.6 | 0% | 0.004 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -72 | -45.8 | -177.3 | -68.1 | -62.3 | 0 | 0 | 0 | 112.7 | Q118 L119 N120 V125 F126 A165 I168 K210 V213 | Q118-F122 WeakPolarHBondContact O-CD2 3.33Å; Q118-F122 PolarHBondContact O-N 3.47Å; Q118-F122 VanDerWaalsContact O-N 3.14Å; L119-F122 PolarHBondContact O-N 3.39Å; N120-F122 PolarHBondContact O-N 3.41Å; F122-V125 PolarHBondContact O-N 3.15Å; F122-F126 HydrophobicContact CB-CD2 4.39Å; F122-F126 HydrophobicContact CB-CE2 3.99Å; F122-F126 HydrophobicContact CB-CZ 4.46Å; F122-F126 HydrophobicContact CD1-CZ 4.31Å; F122-F126 WeakPolarHBondContact O-CB 3.39Å; F122-F126 WeakPolarHBondContact O-CD2 3.25Å; F122-F126 WeakPolarHBondContact O-CG 3.3Å; F122-F126 PolarHBondContact O-N 3Å; F122-A165 HydrophobicContact CB-CB 3.75Å; F122-I168 HydrophobicContact CD1-CG2 4.31Å; F122-I168 HydrophobicContact CD2-CB 4.1Å; F122-I168 HydrophobicContact CD2-CG2 4.03Å; F122-I168 HydrophobicContact CE1-CG2 3.73Å; F122-I168 HydrophobicContact CE2-CB 3.96Å; F122-I168 HydrophobicContact CE2-CG2 3.43Å; F122-I168 VanDerWaalsContact CE2-CG2 3.43Å; F122-I168 HydrophobicContact CG-CB 4.47Å; F122-I168 HydrophobicContact CG-CG2 4.45Å; F122-I168 HydrophobicContact CZ-CB 4.2Å; F122-I168 HydrophobicContact CZ-CG2 3.25Å; F122-K210 HydrophobicContact CZ-CG 4.08Å; F122-V213 HydrophobicContact CE1-CB 4.39Å; F122-V213 HydrophobicContact CE1-CG1 4.44Å |
| 123 | A | 97.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 13.2 Ų | 13.2 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -61 | -49.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | A82 L119 N120 V125 F126 F127 W162 A165 | A82-A123 HydrophobicContact CB-CB 4.05Å; L119-A123 WeakPolarHBondContact O-CB 3.37Å; L119-A123 PolarHBondContact O-N 3.3Å; N120-A123 PolarHBondContact O-N 2.97Å; A123-V125 VanDerWaalsContact C-N 3.35Å; A123-V125 PolarHBondContact O-N 2.98Å; A123-F126 PolarHBondContact O-N 3.24Å; A123-F127 HydrophobicContact CB-CD2 4.47Å; A123-F127 HydrophobicContact CB-CE2 4.32Å; A123-F127 WeakPolarHBondContact O-CD2 3.41Å; A123-F127 PolarHBondContact O-N 3.41Å; A123-W162 HydrophobicContact CB-CE3 4.46Å; A123-W162 HydrophobicContact CB-CZ3 4.24Å; A123-A165 HydrophobicContact CB-CB 3.97Å |
| 124 | S | 95.4 | Very high | 95.3 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -62 | -43.8 | -177.8 | -66.8 | 0 | 0 | 0 | 0 | 111.4 | L79 D83 N120 F127 L128 | L79-S124 VanDerWaalsContact CD1-CA 3.48Å; L79-S124 WeakPolarHBondContact CD1-OG 3.29Å; D83-S124 PolarHBondContact OD1-OG 2.82Å; N120-S124 WeakPolarHBondContact O-CB 3.46Å; N120-S124 PolarHBondContact O-N 3.15Å; N120-S124 PolarHBondContact O-OG 3.02Å; N120-S124 PolarHBondContact OD1-OG 3.09Å; S124-F127 PolarHBondContact O-N 3.2Å; S124-L128 VanDerWaalsContact O-CG 3.3Å; S124-L128 WeakPolarHBondContact O-CG 3.48Å; S124-L128 PolarHBondContact O-N 3.24Å |
| 125 | V | 95.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -68.7 | -38.7 | 179.4 | 177 | 0 | 0 | 0 | 0 | 112.7 | M121 F122 A123 L128 T129 P218 F255 | M121-V125 WeakPolarHBondContact O-CB 3.24Å; M121-V125 WeakPolarHBondContact O-CG2 3.46Å; M121-V125 PolarHBondContact O-N 3.44Å; F122-V125 PolarHBondContact O-N 3.15Å; A123-V125 VanDerWaalsContact C-N 3.35Å; A123-V125 PolarHBondContact O-N 2.98Å; V125-L128 PolarHBondContact O-N 3.4Å; V125-T129 WeakPolarHBondContact O-CB 3.29Å; V125-T129 PolarHBondContact O-N 2.97Å; V125-T129 PolarHBondContact O-OG1 3.49Å; V125-P218 HydrophobicContact CG1-CB 3.17Å; V125-P218 HydrophobicContact CG1-CG 3.24Å; V125-F255 HydrophobicContact CB-CE2 4.33Å; V125-F255 HydrophobicContact CG1-CE2 4.09Å; V125-F255 HydrophobicContact CG1-CZ 4.04Å; V125-F255 HydrophobicContact CG2-CD2 3.97Å; V125-F255 HydrophobicContact CG2-CE2 3.28Å; V125-F255 HydrophobicContact CG2-CZ 4.01Å |
| 126 | F | 97.3 | Very high | 94.8 | Very high | 19 Ų | 19 | 13.1 Ų | 13.1 | 8% | 0.083 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -65.4 | -40.2 | 173.7 | -66 | -25.6 | 0 | 0 | 0 | 112 | F122 A123 T129 V130 I161 L164 A165 I168 V213 | F122-F126 HydrophobicContact CB-CD2 4.39Å; F122-F126 HydrophobicContact CB-CE2 3.99Å; F122-F126 HydrophobicContact CB-CZ 4.46Å; F122-F126 HydrophobicContact CD1-CZ 4.31Å; F122-F126 WeakPolarHBondContact O-CB 3.39Å; F122-F126 WeakPolarHBondContact O-CD2 3.25Å; F122-F126 WeakPolarHBondContact O-CG 3.3Å; F122-F126 PolarHBondContact O-N 3Å; A123-F126 PolarHBondContact O-N 3.24Å; F126-T129 WeakPolarHBondContact O-CB 3.35Å; F126-T129 PolarHBondContact O-N 2.91Å; F126-V130 WeakPolarHBondContact O-CG2 3.2Å; F126-V130 PolarHBondContact O-N 2.83Å; F126-I161 HydrophobicContact CB-CG1 4.27Å; F126-I161 HydrophobicContact CB-CG2 3.75Å; F126-I161 HydrophobicContact CD2-CG2 4.25Å; F126-L164 HydrophobicContact CD2-CD2 4.39Å; F126-L164 HydrophobicContact CE2-CB 4.34Å; F126-L164 HydrophobicContact CE2-CD2 3.76Å; F126-L164 HydrophobicContact CE2-CG 3.84Å; F126-L164 HydrophobicContact CZ-CD2 3.97Å; F126-L164 HydrophobicContact CZ-CG 4.29Å; F126-A165 HydrophobicContact CD2-CB 4.44Å; F126-I168 HydrophobicContact CE2-CD1 4.31Å; F126-I168 HydrophobicContact CZ-CD1 4.05Å; F126-V213 HydrophobicContact CE1-CG1 3.91Å; F126-V213 HydrophobicContact CZ-CG1 3.64Å |
| 127 | F | 96.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -63.8 | -42.3 | 173.6 | -76 | -56.6 | 0 | 0 | 0 | 112.1 | W75 N78 L79 A123 S124 T129 V130 I131 I158 I161 W162 | W75-F127 HydrophobicContact CE3-CD1 4.18Å; W75-F127 HydrophobicContact CE3-CE1 4.28Å; N78-F127 HydrophobicContact CB-CD1 4.24Å; N78-F127 HydrophobicContact CB-CD2 4.23Å; N78-F127 HydrophobicContact CB-CE1 3.66Å; N78-F127 HydrophobicContact CB-CE2 3.65Å; N78-F127 HydrophobicContact CB-CZ 3.35Å; L79-F127 HydrophobicContact CB-CB 4.14Å; L79-F127 HydrophobicContact CD1-CB 4.33Å; A123-F127 HydrophobicContact CB-CD2 4.47Å; A123-F127 HydrophobicContact CB-CE2 4.32Å; A123-F127 WeakPolarHBondContact O-CD2 3.41Å; A123-F127 PolarHBondContact O-N 3.41Å; S124-F127 PolarHBondContact O-N 3.2Å; F127-T129 VanDerWaalsContact C-N 3.3Å; F127-T129 PolarHBondContact O-N 3.48Å; F127-V130 PolarHBondContact O-N 3.22Å; F127-I131 WeakPolarHBondContact O-CB 3.25Å; F127-I131 WeakPolarHBondContact O-CD1 3.4Å; F127-I131 WeakPolarHBondContact O-CG1 3.32Å; F127-I131 PolarHBondContact O-N 2.62Å; F127-I158 HydrophobicContact CE1-CG1 4.07Å; F127-I158 HydrophobicContact CZ-CG2 4.35Å; F127-I161 HydrophobicContact CD1-CD1 3.81Å; F127-I161 HydrophobicContact CD1-CG2 4.43Å; F127-I161 HydrophobicContact CD2-CG2 4.21Å; F127-I161 HydrophobicContact CE1-CB 4.29Å; F127-I161 HydrophobicContact CE1-CD1 3.66Å; F127-I161 HydrophobicContact CE1-CG2 4.02Å; F127-I161 HydrophobicContact CE2-CG2 3.78Å; F127-I161 HydrophobicContact CG-CG2 4.49Å; F127-I161 HydrophobicContact CZ-CB 4.15Å; F127-I161 HydrophobicContact CZ-CD1 4.35Å; F127-I161 HydrophobicContact CZ-CG2 3.65Å; F127-W162 HydrophobicContact CE2-CZ2 4.38Å; F127-W162 AromaticContact CZ-NE1 3.8Å |
| 128 | L | 93.9 | Very high | 94.2 | Very high | 3 Ų | 3 | 18.5 Ų | 18.5 | 2% | 0.016 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -60.6 | -39.9 | 174.4 | -71.9 | -178.5 | 0 | 0 | 0 | 112.7 | L79 S124 V125 I131 S132 M222 V251 F255 | L79-L128 HydrophobicContact CD2-CD2 3.66Å; L79-L128 HydrophobicContact CD2-CG 4.29Å; S124-L128 VanDerWaalsContact O-CG 3.3Å; S124-L128 WeakPolarHBondContact O-CG 3.48Å; S124-L128 PolarHBondContact O-N 3.24Å; V125-L128 PolarHBondContact O-N 3.4Å; L128-I131 HydrophobicContact CD2-CD1 4.45Å; L128-I131 PolarHBondContact O-N 2.78Å; L128-S132 PolarHBondContact O-N 3.22Å; L128-S132 PolarHBondContact O-OG 3.4Å; L128-M222 HydrophobicContact CB-SD 4.12Å; L128-V251 HydrophobicContact CD1-CG1 4.15Å; L128-V251 HydrophobicContact CD2-CG1 3.23Å; L128-V251 HydrophobicContact CG-CG1 4.31Å; L128-F255 HydrophobicContact CD1-CB 4.28Å; L128-F255 HydrophobicContact CD1-CD2 4.35Å |
| 129 | T | 95.9 | Very high | 93.8 | Very high | 7 Ų | 7 | 20.9 Ų | 20.9 | 4% | 0.043 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -63.2 | -46.7 | 175.7 | -55.9 | 0 | 0 | 0 | 0 | 110.8 | V125 F126 F127 S132 L133 P218 T221 | V125-T129 WeakPolarHBondContact O-CB 3.29Å; V125-T129 PolarHBondContact O-N 2.97Å; V125-T129 PolarHBondContact O-OG1 3.49Å; F126-T129 WeakPolarHBondContact O-CB 3.35Å; F126-T129 PolarHBondContact O-N 2.91Å; F127-T129 VanDerWaalsContact C-N 3.3Å; F127-T129 PolarHBondContact O-N 3.48Å; T129-S132 PolarHBondContact O-N 3.2Å; T129-L133 HydrophobicContact CG2-CD1 4.04Å; T129-L133 WeakPolarHBondContact O-CB 3.27Å; T129-L133 WeakPolarHBondContact O-CG 2.99Å; T129-L133 PolarHBondContact O-N 3.46Å; T129-P218 WeakPolarHBondContact OG1-CB 3.48Å; T129-T221 HydrophobicContact CG2-CG2 3.58Å |
| 130 | V | 95.6 | Very high | 93.3 | Very high | 29 Ų | 29 | 21.6 Ų | 21.6 | 18% | 0.176 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -66.7 | -36.8 | 177.5 | 169.7 | 0 | 0 | 0 | 0 | 112.2 | W75 F126 F127 S132 L133 D134 V157 I161 | W75-V130 HydrophobicContact CD2-CG1 3.85Å; W75-V130 HydrophobicContact CE3-CG1 3.91Å; W75-V130 HydrophobicContact CH2-CG1 3.78Å; W75-V130 HydrophobicContact CZ2-CG1 3.71Å; W75-V130 HydrophobicContact CZ3-CG1 3.85Å; F126-V130 WeakPolarHBondContact O-CG2 3.2Å; F126-V130 PolarHBondContact O-N 2.83Å; F127-V130 PolarHBondContact O-N 3.22Å; V130-S132 VanDerWaalsContact C-N 3.32Å; V130-S132 PolarHBondContact O-N 3.49Å; V130-L133 PolarHBondContact O-N 3.19Å; V130-D134 VanDerWaalsContact O-CB 3.28Å; V130-D134 WeakPolarHBondContact O-CB 3.47Å; V130-D134 PolarHBondContact O-N 3.39Å; V130-V157 HydrophobicContact CG2-CG1 4.38Å; V130-I161 HydrophobicContact CG2-CD1 3.87Å |
| 131 | I | 92.7 | Very high | 92.9 | Very high | 7 Ų | 7 | 24.4 Ų | 24.4 | 4% | 0.036 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -61.2 | -44 | 174.1 | -71.3 | 161.5 | 0 | 0 | 0 | 110.4 | W75 F76 L79 F127 L128 H135 I248 | W75-I131 HydrophobicContact CB-CD1 4.03Å; W75-I131 HydrophobicContact CB-CG1 3.54Å; W75-I131 HydrophobicContact CG-CG1 4.18Å; F76-I131 HydrophobicContact CD1-CD1 3.94Å; F76-I131 HydrophobicContact CE1-CD1 3.84Å; F76-I131 HydrophobicContact CE1-CG2 4.26Å; F76-I131 HydrophobicContact CZ-CD1 4.49Å; F76-I131 HydrophobicContact CZ-CG2 4.07Å; L79-I131 HydrophobicContact CD2-CD1 4.02Å; F127-I131 WeakPolarHBondContact O-CB 3.25Å; F127-I131 WeakPolarHBondContact O-CD1 3.4Å; F127-I131 WeakPolarHBondContact O-CG1 3.32Å; F127-I131 PolarHBondContact O-N 2.62Å; L128-I131 HydrophobicContact CD2-CD1 4.45Å; L128-I131 PolarHBondContact O-N 2.78Å; I131-H135 WeakPolarHBondContact O-CB 3.5Å; I131-H135 PolarHBondContact O-N 3Å; I131-I248 HydrophobicContact CG2-CD1 3.93Å; I131-I248 HydrophobicContact CG2-CG1 4.09Å; I131-I248 HydrophobicContact CG2-CG2 4.08Å |
| 132 | S | 92.5 | Very high | 92.5 | Very high | 1 Ų | 1 | 28.3 Ų | 28.3 | 1% | 0.007 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -65.2 | -42.8 | 177.6 | -59.1 | 0 | 0 | 0 | 0 | 111.8 | L128 T129 V130 H135 Y136 | L128-S132 PolarHBondContact O-N 3.22Å; L128-S132 PolarHBondContact O-OG 3.4Å; T129-S132 PolarHBondContact O-N 3.2Å; V130-S132 VanDerWaalsContact C-N 3.32Å; V130-S132 PolarHBondContact O-N 3.49Å; S132-H135 PolarHBondContact O-N 3.24Å; S132-Y136 PolarHBondContact O-N 3.05Å |
| 133 | L | 93.9 | Very high | 92.2 | Very high | 60 Ų | 60 | 33.9 Ų | 33.9 | 31% | 0.314 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -66.2 | -45.2 | 175.9 | -76.3 | 165.8 | 0 | 0 | 0 | 112.6 | T129 V130 H135 Y136 I137 T221 C225 | T129-L133 HydrophobicContact CG2-CD1 4.04Å; T129-L133 WeakPolarHBondContact O-CB 3.27Å; T129-L133 WeakPolarHBondContact O-CG 2.99Å; T129-L133 PolarHBondContact O-N 3.46Å; V130-L133 PolarHBondContact O-N 3.19Å; L133-H135 VanDerWaalsContact C-N 3.28Å; L133-H135 PolarHBondContact O-N 3.31Å; L133-Y136 PolarHBondContact O-N 2.98Å; L133-I137 WeakPolarHBondContact O-CB 3.24Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.39Å; L133-I137 PolarHBondContact O-N 3.4Å; L133-T221 HydrophobicContact CD1-CG2 3.95Å; L133-T221 HydrophobicContact CD2-CG2 3.99Å; L133-T221 HydrophobicContact CG-CG2 4Å; L133-C225 WeakPolarHBondContact CD2-SG 3.35Å |
| 134 | D | 91.8 | Very high | 91.7 | Very high | 19 Ų | 19 | 37.2 Ų | 37.2 | 10% | 0.102 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -57.9 | -43.9 | 176.6 | 179.2 | 70.3 | 0 | 0 | 0 | 110.2 | V130 I137 H138 R149 | V130-D134 VanDerWaalsContact O-CB 3.28Å; V130-D134 WeakPolarHBondContact O-CB 3.47Å; V130-D134 PolarHBondContact O-N 3.39Å; D134-I137 PolarHBondContact O-N 2.96Å; D134-H138 WeakPolarHBondContact O-CB 3.38Å; D134-H138 PolarHBondContact O-N 3.43Å; D134-R149 WeakPolarHBondContact OD1-CD 3.38Å; D134-R149 IonicContact OD1-CZ 3.74Å; D134-R149 IonicContact OD1-NE 2.84Å; D134-R149 PolarHBondContact OD1-NE 3.32Å; D134-R149 IonicContact OD1-NH2 3.82Å; D134-R149 IonicContact OD2-CZ 3.45Å; D134-R149 IonicContact OD2-NE 3.31Å; D134-R149 PolarHBondContact OD2-NE 3.08Å; D134-R149 IonicContact OD2-NH2 2.79Å; D134-R149 PolarHBondContact OD2-NH2 3.29Å |
| 135 | H | 89.4 | Confident | 91.4 | Very high | 6 Ų | 6 | 37.8 Ų | 37.8 | 3% | 0.028 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.2 | -44 | 177.2 | -169.2 | -175.6 | 0 | 0 | 0 | 112 | I131 S132 L133 H138 L139 H244 I248 | I131-H135 WeakPolarHBondContact O-CB 3.5Å; I131-H135 PolarHBondContact O-N 3Å; S132-H135 PolarHBondContact O-N 3.24Å; L133-H135 VanDerWaalsContact C-N 3.28Å; L133-H135 PolarHBondContact O-N 3.31Å; H135-H138 PolarHBondContact O-N 3.07Å; H135-L139 VanDerWaalsContact NE2-CD1 3.32Å; H135-L139 WeakPolarHBondContact NE2-CD1 3.14Å; H135-L139 PolarHBondContact O-N 3.25Å; H135-H244 AromaticContact CD2-ND1 3.85Å; H135-H244 AromaticContact CE1-ND1 3.24Å; H135-H244 PolarHBondContact CE1-ND1 2.93Å; H135-H244 AromaticContact CG-ND1 3.91Å; H135-H244 AromaticContact ND1-ND1 3.56Å; H135-H244 AromaticContact NE2-ND1 3.4Å; H135-H244 PolarHBondContact NE2-ND1 3.03Å; H135-I248 HydrophobicContact CB-CD1 3.99Å; H135-I248 WeakPolarHBondContact ND1-CD1 3.39Å |
| 136 | Y | 90.2 | Very high | 91 | Very high | 35 Ų | 35 | 45.9 Ų | 45.9 | 14% | 0.137 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.7 | -50.5 | 175 | 168.8 | -105.1 | 0 | 0 | 0 | 112.1 | S132 L133 H138 L139 I140 H141 C225 C228 L229 | S132-Y136 PolarHBondContact O-N 3.05Å; L133-Y136 PolarHBondContact O-N 2.98Å; Y136-H138 VanDerWaalsContact C-N 3.32Å; Y136-H138 PolarHBondContact O-N 3.4Å; Y136-L139 PolarHBondContact O-N 3.36Å; Y136-I140 HydrophobicContact CD2-CB 4.25Å; Y136-I140 HydrophobicContact CD2-CG1 3.67Å; Y136-I140 HydrophobicContact CE2-CB 3.91Å; Y136-I140 HydrophobicContact CE2-CG1 3.55Å; Y136-I140 HydrophobicContact CE2-CG2 4.08Å; Y136-I140 WeakPolarHBondContact O-CB 3.45Å; Y136-I140 PolarHBondContact O-N 3.37Å; Y136-H141 AromaticContact CE1-CD2 3.88Å; Y136-H141 AromaticContact CE1-NE2 3.88Å; Y136-H141 AromaticContact CZ-NE2 3.79Å; Y136-H141 PolarHBondContact OH-NE2 3.11Å; Y136-C225 HydrophobicContact CG-CB 4.43Å; Y136-C228 HydrophobicContact CD2-CB 4.22Å; Y136-C228 HydrophobicContact CE2-CB 3.6Å; Y136-L229 HydrophobicContact CD2-CD2 4.16Å; Y136-L229 HydrophobicContact CD2-CG 4.08Å |
| 137 | I | 90.8 | Very high | 90.6 | Very high | 64 Ų | 64 | 52.6 Ų | 52.6 | 33% | 0.328 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.8 | -42.7 | -179.8 | -68.1 | 166.6 | 0 | 0 | 0 | 110.5 | L133 D134 L139 H141 L144 | L133-I137 WeakPolarHBondContact O-CB 3.24Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.39Å; L133-I137 PolarHBondContact O-N 3.4Å; D134-I137 PolarHBondContact O-N 2.96Å; I137-L139 VanDerWaalsContact C-N 3.32Å; I137-L139 PolarHBondContact O-N 2.98Å; I137-H141 HydrophobicContact CG2-CB 4.44Å; I137-H141 CarbonylContact O-C 3.22Å; I137-H141 VanDerWaalsContact O-C 3.22Å; I137-H141 WeakPolarHBondContact O-CA 3.49Å; I137-H141 PolarHBondContact O-N 3.29Å; I137-L144 HydrophobicContact CG2-CB 4.37Å |
| 138 | H | 87.8 | Confident | 90.3 | Very high | 84 Ų | 84 | 57.3 Ų | 57.3 | 39% | 0.389 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.1 | -40.7 | -180 | -178.4 | 54.8 | 0 | 0 | 0 | 112.9 | D134 H135 Y136 S145 R149 | D134-H138 WeakPolarHBondContact O-CB 3.38Å; D134-H138 PolarHBondContact O-N 3.43Å; H135-H138 PolarHBondContact O-N 3.07Å; Y136-H138 VanDerWaalsContact C-N 3.32Å; Y136-H138 PolarHBondContact O-N 3.4Å; H138-S145 PolarHBondContact ND1-OG 3.4Å; H138-R149 PolarHBondContact ND1-NH1 3.05Å; H138-R149 VanDerWaalsContact ND1-NH1 3.19Å |
| 139 | L | 86.5 | Confident | 90.3 | Very high | 75 Ų | 75 | 60.6 Ų | 60.6 | 39% | 0.393 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -86.8 | -36.9 | -176.6 | -68.9 | -178.3 | 0 | 0 | 0 | 114 | H135 Y136 I137 L229 L239 | H135-L139 VanDerWaalsContact NE2-CD1 3.32Å; H135-L139 WeakPolarHBondContact NE2-CD1 3.14Å; H135-L139 PolarHBondContact O-N 3.25Å; Y136-L139 PolarHBondContact O-N 3.36Å; I137-L139 VanDerWaalsContact C-N 3.32Å; I137-L139 PolarHBondContact O-N 2.98Å; L139-L229 HydrophobicContact CB-CD2 3.95Å; L139-L229 HydrophobicContact CD1-CD2 3.84Å; L139-L239 HydrophobicContact CD1-CD1 3.74Å |
| 140 | I | 88.4 | Confident | 90.2 | Very high | 34 Ų | 34 | 62.9 Ų | 62.9 | 17% | 0.174 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -95.9 | -32.1 | -172.9 | -57.9 | -56.5 | 0 | 0 | 0 | 112 | Y136 P142 L229 K232 V233 | Y136-I140 HydrophobicContact CD2-CB 4.25Å; Y136-I140 HydrophobicContact CD2-CG1 3.67Å; Y136-I140 HydrophobicContact CE2-CB 3.91Å; Y136-I140 HydrophobicContact CE2-CG1 3.55Å; Y136-I140 HydrophobicContact CE2-CG2 4.08Å; Y136-I140 WeakPolarHBondContact O-CB 3.45Å; Y136-I140 PolarHBondContact O-N 3.37Å; I140-P142 VanDerWaalsContact C-CD 3.5Å; I140-P142 WeakPolarHBondContact O-CD 3.13Å; I140-L229 HydrophobicContact CD1-CD2 4.07Å; I140-L229 HydrophobicContact CG1-CD2 3.84Å; I140-K232 HydrophobicContact CD1-CB 3.86Å; I140-K232 HydrophobicContact CG2-CD 4.04Å; I140-V233 HydrophobicContact CD1-CG2 3.71Å |
| 141 | H | 87.6 | Confident | 90 | Very high | 66 Ų | 66 | 65.2 Ų | 65.2 | 31% | 0.306 | 32% | 0.323 | S | S | . | . | trans | -125.5 | 67.4 | -172.9 | -61.2 | -71.2 | 0 | 0 | 0 | 111.8 | Y136 I137 V143 L144 S145 | Y136-H141 AromaticContact CE1-CD2 3.88Å; Y136-H141 AromaticContact CE1-NE2 3.88Å; Y136-H141 AromaticContact CZ-NE2 3.79Å; Y136-H141 PolarHBondContact OH-NE2 3.11Å; I137-H141 HydrophobicContact CG2-CB 4.44Å; I137-H141 CarbonylContact O-C 3.22Å; I137-H141 VanDerWaalsContact O-C 3.22Å; I137-H141 WeakPolarHBondContact O-CA 3.49Å; I137-H141 PolarHBondContact O-N 3.29Å; H141-V143 VanDerWaalsContact C-N 3.27Å; H141-V143 PolarHBondContact O-N 2.84Å; H141-L144 HydrophobicContact CB-CB 4.05Å; H141-L144 HydrophobicContact CB-CD1 4.02Å; H141-L144 HydrophobicContact CB-CG 4.32Å; H141-L144 PolarHBondContact O-N 3.23Å; H141-L144 VanDerWaalsContact O-N 3.11Å; H141-S145 PolarHBondContact O-N 2.96Å | ||
| 142 | P | 86.2 | Confident | 90.1 | Very high | 84 Ų | 84 | 72.8 Ų | 72.8 | 55% | 0.545 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.7 | -33.1 | -172.6 | 23.8 | -34.3 | 0 | 0 | 0 | 113.4 | I140 S145 H146 | I140-P142 VanDerWaalsContact C-CD 3.5Å; I140-P142 WeakPolarHBondContact O-CD 3.13Å; P142-S145 PolarHBondContact O-N 3.03Å; P142-H146 WeakPolarHBondContact O-CB 3.41Å; P142-H146 PolarHBondContact O-N 3.31Å |
| 143 | V | 90.5 | Very high | 90.2 | Very high | 118 Ų | 118 | 75.8 Ų | 75.8 | 72% | 0.715 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -66.6 | -44.7 | 176.9 | -178.8 | 0 | 0 | 0 | 0 | 111.3 | H141 H146 R147 | H141-V143 VanDerWaalsContact C-N 3.27Å; H141-V143 PolarHBondContact O-N 2.84Å; V143-H146 PolarHBondContact O-N 2.87Å; V143-R147 PolarHBondContact O-N 3.44Å; V143-R147 VanDerWaalsContact O-N 3.12Å |
| 144 | L | 87.8 | Confident | 90.3 | Very high | 71 Ų | 71 | 73.1 Ų | 73.1 | 37% | 0.372 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -66.5 | -41.4 | 175.5 | -69.5 | 178.1 | 0 | 0 | 0 | 111.1 | I137 H141 H146 R147 H148 | I137-L144 HydrophobicContact CG2-CB 4.37Å; H141-L144 HydrophobicContact CB-CB 4.05Å; H141-L144 HydrophobicContact CB-CD1 4.02Å; H141-L144 HydrophobicContact CB-CG 4.32Å; H141-L144 PolarHBondContact O-N 3.23Å; H141-L144 VanDerWaalsContact O-N 3.11Å; L144-H146 VanDerWaalsContact C-N 3.34Å; L144-H146 PolarHBondContact O-N 2.88Å; L144-R147 PolarHBondContact O-N 3.2Å; L144-H148 WeakPolarHBondContact O-CB 3.45Å; L144-H148 PolarHBondContact O-N 3.43Å |
| 145 | S | 88.4 | Confident | 90.5 | Very high | 11 Ų | 11 | 76.5 Ų | 76.5 | 8% | 0.077 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -56.6 | -48.5 | 173.8 | 179.6 | 0 | 0 | 0 | 0 | 110.8 | H138 H141 P142 R147 R149 | H138-S145 PolarHBondContact ND1-OG 3.4Å; H141-S145 PolarHBondContact O-N 2.96Å; P142-S145 PolarHBondContact O-N 3.03Å; S145-R147 VanDerWaalsContact C-N 3.32Å; S145-R147 PolarHBondContact O-N 3.09Å; S145-R149 WeakPolarHBondContact O-CB 3.43Å; S145-R149 PolarHBondContact O-N 3.14Å; S145-R149 WeakPolarHBondContact OG-CD 3.19Å |
| 146 | H | 86.8 | Confident | 90.8 | Very high | 170 Ų | 170 | 81.6 Ų | 81.6 | 79% | 0.787 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -62.6 | -39.5 | -179.3 | -175.5 | -89.1 | 0 | 0 | 0 | 112.3 | P142 V143 L144 | P142-H146 WeakPolarHBondContact O-CB 3.41Å; P142-H146 PolarHBondContact O-N 3.31Å; V143-H146 PolarHBondContact O-N 2.87Å; L144-H146 VanDerWaalsContact C-N 3.34Å; L144-H146 PolarHBondContact O-N 2.88Å |
| 147 | R | 90.4 | Very high | 91.2 | Very high | 160 Ų | 160 | 82.5 Ų | 82.5 | 60% | 0.604 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -75.6 | -42.7 | -177.2 | -172.8 | 169.8 | 67.8 | 178.4 | -0.2 | 113.8 | V143 L144 S145 | V143-R147 PolarHBondContact O-N 3.44Å; V143-R147 VanDerWaalsContact O-N 3.12Å; L144-R147 PolarHBondContact O-N 3.2Å; S145-R147 VanDerWaalsContact C-N 3.32Å; S145-R147 PolarHBondContact O-N 3.09Å |
| 148 | H | 89.6 | Confident | 91.5 | Very high | 99 Ų | 99 | 80 Ų | 80 | 46% | 0.458 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -106.8 | -19.3 | -166.7 | -71.6 | -56.1 | 0 | 0 | 0 | 114.6 | L144 T150 N153 | L144-H148 WeakPolarHBondContact O-CB 3.45Å; L144-H148 PolarHBondContact O-N 3.43Å; H148-T150 PolarHBondContact O-N 3.12Å; H148-N153 WeakPolarHBondContact O-CB 3.47Å; H148-N153 PolarHBondContact O-ND2 3.3Å |
| 149 | R | 92.4 | Very high | 92 | Very high | 73 Ų | 73 | 80.9 Ų | 80.9 | 28% | 0.275 | 41% | 0.405 | S | S | . | . | trans | -81.3 | 60.5 | -177.9 | -160.9 | -178.4 | -176.2 | -146.9 | 2.9 | 111.5 | V71 S72 D134 H138 S145 | V71-R149 HydrophobicContact CB-CG 3.97Å; V71-R149 HydrophobicContact CG1-CG 3.79Å; V71-R149 HydrophobicContact CG2-CG 3.91Å; S72-R149 PolarHBondContact OG-NH2 3.4Å; D134-R149 WeakPolarHBondContact OD1-CD 3.38Å; D134-R149 IonicContact OD1-CZ 3.74Å; D134-R149 IonicContact OD1-NE 2.84Å; D134-R149 PolarHBondContact OD1-NE 3.32Å; D134-R149 IonicContact OD1-NH2 3.82Å; D134-R149 IonicContact OD2-CZ 3.45Å; D134-R149 IonicContact OD2-NE 3.31Å; D134-R149 PolarHBondContact OD2-NE 3.08Å; D134-R149 IonicContact OD2-NH2 2.79Å; D134-R149 PolarHBondContact OD2-NH2 3.29Å; H138-R149 PolarHBondContact ND1-NH1 3.05Å; H138-R149 VanDerWaalsContact ND1-NH1 3.19Å; S145-R149 WeakPolarHBondContact O-CB 3.43Å; S145-R149 PolarHBondContact O-N 3.14Å; S145-R149 WeakPolarHBondContact OG-CD 3.19Å | ||
| 150 | T | 93.8 | Very high | 92.6 | Very high | 55 Ų | 55 | 83.4 Ų | 83.4 | 34% | 0.337 | 41% | 0.413 | S | S | . | . | trans | -105.1 | 154 | 178.1 | 72.1 | 0 | 0 | 0 | 0 | 110.8 | H148 K152 N153 S154 | H148-T150 PolarHBondContact O-N 3.12Å; T150-K152 VanDerWaalsContact C-N 3.25Å; T150-K152 PolarHBondContact O-N 2.91Å; T150-N153 PolarHBondContact O-N 3.48Å; T150-N153 VanDerWaalsContact OG1-CG 3.31Å; T150-N153 PolarHBondContact OG1-N 3.29Å; T150-S154 PolarHBondContact O-N 3.49Å; T150-S154 PolarHBondContact O-OG 2.89Å | ||
| 151 | L | 93.1 | Very high | 93.1 | Very high | 77 Ų | 77 | 82.1 Ų | 82.1 | 40% | 0.403 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -58.7 | -37.9 | 177.9 | -63.9 | 176.7 | 0 | 0 | 0 | 112.2 | V71 L74 S154 L155 | V71-L151 HydrophobicContact CG2-CD2 4.27Å; L74-L151 HydrophobicContact CD1-CD2 3.79Å; L151-S154 PolarHBondContact O-N 3.46Å; L151-L155 WeakPolarHBondContact O-CG 3.45Å; L151-L155 PolarHBondContact O-N 3.39Å |
| 152 | K | 94.4 | Very high | 93.6 | Very high | 167 Ų | 167 | 81.6 Ų | 81.6 | 73% | 0.726 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -62 | -49.8 | 178.7 | -68.2 | -176.2 | 179 | -176.4 | 0 | 111.5 | T150 S154 L155 I156 | T150-K152 VanDerWaalsContact C-N 3.25Å; T150-K152 PolarHBondContact O-N 2.91Å; K152-S154 VanDerWaalsContact C-N 3.31Å; K152-S154 PolarHBondContact O-N 2.99Å; K152-L155 PolarHBondContact O-N 3.29Å; K152-I156 WeakPolarHBondContact O-CG1 3.39Å; K152-I156 PolarHBondContact O-N 3.31Å |
| 153 | N | 95.2 | Very high | 94.2 | Very high | 63 Ų | 63 | 83 Ų | 83 | 34% | 0.337 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64 | -39.2 | 178.7 | -67.6 | -1.8 | 0 | 0 | 0 | 111.3 | H148 T150 L155 I156 V157 | H148-N153 WeakPolarHBondContact O-CB 3.47Å; H148-N153 PolarHBondContact O-ND2 3.3Å; T150-N153 PolarHBondContact O-N 3.48Å; T150-N153 VanDerWaalsContact OG1-CG 3.31Å; T150-N153 PolarHBondContact OG1-N 3.29Å; N153-L155 VanDerWaalsContact C-N 3.35Å; N153-L155 PolarHBondContact O-N 3.43Å; N153-I156 PolarHBondContact O-N 2.99Å; N153-V157 WeakPolarHBondContact O-CG2 3.26Å; N153-V157 PolarHBondContact O-N 3.19Å; N153-V157 VanDerWaalsContact O-N 3.09Å |
| 154 | S | 94.8 | Very high | 94.5 | Very high | 4 Ų | 4 | 79.9 Ų | 79.9 | 3% | 0.028 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61.4 | -41.1 | 175.5 | -62.6 | 0 | 0 | 0 | 0 | 112.6 | V71 T150 L151 K152 I156 V157 I158 | V71-S154 WeakPolarHBondContact CG1-OG 3.47Å; V71-S154 WeakPolarHBondContact CG2-OG 3.08Å; T150-S154 PolarHBondContact O-N 3.49Å; T150-S154 PolarHBondContact O-OG 2.89Å; L151-S154 PolarHBondContact O-N 3.46Å; K152-S154 VanDerWaalsContact C-N 3.31Å; K152-S154 PolarHBondContact O-N 2.99Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 2.89Å; S154-V157 PolarHBondContact O-N 3.46Å; S154-I158 WeakPolarHBondContact O-CD1 3.45Å; S154-I158 VanDerWaalsContact O-CG1 3.23Å; S154-I158 WeakPolarHBondContact O-CG1 3.39Å; S154-I158 PolarHBondContact O-N 3.24Å |
| 155 | L | 95.9 | Very high | 95 | Very high | 90 Ų | 90 | 76.5 Ų | 76.5 | 47% | 0.471 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63 | -40 | 176.4 | -71.6 | 170.7 | 0 | 0 | 0 | 112.4 | L151 K152 N153 V157 I158 I159 | L151-L155 WeakPolarHBondContact O-CG 3.45Å; L151-L155 PolarHBondContact O-N 3.39Å; K152-L155 PolarHBondContact O-N 3.29Å; N153-L155 VanDerWaalsContact C-N 3.35Å; N153-L155 PolarHBondContact O-N 3.43Å; L155-V157 VanDerWaalsContact C-N 3.34Å; L155-V157 PolarHBondContact O-N 3.02Å; L155-I158 HydrophobicContact CD2-CD1 4.35Å; L155-I158 PolarHBondContact O-N 3.09Å; L155-I159 WeakPolarHBondContact O-CG1 3.17Å; L155-I159 PolarHBondContact O-N 3.3Å |
| 156 | I | 97.3 | Very high | 95.5 | Very high | 113 Ų | 113 | 78 Ų | 78 | 58% | 0.579 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -60.5 | -46.6 | 175.3 | -65.1 | 168.2 | 0 | 0 | 0 | 110.4 | K152 N153 S154 I158 I159 F160 | K152-I156 WeakPolarHBondContact O-CG1 3.39Å; K152-I156 PolarHBondContact O-N 3.31Å; N153-I156 PolarHBondContact O-N 2.99Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 2.89Å; I156-I158 PolarHBondContact O-N 3.19Å; I156-I159 PolarHBondContact O-N 2.93Å; I156-F160 WeakPolarHBondContact O-CB 3.28Å; I156-F160 PolarHBondContact O-N 3.35Å |
| 157 | V | 97.6 | Very high | 95.9 | Very high | 55 Ų | 55 | 76 Ų | 76 | 33% | 0.333 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -64.1 | -39.6 | 178 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | W75 V130 N153 S154 L155 F160 I161 | W75-V157 HydrophobicContact CH2-CB 3.84Å; W75-V157 HydrophobicContact CH2-CG1 3.69Å; W75-V157 HydrophobicContact CZ3-CB 4.27Å; W75-V157 HydrophobicContact CZ3-CG1 3.9Å; V130-V157 HydrophobicContact CG2-CG1 4.38Å; N153-V157 WeakPolarHBondContact O-CG2 3.26Å; N153-V157 PolarHBondContact O-N 3.19Å; N153-V157 VanDerWaalsContact O-N 3.09Å; S154-V157 PolarHBondContact O-N 3.46Å; L155-V157 VanDerWaalsContact C-N 3.34Å; L155-V157 PolarHBondContact O-N 3.02Å; V157-F160 PolarHBondContact O-N 3.46Å; V157-I161 HydrophobicContact CG1-CD1 3.88Å; V157-I161 HydrophobicContact CG1-CG1 4.38Å; V157-I161 VanDerWaalsContact O-CG1 3.26Å; V157-I161 WeakPolarHBondContact O-CG1 3.43Å; V157-I161 PolarHBondContact O-N 2.97Å |
| 158 | I | 98.1 | Very high | 96.2 | Very high | 10 Ų | 10 | 70 Ų | 70 | 5% | 0.051 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -59.4 | -49.9 | 175.4 | -71.7 | 160.1 | 0 | 0 | 0 | 110.9 | L74 W75 N78 F127 S154 L155 I156 F160 I161 W162 | L74-I158 HydrophobicContact CB-CD1 3.98Å; L74-I158 HydrophobicContact CD1-CD1 4.45Å; W75-I158 HydrophobicContact CE3-CD1 4.35Å; W75-I158 HydrophobicContact CE3-CG1 3.95Å; W75-I158 HydrophobicContact CH2-CG1 4.49Å; W75-I158 HydrophobicContact CZ3-CD1 4.15Å; W75-I158 HydrophobicContact CZ3-CG1 3.54Å; N78-I158 WeakPolarHBondContact ND2-CD1 3.42Å; N78-I158 VanDerWaalsContact OD1-CG2 3.25Å; N78-I158 WeakPolarHBondContact OD1-CG2 3.08Å; F127-I158 HydrophobicContact CE1-CG1 4.07Å; F127-I158 HydrophobicContact CZ-CG2 4.35Å; S154-I158 WeakPolarHBondContact O-CD1 3.45Å; S154-I158 VanDerWaalsContact O-CG1 3.23Å; S154-I158 WeakPolarHBondContact O-CG1 3.39Å; S154-I158 PolarHBondContact O-N 3.24Å; L155-I158 HydrophobicContact CD2-CD1 4.35Å; L155-I158 PolarHBondContact O-N 3.09Å; I156-I158 PolarHBondContact O-N 3.19Å; I158-F160 VanDerWaalsContact C-N 3.29Å; I158-F160 PolarHBondContact O-N 3.13Å; I158-I161 PolarHBondContact O-N 3.43Å; I158-W162 VanDerWaalsContact O-CD1 3.24Å; I158-W162 PolarHBondContact O-N 3.25Å |
| 159 | I | 98.2 | Very high | 96.4 | Very high | 104 Ų | 104 | 65.3 Ų | 65.3 | 53% | 0.533 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -59.4 | -45.2 | 178.7 | -68.5 | 165.9 | 0 | 0 | 0 | 109.9 | L155 I156 I161 W162 L163 | L155-I159 WeakPolarHBondContact O-CG1 3.17Å; L155-I159 PolarHBondContact O-N 3.3Å; I156-I159 PolarHBondContact O-N 2.93Å; I159-I161 PolarHBondContact O-N 3.15Å; I159-W162 PolarHBondContact O-N 3.38Å; I159-L163 HydrophobicContact CG2-CD1 3.88Å; I159-L163 HydrophobicContact CG2-CG 4.34Å; I159-L163 WeakPolarHBondContact O-CB 3.25Å; I159-L163 VanDerWaalsContact O-CG 3.31Å; I159-L163 WeakPolarHBondContact O-CG 3.45Å; I159-L163 PolarHBondContact O-N 2.96Å |
| 160 | F | 98.2 | Very high | 96.5 | Very high | 127 Ų | 127 | 62.9 Ų | 62.9 | 56% | 0.557 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -59.2 | -44.6 | 176.9 | 178.1 | -99.4 | 0 | 0 | 0 | 112.4 | I156 V157 I158 W162 L163 L164 | I156-F160 WeakPolarHBondContact O-CB 3.28Å; I156-F160 PolarHBondContact O-N 3.35Å; V157-F160 PolarHBondContact O-N 3.46Å; I158-F160 VanDerWaalsContact C-N 3.29Å; I158-F160 PolarHBondContact O-N 3.13Å; F160-W162 PolarHBondContact O-N 2.94Å; F160-L163 PolarHBondContact O-N 3.09Å; F160-L164 HydrophobicContact CE1-CD2 3.96Å; F160-L164 HydrophobicContact CZ-CD2 4.18Å; F160-L164 VanDerWaalsContact O-CB 3.3Å; F160-L164 WeakPolarHBondContact O-CB 3.21Å; F160-L164 PolarHBondContact O-N 3.42Å |
| 161 | I | 98.4 | Very high | 96.5 | Very high | 8 Ų | 8 | 62.2 Ų | 62.2 | 4% | 0.041 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.4 | -47 | 177.4 | -72.4 | 168.7 | 0 | 0 | 0 | 111.1 | F126 F127 V130 V157 I158 I159 L163 L164 A165 | F126-I161 HydrophobicContact CB-CG1 4.27Å; F126-I161 HydrophobicContact CB-CG2 3.75Å; F126-I161 HydrophobicContact CD2-CG2 4.25Å; F127-I161 HydrophobicContact CD1-CD1 3.81Å; F127-I161 HydrophobicContact CD1-CG2 4.43Å; F127-I161 HydrophobicContact CD2-CG2 4.21Å; F127-I161 HydrophobicContact CE1-CB 4.29Å; F127-I161 HydrophobicContact CE1-CD1 3.66Å; F127-I161 HydrophobicContact CE1-CG2 4.02Å; F127-I161 HydrophobicContact CE2-CG2 3.78Å; F127-I161 HydrophobicContact CG-CG2 4.49Å; F127-I161 HydrophobicContact CZ-CB 4.15Å; F127-I161 HydrophobicContact CZ-CD1 4.35Å; F127-I161 HydrophobicContact CZ-CG2 3.65Å; V130-I161 HydrophobicContact CG2-CD1 3.87Å; V157-I161 HydrophobicContact CG1-CD1 3.88Å; V157-I161 HydrophobicContact CG1-CG1 4.38Å; V157-I161 VanDerWaalsContact O-CG1 3.26Å; V157-I161 WeakPolarHBondContact O-CG1 3.43Å; V157-I161 PolarHBondContact O-N 2.97Å; I158-I161 PolarHBondContact O-N 3.43Å; I159-I161 PolarHBondContact O-N 3.15Å; I161-L163 PolarHBondContact O-N 3.37Å; I161-L164 PolarHBondContact O-N 2.94Å; I161-A165 VanDerWaalsContact O-CB 3.25Å; I161-A165 WeakPolarHBondContact O-CB 3.48Å; I161-A165 PolarHBondContact O-N 2.85Å |
| 162 | W | 98.4 | Very high | 96.3 | Very high | 54 Ų | 54 | 59.1 Ų | 59.1 | 21% | 0.205 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 178.9 | -81.6 | 112.5 | 0 | 0 | 0 | 112.3 | N78 I81 A82 L119 A123 F127 I158 I159 F160 S166 | N78-W162 PolarHBondContact OD1-NE1 2.97Å; N78-W162 VanDerWaalsContact OD1-NE1 3.09Å; I81-W162 HydrophobicContact CG2-CH2 4.43Å; I81-W162 HydrophobicContact CG2-CZ2 4.15Å; A82-W162 HydrophobicContact CB-CH2 3.79Å; A82-W162 HydrophobicContact CB-CZ2 4.28Å; L119-W162 HydrophobicContact CD1-CE3 4.14Å; L119-W162 HydrophobicContact CD1-CZ3 4.19Å; L119-W162 HydrophobicContact CD2-CE3 4.48Å; L119-W162 HydrophobicContact CD2-CZ3 3.92Å; L119-W162 HydrophobicContact CG-CE3 4.45Å; L119-W162 HydrophobicContact CG-CZ3 3.98Å; A123-W162 HydrophobicContact CB-CE3 4.46Å; A123-W162 HydrophobicContact CB-CZ3 4.24Å; F127-W162 HydrophobicContact CE2-CZ2 4.38Å; F127-W162 AromaticContact CZ-NE1 3.8Å; I158-W162 VanDerWaalsContact O-CD1 3.24Å; I158-W162 PolarHBondContact O-N 3.25Å; I159-W162 PolarHBondContact O-N 3.38Å; F160-W162 PolarHBondContact O-N 2.94Å; W162-S166 VanDerWaalsContact O-CB 3.27Å; W162-S166 WeakPolarHBondContact O-CB 3.35Å; W162-S166 PolarHBondContact O-N 3.39Å; W162-S166 PolarHBondContact O-OG 3.05Å |
| 163 | L | 98.4 | Very high | 96.3 | Very high | 114 Ų | 114 | 54.9 Ų | 54.9 | 60% | 0.597 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -63.8 | -45.3 | 176.3 | -70.8 | 174.6 | 0 | 0 | 0 | 111.4 | I159 F160 I161 S166 L167 | I159-L163 HydrophobicContact CG2-CD1 3.88Å; I159-L163 HydrophobicContact CG2-CG 4.34Å; I159-L163 WeakPolarHBondContact O-CB 3.25Å; I159-L163 VanDerWaalsContact O-CG 3.31Å; I159-L163 WeakPolarHBondContact O-CG 3.45Å; I159-L163 PolarHBondContact O-N 2.96Å; F160-L163 PolarHBondContact O-N 3.09Å; I161-L163 PolarHBondContact O-N 3.37Å; L163-S166 PolarHBondContact O-N 2.93Å; L163-L167 VanDerWaalsContact O-CB 3.29Å; L163-L167 WeakPolarHBondContact O-CB 3.23Å; L163-L167 PolarHBondContact O-N 3.41Å |
| 164 | L | 97.9 | Very high | 96.1 | Very high | 52 Ų | 52 | 59 Ų | 59 | 27% | 0.272 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -65.1 | -45.1 | 179.3 | -174.4 | 62.5 | 0 | 0 | 0 | 111.5 | F126 F160 I161 S166 L167 I168 | F126-L164 HydrophobicContact CD2-CD2 4.39Å; F126-L164 HydrophobicContact CE2-CB 4.34Å; F126-L164 HydrophobicContact CE2-CD2 3.76Å; F126-L164 HydrophobicContact CE2-CG 3.84Å; F126-L164 HydrophobicContact CZ-CD2 3.97Å; F126-L164 HydrophobicContact CZ-CG 4.29Å; F160-L164 HydrophobicContact CE1-CD2 3.96Å; F160-L164 HydrophobicContact CZ-CD2 4.18Å; F160-L164 VanDerWaalsContact O-CB 3.3Å; F160-L164 WeakPolarHBondContact O-CB 3.21Å; F160-L164 PolarHBondContact O-N 3.42Å; I161-L164 PolarHBondContact O-N 2.94Å; L164-S166 VanDerWaalsContact C-N 3.33Å; L164-S166 PolarHBondContact O-N 2.89Å; L164-L167 PolarHBondContact O-N 3.34Å; L164-I168 HydrophobicContact CD1-CD1 3.83Å; L164-I168 HydrophobicContact CD1-CG1 4.27Å; L164-I168 HydrophobicContact CG-CD1 3.84Å; L164-I168 VanDerWaalsContact O-CG1 3.26Å; L164-I168 WeakPolarHBondContact O-CG1 2.91Å; L164-I168 PolarHBondContact O-N 3.46Å |
| 165 | A | 98.1 | Very high | 95.8 | Very high | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -62.1 | -41.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L119 F122 A123 F126 I161 G169 | L119-A165 HydrophobicContact CD1-CB 3.92Å; F122-A165 HydrophobicContact CB-CB 3.75Å; A123-A165 HydrophobicContact CB-CB 3.97Å; F126-A165 HydrophobicContact CD2-CB 4.44Å; I161-A165 VanDerWaalsContact O-CB 3.25Å; I161-A165 WeakPolarHBondContact O-CB 3.48Å; I161-A165 PolarHBondContact O-N 2.85Å; A165-G169 PolarHBondContact O-N 3.39Å |
| 166 | S | 97.6 | Very high | 95.5 | Very high | 42 Ų | 42 | 58.9 Ų | 58.9 | 29% | 0.294 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -67.5 | -38.6 | 176.5 | -57.7 | 0 | 0 | 0 | 0 | 112.1 | L119 W162 L163 L164 G170 | L119-S166 WeakPolarHBondContact CD1-OG 3.23Å; W162-S166 VanDerWaalsContact O-CB 3.27Å; W162-S166 WeakPolarHBondContact O-CB 3.35Å; W162-S166 PolarHBondContact O-N 3.39Å; W162-S166 PolarHBondContact O-OG 3.05Å; L163-S166 PolarHBondContact O-N 2.93Å; L164-S166 VanDerWaalsContact C-N 3.33Å; L164-S166 PolarHBondContact O-N 2.89Å; S166-G170 VanDerWaalsContact O-CA 3.25Å; S166-G170 WeakPolarHBondContact O-CA 3.43Å; S166-G170 PolarHBondContact O-N 3.18Å |
| 167 | L | 96.9 | Very high | 95.2 | Very high | 129 Ų | 129 | 55.4 Ų | 55.4 | 68% | 0.675 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -64.3 | -47.3 | 177.7 | 179.1 | 64.2 | 0 | 0 | 0 | 111.2 | L163 L164 G170 P171 | L163-L167 VanDerWaalsContact O-CB 3.29Å; L163-L167 WeakPolarHBondContact O-CB 3.23Å; L163-L167 PolarHBondContact O-N 3.41Å; L164-L167 PolarHBondContact O-N 3.34Å; L167-G170 PolarHBondContact O-N 3.43Å; L167-P171 WeakPolarHBondContact O-CD 3.29Å |
| 168 | I | 95.4 | Very high | 94.8 | Very high | 34 Ų | 34 | 54.7 Ų | 54.7 | 17% | 0.174 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -76.1 | -32.9 | -178 | -54.9 | 166.1 | 0 | 0 | 0 | 111.3 | F122 F126 L164 P171 V209 V213 | F122-I168 HydrophobicContact CD1-CG2 4.31Å; F122-I168 HydrophobicContact CD2-CB 4.1Å; F122-I168 HydrophobicContact CD2-CG2 4.03Å; F122-I168 HydrophobicContact CE1-CG2 3.73Å; F122-I168 HydrophobicContact CE2-CB 3.96Å; F122-I168 HydrophobicContact CE2-CG2 3.43Å; F122-I168 VanDerWaalsContact CE2-CG2 3.43Å; F122-I168 HydrophobicContact CG-CB 4.47Å; F122-I168 HydrophobicContact CG-CG2 4.45Å; F122-I168 HydrophobicContact CZ-CB 4.2Å; F122-I168 HydrophobicContact CZ-CG2 3.25Å; F126-I168 HydrophobicContact CE2-CD1 4.31Å; F126-I168 HydrophobicContact CZ-CD1 4.05Å; L164-I168 HydrophobicContact CD1-CD1 3.83Å; L164-I168 HydrophobicContact CD1-CG1 4.27Å; L164-I168 HydrophobicContact CG-CD1 3.84Å; L164-I168 VanDerWaalsContact O-CG1 3.26Å; L164-I168 WeakPolarHBondContact O-CG1 2.91Å; L164-I168 PolarHBondContact O-N 3.46Å; I168-P171 VanDerWaalsContact O-CD 3.25Å; I168-P171 WeakPolarHBondContact O-CD 3.47Å; I168-V209 HydrophobicContact CG2-CG1 3.82Å; I168-V213 HydrophobicContact CD1-CG1 3.79Å |
| 169 | G | 94.7 | Very high | 94.3 | Very high | 1 Ų | 1 | 56.4 Ų | 56.4 | 1% | 0.01 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -76.1 | -22.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | A165 A172 | A165-G169 PolarHBondContact O-N 3.39Å; G169-A172 VanDerWaalsContact O-CB 3.26Å; G169-A172 WeakPolarHBondContact O-CB 3.44Å; G169-A172 PolarHBondContact O-N 3.47Å; G169-A172 VanDerWaalsContact O-N 3.08Å |
| 170 | G | 94.4 | Very high | 93.8 | Very high | 21 Ų | 21 | 57.7 Ų | 57.7 | 22% | 0.216 | 29% | 0.291 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.9 | -36.6 | -175.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | S166 L167 A172 L173 | S166-G170 VanDerWaalsContact O-CA 3.25Å; S166-G170 WeakPolarHBondContact O-CA 3.43Å; S166-G170 PolarHBondContact O-N 3.18Å; L167-G170 PolarHBondContact O-N 3.43Å; G170-A172 PolarHBondContact O-N 2.92Å; G170-L173 WeakPolarHBondContact O-CB 3.24Å; G170-L173 PolarHBondContact O-N 3.19Å |
| 171 | P | 92.6 | Very high | 93 | Very high | 41 Ų | 41 | 57.3 Ų | 57.3 | 27% | 0.266 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -52.9 | -27 | 174.2 | -29.1 | 36.6 | 0 | 0 | 0 | 113.8 | L167 I168 L173 Y174 F175 L206 | L167-P171 WeakPolarHBondContact O-CD 3.29Å; I168-P171 VanDerWaalsContact O-CD 3.25Å; I168-P171 WeakPolarHBondContact O-CD 3.47Å; P171-L173 VanDerWaalsContact C-N 3.28Å; P171-L173 PolarHBondContact O-N 3.35Å; P171-Y174 PolarHBondContact O-N 3.22Å; P171-F175 HydrophobicContact CB-CD2 3.89Å; P171-F175 HydrophobicContact CB-CE2 4.03Å; P171-F175 VanDerWaalsContact O-CD2 3.3Å; P171-F175 WeakPolarHBondContact O-CD2 3.5Å; P171-F175 PolarHBondContact O-N 3.02Å; P171-L206 HydrophobicContact CB-CD2 3.9Å; P171-L206 HydrophobicContact CG-CD2 4.19Å |
| 172 | A | 89.9 | Confident | 92.3 | Very high | 13 Ų | 13 | 63.5 Ų | 63.5 | 11% | 0.107 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.9 | -31.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q118 G169 G170 Y174 R176 | Q118-A172 HydrophobicContact CG-CB 4.14Å; G169-A172 VanDerWaalsContact O-CB 3.26Å; G169-A172 WeakPolarHBondContact O-CB 3.44Å; G169-A172 PolarHBondContact O-N 3.47Å; G169-A172 VanDerWaalsContact O-N 3.08Å; G170-A172 PolarHBondContact O-N 2.92Å; A172-Y174 VanDerWaalsContact C-N 3.3Å; A172-R176 WeakPolarHBondContact O-CB 3.37Å; A172-R176 WeakPolarHBondContact O-CG 3.37Å; A172-R176 PolarHBondContact O-N 3.25Å |
| 173 | L | 93.5 | Very high | 91.7 | Very high | 77 Ų | 77 | 67.7 Ų | 67.7 | 40% | 0.403 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -68.7 | -32.7 | 175.6 | -67.8 | 172 | 0 | 0 | 0 | 111.8 | K111 F115 G170 P171 | K111-L173 HydrophobicContact CB-CD2 4.27Å; K111-L173 WeakPolarHBondContact CD-O 3.44Å; K111-L173 PolarHBondContact NZ-O 2.92Å; F115-L173 HydrophobicContact CB-CD2 3.48Å; F115-L173 VanDerWaalsContact CB-CD2 3.48Å; F115-L173 HydrophobicContact CB-CG 3.77Å; F115-L173 HydrophobicContact CD1-CD1 4.46Å; F115-L173 HydrophobicContact CD1-CD2 4.26Å; F115-L173 HydrophobicContact CD1-CG 4.49Å; F115-L173 HydrophobicContact CD2-CD1 3.79Å; F115-L173 HydrophobicContact CD2-CD2 4.24Å; F115-L173 HydrophobicContact CD2-CG 3.67Å; F115-L173 HydrophobicContact CE2-CD1 4.03Å; F115-L173 HydrophobicContact CE2-CG 4.41Å; F115-L173 HydrophobicContact CG-CD1 4.01Å; F115-L173 HydrophobicContact CG-CD2 3.73Å; F115-L173 HydrophobicContact CG-CG 3.71Å; F115-L173 HydrophobicContact CZ-CD1 4.46Å; G170-L173 WeakPolarHBondContact O-CB 3.24Å; G170-L173 PolarHBondContact O-N 3.19Å; P171-L173 VanDerWaalsContact C-N 3.28Å; P171-L173 PolarHBondContact O-N 3.35Å |
| 174 | Y | 91.6 | Very high | 91 | Very high | 149 Ų | 149 | 64.7 Ų | 64.7 | 58% | 0.584 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -82.1 | -56.7 | -179.7 | -176 | -104.2 | 0 | 0 | 0 | 111.4 | K111 P171 A172 R176 | K111-Y174 PolarHBondContact NZ-O 2.89Å; P171-Y174 PolarHBondContact O-N 3.22Å; A172-Y174 VanDerWaalsContact C-N 3.3Å; Y174-R176 PolarHBondContact O-N 3.18Å |
| 175 | F | 89 | Confident | 90.6 | Very high | 31 Ų | 31 | 63.7 Ų | 63.7 | 14% | 0.136 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -79 | -16.8 | -171.5 | -65.4 | -61 | 0 | 0 | 0 | 114.5 | P171 N189 N190 F191 L206 | P171-F175 HydrophobicContact CB-CD2 3.89Å; P171-F175 HydrophobicContact CB-CE2 4.03Å; P171-F175 VanDerWaalsContact O-CD2 3.3Å; P171-F175 WeakPolarHBondContact O-CD2 3.5Å; P171-F175 PolarHBondContact O-N 3.02Å; F175-N189 CarbonylContact O-C 3.56Å; F175-N190 PolarHBondContact O-N 3.49Å; F175-F191 HydrophobicContact CB-CD1 4.18Å; F175-F191 HydrophobicContact CB-CE1 3.94Å; F175-F191 AromaticContact CD1-CD1 3.75Å; F175-F191 HydrophobicContact CD1-CD1 3.75Å; F175-F191 HydrophobicContact CD1-CE1 4.19Å; F175-F191 HydrophobicContact CD2-CD1 4.48Å; F175-F191 HydrophobicContact CD2-CE1 4.15Å; F175-F191 HydrophobicContact CE1-CD1 4.24Å; F175-F191 AromaticContact CG-CD1 3.9Å; F175-F191 HydrophobicContact CG-CD1 3.9Å; F175-F191 AromaticContact CG-CE1 3.84Å; F175-F191 HydrophobicContact CG-CE1 3.84Å; F175-L206 HydrophobicContact CD2-CD1 4.09Å; F175-L206 HydrophobicContact CE2-CD1 4.34Å |
| 176 | R | 89.6 | Confident | 89.9 | Confident | 61 Ų | 61 | 64 Ų | 64 | 23% | 0.23 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.9 | 136.2 | 174.6 | -74.3 | -71.4 | -165 | 167.5 | -0.4 | 111.5 | K111 S114 A172 Y174 C187 Y188 N189 | K111-R176 WeakPolarHBondContact CE-O 3.34Å; K111-R176 HydrophobicContact CG-CB 4.01Å; K111-R176 WeakPolarHBondContact CG-O 3.26Å; K111-R176 PolarHBondContact NZ-O 3.43Å; S114-R176 PolarHBondContact OG-NE 3.31Å; S114-R176 VanDerWaalsContact OG-NE 3.15Å; A172-R176 WeakPolarHBondContact O-CB 3.37Å; A172-R176 WeakPolarHBondContact O-CG 3.37Å; A172-R176 PolarHBondContact O-N 3.25Å; Y174-R176 PolarHBondContact O-N 3.18Å; R176-C187 PolarHBondContact NH1-O 3.36Å; R176-Y188 WeakPolarHBondContact CA-O 3.22Å; R176-Y188 VanDerWaalsContact CD-O 3.3Å; R176-Y188 WeakPolarHBondContact CD-O 3.3Å; R176-N189 WeakPolarHBondContact CD-OD1 3.33Å; R176-N189 PolarHBondContact NE-OD1 3.16Å |
| 177 | D | 90.3 | Very high | 89.5 | Confident | 41 Ų | 41 | 62.5 Ų | 62.5 | 22% | 0.219 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.8 | 169.2 | -177.2 | -151.7 | -5.9 | 0 | 0 | 0 | 111.3 | I107 C110 Y188 N190 | I107-D177 WeakPolarHBondContact CD1-OD1 3.44Å; C110-D177 PolarHBondContact SG-O 3.33Å; D177-Y188 HydrophobicContact CB-CE1 4.13Å; D177-Y188 PolarHBondContact N-O 3.31Å; D177-Y188 WeakPolarHBondContact O-CD1 3.38Å; D177-Y188 PolarHBondContact O-N 3.16Å; D177-N190 HydrophobicContact CB-CB 3.57Å; D177-N190 PolarHBondContact OD2-ND2 2.89Å |
| 178 | T | 89.1 | Confident | 88.8 | Confident | 40 Ų | 40 | 57.9 Ų | 57.9 | 25% | 0.245 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 131.9 | 175.7 | 51 | 0 | 0 | 0 | 0 | 110.8 | I107 C110 T185 L186 | I107-T178 HydrophobicContact CB-CG2 4.37Å; C110-T178 HydrophobicContact CB-CG2 3.85Å; T178-T185 HydrophobicContact CG2-CG2 4.34Å; T178-L186 VanDerWaalsContact CA-O 3.24Å; T178-L186 WeakPolarHBondContact CA-O 2.79Å |
| 179 | V | 87.5 | Confident | 88.2 | Confident | 46 Ų | 46 | 59.1 Ų | 59.1 | 28% | 0.279 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 139 | 171.7 | 63.5 | 0 | 0 | 0 | 0 | 109.1 | T185 L186 Y188 | V179-T185 CarbonylContact O-C 3.55Å; V179-T185 WeakPolarHBondContact O-CA 3.44Å; V179-L186 HydrophobicContact CG1-CB 4.05Å; V179-L186 HydrophobicContact CG1-CD1 4.48Å; V179-L186 PolarHBondContact N-O 2.9Å; V179-L186 VanDerWaalsContact N-O 3.1Å; V179-L186 PolarHBondContact O-N 2.97Å; V179-Y188 HydrophobicContact CB-CD1 4.11Å; V179-Y188 HydrophobicContact CB-CE1 3.55Å; V179-Y188 HydrophobicContact CG1-CD1 3.6Å; V179-Y188 HydrophobicContact CG1-CE1 3.53Å; V179-Y188 HydrophobicContact CG1-CG 4.41Å |
| 180 | E | 87.8 | Confident | 87.7 | Confident | 130 Ų | 130 | 61.2 Ų | 61.2 | 61% | 0.607 | 31% | 0.311 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.5 | 128.9 | 174.7 | -172.1 | 177.4 | 176.9 | 0 | 0 | 109.4 | ||
| 181 | F | 82.8 | Confident | 87 | Confident | 119 Ų | 119 | 61.1 Ų | 61.1 | 52% | 0.522 | 31% | 0.305 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.1 | 119 | 176.6 | -176 | -102.9 | 0 | 0 | 0 | 108.6 | N183 H184 | F181-N183 PolarHBondContact O-N 3.17Å; F181-H184 PolarHBondContact N-O 3.3Å; F181-H184 WeakPolarHBondContact O-CA 3.35Å; F181-H184 WeakPolarHBondContact O-CB 3.14Å; F181-H184 PolarHBondContact O-N 3.25Å |
| 182 | N | 83.2 | Confident | 85.8 | Confident | 139 Ų | 139 | 63 Ų | 63 | 74% | 0.743 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 51.8 | 179.4 | -63.7 | -23.2 | 0 | 0 | 0 | 114.5 | H184 | N182-H184 PolarHBondContact O-N 3.13Å; N182-H184 VanDerWaalsContact O-N 3.13Å |
| 183 | N | 85.4 | Confident | 84.4 | Confident | 142 Ų | 142 | 69.1 Ų | 69.1 | 76% | 0.759 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 15 | -172.8 | -74.3 | 2.6 | 0 | 0 | 0 | 114.7 | F181 | F181-N183 PolarHBondContact O-N 3.17Š|
| 184 | H | 83.6 | Confident | 83.1 | Confident | 51 Ų | 51 | 74.1 Ų | 74.1 | 24% | 0.236 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 113.7 | 177.6 | -164 | -98.3 | 0 | 0 | 0 | 110.5 | N100 F101 H102 F181 N182 L186 | N100-H184 PolarHBondContact O-CE1 2.87Å; N100-H184 PolarHBondContact O-NE2 2.87Å; F101-H184 VanDerWaalsContact C-CE1 3.41Å; F101-H184 PolarHBondContact O-CE1 3.39Å; H102-H184 WeakPolarHBondContact CA-NE2 3.5Å; H102-H184 VanDerWaalsContact CB-NE2 3.33Å; H102-H184 WeakPolarHBondContact CB-NE2 3.09Å; H102-H184 PolarHBondContact N-CE1 3.37Å; H102-H184 PolarHBondContact N-NE2 3.27Å; H102-H184 AromaticContact ND1-CD2 3.58Å; H102-H184 AromaticContact ND1-CG 3.94Å; F181-H184 PolarHBondContact N-O 3.3Å; F181-H184 WeakPolarHBondContact O-CA 3.35Å; F181-H184 WeakPolarHBondContact O-CB 3.14Å; F181-H184 PolarHBondContact O-N 3.25Å; N182-H184 PolarHBondContact O-N 3.13Å; N182-H184 VanDerWaalsContact O-N 3.13Å; H184-L186 WeakPolarHBondContact ND1-CD2 3.19Å |
| 185 | T | 88.8 | Confident | 82.3 | Confident | 30 Ų | 30 | 70.2 Ų | 70.2 | 18% | 0.184 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.8 | 126 | 179.6 | -53.3 | 0 | 0 | 0 | 0 | 110.8 | H102 W103 T178 V179 | H102-T185 CarbonylContact C-O 3.57Å; H102-T185 PolarHBondContact CE1-N 3.34Å; H102-T185 PolarHBondContact ND1-N 2.89Å; H102-T185 VanDerWaalsContact ND1-N 3.2Å; W103-T185 PolarHBondContact N-O 3.31Å; W103-T185 WeakPolarHBondContact O-CB 3.38Å; W103-T185 WeakPolarHBondContact O-CG2 3.42Å; T178-T185 HydrophobicContact CG2-CG2 4.34Å; V179-T185 CarbonylContact O-C 3.55Å; V179-T185 WeakPolarHBondContact O-CA 3.44Å |
| 186 | L | 85 | Confident | 81.5 | Confident | 8 Ų | 8 | 72 Ų | 72 | 4% | 0.042 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 139.5 | 177.1 | -61.9 | 174 | 0 | 0 | 0 | 110.7 | Y22 F101 T178 V179 H184 | Y22-L186 HydrophobicContact CD1-CD2 4.37Å; Y22-L186 HydrophobicContact CD2-CD1 3.54Å; Y22-L186 HydrophobicContact CD2-CD2 4.06Å; Y22-L186 HydrophobicContact CD2-CG 4.46Å; Y22-L186 HydrophobicContact CE1-CD2 4Å; Y22-L186 HydrophobicContact CE2-CD1 3.88Å; Y22-L186 HydrophobicContact CE2-CD2 3.7Å; Y22-L186 HydrophobicContact CE2-CG 4.4Å; Y22-L186 HydrophobicContact CG-CD1 4.1Å; Y22-L186 HydrophobicContact CG-CD2 4.43Å; F101-L186 WeakPolarHBondContact O-CD2 3.17Å; T178-L186 VanDerWaalsContact CA-O 3.24Å; T178-L186 WeakPolarHBondContact CA-O 2.79Å; V179-L186 HydrophobicContact CG1-CB 4.05Å; V179-L186 HydrophobicContact CG1-CD1 4.48Å; V179-L186 PolarHBondContact N-O 2.9Å; V179-L186 VanDerWaalsContact N-O 3.1Å; V179-L186 PolarHBondContact O-N 2.97Å; H184-L186 WeakPolarHBondContact ND1-CD2 3.19Å |
| 187 | C | 87.9 | Confident | 81 | Confident | 9 Ų | 9 | 74.7 Ų | 74.7 | 6% | 0.061 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 102.5 | 169.7 | 174.4 | 0 | 0 | 0 | 0 | 109.5 | W103 C110 R176 | W103-C187 HydrophobicContact CB-CB 3.98Å; W103-C187 HydrophobicContact CD2-CB 3.87Å; W103-C187 HydrophobicContact CE3-CB 4.17Å; W103-C187 HydrophobicContact CG-CB 3.75Å; C110-C187 VanDerWaalsContact CA-SG 3.54Å; C110-C187 HydrophobicContact CB-CB 3.88Å; C110-C187 WeakPolarHBondContact CB-SG 3.44Å; C110-C187 WeakPolarHBondContact SG-CB 3.34Å; C110-C187 CovalentContact SG-SG 2.03Å; C110-C187 PolarHBondContact SG-SG 2.9Å; R176-C187 PolarHBondContact NH1-O 3.36Å |
| 188 | Y | 83.7 | Confident | 80.5 | Confident | 33 Ų | 33 | 75.8 Ų | 75.8 | 13% | 0.129 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.7 | 173.5 | -167.8 | 81.8 | -70.5 | 0 | 0 | 0 | 112.4 | A18 R176 D177 V179 N190 | A18-Y188 HydrophobicContact CB-CD2 4.45Å; R176-Y188 WeakPolarHBondContact CA-O 3.22Å; R176-Y188 VanDerWaalsContact CD-O 3.3Å; R176-Y188 WeakPolarHBondContact CD-O 3.3Å; D177-Y188 HydrophobicContact CB-CE1 4.13Å; D177-Y188 PolarHBondContact N-O 3.31Å; D177-Y188 WeakPolarHBondContact O-CD1 3.38Å; D177-Y188 PolarHBondContact O-N 3.16Å; V179-Y188 HydrophobicContact CB-CD1 4.11Å; V179-Y188 HydrophobicContact CB-CE1 3.55Å; V179-Y188 HydrophobicContact CG1-CD1 3.6Å; V179-Y188 HydrophobicContact CG1-CE1 3.53Å; V179-Y188 HydrophobicContact CG1-CG 4.41Å; Y188-N190 HydrophobicContact CE2-CB 4.02Å |
| 189 | N | 82.1 | Confident | 80 | Confident | 60 Ų | 60 | 74.9 Ų | 74.9 | 32% | 0.321 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.6 | 111.3 | 173.1 | -63.3 | -63.6 | 0 | 0 | 0 | 109.5 | F175 R176 F191 | F175-N189 CarbonylContact O-C 3.56Å; R176-N189 WeakPolarHBondContact CD-OD1 3.33Å; R176-N189 PolarHBondContact NE-OD1 3.16Å; N189-F191 HydrophobicContact CB-CD2 4.28Å; N189-F191 HydrophobicContact CB-CE1 4.24Å; N189-F191 HydrophobicContact CB-CE2 3.73Å; N189-F191 HydrophobicContact CB-CZ 3.7Å; N189-F191 PolarHBondContact O-N 2.95Å |
| 190 | N | 83.8 | Confident | 79.6 | Confident | 44 Ų | 44 | 74.5 Ų | 74.5 | 24% | 0.235 | 38% | 0.376 | C | S | . | . | trans | -88.8 | 81.8 | 172.6 | -171.7 | 2.5 | 0 | 0 | 0 | 110 | F175 D177 Y188 Q192 | F175-N190 PolarHBondContact O-N 3.49Å; D177-N190 HydrophobicContact CB-CB 3.57Å; D177-N190 PolarHBondContact OD2-ND2 2.89Å; Y188-N190 HydrophobicContact CE2-CB 4.02Å; N190-Q192 PolarHBondContact O-N 3.41Å | ||
| 191 | F | 79.5 | Confident | 79.5 | Confident | 20 Ų | 20 | 72.9 Ų | 72.9 | 9% | 0.088 | 37% | 0.37 | C | S | . | . | trans | -78.6 | 106.1 | 161.8 | -53.6 | -50.5 | 0 | 0 | 0 | 106.3 | F175 N189 K193 T199 R202 H203 L206 | F175-F191 HydrophobicContact CB-CD1 4.18Å; F175-F191 HydrophobicContact CB-CE1 3.94Å; F175-F191 AromaticContact CD1-CD1 3.75Å; F175-F191 HydrophobicContact CD1-CD1 3.75Å; F175-F191 HydrophobicContact CD1-CE1 4.19Å; F175-F191 HydrophobicContact CD2-CD1 4.48Å; F175-F191 HydrophobicContact CD2-CE1 4.15Å; F175-F191 HydrophobicContact CE1-CD1 4.24Å; F175-F191 AromaticContact CG-CD1 3.9Å; F175-F191 HydrophobicContact CG-CD1 3.9Å; F175-F191 AromaticContact CG-CE1 3.84Å; F175-F191 HydrophobicContact CG-CE1 3.84Å; N189-F191 HydrophobicContact CB-CD2 4.28Å; N189-F191 HydrophobicContact CB-CE1 4.24Å; N189-F191 HydrophobicContact CB-CE2 3.73Å; N189-F191 HydrophobicContact CB-CZ 3.7Å; N189-F191 PolarHBondContact O-N 2.95Å; F191-K193 PolarHBondContact O-N 3.05Å; F191-T199 HydrophobicContact CB-CG2 3.7Å; F191-T199 HydrophobicContact CD2-CG2 4.16Å; F191-T199 HydrophobicContact CG-CG2 4.39Å; F191-T199 PolarHBondContact O-OG1 3.1Å; F191-R202 HydrophobicContact CD1-CB 4.04Å; F191-R202 HydrophobicContact CE1-CB 4.45Å; F191-R202 HydrophobicContact CG-CB 4.34Å; F191-H203 HydrophobicContact CD2-CB 4.21Å; F191-H203 HydrophobicContact CE2-CB 3.76Å; F191-H203 AromaticContact CE2-ND1 3.71Å; F191-H203 HydrophobicContact CZ-CB 4.4Å; F191-L206 HydrophobicContact CE1-CD1 3.54Å; F191-L206 HydrophobicContact CZ-CD1 3.81Å | ||
| 192 | Q | 67.6 | Low | 79.6 | Confident | 80 Ų | 80 | 70 Ų | 70 | 37% | 0.374 | 36% | 0.356 | S | S | . | . | trans | -36.5 | 122.5 | -172.8 | -85.6 | 153.5 | -36.5 | 0 | 0 | 114 | N190 H194 T199 | N190-Q192 PolarHBondContact O-N 3.41Å; Q192-H194 PolarHBondContact O-N 2.94Å; Q192-T199 PolarHBondContact O-OG1 3.27Å | ||
| 193 | K | 61.6 | Low | 79.7 | Confident | 142 Ų | 142 | 65.2 Ų | 65.2 | 62% | 0.617 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.1 | 0.4 | -174.1 | -62.9 | -174.1 | 177.5 | -173.8 | 0 | 115.6 | F191 D195 | F191-K193 PolarHBondContact O-N 3.05Å; K193-D195 PolarHBondContact O-N 3.42Å |
| 194 | H | 65.9 | Low | 79.8 | Confident | 182 Ų | 182 | 61.4 Ų | 61.4 | 84% | 0.843 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.6 | -17.9 | -175.4 | -66.5 | -54.5 | 0 | 0 | 0 | 113.3 | Q192 | Q192-H194 PolarHBondContact O-N 2.94Š|
| 195 | D | 75.1 | Confident | 80.2 | Confident | 67 Ų | 67 | 62.8 Ų | 62.8 | 36% | 0.358 | 32% | 0.318 | S | S | . | . | trans | -144.8 | 110.4 | 178.9 | -175.3 | -20.6 | 0 | 0 | 0 | 109.4 | K193 D197 L198 T199 | K193-D195 PolarHBondContact O-N 3.42Å; D195-D197 WeakPolarHBondContact OD1-CB 3.27Å; D195-D197 PolarHBondContact OD1-N 3Å; D195-L198 HydrophobicContact CB-CB 3.78Å; D195-L198 HydrophobicContact CB-CD2 4.48Å; D195-L198 PolarHBondContact O-N 3.31Å; D195-L198 PolarHBondContact OD1-N 2.93Å; D195-T199 PolarHBondContact O-N 3.36Å; D195-T199 PolarHBondContact O-OG1 2.85Å | ||
| 196 | P | 71.5 | Confident | 80.2 | Confident | 68 Ų | 68 | 63 Ų | 63 | 44% | 0.442 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.7 | -36.6 | -178.3 | 26.4 | -32.5 | 0 | 0 | 0 | 112.1 | L198 T199 V200 | P196-L198 VanDerWaalsContact C-N 3.33Å; P196-L198 PolarHBondContact O-N 3.4Å; P196-T199 WeakPolarHBondContact O-CB 3.48Å; P196-T199 PolarHBondContact O-N 2.91Å; P196-V200 WeakPolarHBondContact O-CG2 3.38Å; P196-V200 PolarHBondContact O-N 3.45Å; P196-V200 VanDerWaalsContact O-N 3.14Å |
| 197 | D | 77.9 | Confident | 80.5 | Confident | 118 Ų | 118 | 63 Ų | 63 | 63% | 0.631 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -64.4 | -42.8 | 178.7 | -68 | -27.5 | 0 | 0 | 0 | 110.2 | D195 T199 V200 I201 | D195-D197 WeakPolarHBondContact OD1-CB 3.27Å; D195-D197 PolarHBondContact OD1-N 3Å; D197-T199 VanDerWaalsContact C-N 3.27Å; D197-T199 PolarHBondContact O-N 3.02Å; D197-V200 PolarHBondContact O-N 3.42Å; D197-I201 WeakPolarHBondContact O-CB 3.43Å; D197-I201 WeakPolarHBondContact O-CD1 3.44Å; D197-I201 VanDerWaalsContact O-CG1 3.22Å; D197-I201 WeakPolarHBondContact O-CG1 3.38Å; D197-I201 PolarHBondContact O-N 3.2Å |
| 198 | L | 80.3 | Confident | 80.8 | Confident | 63 Ų | 63 | 67.9 Ų | 67.9 | 33% | 0.33 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.6 | -33.5 | 177.3 | -173.6 | 59.1 | 0 | 0 | 0 | 112.6 | D195 P196 R202 | D195-L198 HydrophobicContact CB-CB 3.78Å; D195-L198 HydrophobicContact CB-CD2 4.48Å; D195-L198 PolarHBondContact O-N 3.31Å; D195-L198 PolarHBondContact OD1-N 2.93Å; P196-L198 VanDerWaalsContact C-N 3.33Å; P196-L198 PolarHBondContact O-N 3.4Å; L198-R202 HydrophobicContact CD1-CG 4.44Å; L198-R202 WeakPolarHBondContact O-CB 3.14Å; L198-R202 WeakPolarHBondContact O-CD 3.4Å; L198-R202 WeakPolarHBondContact O-CG 3.3Å; L198-R202 PolarHBondContact O-N 3.47Å |
| 199 | T | 79.2 | Confident | 81.3 | Confident | 22 Ų | 22 | 69 Ų | 69 | 14% | 0.135 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -66.1 | -47.8 | 176.4 | -70.4 | 0 | 0 | 0 | 0 | 111.6 | F191 Q192 D195 P196 D197 R202 H203 | F191-T199 HydrophobicContact CB-CG2 3.7Å; F191-T199 HydrophobicContact CD2-CG2 4.16Å; F191-T199 HydrophobicContact CG-CG2 4.39Å; F191-T199 PolarHBondContact O-OG1 3.1Å; Q192-T199 PolarHBondContact O-OG1 3.27Å; D195-T199 PolarHBondContact O-N 3.36Å; D195-T199 PolarHBondContact O-OG1 2.85Å; P196-T199 WeakPolarHBondContact O-CB 3.48Å; P196-T199 PolarHBondContact O-N 2.91Å; D197-T199 VanDerWaalsContact C-N 3.27Å; D197-T199 PolarHBondContact O-N 3.02Å; T199-R202 PolarHBondContact O-N 3.48Å; T199-H203 PolarHBondContact O-N 3.23Å |
| 200 | V | 79.2 | Confident | 81.9 | Confident | 38 Ų | 38 | 68.4 Ų | 68.4 | 23% | 0.23 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.9 | -47.2 | 177.3 | 176 | 0 | 0 | 0 | 0 | 110.3 | Y15 P196 D197 R202 H203 H204 | Y15-V200 HydrophobicContact CD1-CG2 3.77Å; Y15-V200 HydrophobicContact CE1-CG2 3.72Å; Y15-V200 HydrophobicContact CG-CG2 4.29Å; P196-V200 WeakPolarHBondContact O-CG2 3.38Å; P196-V200 PolarHBondContact O-N 3.45Å; P196-V200 VanDerWaalsContact O-N 3.14Å; D197-V200 PolarHBondContact O-N 3.42Å; V200-R202 PolarHBondContact O-N 2.92Å; V200-H203 PolarHBondContact O-N 2.95Å; V200-H204 VanDerWaalsContact CG1-CE1 3.47Å; V200-H204 WeakPolarHBondContact CG1-CE1 3.35Å; V200-H204 WeakPolarHBondContact CG1-ND1 3.45Å; V200-H204 WeakPolarHBondContact O-CB 3.46Å; V200-H204 PolarHBondContact O-N 3.47Å; V200-H204 PolarHBondContact O-ND1 3.41Å |
| 201 | I | 85 | Confident | 82.4 | Confident | 96 Ų | 96 | 67.9 Ų | 67.9 | 49% | 0.492 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -59.3 | -47.8 | 178.5 | -68.2 | 165.1 | 0 | 0 | 0 | 110.8 | D197 H203 H204 V205 | D197-I201 WeakPolarHBondContact O-CB 3.43Å; D197-I201 WeakPolarHBondContact O-CD1 3.44Å; D197-I201 VanDerWaalsContact O-CG1 3.22Å; D197-I201 WeakPolarHBondContact O-CG1 3.38Å; D197-I201 PolarHBondContact O-N 3.2Å; I201-H203 PolarHBondContact O-N 2.94Å; I201-H204 PolarHBondContact O-N 3.48Å; I201-V205 HydrophobicContact CG2-CG2 4.12Å; I201-V205 WeakPolarHBondContact O-CB 3.1Å; I201-V205 WeakPolarHBondContact O-CG2 3.04Å; I201-V205 PolarHBondContact O-N 3.14Å |
| 202 | R | 86.1 | Confident | 83.2 | Confident | 57 Ų | 57 | 70.8 Ų | 70.8 | 22% | 0.215 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 179.1 | -76.6 | 169.3 | 177.9 | -174.5 | -2 | 111.7 | F191 L198 T199 V200 V205 L206 | F191-R202 HydrophobicContact CD1-CB 4.04Å; F191-R202 HydrophobicContact CE1-CB 4.45Å; F191-R202 HydrophobicContact CG-CB 4.34Å; L198-R202 HydrophobicContact CD1-CG 4.44Å; L198-R202 WeakPolarHBondContact O-CB 3.14Å; L198-R202 WeakPolarHBondContact O-CD 3.4Å; L198-R202 WeakPolarHBondContact O-CG 3.3Å; L198-R202 PolarHBondContact O-N 3.47Å; T199-R202 PolarHBondContact O-N 3.48Å; V200-R202 PolarHBondContact O-N 2.92Å; R202-V205 PolarHBondContact O-N 2.87Å; R202-L206 WeakPolarHBondContact O-CB 3.45Å; R202-L206 VanDerWaalsContact O-CG 3.25Å; R202-L206 WeakPolarHBondContact O-CG 3.4Å; R202-L206 PolarHBondContact O-N 3.36Å |
| 203 | H | 83.8 | Confident | 84.6 | Confident | 40 Ų | 40 | 68.9 Ų | 68.9 | 19% | 0.185 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.6 | -48.7 | 178.8 | -175.2 | 61.5 | 0 | 0 | 0 | 111.5 | F191 T199 V200 I201 V205 L206 T207 L270 | F191-H203 HydrophobicContact CD2-CB 4.21Å; F191-H203 HydrophobicContact CE2-CB 3.76Å; F191-H203 AromaticContact CE2-ND1 3.71Å; F191-H203 HydrophobicContact CZ-CB 4.4Å; T199-H203 PolarHBondContact O-N 3.23Å; V200-H203 PolarHBondContact O-N 2.95Å; I201-H203 PolarHBondContact O-N 2.94Å; H203-V205 PolarHBondContact O-N 3.46Å; H203-L206 PolarHBondContact O-N 2.91Å; H203-T207 WeakPolarHBondContact O-CB 3.48Å; H203-T207 PolarHBondContact O-N 2.9Å; H203-T207 PolarHBondContact O-OG1 2.82Å; H203-L270 WeakPolarHBondContact CD2-CD2 3.33Å; H203-L270 WeakPolarHBondContact NE2-CD2 3.25Å |
| 204 | H | 88.8 | Confident | 86.1 | Confident | 62 Ų | 62 | 62.1 Ų | 62.1 | 29% | 0.287 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.1 | -50.2 | 176.2 | -79.5 | 70.6 | 0 | 0 | 0 | 111.9 | V200 I201 L206 T207 W208 | V200-H204 VanDerWaalsContact CG1-CE1 3.47Å; V200-H204 WeakPolarHBondContact CG1-CE1 3.35Å; V200-H204 WeakPolarHBondContact CG1-ND1 3.45Å; V200-H204 WeakPolarHBondContact O-CB 3.46Å; V200-H204 PolarHBondContact O-N 3.47Å; V200-H204 PolarHBondContact O-ND1 3.41Å; I201-H204 PolarHBondContact O-N 3.48Å; H204-L206 VanDerWaalsContact C-N 3.34Å; H204-L206 PolarHBondContact O-N 3.37Å; H204-T207 PolarHBondContact O-N 3.42Å; H204-W208 WeakPolarHBondContact O-CB 3.37Å; H204-W208 PolarHBondContact O-N 3.26Å |
| 205 | V | 91.1 | Very high | 87.5 | Confident | 79 Ų | 79 | 54.4 Ų | 54.4 | 48% | 0.479 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.6 | -47.1 | 179.9 | 168.5 | 0 | 0 | 0 | 0 | 110.5 | I201 R202 H203 T207 W208 V209 | I201-V205 HydrophobicContact CG2-CG2 4.12Å; I201-V205 WeakPolarHBondContact O-CB 3.1Å; I201-V205 WeakPolarHBondContact O-CG2 3.04Å; I201-V205 PolarHBondContact O-N 3.14Å; R202-V205 PolarHBondContact O-N 2.87Å; H203-V205 PolarHBondContact O-N 3.46Å; V205-T207 PolarHBondContact O-N 3.46Å; V205-W208 PolarHBondContact O-N 2.92Å; V205-V209 HydrophobicContact CG1-CG2 4.23Å; V205-V209 VanDerWaalsContact O-CB 3.29Å; V205-V209 WeakPolarHBondContact O-CB 3.3Å; V205-V209 WeakPolarHBondContact O-CG2 3.4Å; V205-V209 PolarHBondContact O-N 2.77Å |
| 206 | L | 90 | Very high | 88.5 | Confident | 35 Ų | 35 | 54.3 Ų | 54.3 | 18% | 0.183 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.6 | -42.3 | 179.1 | -70.5 | 174 | 0 | 0 | 0 | 111.7 | P171 F175 F191 R202 H203 H204 K210 | P171-L206 HydrophobicContact CB-CD2 3.9Å; P171-L206 HydrophobicContact CG-CD2 4.19Å; F175-L206 HydrophobicContact CD2-CD1 4.09Å; F175-L206 HydrophobicContact CE2-CD1 4.34Å; F191-L206 HydrophobicContact CE1-CD1 3.54Å; F191-L206 HydrophobicContact CZ-CD1 3.81Å; R202-L206 WeakPolarHBondContact O-CB 3.45Å; R202-L206 VanDerWaalsContact O-CG 3.25Å; R202-L206 WeakPolarHBondContact O-CG 3.4Å; R202-L206 PolarHBondContact O-N 3.36Å; H203-L206 PolarHBondContact O-N 2.91Å; H204-L206 VanDerWaalsContact C-N 3.34Å; H204-L206 PolarHBondContact O-N 3.37Å; L206-K210 WeakPolarHBondContact O-CB 3.49Å; L206-K210 WeakPolarHBondContact O-CG 3.28Å; L206-K210 PolarHBondContact O-N 3.33Å |
| 207 | T | 90.2 | Very high | 89.6 | Confident | 9 Ų | 9 | 56.7 Ų | 56.7 | 6% | 0.055 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65.8 | -45.4 | 178.8 | -64.1 | 0 | 0 | 0 | 0 | 111.9 | H203 H204 V205 K210 F211 S266 L270 | H203-T207 WeakPolarHBondContact O-CB 3.48Å; H203-T207 PolarHBondContact O-N 2.9Å; H203-T207 PolarHBondContact O-OG1 2.82Å; H204-T207 PolarHBondContact O-N 3.42Å; V205-T207 PolarHBondContact O-N 3.46Å; T207-K210 PolarHBondContact O-N 3.29Å; T207-F211 PolarHBondContact O-N 3.33Å; T207-S266 WeakPolarHBondContact CG2-O 3.44Å; T207-L270 HydrophobicContact CG2-CD1 3.64Å; T207-L270 HydrophobicContact CG2-CD2 4.28Å; T207-L270 HydrophobicContact CG2-CG 4.02Å |
| 208 | W | 94.4 | Very high | 90.5 | Very high | 111 Ų | 111 | 51 Ų | 51 | 42% | 0.42 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -66.4 | -39.6 | 176.8 | -79.5 | 110.2 | 0 | 0 | 0 | 112.8 | H204 V205 K210 F211 I212 I267 | H204-W208 WeakPolarHBondContact O-CB 3.37Å; H204-W208 PolarHBondContact O-N 3.26Å; V205-W208 PolarHBondContact O-N 2.92Å; W208-K210 VanDerWaalsContact C-N 3.35Å; W208-K210 PolarHBondContact O-N 2.91Å; W208-F211 AromaticContact CE3-CD1 3.84Å; W208-F211 HydrophobicContact CE3-CD1 3.84Å; W208-F211 AromaticContact CZ3-CD1 3.74Å; W208-F211 HydrophobicContact CZ3-CD1 3.74Å; W208-F211 AromaticContact CZ3-CE1 3.99Å; W208-F211 HydrophobicContact CZ3-CE1 3.99Å; W208-F211 PolarHBondContact O-N 3.38Å; W208-I212 HydrophobicContact CE3-CD1 4.45Å; W208-I212 WeakPolarHBondContact O-CB 3.48Å; W208-I212 VanDerWaalsContact O-CG1 3.28Å; W208-I212 WeakPolarHBondContact O-CG1 3.37Å; W208-I212 PolarHBondContact O-N 3.47Å; W208-I267 HydrophobicContact CZ3-CD1 4.5Å |
| 209 | V | 94.8 | Very high | 91.2 | Very high | 56 Ų | 56 | 49.4 Ų | 49.4 | 34% | 0.339 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.1 | -45.2 | 174 | 167.3 | 0 | 0 | 0 | 0 | 110.5 | I168 V205 F211 V213 | I168-V209 HydrophobicContact CG2-CG1 3.82Å; V205-V209 HydrophobicContact CG1-CG2 4.23Å; V205-V209 VanDerWaalsContact O-CB 3.29Å; V205-V209 WeakPolarHBondContact O-CB 3.3Å; V205-V209 WeakPolarHBondContact O-CG2 3.4Å; V205-V209 PolarHBondContact O-N 2.77Å; V209-F211 PolarHBondContact O-N 3.47Å; V209-V213 HydrophobicContact CG1-CG2 4.39Å; V209-V213 VanDerWaalsContact O-CB 3.29Å; V209-V213 WeakPolarHBondContact O-CB 3.28Å; V209-V213 PolarHBondContact O-N 3.11Å |
| 210 | K | 93.3 | Very high | 92 | Very high | 47 Ų | 47 | 52.8 Ų | 52.8 | 20% | 0.204 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60 | -44.6 | 175.6 | -70.6 | 175.6 | -155.1 | -173.1 | 0 | 111.6 | M121 F122 L206 T207 W208 G214 | M121-K210 HydrophobicContact CE-CB 3.93Å; M121-K210 HydrophobicContact CE-CD 4.49Å; M121-K210 HydrophobicContact CE-CG 3.88Å; F122-K210 HydrophobicContact CZ-CG 4.08Å; L206-K210 WeakPolarHBondContact O-CB 3.49Å; L206-K210 WeakPolarHBondContact O-CG 3.28Å; L206-K210 PolarHBondContact O-N 3.33Å; T207-K210 PolarHBondContact O-N 3.29Å; W208-K210 VanDerWaalsContact C-N 3.35Å; W208-K210 PolarHBondContact O-N 2.91Å; K210-G214 CarbonylContact O-C 3.6Å; K210-G214 WeakPolarHBondContact O-CA 3.34Å; K210-G214 PolarHBondContact O-N 2.91Å |
| 211 | F | 95.6 | Very high | 92.7 | Very high | 34 Ų | 34 | 52.3 Ų | 52.3 | 15% | 0.149 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.4 | -51.1 | 178.4 | 172.8 | -112.1 | 0 | 0 | 0 | 112.4 | T207 W208 V209 Y215 L216 H263 I267 | T207-F211 PolarHBondContact O-N 3.33Å; W208-F211 AromaticContact CE3-CD1 3.84Å; W208-F211 HydrophobicContact CE3-CD1 3.84Å; W208-F211 AromaticContact CZ3-CD1 3.74Å; W208-F211 HydrophobicContact CZ3-CD1 3.74Å; W208-F211 AromaticContact CZ3-CE1 3.99Å; W208-F211 HydrophobicContact CZ3-CE1 3.99Å; W208-F211 PolarHBondContact O-N 3.38Å; V209-F211 PolarHBondContact O-N 3.47Å; F211-Y215 AromaticContact CD2-CD1 3.88Å; F211-Y215 HydrophobicContact CD2-CD1 3.88Å; F211-Y215 AromaticContact CE2-CD1 3.56Å; F211-Y215 HydrophobicContact CE2-CD1 3.56Å; F211-Y215 HydrophobicContact CE2-CE1 4.06Å; F211-Y215 CarbonylContact O-C 3.57Å; F211-Y215 WeakPolarHBondContact O-CA 3.26Å; F211-Y215 VanDerWaalsContact O-CB 3.31Å; F211-Y215 WeakPolarHBondContact O-CB 3.5Å; F211-Y215 PolarHBondContact O-N 2.82Å; F211-L216 HydrophobicContact CE1-CB 4.3Å; F211-L216 HydrophobicContact CE1-CD2 4.07Å; F211-L216 HydrophobicContact CZ-CB 4.34Å; F211-L216 HydrophobicContact CZ-CD2 4.49Å; F211-L216 PolarHBondContact O-N 3Å; F211-H263 HydrophobicContact CD2-CB 3.88Å; F211-H263 HydrophobicContact CE2-CB 4.41Å; F211-I267 HydrophobicContact CB-CD1 4.22Å; F211-I267 HydrophobicContact CD1-CD1 3.99Å; F211-I267 HydrophobicContact CD2-CD1 3.64Å; F211-I267 HydrophobicContact CE1-CD1 4.22Å; F211-I267 HydrophobicContact CE2-CD1 3.86Å; F211-I267 HydrophobicContact CG-CD1 3.68Å; F211-I267 HydrophobicContact CZ-CD1 4.15Å |
| 212 | I | 96.5 | Very high | 93.1 | Very high | 80 Ų | 80 | 47.7 Ų | 47.7 | 41% | 0.41 | 23% | 0.234 | S | C | . | . | I | π-helix | trans | -67 | -50.8 | -174.7 | -66.7 | 169.2 | 0 | 0 | 0 | 110.1 | W208 L216 F217 | W208-I212 HydrophobicContact CE3-CD1 4.45Å; W208-I212 WeakPolarHBondContact O-CB 3.48Å; W208-I212 VanDerWaalsContact O-CG1 3.28Å; W208-I212 WeakPolarHBondContact O-CG1 3.37Å; W208-I212 PolarHBondContact O-N 3.47Å; I212-L216 PolarHBondContact O-N 2.85Å; I212-F217 VanDerWaalsContact O-CB 3.3Å; I212-F217 WeakPolarHBondContact O-CB 3.28Å; I212-F217 PolarHBondContact O-N 3.36Å |
| 213 | V | 96.2 | Very high | 93.4 | Very high | 41 Ų | 41 | 47.1 Ų | 47.1 | 25% | 0.248 | 24% | 0.238 | C | C | . | . | I | π-helix | trans | -86.4 | -36.4 | -172 | -175.7 | 0 | 0 | 0 | 0 | 112.2 | F122 F126 I168 V209 P218 | F122-V213 HydrophobicContact CE1-CB 4.39Å; F122-V213 HydrophobicContact CE1-CG1 4.44Å; F126-V213 HydrophobicContact CE1-CG1 3.91Å; F126-V213 HydrophobicContact CZ-CG1 3.64Å; I168-V213 HydrophobicContact CD1-CG1 3.79Å; V209-V213 HydrophobicContact CG1-CG2 4.39Å; V209-V213 VanDerWaalsContact O-CB 3.29Å; V209-V213 WeakPolarHBondContact O-CB 3.28Å; V209-V213 PolarHBondContact O-N 3.11Å; V213-P218 VanDerWaalsContact O-CD 3.26Å; V213-P218 WeakPolarHBondContact O-CD 3.32Å; V213-P218 WeakPolarHBondContact O-CG 3.38Å |
| 214 | G | 93 | Very high | 93.9 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -85.3 | -12.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | K210 | K210-G214 CarbonylContact O-C 3.6Å; K210-G214 WeakPolarHBondContact O-CA 3.34Å; K210-G214 PolarHBondContact O-N 2.91Å |
| 215 | Y | 95 | Very high | 94 | Very high | 20 Ų | 20 | 47.3 Ų | 47.3 | 8% | 0.078 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -139.2 | -61.2 | -176.8 | -179.5 | -99.9 | 0 | 0 | 0 | 115 | F211 P218 L219 F255 W259 T260 H263 | F211-Y215 AromaticContact CD2-CD1 3.88Å; F211-Y215 HydrophobicContact CD2-CD1 3.88Å; F211-Y215 AromaticContact CE2-CD1 3.56Å; F211-Y215 HydrophobicContact CE2-CD1 3.56Å; F211-Y215 HydrophobicContact CE2-CE1 4.06Å; F211-Y215 CarbonylContact O-C 3.57Å; F211-Y215 WeakPolarHBondContact O-CA 3.26Å; F211-Y215 VanDerWaalsContact O-CB 3.31Å; F211-Y215 WeakPolarHBondContact O-CB 3.5Å; F211-Y215 PolarHBondContact O-N 2.82Å; Y215-P218 WeakPolarHBondContact O-CD 3.5Å; Y215-L219 HydrophobicContact CE1-CD2 4Å; Y215-L219 HydrophobicContact CE2-CD2 4.39Å; Y215-L219 WeakPolarHBondContact O-CB 3.21Å; Y215-L219 PolarHBondContact O-N 3.46Å; Y215-F255 AromaticContact CD2-CE1 3.86Å; Y215-F255 HydrophobicContact CD2-CE1 3.86Å; Y215-F255 AromaticContact CD2-CZ 3.62Å; Y215-F255 HydrophobicContact CD2-CZ 3.62Å; Y215-F255 HydrophobicContact CE2-CE1 4.04Å; Y215-F255 HydrophobicContact CE2-CZ 4.22Å; Y215-W259 HydrophobicContact CD2-CB 3.91Å; Y215-W259 HydrophobicContact CE2-CB 4.12Å; Y215-T260 PolarHBondContact OH-OG1 3.47Å; Y215-H263 WeakPolarHBondContact CB-CD2 3.34Å; Y215-H263 WeakPolarHBondContact CB-NE2 3.5Å; Y215-H263 AromaticContact CD2-CD2 3.65Å; Y215-H263 AromaticContact CG-CD2 3.5Å; Y215-H263 VanDerWaalsContact CG-CD2 3.5Å |
| 216 | L | 96.4 | Very high | 93.8 | Very high | 64 Ų | 64 | 44 Ų | 44 | 34% | 0.335 | 22% | 0.221 | S | C | . | . | I | π-helix | trans | -65.4 | -52.9 | -170.9 | -177.2 | 62.3 | 0 | 0 | 0 | 112.9 | F211 I212 L219 L220 | F211-L216 HydrophobicContact CE1-CB 4.3Å; F211-L216 HydrophobicContact CE1-CD2 4.07Å; F211-L216 HydrophobicContact CZ-CB 4.34Å; F211-L216 HydrophobicContact CZ-CD2 4.49Å; F211-L216 PolarHBondContact O-N 3Å; I212-L216 PolarHBondContact O-N 2.85Å; L216-L219 PolarHBondContact O-N 3.5Å; L216-L220 HydrophobicContact CD1-CD1 4.01Å; L216-L220 HydrophobicContact CD1-CG 4.12Å; L216-L220 HydrophobicContact CG-CD1 4.01Å; L216-L220 HydrophobicContact CG-CG 4.47Å; L216-L220 WeakPolarHBondContact O-CB 3.26Å; L216-L220 VanDerWaalsContact O-CG 3.27Å; L216-L220 WeakPolarHBondContact O-CG 3.31Å; L216-L220 PolarHBondContact O-N 3.22Å |
| 217 | F | 95.9 | Very high | 93.7 | Very high | 118 Ų | 118 | 46.7 Ų | 46.7 | 52% | 0.518 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -60 | -47.9 | 179.2 | 166.6 | -93.7 | 0 | 0 | 0 | 112.5 | I212 T221 | I212-F217 VanDerWaalsContact O-CB 3.3Å; I212-F217 WeakPolarHBondContact O-CB 3.28Å; I212-F217 PolarHBondContact O-N 3.36Å; F217-T221 WeakPolarHBondContact O-CB 3.46Å; F217-T221 PolarHBondContact O-N 2.88Å; F217-T221 PolarHBondContact O-OG1 3.42Å |
| 218 | P | 95.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -57.2 | -48.4 | 172.4 | -29.9 | 38.9 | 0 | 0 | 0 | 113.4 | V125 T129 V213 Y215 L220 T221 M222 | V125-P218 HydrophobicContact CG1-CB 3.17Å; V125-P218 HydrophobicContact CG1-CG 3.24Å; T129-P218 WeakPolarHBondContact OG1-CB 3.48Å; V213-P218 VanDerWaalsContact O-CD 3.26Å; V213-P218 WeakPolarHBondContact O-CD 3.32Å; V213-P218 WeakPolarHBondContact O-CG 3.38Å; Y215-P218 WeakPolarHBondContact O-CD 3.5Å; P218-L220 PolarHBondContact O-N 3.31Å; P218-T221 PolarHBondContact O-N 3.01Å; P218-M222 HydrophobicContact CB-CE 4.13Å; P218-M222 WeakPolarHBondContact O-CB 3.24Å; P218-M222 WeakPolarHBondContact O-CE 3.23Å; P218-M222 VanDerWaalsContact O-CG 3.28Å; P218-M222 WeakPolarHBondContact O-CG 3.01Å; P218-M222 PolarHBondContact O-N 3.33Å |
| 219 | L | 95.1 | Very high | 93.3 | Very high | 29 Ų | 29 | 42.7 Ų | 42.7 | 15% | 0.152 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.5 | -46.3 | -178.8 | 179.2 | 59.5 | 0 | 0 | 0 | 111.7 | Y215 L216 M222 S223 F255 V256 | Y215-L219 HydrophobicContact CE1-CD2 4Å; Y215-L219 HydrophobicContact CE2-CD2 4.39Å; Y215-L219 WeakPolarHBondContact O-CB 3.21Å; Y215-L219 PolarHBondContact O-N 3.46Å; L216-L219 PolarHBondContact O-N 3.5Å; L219-M222 PolarHBondContact O-N 3.44Å; L219-S223 WeakPolarHBondContact O-CB 3.44Å; L219-S223 PolarHBondContact O-N 2.96Å; L219-S223 PolarHBondContact O-OG 2.99Å; L219-F255 HydrophobicContact CB-CE1 4.39Å; L219-V256 HydrophobicContact CD1-CG2 3.4Å; L219-V256 VanDerWaalsContact CD1-CG2 3.4Å |
| 220 | L | 95.7 | Very high | 92.9 | Very high | 93 Ų | 93 | 43.1 Ų | 43.1 | 49% | 0.487 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.6 | -45.7 | 177 | -71.5 | 175 | 0 | 0 | 0 | 110.9 | L216 P218 S223 I224 | L216-L220 HydrophobicContact CD1-CD1 4.01Å; L216-L220 HydrophobicContact CD1-CG 4.12Å; L216-L220 HydrophobicContact CG-CD1 4.01Å; L216-L220 HydrophobicContact CG-CG 4.47Å; L216-L220 WeakPolarHBondContact O-CB 3.26Å; L216-L220 VanDerWaalsContact O-CG 3.27Å; L216-L220 WeakPolarHBondContact O-CG 3.31Å; L216-L220 PolarHBondContact O-N 3.22Å; P218-L220 PolarHBondContact O-N 3.31Å; L220-S223 PolarHBondContact O-N 3.36Å; L220-I224 WeakPolarHBondContact O-CB 3.39Å; L220-I224 WeakPolarHBondContact O-CD1 3.27Å; L220-I224 WeakPolarHBondContact O-CG1 3.49Å; L220-I224 PolarHBondContact O-N 3.45Å |
| 221 | T | 95.3 | Very high | 92.5 | Very high | 27 Ų | 27 | 47.6 Ų | 47.6 | 17% | 0.166 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.8 | -49.6 | 179.4 | -60.1 | 0 | 0 | 0 | 0 | 111.4 | T129 L133 F217 P218 I224 C225 | T129-T221 HydrophobicContact CG2-CG2 3.58Å; L133-T221 HydrophobicContact CD1-CG2 3.95Å; L133-T221 HydrophobicContact CD2-CG2 3.99Å; L133-T221 HydrophobicContact CG-CG2 4Å; F217-T221 WeakPolarHBondContact O-CB 3.46Å; F217-T221 PolarHBondContact O-N 2.88Å; F217-T221 PolarHBondContact O-OG1 3.42Å; P218-T221 PolarHBondContact O-N 3.01Å; T221-I224 PolarHBondContact O-N 3.34Å; T221-C225 WeakPolarHBondContact O-CB 3.42Å; T221-C225 PolarHBondContact O-N 3.21Å; T221-C225 PolarHBondContact O-SG 2.87Å |
| 222 | M | 93.7 | Very high | 91.9 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.1 | -50.4 | 176.7 | -67.4 | -175.1 | -73 | 0 | 0 | 110.5 | L128 P218 L219 I224 C225 Y226 V252 F255 | L128-M222 HydrophobicContact CB-SD 4.12Å; P218-M222 HydrophobicContact CB-CE 4.13Å; P218-M222 WeakPolarHBondContact O-CB 3.24Å; P218-M222 WeakPolarHBondContact O-CE 3.23Å; P218-M222 VanDerWaalsContact O-CG 3.28Å; P218-M222 WeakPolarHBondContact O-CG 3.01Å; P218-M222 PolarHBondContact O-N 3.33Å; L219-M222 PolarHBondContact O-N 3.44Å; M222-I224 PolarHBondContact O-N 2.96Å; M222-C225 WeakPolarHBondContact O-CB 3.43Å; M222-C225 PolarHBondContact O-N 3.45Å; M222-C225 VanDerWaalsContact O-N 3.14Å; M222-Y226 WeakPolarHBondContact O-CD2 3.44Å; M222-Y226 PolarHBondContact O-N 3.03Å; M222-V252 HydrophobicContact CB-CG1 4.38Å; M222-V252 HydrophobicContact CB-CG2 4.23Å; M222-V252 HydrophobicContact CG-CG2 4.49Å; M222-V252 HydrophobicContact SD-CG2 3.89Å; M222-F255 HydrophobicContact CE-CD1 3.62Å; M222-F255 HydrophobicContact CE-CE1 3.71Å; M222-F255 HydrophobicContact CE-CG 4.32Å |
| 223 | S | 92.1 | Very high | 91.2 | Very high | 44 Ų | 44 | 49.3 Ų | 49.3 | 31% | 0.308 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -57.9 | -47.1 | -179.7 | -59.3 | 0 | 0 | 0 | 0 | 112.2 | L219 L220 C225 Y226 L227 | L219-S223 WeakPolarHBondContact O-CB 3.44Å; L219-S223 PolarHBondContact O-N 2.96Å; L219-S223 PolarHBondContact O-OG 2.99Å; L220-S223 PolarHBondContact O-N 3.36Å; S223-C225 VanDerWaalsContact C-N 3.34Å; S223-C225 PolarHBondContact O-N 3.18Å; S223-Y226 PolarHBondContact O-N 3.14Å; S223-L227 WeakPolarHBondContact O-CB 3.39Å; S223-L227 VanDerWaalsContact O-CG 3.25Å; S223-L227 WeakPolarHBondContact O-CG 3.44Å; S223-L227 PolarHBondContact O-N 3.48Å |
| 224 | I | 92.9 | Very high | 90.2 | Very high | 98 Ų | 98 | 57.9 Ų | 57.9 | 50% | 0.503 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.2 | -43.1 | 177.3 | -69.5 | 165.9 | 0 | 0 | 0 | 110.9 | L220 T221 M222 Y226 L227 C228 | L220-I224 WeakPolarHBondContact O-CB 3.39Å; L220-I224 WeakPolarHBondContact O-CD1 3.27Å; L220-I224 WeakPolarHBondContact O-CG1 3.49Å; L220-I224 PolarHBondContact O-N 3.45Å; T221-I224 PolarHBondContact O-N 3.34Å; M222-I224 PolarHBondContact O-N 2.96Å; I224-Y226 VanDerWaalsContact C-N 3.33Å; I224-Y226 PolarHBondContact O-N 3.37Å; I224-L227 PolarHBondContact O-N 3.06Å; I224-C228 VanDerWaalsContact O-CB 3.23Å; I224-C228 WeakPolarHBondContact O-CB 3.39Å; I224-C228 PolarHBondContact O-N 3.46Å; I224-C228 PolarHBondContact O-SG 3.36Å |
| 225 | C | 91.3 | Very high | 89.4 | Confident | 8 Ų | 8 | 63.9 Ų | 63.9 | 5% | 0.054 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -58.3 | -45.5 | 176.2 | -69.9 | 0 | 0 | 0 | 0 | 111.6 | L133 Y136 T221 M222 S223 C228 L229 | L133-C225 WeakPolarHBondContact CD2-SG 3.35Å; Y136-C225 HydrophobicContact CG-CB 4.43Å; T221-C225 WeakPolarHBondContact O-CB 3.42Å; T221-C225 PolarHBondContact O-N 3.21Å; T221-C225 PolarHBondContact O-SG 2.87Å; M222-C225 WeakPolarHBondContact O-CB 3.43Å; M222-C225 PolarHBondContact O-N 3.45Å; M222-C225 VanDerWaalsContact O-N 3.14Å; S223-C225 VanDerWaalsContact C-N 3.34Å; S223-C225 PolarHBondContact O-N 3.18Å; C225-C228 PolarHBondContact O-N 3.36Å; C225-L229 WeakPolarHBondContact O-CG 3.24Å; C225-L229 PolarHBondContact O-N 3.48Å |
| 226 | Y | 87.1 | Confident | 88.4 | Confident | 10 Ų | 10 | 68.9 Ų | 68.9 | 4% | 0.039 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -69.1 | -44.4 | -179.9 | -84.9 | -74.8 | 0 | 0 | 0 | 113.3 | M222 S223 I224 C228 L229 I230 F245 I248 L249 V252 | M222-Y226 WeakPolarHBondContact O-CD2 3.44Å; M222-Y226 PolarHBondContact O-N 3.03Å; S223-Y226 PolarHBondContact O-N 3.14Å; I224-Y226 VanDerWaalsContact C-N 3.33Å; I224-Y226 PolarHBondContact O-N 3.37Å; Y226-C228 VanDerWaalsContact C-N 3.31Å; Y226-C228 PolarHBondContact O-N 3.18Å; Y226-L229 HydrophobicContact CD1-CD1 4.35Å; Y226-L229 HydrophobicContact CE1-CD1 4.31Å; Y226-L229 WeakPolarHBondContact O-CB 3.23Å; Y226-L229 PolarHBondContact O-N 3.42Å; Y226-I230 VanDerWaalsContact O-CG1 3.3Å; Y226-I230 WeakPolarHBondContact O-CG1 3.27Å; Y226-I230 PolarHBondContact O-N 3.42Å; Y226-F245 HydrophobicContact CD1-CD2 4.28Å; Y226-F245 AromaticContact CD1-CE2 3.67Å; Y226-F245 HydrophobicContact CD1-CE2 3.67Å; Y226-F245 HydrophobicContact CD1-CZ 4.28Å; Y226-F245 HydrophobicContact CE1-CD2 4.01Å; Y226-F245 AromaticContact CE1-CE2 3.86Å; Y226-F245 HydrophobicContact CE1-CE2 3.86Å; Y226-I248 HydrophobicContact CE2-CG2 4.3Å; Y226-I248 WeakPolarHBondContact OH-CB 3.43Å; Y226-I248 WeakPolarHBondContact OH-CG2 3.5Å; Y226-L249 HydrophobicContact CD1-CD1 4.41Å; Y226-L249 HydrophobicContact CE1-CB 4.39Å; Y226-V252 HydrophobicContact CD2-CG2 4.26Å; Y226-V252 HydrophobicContact CE2-CG2 3.76Å |
| 227 | L | 88.8 | Confident | 87.3 | Confident | 92 Ų | 92 | 69.4 Ų | 69.4 | 48% | 0.482 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -58.3 | -48 | 173.6 | -68.7 | 172.3 | 0 | 0 | 0 | 109.8 | S223 I224 L229 I230 F231 | S223-L227 WeakPolarHBondContact O-CB 3.39Å; S223-L227 VanDerWaalsContact O-CG 3.25Å; S223-L227 WeakPolarHBondContact O-CG 3.44Å; S223-L227 PolarHBondContact O-N 3.48Å; I224-L227 PolarHBondContact O-N 3.06Å; L227-L229 VanDerWaalsContact C-N 3.32Å; L227-L229 PolarHBondContact O-N 3.17Å; L227-I230 PolarHBondContact O-N 2.97Å; L227-I230 VanDerWaalsContact O-N 3.17Å; L227-F231 HydrophobicContact CB-CD2 4.38Å; L227-F231 HydrophobicContact CB-CE2 4.33Å; L227-F231 HydrophobicContact CD2-CE2 4.3Å; L227-F231 WeakPolarHBondContact O-CD2 3.47Å; L227-F231 PolarHBondContact O-N 3.02Å |
| 228 | C | 89.3 | Confident | 86.3 | Confident | 36 Ų | 36 | 68.8 Ų | 68.8 | 24% | 0.243 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.4 | -39 | 176.8 | -72.7 | 0 | 0 | 0 | 0 | 112.6 | Y136 I224 C225 Y226 F231 K232 | Y136-C228 HydrophobicContact CD2-CB 4.22Å; Y136-C228 HydrophobicContact CE2-CB 3.6Å; I224-C228 VanDerWaalsContact O-CB 3.23Å; I224-C228 WeakPolarHBondContact O-CB 3.39Å; I224-C228 PolarHBondContact O-N 3.46Å; I224-C228 PolarHBondContact O-SG 3.36Å; C225-C228 PolarHBondContact O-N 3.36Å; Y226-C228 VanDerWaalsContact C-N 3.31Å; Y226-C228 PolarHBondContact O-N 3.18Å; C228-F231 PolarHBondContact O-N 2.91Å; C228-K232 VanDerWaalsContact O-CB 3.24Å; C228-K232 WeakPolarHBondContact O-CB 3.33Å; C228-K232 PolarHBondContact O-N 3.39Å |
| 229 | L | 86.9 | Confident | 85.4 | Confident | 0 Ų | 0 | 69.2 Ų | 69.2 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.5 | -47.9 | 173.7 | -79 | 173.8 | 0 | 0 | 0 | 111.6 | Y136 L139 I140 C225 Y226 L227 F231 V233 L239 | Y136-L229 HydrophobicContact CD2-CD2 4.16Å; Y136-L229 HydrophobicContact CD2-CG 4.08Å; L139-L229 HydrophobicContact CB-CD2 3.95Å; L139-L229 HydrophobicContact CD1-CD2 3.84Å; I140-L229 HydrophobicContact CD1-CD2 4.07Å; I140-L229 HydrophobicContact CG1-CD2 3.84Å; C225-L229 WeakPolarHBondContact O-CG 3.24Å; C225-L229 PolarHBondContact O-N 3.48Å; Y226-L229 HydrophobicContact CD1-CD1 4.35Å; Y226-L229 HydrophobicContact CE1-CD1 4.31Å; Y226-L229 WeakPolarHBondContact O-CB 3.23Å; Y226-L229 PolarHBondContact O-N 3.42Å; L227-L229 VanDerWaalsContact C-N 3.32Å; L227-L229 PolarHBondContact O-N 3.17Å; L229-F231 VanDerWaalsContact C-N 3.31Å; L229-F231 PolarHBondContact O-N 3.33Å; L229-V233 HydrophobicContact CD2-CG2 4.38Å; L229-V233 WeakPolarHBondContact O-CB 3.39Å; L229-V233 WeakPolarHBondContact O-CG2 3.09Å; L229-V233 PolarHBondContact O-N 3.5Å; L229-V233 VanDerWaalsContact O-N 3.16Å; L229-L239 HydrophobicContact CB-CD2 4.18Å |
| 230 | I | 85.3 | Confident | 84.4 | Confident | 64 Ų | 64 | 72.1 Ų | 72.1 | 33% | 0.328 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.2 | -38.2 | -179.2 | -67.5 | 164.5 | 0 | 0 | 0 | 111.3 | Y226 L227 R236 F245 | Y226-I230 VanDerWaalsContact O-CG1 3.3Å; Y226-I230 WeakPolarHBondContact O-CG1 3.27Å; Y226-I230 PolarHBondContact O-N 3.42Å; L227-I230 PolarHBondContact O-N 2.97Å; L227-I230 VanDerWaalsContact O-N 3.17Å; I230-R236 PolarHBondContact O-NE 3.44Å; I230-F245 HydrophobicContact CD1-CZ 4.33Å; I230-F245 HydrophobicContact CG1-CE2 4.39Å; I230-F245 HydrophobicContact CG1-CZ 4.09Å |
| 231 | F | 84.9 | Confident | 83.3 | Confident | 142 Ų | 142 | 72.5 Ų | 72.5 | 62% | 0.623 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -83.4 | -39.2 | -178.5 | -69.8 | -63.6 | 0 | 0 | 0 | 114.1 | L227 C228 L229 | L227-F231 HydrophobicContact CB-CD2 4.38Å; L227-F231 HydrophobicContact CB-CE2 4.33Å; L227-F231 HydrophobicContact CD2-CE2 4.3Å; L227-F231 WeakPolarHBondContact O-CD2 3.47Å; L227-F231 PolarHBondContact O-N 3.02Å; C228-F231 PolarHBondContact O-N 2.91Å; L229-F231 VanDerWaalsContact C-N 3.31Å; L229-F231 PolarHBondContact O-N 3.33Å |
| 232 | K | 83.5 | Confident | 82.5 | Confident | 120 Ų | 120 | 73.1 Ų | 73.1 | 52% | 0.522 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -88.7 | -22 | -173.5 | -71.8 | -171.3 | 171.9 | 175.7 | 0 | 114.8 | I140 C228 K234 | I140-K232 HydrophobicContact CD1-CB 3.86Å; I140-K232 HydrophobicContact CG2-CD 4.04Å; C228-K232 VanDerWaalsContact O-CB 3.24Å; C228-K232 WeakPolarHBondContact O-CB 3.33Å; C228-K232 PolarHBondContact O-N 3.39Å; K232-K234 PolarHBondContact O-N 2.93Å |
| 233 | V | 81.5 | Confident | 81.6 | Confident | 29 Ų | 29 | 77 Ų | 77 | 18% | 0.176 | 39% | 0.387 | C | S | . | . | trans | -72 | 105.4 | 178.8 | 177 | 0 | 0 | 0 | 0 | 109.7 | I140 L229 K235 L239 | I140-V233 HydrophobicContact CD1-CG2 3.71Å; L229-V233 HydrophobicContact CD2-CG2 4.38Å; L229-V233 WeakPolarHBondContact O-CB 3.39Å; L229-V233 WeakPolarHBondContact O-CG2 3.09Å; L229-V233 PolarHBondContact O-N 3.5Å; L229-V233 VanDerWaalsContact O-N 3.16Å; V233-K235 PolarHBondContact O-N 2.56Å; V233-K235 VanDerWaalsContact O-N 3.09Å; V233-L239 HydrophobicContact CB-CB 4.4Å; V233-L239 HydrophobicContact CB-CD2 4.19Å; V233-L239 HydrophobicContact CG1-CB 4.02Å; V233-L239 HydrophobicContact CG2-CD1 4.39Å; V233-L239 HydrophobicContact CG2-CD2 4.08Å | ||
| 234 | K | 74.8 | Confident | 80.9 | Confident | 221 Ų | 221 | 78.7 Ų | 78.7 | 96% | 0.961 | 39% | 0.39 | S | S | * | . | S | Bend | trans | -50.4 | -36.7 | -176.4 | -70.5 | -173.1 | 177.4 | -176.7 | 0 | 113.7 | K232 | K232-K234 PolarHBondContact O-N 2.93Š|
| 235 | K | 77.6 | Confident | 80.4 | Confident | 126 Ų | 126 | 74.4 Ų | 74.4 | 55% | 0.548 | 37% | 0.368 | S | S | . | . | trans | -113.2 | 82.3 | 178.1 | -167.1 | 163.4 | 168.2 | -176.3 | 0 | 110.3 | V233 S237 I238 | V233-K235 PolarHBondContact O-N 2.56Å; V233-K235 VanDerWaalsContact O-N 3.09Å; K235-S237 PolarHBondContact O-N 3.17Å; K235-S237 VanDerWaalsContact O-N 3.1Å; K235-I238 HydrophobicContact CB-CD1 4.15Å; K235-I238 HydrophobicContact CB-CG1 4.36Å; K235-I238 HydrophobicContact CD-CD1 3.52Å; K235-I238 HydrophobicContact CD-CG1 3.9Å; K235-I238 HydrophobicContact CG-CD1 3.93Å; K235-I238 HydrophobicContact CG-CG1 3.9Å; K235-I238 PolarHBondContact O-N 2.96Å | ||
| 236 | R | 73.9 | Confident | 80.1 | Confident | 125 Ų | 125 | 80 Ų | 80 | 47% | 0.472 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -50.7 | -34.4 | -179.7 | -72.1 | -173.9 | 175.4 | 175.1 | 4.5 | 113.5 | I230 I238 L239 I240 | I230-R236 PolarHBondContact O-NE 3.44Å; R236-I238 VanDerWaalsContact C-N 3.28Å; R236-I238 PolarHBondContact O-N 2.98Å; R236-L239 PolarHBondContact O-N 3.49Å; R236-I240 HydrophobicContact CB-CD1 4.39Å; R236-I240 WeakPolarHBondContact O-CG1 2.94Å; R236-I240 PolarHBondContact O-N 3.22Å |
| 237 | S | 72 | Confident | 79.8 | Confident | 76 Ų | 76 | 80 Ų | 80 | 53% | 0.531 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.6 | -30.6 | 178.2 | 64.6 | 0 | 0 | 0 | 0 | 113.8 | K235 S241 | K235-S237 PolarHBondContact O-N 3.17Å; K235-S237 VanDerWaalsContact O-N 3.1Å; S237-S241 WeakPolarHBondContact O-CB 3.46Å; S237-S241 PolarHBondContact O-N 3.35Å |
| 238 | I | 74.4 | Confident | 79.4 | Confident | 105 Ų | 105 | 75.8 Ų | 75.8 | 54% | 0.538 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -73.3 | -40.8 | 175.4 | -67.2 | 177.1 | 0 | 0 | 0 | 110.7 | K235 R236 S241 S242 | K235-I238 HydrophobicContact CB-CD1 4.15Å; K235-I238 HydrophobicContact CB-CG1 4.36Å; K235-I238 HydrophobicContact CD-CD1 3.52Å; K235-I238 HydrophobicContact CD-CG1 3.9Å; K235-I238 HydrophobicContact CG-CD1 3.93Å; K235-I238 HydrophobicContact CG-CG1 3.9Å; K235-I238 PolarHBondContact O-N 2.96Å; R236-I238 VanDerWaalsContact C-N 3.28Å; R236-I238 PolarHBondContact O-N 2.98Å; I238-S241 PolarHBondContact O-N 2.96Å; I238-S242 PolarHBondContact O-N 3.41Å; I238-S242 VanDerWaalsContact O-N 3.12Å |
| 239 | L | 76.4 | Confident | 79.3 | Confident | 8 Ų | 8 | 76.3 Ų | 76.3 | 4% | 0.042 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -64.6 | -48.9 | 177.5 | -177.2 | 67.2 | 0 | 0 | 0 | 111.5 | L139 L229 V233 R236 S241 S242 F245 | L139-L239 HydrophobicContact CD1-CD1 3.74Å; L229-L239 HydrophobicContact CB-CD2 4.18Å; V233-L239 HydrophobicContact CB-CB 4.4Å; V233-L239 HydrophobicContact CB-CD2 4.19Å; V233-L239 HydrophobicContact CG1-CB 4.02Å; V233-L239 HydrophobicContact CG2-CD1 4.39Å; V233-L239 HydrophobicContact CG2-CD2 4.08Å; R236-L239 PolarHBondContact O-N 3.49Å; L239-S241 VanDerWaalsContact C-N 3.27Å; L239-S241 PolarHBondContact O-N 3.47Å; L239-S242 WeakPolarHBondContact O-CA 3.15Å; L239-S242 WeakPolarHBondContact O-CB 3.39Å; L239-S242 PolarHBondContact O-N 3.28Å; L239-F245 HydrophobicContact CD1-CB 4.25Å; L239-F245 HydrophobicContact CD1-CD2 3.71Å; L239-F245 HydrophobicContact CD1-CE2 4.36Å; L239-F245 HydrophobicContact CD1-CG 4.15Å; L239-F245 HydrophobicContact CD2-CD2 4.15Å; L239-F245 HydrophobicContact CD2-CE2 3.98Å; L239-F245 HydrophobicContact CG-CD2 3.84Å; L239-F245 HydrophobicContact CG-CE2 4.14Å; L239-F245 HydrophobicContact CG-CG 4.15Å |
| 240 | I | 74.5 | Confident | 79.4 | Confident | 90 Ų | 90 | 77.5 Ų | 77.5 | 46% | 0.462 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -70.3 | -27 | -177.9 | -62.9 | 168.5 | 0 | 0 | 0 | 111.2 | R236 S242 W246 | R236-I240 HydrophobicContact CB-CD1 4.39Å; R236-I240 WeakPolarHBondContact O-CG1 2.94Å; R236-I240 PolarHBondContact O-N 3.22Å; I240-S242 VanDerWaalsContact C-N 3.27Å; I240-W246 HydrophobicContact CG2-CZ2 4.06Å; I240-W246 PolarHBondContact O-NE1 3.43Å |
| 241 | S | 73.8 | Confident | 79.5 | Confident | 102 Ų | 102 | 74.7 Ų | 74.7 | 71% | 0.713 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -73.5 | -19.5 | 169.9 | -174.2 | 0 | 0 | 0 | 0 | 112.5 | S237 I238 L239 R243 | S237-S241 WeakPolarHBondContact O-CB 3.46Å; S237-S241 PolarHBondContact O-N 3.35Å; I238-S241 PolarHBondContact O-N 2.96Å; L239-S241 VanDerWaalsContact C-N 3.27Å; L239-S241 PolarHBondContact O-N 3.47Å; S241-R243 PolarHBondContact O-N 3.43Å; S241-R243 VanDerWaalsContact O-N 3.13Å |
| 242 | S | 77.3 | Confident | 79.6 | Confident | 40 Ų | 40 | 68.5 Ų | 68.5 | 28% | 0.28 | 34% | 0.337 | S | S | . | . | trans | -70.6 | 111.1 | 178.3 | -176 | 0 | 0 | 0 | 0 | 111 | I238 L239 I240 H244 F245 W246 | I238-S242 PolarHBondContact O-N 3.41Å; I238-S242 VanDerWaalsContact O-N 3.12Å; L239-S242 WeakPolarHBondContact O-CA 3.15Å; L239-S242 WeakPolarHBondContact O-CB 3.39Å; L239-S242 PolarHBondContact O-N 3.28Å; I240-S242 VanDerWaalsContact C-N 3.27Å; S242-H244 PolarHBondContact O-N 2.8Å; S242-F245 VanDerWaalsContact O-CB 3.31Å; S242-F245 WeakPolarHBondContact O-CB 3.45Å; S242-F245 PolarHBondContact O-N 3.07Å; S242-W246 PolarHBondContact O-N 3.01Å | ||
| 243 | R | 75.1 | Confident | 80 | Confident | 82 Ų | 82 | 66.7 Ų | 66.7 | 31% | 0.309 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.1 | -29.1 | 175.8 | -146.2 | -180 | 162.3 | 166 | -26.7 | 112.8 | S241 F245 W246 T247 L306 I307 K309 | S241-R243 PolarHBondContact O-N 3.43Å; S241-R243 VanDerWaalsContact O-N 3.13Å; R243-F245 VanDerWaalsContact C-N 3.31Å; R243-F245 PolarHBondContact O-N 3.2Å; R243-W246 PolarHBondContact O-N 2.88Å; R243-T247 PolarHBondContact O-N 2.97Å; R243-T247 PolarHBondContact O-OG1 3.24Å; R243-L306 PolarHBondContact NH2-O 3.3Å; R243-I307 WeakPolarHBondContact CD-O 3.28Å; R243-I307 HydrophobicContact CG-CG2 4.22Å; R243-I307 WeakPolarHBondContact CG-O 3.25Å; R243-I307 PolarHBondContact NE-O 3.25Å; R243-K309 VanDerWaalsContact CZ-N 3.28Å |
| 244 | H | 77.3 | Confident | 80.5 | Confident | 78 Ų | 78 | 65.9 Ų | 65.9 | 36% | 0.361 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64 | -34.9 | 175.4 | -166.1 | -95.3 | 0 | 0 | 0 | 112.3 | H135 S242 I248 | H135-H244 AromaticContact CD2-ND1 3.85Å; H135-H244 AromaticContact CE1-ND1 3.24Å; H135-H244 PolarHBondContact CE1-ND1 2.93Å; H135-H244 AromaticContact CG-ND1 3.91Å; H135-H244 AromaticContact ND1-ND1 3.56Å; H135-H244 AromaticContact NE2-ND1 3.4Å; H135-H244 PolarHBondContact NE2-ND1 3.03Å; S242-H244 PolarHBondContact O-N 2.8Å; H244-I248 WeakPolarHBondContact CE1-CD1 3.07Å; H244-I248 WeakPolarHBondContact ND1-CD1 3.36Å; H244-I248 PolarHBondContact O-N 3.03Å |
| 245 | F | 82.9 | Confident | 81.3 | Confident | 8 Ų | 8 | 55.4 Ų | 55.4 | 4% | 0.035 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.8 | -49.8 | 172.4 | 173.7 | -94.4 | 0 | 0 | 0 | 110.9 | Y226 I230 L239 S242 R243 T247 I248 L249 | Y226-F245 HydrophobicContact CD1-CD2 4.28Å; Y226-F245 AromaticContact CD1-CE2 3.67Å; Y226-F245 HydrophobicContact CD1-CE2 3.67Å; Y226-F245 HydrophobicContact CD1-CZ 4.28Å; Y226-F245 HydrophobicContact CE1-CD2 4.01Å; Y226-F245 AromaticContact CE1-CE2 3.86Å; Y226-F245 HydrophobicContact CE1-CE2 3.86Å; I230-F245 HydrophobicContact CD1-CZ 4.33Å; I230-F245 HydrophobicContact CG1-CE2 4.39Å; I230-F245 HydrophobicContact CG1-CZ 4.09Å; L239-F245 HydrophobicContact CD1-CB 4.25Å; L239-F245 HydrophobicContact CD1-CD2 3.71Å; L239-F245 HydrophobicContact CD1-CE2 4.36Å; L239-F245 HydrophobicContact CD1-CG 4.15Å; L239-F245 HydrophobicContact CD2-CD2 4.15Å; L239-F245 HydrophobicContact CD2-CE2 3.98Å; L239-F245 HydrophobicContact CG-CD2 3.84Å; L239-F245 HydrophobicContact CG-CE2 4.14Å; L239-F245 HydrophobicContact CG-CG 4.15Å; S242-F245 VanDerWaalsContact O-CB 3.31Å; S242-F245 WeakPolarHBondContact O-CB 3.45Å; S242-F245 PolarHBondContact O-N 3.07Å; R243-F245 VanDerWaalsContact C-N 3.31Å; R243-F245 PolarHBondContact O-N 3.2Å; F245-T247 PolarHBondContact O-N 3.14Å; F245-I248 PolarHBondContact O-N 3.22Å; F245-L249 HydrophobicContact CE1-CD2 4.02Å; F245-L249 HydrophobicContact CZ-CD2 4.38Å; F245-L249 VanDerWaalsContact O-CB 3.29Å; F245-L249 WeakPolarHBondContact O-CB 3.42Å; F245-L249 PolarHBondContact O-N 2.98Å |
| 246 | W | 84.1 | Confident | 82.1 | Confident | 125 Ų | 125 | 51.6 Ų | 51.6 | 47% | 0.473 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -64.1 | -37.6 | 177.5 | -72.4 | 105 | 0 | 0 | 0 | 113.6 | I240 S242 R243 L249 A250 I307 | I240-W246 HydrophobicContact CG2-CZ2 4.06Å; I240-W246 PolarHBondContact O-NE1 3.43Å; S242-W246 PolarHBondContact O-N 3.01Å; R243-W246 PolarHBondContact O-N 2.88Å; W246-L249 HydrophobicContact CE3-CD2 3.96Å; W246-L249 HydrophobicContact CZ3-CD2 3.88Å; W246-A250 VanDerWaalsContact O-CB 3.24Å; W246-A250 WeakPolarHBondContact O-CB 3.4Å; W246-A250 PolarHBondContact O-N 3.43Å; W246-I307 HydrophobicContact CB-CG2 4.09Å |
| 247 | T | 81.8 | Confident | 83.1 | Confident | 10 Ų | 10 | 49.9 Ų | 49.9 | 6% | 0.061 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.3 | -52.3 | 176.3 | -54.1 | 0 | 0 | 0 | 0 | 110.7 | R243 F245 A250 V251 Y304 I307 | R243-T247 PolarHBondContact O-N 2.97Å; R243-T247 PolarHBondContact O-OG1 3.24Å; F245-T247 PolarHBondContact O-N 3.14Å; T247-A250 PolarHBondContact O-N 3.36Å; T247-V251 VanDerWaalsContact O-CG2 3.27Å; T247-V251 WeakPolarHBondContact O-CG2 3.16Å; T247-V251 PolarHBondContact O-N 3.39Å; T247-Y304 HydrophobicContact CG2-CD1 3.96Å; T247-I307 HydrophobicContact CG2-CB 4.37Å; T247-I307 VanDerWaalsContact OG1-CG2 3.29Å; T247-I307 WeakPolarHBondContact OG1-CG2 3.16Å; T247-I307 PolarHBondContact OG1-O 3.44Å |
| 248 | I | 81.1 | Confident | 84.2 | Confident | 4 Ų | 4 | 46.5 Ų | 46.5 | 2% | 0.021 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -74.4 | -34.2 | -175.7 | -54 | 163 | 0 | 0 | 0 | 110.8 | I131 H135 Y226 H244 F245 A250 V251 V252 | I131-I248 HydrophobicContact CG2-CD1 3.93Å; I131-I248 HydrophobicContact CG2-CG1 4.09Å; I131-I248 HydrophobicContact CG2-CG2 4.08Å; H135-I248 HydrophobicContact CB-CD1 3.99Å; H135-I248 WeakPolarHBondContact ND1-CD1 3.39Å; Y226-I248 HydrophobicContact CE2-CG2 4.3Å; Y226-I248 WeakPolarHBondContact OH-CB 3.43Å; Y226-I248 WeakPolarHBondContact OH-CG2 3.5Å; H244-I248 WeakPolarHBondContact CE1-CD1 3.07Å; H244-I248 WeakPolarHBondContact ND1-CD1 3.36Å; H244-I248 PolarHBondContact O-N 3.03Å; F245-I248 PolarHBondContact O-N 3.22Å; I248-A250 VanDerWaalsContact C-N 3.33Å; I248-A250 PolarHBondContact O-N 2.85Å; I248-V251 PolarHBondContact O-N 3.2Å; I248-V252 WeakPolarHBondContact O-CG2 3.17Å; I248-V252 PolarHBondContact O-N 3.46Å |
| 249 | L | 86.1 | Confident | 85.2 | Confident | 47 Ų | 47 | 42.1 Ų | 42.1 | 25% | 0.246 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -58.5 | -45.2 | 171.2 | -179.3 | 63.6 | 0 | 0 | 0 | 111.5 | Y226 F245 W246 V251 V252 V253 | Y226-L249 HydrophobicContact CD1-CD1 4.41Å; Y226-L249 HydrophobicContact CE1-CB 4.39Å; F245-L249 HydrophobicContact CE1-CD2 4.02Å; F245-L249 HydrophobicContact CZ-CD2 4.38Å; F245-L249 VanDerWaalsContact O-CB 3.29Å; F245-L249 WeakPolarHBondContact O-CB 3.42Å; F245-L249 PolarHBondContact O-N 2.98Å; W246-L249 HydrophobicContact CE3-CD2 3.96Å; W246-L249 HydrophobicContact CZ3-CD2 3.88Å; L249-V251 VanDerWaalsContact C-N 3.29Å; L249-V251 PolarHBondContact O-N 2.89Å; L249-V252 PolarHBondContact O-N 2.86Å; L249-V253 WeakPolarHBondContact O-CG2 3.14Å; L249-V253 PolarHBondContact O-N 3.45Å |
| 250 | A | 88.6 | Confident | 86.1 | Confident | 26 Ų | 26 | 43.4 Ų | 43.4 | 22% | 0.215 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.6 | -37.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | W246 T247 I248 V253 A254 L303 I307 | W246-A250 VanDerWaalsContact O-CB 3.24Å; W246-A250 WeakPolarHBondContact O-CB 3.4Å; W246-A250 PolarHBondContact O-N 3.43Å; T247-A250 PolarHBondContact O-N 3.36Å; I248-A250 VanDerWaalsContact C-N 3.33Å; I248-A250 PolarHBondContact O-N 2.85Å; A250-V253 PolarHBondContact O-N 2.87Å; A250-A254 WeakPolarHBondContact O-CB 3.37Å; A250-A254 PolarHBondContact O-N 2.83Å; A250-L303 HydrophobicContact CB-CD2 4.13Å; A250-I307 HydrophobicContact CB-CD1 3.42Å; A250-I307 VanDerWaalsContact CB-CD1 3.42Å |
| 251 | V | 87.3 | Confident | 87.1 | Confident | 4 Ų | 4 | 40.7 Ų | 40.7 | 2% | 0.024 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.4 | -40.2 | 174.9 | 173.7 | 0 | 0 | 0 | 0 | 111.6 | L128 T247 I248 L249 A254 F255 L303 Y304 | L128-V251 HydrophobicContact CD1-CG1 4.15Å; L128-V251 HydrophobicContact CD2-CG1 3.23Å; L128-V251 HydrophobicContact CG-CG1 4.31Å; T247-V251 VanDerWaalsContact O-CG2 3.27Å; T247-V251 WeakPolarHBondContact O-CG2 3.16Å; T247-V251 PolarHBondContact O-N 3.39Å; I248-V251 PolarHBondContact O-N 3.2Å; L249-V251 VanDerWaalsContact C-N 3.29Å; L249-V251 PolarHBondContact O-N 2.89Å; V251-A254 PolarHBondContact O-N 3.45Å; V251-F255 WeakPolarHBondContact O-CB 3.23Å; V251-F255 PolarHBondContact O-N 3.45Å; V251-L303 HydrophobicContact CB-CD1 4.44Å; V251-L303 HydrophobicContact CG2-CB 4.08Å; V251-L303 HydrophobicContact CG2-CD1 3.81Å; V251-Y304 HydrophobicContact CG2-CE1 3.97Å |
| 252 | V | 87.7 | Confident | 88.1 | Confident | 13 Ų | 13 | 37.6 Ų | 37.6 | 8% | 0.079 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.1 | -41.8 | 174 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | M222 Y226 I248 L249 F255 V256 | M222-V252 HydrophobicContact CB-CG1 4.38Å; M222-V252 HydrophobicContact CB-CG2 4.23Å; M222-V252 HydrophobicContact CG-CG2 4.49Å; M222-V252 HydrophobicContact SD-CG2 3.89Å; Y226-V252 HydrophobicContact CD2-CG2 4.26Å; Y226-V252 HydrophobicContact CE2-CG2 3.76Å; I248-V252 WeakPolarHBondContact O-CG2 3.17Å; I248-V252 PolarHBondContact O-N 3.46Å; L249-V252 PolarHBondContact O-N 2.86Å; V252-F255 WeakPolarHBondContact O-CB 3.45Å; V252-F255 PolarHBondContact O-N 2.78Å; V252-V256 WeakPolarHBondContact O-CG2 3.26Å; V252-V256 PolarHBondContact O-N 3.12Å |
| 253 | V | 91.3 | Very high | 88.9 | Confident | 81 Ų | 81 | 35.9 Ų | 35.9 | 49% | 0.491 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -64.5 | -44.2 | 176.1 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | L249 A250 F255 V256 V257 | L249-V253 WeakPolarHBondContact O-CG2 3.14Å; L249-V253 PolarHBondContact O-N 3.45Å; A250-V253 PolarHBondContact O-N 2.87Å; V253-F255 VanDerWaalsContact C-N 3.31Å; V253-F255 PolarHBondContact O-N 3.49Å; V253-V256 PolarHBondContact O-N 3.19Å; V253-V257 HydrophobicContact CG1-CG2 4.34Å; V253-V257 WeakPolarHBondContact O-CG2 3.26Å; V253-V257 PolarHBondContact O-N 2.74Å |
| 254 | A | 92 | Very high | 89.8 | Confident | 13 Ų | 13 | 37 Ų | 37 | 11% | 0.107 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.8 | -43.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | A250 V251 V256 V257 C258 L299 L303 | A250-A254 WeakPolarHBondContact O-CB 3.37Å; A250-A254 PolarHBondContact O-N 2.83Å; V251-A254 PolarHBondContact O-N 3.45Å; A254-V256 PolarHBondContact O-N 3.28Å; A254-V257 PolarHBondContact O-N 2.87Å; A254-C258 VanDerWaalsContact O-CB 3.26Å; A254-C258 WeakPolarHBondContact O-CB 3.12Å; A254-C258 PolarHBondContact O-N 3.24Å; A254-C258 PolarHBondContact O-SG 3.46Å; A254-L299 HydrophobicContact CB-CD1 4.21Å; A254-L303 HydrophobicContact CB-CD1 3.81Å |
| 255 | F | 91.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -55.8 | -50.1 | 173.8 | 168.9 | -101.3 | 0 | 0 | 0 | 111.8 | V125 L128 Y215 L219 M222 V251 V252 V253 V257 C258 W259 | V125-F255 HydrophobicContact CB-CE2 4.33Å; V125-F255 HydrophobicContact CG1-CE2 4.09Å; V125-F255 HydrophobicContact CG1-CZ 4.04Å; V125-F255 HydrophobicContact CG2-CD2 3.97Å; V125-F255 HydrophobicContact CG2-CE2 3.28Å; V125-F255 HydrophobicContact CG2-CZ 4.01Å; L128-F255 HydrophobicContact CD1-CB 4.28Å; L128-F255 HydrophobicContact CD1-CD2 4.35Å; Y215-F255 AromaticContact CD2-CE1 3.86Å; Y215-F255 HydrophobicContact CD2-CE1 3.86Å; Y215-F255 AromaticContact CD2-CZ 3.62Å; Y215-F255 HydrophobicContact CD2-CZ 3.62Å; Y215-F255 HydrophobicContact CE2-CE1 4.04Å; Y215-F255 HydrophobicContact CE2-CZ 4.22Å; L219-F255 HydrophobicContact CB-CE1 4.39Å; M222-F255 HydrophobicContact CE-CD1 3.62Å; M222-F255 HydrophobicContact CE-CE1 3.71Å; M222-F255 HydrophobicContact CE-CG 4.32Å; V251-F255 WeakPolarHBondContact O-CB 3.23Å; V251-F255 PolarHBondContact O-N 3.45Å; V252-F255 WeakPolarHBondContact O-CB 3.45Å; V252-F255 PolarHBondContact O-N 2.78Å; V253-F255 VanDerWaalsContact C-N 3.31Å; V253-F255 PolarHBondContact O-N 3.49Å; F255-V257 PolarHBondContact O-N 2.03Å; F255-C258 PolarHBondContact O-N 3.15Å; F255-W259 HydrophobicContact CD2-CB 4.39Å; F255-W259 AromaticContact CD2-CD1 3.15Å; F255-W259 AromaticContact CD2-CG 3.88Å; F255-W259 HydrophobicContact CD2-CG 3.88Å; F255-W259 AromaticContact CD2-NE1 3.67Å; F255-W259 HydrophobicContact CE2-CB 3.98Å; F255-W259 AromaticContact CE2-CD1 3.32Å; F255-W259 HydrophobicContact CE2-CD2 4.29Å; F255-W259 AromaticContact CE2-CG 3.58Å; F255-W259 HydrophobicContact CE2-CG 3.58Å; F255-W259 AromaticContact CE2-NE1 3.83Å; F255-W259 HydrophobicContact CZ-CB 4.36Å; F255-W259 HydrophobicContact CZ-CG 4.4Å; F255-W259 WeakPolarHBondContact O-CB 3.25Å; F255-W259 VanDerWaalsContact O-CD1 3.3Å; F255-W259 PolarHBondContact O-N 3.44Å |
| 256 | V | 93.8 | Very high | 90.6 | Very high | 47 Ų | 47 | 35.7 Ų | 35.7 | 29% | 0.285 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -59.4 | -51.3 | 178.2 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | L219 V252 V253 A254 C258 W259 T260 | L219-V256 HydrophobicContact CD1-CG2 3.4Å; L219-V256 VanDerWaalsContact CD1-CG2 3.4Å; V252-V256 WeakPolarHBondContact O-CG2 3.26Å; V252-V256 PolarHBondContact O-N 3.12Å; V253-V256 PolarHBondContact O-N 3.19Å; A254-V256 PolarHBondContact O-N 3.28Å; V256-C258 VanDerWaalsContact C-N 3.3Å; V256-C258 PolarHBondContact O-N 2.91Å; V256-W259 PolarHBondContact O-N 3.37Å; V256-T260 WeakPolarHBondContact CG1-OG1 3.29Å; V256-T260 VanDerWaalsContact O-CB 3.24Å; V256-T260 WeakPolarHBondContact O-CB 3.46Å; V256-T260 PolarHBondContact O-N 3.44Å; V256-T260 PolarHBondContact O-OG1 3.2Å |
| 257 | V | 95.2 | Very high | 90.9 | Very high | 89 Ų | 89 | 31.4 Ų | 31.4 | 54% | 0.539 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -61.2 | -39 | -177.7 | 171.5 | 0 | 0 | 0 | 0 | 111.9 | V253 A254 F255 P261 | V253-V257 HydrophobicContact CG1-CG2 4.34Å; V253-V257 WeakPolarHBondContact O-CG2 3.26Å; V253-V257 PolarHBondContact O-N 2.74Å; A254-V257 PolarHBondContact O-N 2.87Å; F255-V257 PolarHBondContact O-N 2.03Å; V257-P261 VanDerWaalsContact O-CD 3.26Å; V257-P261 WeakPolarHBondContact O-CD 3.25Å |
| 258 | C | 95.1 | Very high | 91.2 | Very high | 5 Ų | 5 | 35.9 Ų | 35.9 | 3% | 0.034 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -76.5 | -42.3 | -177.7 | -66.1 | 0 | 0 | 0 | 0 | 112.8 | A254 F255 V256 L292 A293 N296 | A254-C258 VanDerWaalsContact O-CB 3.26Å; A254-C258 WeakPolarHBondContact O-CB 3.12Å; A254-C258 PolarHBondContact O-N 3.24Å; A254-C258 PolarHBondContact O-SG 3.46Å; F255-C258 PolarHBondContact O-N 3.15Å; V256-C258 VanDerWaalsContact C-N 3.3Å; V256-C258 PolarHBondContact O-N 2.91Å; C258-L292 WeakPolarHBondContact CB-O 3.26Å; C258-L292 CarbonylContact O-C 3.52Å; C258-L292 PolarHBondContact SG-O 3.23Å; C258-A293 WeakPolarHBondContact O-CA 3.19Å; C258-A293 PolarHBondContact O-N 2.89Å; C258-N296 HydrophobicContact CB-CB 3.85Å |
| 259 | W | 95.6 | Very high | 91.3 | Very high | 12 Ų | 12 | 38 Ų | 38 | 5% | 0.045 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -95.3 | -27.3 | -169.8 | -72.4 | 92.7 | 0 | 0 | 0 | 114.6 | M121 Y215 F255 V256 Y262 H263 A293 N296 | M121-W259 HydrophobicContact CB-CH2 3.59Å; M121-W259 HydrophobicContact CB-CZ2 4.34Å; M121-W259 HydrophobicContact CB-CZ3 4.1Å; M121-W259 HydrophobicContact CG-CE3 4.24Å; M121-W259 HydrophobicContact CG-CH2 3.37Å; M121-W259 HydrophobicContact CG-CZ2 4.14Å; M121-W259 HydrophobicContact CG-CZ3 3.42Å; M121-W259 VanDerWaalsContact CG-CZ3 3.42Å; M121-W259 HydrophobicContact SD-CE3 4.37Å; M121-W259 HydrophobicContact SD-CH2 4.09Å; M121-W259 HydrophobicContact SD-CZ3 3.58Å; M121-W259 VanDerWaalsContact SD-CZ3 3.58Å; Y215-W259 HydrophobicContact CD2-CB 3.91Å; Y215-W259 HydrophobicContact CE2-CB 4.12Å; F255-W259 HydrophobicContact CD2-CB 4.39Å; F255-W259 AromaticContact CD2-CD1 3.15Å; F255-W259 AromaticContact CD2-CG 3.88Å; F255-W259 HydrophobicContact CD2-CG 3.88Å; F255-W259 AromaticContact CD2-NE1 3.67Å; F255-W259 HydrophobicContact CE2-CB 3.98Å; F255-W259 AromaticContact CE2-CD1 3.32Å; F255-W259 HydrophobicContact CE2-CD2 4.29Å; F255-W259 AromaticContact CE2-CG 3.58Å; F255-W259 HydrophobicContact CE2-CG 3.58Å; F255-W259 AromaticContact CE2-NE1 3.83Å; F255-W259 HydrophobicContact CZ-CB 4.36Å; F255-W259 HydrophobicContact CZ-CG 4.4Å; F255-W259 WeakPolarHBondContact O-CB 3.25Å; F255-W259 VanDerWaalsContact O-CD1 3.3Å; F255-W259 PolarHBondContact O-N 3.44Å; V256-W259 PolarHBondContact O-N 3.37Å; W259-Y262 HydrophobicContact CE3-CD1 4.09Å; W259-Y262 HydrophobicContact CZ3-CD1 4.17Å; W259-Y262 HydrophobicContact CZ3-CE1 4.37Å; W259-Y262 PolarHBondContact O-N 3.17Å; W259-H263 AromaticContact CE3-NE2 3.86Å; W259-H263 PolarHBondContact O-CD2 3.18Å; W259-H263 VanDerWaalsContact O-CD2 3.28Å; W259-H263 PolarHBondContact O-N 3.23Å; W259-H263 VanDerWaalsContact O-N 3.14Å; W259-A293 HydrophobicContact CD2-CB 4.24Å; W259-A293 HydrophobicContact CE3-CB 4.03Å; W259-A293 HydrophobicContact CH2-CB 4.27Å; W259-A293 HydrophobicContact CZ3-CB 4.03Å; W259-N296 VanDerWaalsContact NE1-CG 3.31Å; W259-N296 PolarHBondContact NE1-ND2 3.41Å |
| 260 | T | 96 | Very high | 91 | Very high | 36 Ų | 36 | 36.6 Ų | 36.6 | 22% | 0.221 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -55.3 | -49.2 | 179.8 | -51.7 | 0 | 0 | 0 | 0 | 112 | Y215 V256 Y262 H263 L264 | Y215-T260 PolarHBondContact OH-OG1 3.47Å; V256-T260 WeakPolarHBondContact CG1-OG1 3.29Å; V256-T260 VanDerWaalsContact O-CB 3.24Å; V256-T260 WeakPolarHBondContact O-CB 3.46Å; V256-T260 PolarHBondContact O-N 3.44Å; V256-T260 PolarHBondContact O-OG1 3.2Å; T260-Y262 VanDerWaalsContact C-N 3.3Å; T260-Y262 PolarHBondContact O-N 3.06Å; T260-H263 PolarHBondContact O-N 3.43Å; T260-L264 HydrophobicContact CG2-CD1 3.79Å; T260-L264 HydrophobicContact CG2-CG 4.09Å; T260-L264 WeakPolarHBondContact O-CG 3.27Å; T260-L264 PolarHBondContact O-N 3.11Å |
| 261 | P | 95.7 | Very high | 90.4 | Very high | 32 Ų | 32 | 39.7 Ų | 39.7 | 21% | 0.208 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -58.8 | -44.4 | -178 | -24.1 | 36.4 | 0 | 0 | 0 | 111.5 | V257 H263 L264 F265 L292 | V257-P261 VanDerWaalsContact O-CD 3.26Å; V257-P261 WeakPolarHBondContact O-CD 3.25Å; P261-H263 PolarHBondContact O-N 3.37Å; P261-L264 PolarHBondContact O-N 3.02Å; P261-F265 WeakPolarHBondContact O-CD2 3.3Å; P261-F265 PolarHBondContact O-N 3.14Å; P261-L292 HydrophobicContact CB-CD1 4.24Å; P261-L292 HydrophobicContact CG-CD1 3.91Å |
| 262 | Y | 94.3 | Very high | 89.4 | Confident | 37 Ų | 37 | 40.3 Ų | 40.3 | 15% | 0.145 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.2 | -48.2 | -178.5 | 170.5 | -101.5 | 0 | 0 | 0 | 111.3 | M121 W259 T260 L264 F265 S266 A293 | M121-Y262 HydrophobicContact SD-CE1 4.48Å; W259-Y262 HydrophobicContact CE3-CD1 4.09Å; W259-Y262 HydrophobicContact CZ3-CD1 4.17Å; W259-Y262 HydrophobicContact CZ3-CE1 4.37Å; W259-Y262 PolarHBondContact O-N 3.17Å; T260-Y262 VanDerWaalsContact C-N 3.3Å; T260-Y262 PolarHBondContact O-N 3.06Å; Y262-L264 PolarHBondContact O-N 2.85Å; Y262-F265 PolarHBondContact O-N 2.86Å; Y262-S266 WeakPolarHBondContact O-CB 3.37Å; Y262-S266 PolarHBondContact O-N 2.95Å; Y262-S266 PolarHBondContact O-OG 3.46Å; Y262-A293 HydrophobicContact CG-CB 4.49Å |
| 263 | H | 94.1 | Very high | 87.8 | Confident | 4 Ų | 4 | 46.2 Ų | 46.2 | 2% | 0.019 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.2 | -35.7 | 179.4 | -75.7 | -62.2 | 0 | 0 | 0 | 113.3 | F211 Y215 W259 T260 P261 I267 | F211-H263 HydrophobicContact CD2-CB 3.88Å; F211-H263 HydrophobicContact CE2-CB 4.41Å; Y215-H263 WeakPolarHBondContact CB-CD2 3.34Å; Y215-H263 WeakPolarHBondContact CB-NE2 3.5Å; Y215-H263 AromaticContact CD2-CD2 3.65Å; Y215-H263 AromaticContact CG-CD2 3.5Å; Y215-H263 VanDerWaalsContact CG-CD2 3.5Å; W259-H263 AromaticContact CE3-NE2 3.86Å; W259-H263 PolarHBondContact O-CD2 3.18Å; W259-H263 VanDerWaalsContact O-CD2 3.28Å; W259-H263 PolarHBondContact O-N 3.23Å; W259-H263 VanDerWaalsContact O-N 3.14Å; T260-H263 PolarHBondContact O-N 3.43Å; P261-H263 PolarHBondContact O-N 3.37Å; H263-I267 WeakPolarHBondContact O-CB 3.28Å; H263-I267 VanDerWaalsContact O-CG1 3.27Å; H263-I267 WeakPolarHBondContact O-CG1 3.12Å; H263-I267 PolarHBondContact O-N 3.47Å |
| 264 | L | 93.5 | Very high | 86.1 | Confident | 106 Ų | 106 | 50.9 Ų | 50.9 | 56% | 0.555 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -63.9 | -47.5 | 175 | -70.5 | 178 | 0 | 0 | 0 | 111.2 | T260 P261 Y262 I267 W268 | T260-L264 HydrophobicContact CG2-CD1 3.79Å; T260-L264 HydrophobicContact CG2-CG 4.09Å; T260-L264 WeakPolarHBondContact O-CG 3.27Å; T260-L264 PolarHBondContact O-N 3.11Å; P261-L264 PolarHBondContact O-N 3.02Å; Y262-L264 PolarHBondContact O-N 2.85Å; L264-I267 PolarHBondContact O-N 2.76Å; L264-W268 VanDerWaalsContact O-CB 3.26Å; L264-W268 WeakPolarHBondContact O-CB 3.49Å; L264-W268 PolarHBondContact O-N 3.01Å |
| 265 | F | 90.3 | Very high | 84.7 | Confident | 44 Ų | 44 | 54.3 Ų | 54.3 | 19% | 0.193 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65 | -41 | 176.6 | -79.1 | -70 | 0 | 0 | 0 | 112.1 | P261 Y262 I267 W268 E269 V281 M282 I286 | P261-F265 WeakPolarHBondContact O-CD2 3.3Å; P261-F265 PolarHBondContact O-N 3.14Å; Y262-F265 PolarHBondContact O-N 2.86Å; F265-I267 VanDerWaalsContact C-N 3.34Å; F265-I267 PolarHBondContact O-N 3.41Å; F265-W268 HydrophobicContact CD1-CE3 4.03Å; F265-W268 HydrophobicContact CD1-CZ3 4.43Å; F265-W268 HydrophobicContact CE1-CE3 4Å; F265-W268 AromaticContact CE1-CZ3 3.94Å; F265-W268 HydrophobicContact CE1-CZ3 3.94Å; F265-W268 PolarHBondContact O-N 2.89Å; F265-E269 WeakPolarHBondContact O-CB 3.2Å; F265-E269 PolarHBondContact O-N 2.86Å; F265-V281 HydrophobicContact CE1-CG1 4.3Å; F265-M282 HydrophobicContact CB-SD 4.23Å; F265-M282 HydrophobicContact CD1-CE 4.33Å; F265-M282 HydrophobicContact CD1-SD 3.84Å; F265-I286 HydrophobicContact CB-CG1 4.26Å |
| 266 | S | 87.9 | Confident | 83.4 | Confident | 15 Ų | 15 | 58.6 Ų | 58.6 | 11% | 0.105 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.5 | -35.5 | 176.2 | -62.9 | 0 | 0 | 0 | 0 | 113.4 | T207 Y262 | T207-S266 WeakPolarHBondContact CG2-O 3.44Å; Y262-S266 WeakPolarHBondContact O-CB 3.37Å; Y262-S266 PolarHBondContact O-N 2.95Å; Y262-S266 PolarHBondContact O-OG 3.46Å |
| 267 | I | 90.6 | Very high | 82.2 | Confident | 35 Ų | 35 | 64.4 Ų | 64.4 | 18% | 0.179 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -75.1 | -40.6 | 175.6 | -69.6 | 166.8 | 0 | 0 | 0 | 110.4 | W208 F211 H263 L264 F265 E269 L270 | W208-I267 HydrophobicContact CZ3-CD1 4.5Å; F211-I267 HydrophobicContact CB-CD1 4.22Å; F211-I267 HydrophobicContact CD1-CD1 3.99Å; F211-I267 HydrophobicContact CD2-CD1 3.64Å; F211-I267 HydrophobicContact CE1-CD1 4.22Å; F211-I267 HydrophobicContact CE2-CD1 3.86Å; F211-I267 HydrophobicContact CG-CD1 3.68Å; F211-I267 HydrophobicContact CZ-CD1 4.15Å; H263-I267 WeakPolarHBondContact O-CB 3.28Å; H263-I267 VanDerWaalsContact O-CG1 3.27Å; H263-I267 WeakPolarHBondContact O-CG1 3.12Å; H263-I267 PolarHBondContact O-N 3.47Å; L264-I267 PolarHBondContact O-N 2.76Å; F265-I267 VanDerWaalsContact C-N 3.34Å; F265-I267 PolarHBondContact O-N 3.41Å; I267-E269 VanDerWaalsContact C-N 3.26Å; I267-E269 PolarHBondContact O-N 3Å; I267-L270 VanDerWaalsContact O-CB 3.28Å; I267-L270 WeakPolarHBondContact O-CB 3.2Å; I267-L270 PolarHBondContact O-N 3.46Å |
| 268 | W | 87.1 | Confident | 81.1 | Confident | 104 Ų | 104 | 61.2 Ų | 61.2 | 39% | 0.394 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.3 | -34.2 | 178.3 | -171.7 | 11.2 | 0 | 0 | 0 | 111.6 | L264 F265 L270 T271 I272 V281 M282 | L264-W268 VanDerWaalsContact O-CB 3.26Å; L264-W268 WeakPolarHBondContact O-CB 3.49Å; L264-W268 PolarHBondContact O-N 3.01Å; F265-W268 HydrophobicContact CD1-CE3 4.03Å; F265-W268 HydrophobicContact CD1-CZ3 4.43Å; F265-W268 HydrophobicContact CE1-CE3 4Å; F265-W268 AromaticContact CE1-CZ3 3.94Å; F265-W268 HydrophobicContact CE1-CZ3 3.94Å; F265-W268 PolarHBondContact O-N 2.89Å; W268-L270 PolarHBondContact O-N 3.36Å; W268-L270 VanDerWaalsContact O-N 3.16Å; W268-T271 PolarHBondContact O-N 2.85Å; W268-T271 PolarHBondContact O-OG1 2.84Å; W268-I272 HydrophobicContact CG-CD1 4.35Å; W268-I272 WeakPolarHBondContact O-CG1 3.37Å; W268-V281 HydrophobicContact CH2-CB 4.48Å; W268-V281 HydrophobicContact CH2-CG1 3.73Å; W268-V281 HydrophobicContact CZ3-CG1 3.77Å; W268-M282 HydrophobicContact CB-CE 3.99Å; W268-M282 HydrophobicContact CD2-CE 4.11Å; W268-M282 HydrophobicContact CE3-CE 4.34Å; W268-M282 HydrophobicContact CG-CE 3.97Å |
| 269 | E | 82.8 | Confident | 80 | Confident | 49 Ų | 49 | 64.6 Ų | 64.6 | 23% | 0.229 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -54.8 | -30.3 | 170.6 | -173.2 | -179.2 | -158.5 | 0 | 0 | 112.5 | Y17 F265 I267 M282 | Y17-E269 HydrophobicContact CD1-CG 4.38Å; Y17-E269 HydrophobicContact CE1-CG 4Å; Y17-E269 PolarHBondContact OH-O 3.3Å; F265-E269 WeakPolarHBondContact O-CB 3.2Å; F265-E269 PolarHBondContact O-N 2.86Å; I267-E269 VanDerWaalsContact C-N 3.26Å; I267-E269 PolarHBondContact O-N 3Å; E269-M282 HydrophobicContact CB-CE 4.11Å; E269-M282 HydrophobicContact CB-SD 4.32Å |
| 270 | L | 81.1 | Confident | 79 | Confident | 16 Ų | 16 | 68.3 Ų | 68.3 | 8% | 0.084 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.6 | -22.6 | 178.4 | -57.8 | 179.9 | 0 | 0 | 0 | 114.2 | H203 T207 I267 W268 | H203-L270 WeakPolarHBondContact CD2-CD2 3.33Å; H203-L270 WeakPolarHBondContact NE2-CD2 3.25Å; T207-L270 HydrophobicContact CG2-CD1 3.64Å; T207-L270 HydrophobicContact CG2-CD2 4.28Å; T207-L270 HydrophobicContact CG2-CG 4.02Å; I267-L270 VanDerWaalsContact O-CB 3.28Å; I267-L270 WeakPolarHBondContact O-CB 3.2Å; I267-L270 PolarHBondContact O-N 3.46Å; W268-L270 PolarHBondContact O-N 3.36Å; W268-L270 VanDerWaalsContact O-N 3.16Å |
| 271 | T | 75.3 | Confident | 78.3 | Confident | 91 Ų | 91 | 68.6 Ų | 68.6 | 56% | 0.558 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.8 | -1.2 | -168.5 | 61.8 | 0 | 0 | 0 | 0 | 114 | W268 H273 | W268-T271 PolarHBondContact O-N 2.85Å; W268-T271 PolarHBondContact O-OG1 2.84Å; T271-H273 PolarHBondContact O-N 2.78Å |
| 272 | I | 65.7 | Low | 77.5 | Confident | 17 Ų | 17 | 67.7 Ų | 67.7 | 9% | 0.087 | 33% | 0.333 | C | S | . | . | trans | -82.4 | 115.4 | -177.8 | -68.1 | 164.7 | 0 | 0 | 0 | 109.7 | Y17 W268 M282 | Y17-I272 PolarHBondContact OH-O 3.49Å; Y17-I272 VanDerWaalsContact OH-O 3.08Å; W268-I272 HydrophobicContact CG-CD1 4.35Å; W268-I272 WeakPolarHBondContact O-CG1 3.37Å; I272-M282 HydrophobicContact CD1-CE 3.49Å; I272-M282 VanDerWaalsContact CD1-CE 3.49Å | ||
| 273 | H | 55 | Low | 76.6 | Confident | 137 Ų | 137 | 67.5 Ų | 67.5 | 63% | 0.634 | 33% | 0.334 | S | S | * | . | trans | -105.3 | 125.5 | 160.8 | -66.3 | -74.2 | 0 | 0 | 0 | 108.5 | T271 N275 | T271-H273 PolarHBondContact O-N 2.78Å; H273-N275 PolarHBondContact O-N 2.84Å; H273-N275 VanDerWaalsContact O-N 3.16Å | ||
| 274 | H | 55.3 | Low | 75.8 | Confident | 179 Ų | 179 | 68.6 Ų | 68.6 | 83% | 0.829 | 34% | 0.343 | S | S | * | . | S | Bend | trans | 27.4 | 65.9 | 164.1 | -55.8 | -20.1 | 0 | 0 | 0 | 117.8 | ||
| 275 | N | 63.3 | Low | 75.4 | Confident | 86 Ų | 86 | 63.8 Ų | 63.8 | 46% | 0.46 | 32% | 0.319 | S | S | . | . | trans | -137.3 | 115.2 | 164.1 | -174.6 | -4.2 | 0 | 0 | 0 | 110.8 | H273 Y277 S278 H279 | H273-N275 PolarHBondContact O-N 2.84Å; H273-N275 VanDerWaalsContact O-N 3.16Å; N275-Y277 PolarHBondContact O-N 3.36Å; N275-Y277 VanDerWaalsContact O-N 3.14Å; N275-Y277 PolarHBondContact OD1-N 2.87Å; N275-S278 WeakPolarHBondContact O-CB 3.03Å; N275-S278 PolarHBondContact O-N 3.24Å; N275-H279 PolarHBondContact O-CD2 2.75Å; N275-H279 VanDerWaalsContact O-CD2 3.24Å; N275-H279 PolarHBondContact O-N 2.81Å | ||
| 276 | S | 63.5 | Low | 75.2 | Confident | 89 Ų | 89 | 63.6 Ų | 63.6 | 62% | 0.622 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -54.2 | -34.1 | -176 | -47.7 | 0 | 0 | 0 | 0 | 113.4 | S278 H279 H280 | S276-S278 PolarHBondContact O-N 2.71Å; S276-H279 PolarHBondContact O-N 3.37Å; S276-H280 PolarHBondContact O-CD2 2.97Å; S276-H280 PolarHBondContact O-N 2.91Å |
| 277 | Y | 68.7 | Low | 75.2 | Confident | 170 Ų | 170 | 63.5 Ų | 63.5 | 67% | 0.667 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -63.6 | -41.5 | 176.1 | -179.8 | -97.7 | 0 | 0 | 0 | 112.6 | N275 H279 H280 V281 | N275-Y277 PolarHBondContact O-N 3.36Å; N275-Y277 VanDerWaalsContact O-N 3.14Å; N275-Y277 PolarHBondContact OD1-N 2.87Å; Y277-H279 VanDerWaalsContact C-N 3.26Å; Y277-H279 PolarHBondContact O-N 3.4Å; Y277-H280 PolarHBondContact O-N 3.02Å; Y277-V281 HydrophobicContact CD1-CG2 4.43Å; Y277-V281 HydrophobicContact CE1-CG2 3.97Å; Y277-V281 PolarHBondContact O-N 3.28Å |
| 278 | S | 72.5 | Confident | 75.2 | Confident | 21 Ų | 21 | 64.7 Ų | 64.7 | 15% | 0.147 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.6 | -31 | 178.4 | -58.3 | 0 | 0 | 0 | 0 | 111.9 | N275 S276 M282 | N275-S278 WeakPolarHBondContact O-CB 3.03Å; N275-S278 PolarHBondContact O-N 3.24Å; S276-S278 PolarHBondContact O-N 2.71Å; S278-M282 WeakPolarHBondContact O-CB 3.41Å; S278-M282 PolarHBondContact O-N 2.77Å; S278-M282 VanDerWaalsContact O-N 3.09Å |
| 279 | H | 71.4 | Confident | 75.5 | Confident | 76 Ų | 76 | 59.9 Ų | 59.9 | 35% | 0.352 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -67.4 | -44.9 | 176.5 | -73.7 | -79.1 | 0 | 0 | 0 | 112.5 | N275 S276 Y277 V281 M282 Q283 | N275-H279 PolarHBondContact O-CD2 2.75Å; N275-H279 VanDerWaalsContact O-CD2 3.24Å; N275-H279 PolarHBondContact O-N 2.81Å; S276-H279 PolarHBondContact O-N 3.37Å; Y277-H279 VanDerWaalsContact C-N 3.26Å; Y277-H279 PolarHBondContact O-N 3.4Å; H279-V281 VanDerWaalsContact C-N 3.35Å; H279-V281 PolarHBondContact O-N 3.45Å; H279-M282 PolarHBondContact O-N 2.99Å; H279-Q283 WeakPolarHBondContact O-CG 3.12Å; H279-Q283 PolarHBondContact O-N 3.32Å |
| 280 | H | 74.2 | Confident | 75.9 | Confident | 90 Ų | 90 | 58.1 Ų | 58.1 | 42% | 0.417 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.4 | -41.3 | 177.1 | -68.6 | -64.8 | 0 | 0 | 0 | 112.5 | S276 Y277 M282 Q283 A284 | S276-H280 PolarHBondContact O-CD2 2.97Å; S276-H280 PolarHBondContact O-N 2.91Å; Y277-H280 PolarHBondContact O-N 3.02Å; H280-M282 VanDerWaalsContact C-N 3.29Å; H280-M282 PolarHBondContact O-N 2.9Å; H280-Q283 PolarHBondContact O-N 3.44Å; H280-A284 PolarHBondContact O-N 2.99Å |
| 281 | V | 81.3 | Confident | 76.4 | Confident | 42 Ų | 42 | 57.3 Ų | 57.3 | 26% | 0.255 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.3 | -38.1 | 176.2 | 176.2 | 0 | 0 | 0 | 0 | 110.9 | F265 W268 Y277 H279 G285 | F265-V281 HydrophobicContact CE1-CG1 4.3Å; W268-V281 HydrophobicContact CH2-CB 4.48Å; W268-V281 HydrophobicContact CH2-CG1 3.73Å; W268-V281 HydrophobicContact CZ3-CG1 3.77Å; Y277-V281 HydrophobicContact CD1-CG2 4.43Å; Y277-V281 HydrophobicContact CE1-CG2 3.97Å; Y277-V281 PolarHBondContact O-N 3.28Å; H279-V281 VanDerWaalsContact C-N 3.35Å; H279-V281 PolarHBondContact O-N 3.45Å; V281-G285 WeakPolarHBondContact O-CA 3.2Å; V281-G285 PolarHBondContact O-N 3.34Å |
| 282 | M | 79.2 | Confident | 77.4 | Confident | 14 Ų | 14 | 55.3 Ų | 55.3 | 7% | 0.069 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -70.7 | -41.4 | 178.8 | -164.2 | 59.8 | 70.5 | 0 | 0 | 112.5 | F265 W268 E269 I272 S278 H279 H280 A284 G285 I286 | F265-M282 HydrophobicContact CB-SD 4.23Å; F265-M282 HydrophobicContact CD1-CE 4.33Å; F265-M282 HydrophobicContact CD1-SD 3.84Å; W268-M282 HydrophobicContact CB-CE 3.99Å; W268-M282 HydrophobicContact CD2-CE 4.11Å; W268-M282 HydrophobicContact CE3-CE 4.34Å; W268-M282 HydrophobicContact CG-CE 3.97Å; E269-M282 HydrophobicContact CB-CE 4.11Å; E269-M282 HydrophobicContact CB-SD 4.32Å; I272-M282 HydrophobicContact CD1-CE 3.49Å; I272-M282 VanDerWaalsContact CD1-CE 3.49Å; S278-M282 WeakPolarHBondContact O-CB 3.41Å; S278-M282 PolarHBondContact O-N 2.77Å; S278-M282 VanDerWaalsContact O-N 3.09Å; H279-M282 PolarHBondContact O-N 2.99Å; H280-M282 VanDerWaalsContact C-N 3.29Å; H280-M282 PolarHBondContact O-N 2.9Å; M282-A284 VanDerWaalsContact C-N 3.25Å; M282-A284 PolarHBondContact O-N 3.33Å; M282-G285 PolarHBondContact O-N 3.41Å; M282-I286 HydrophobicContact CG-CD1 3.48Å; M282-I286 VanDerWaalsContact CG-CD1 3.48Å; M282-I286 HydrophobicContact CG-CG1 3.9Å; M282-I286 PolarHBondContact O-N 3.26Å; M282-I286 HydrophobicContact SD-CD1 3.47Å; M282-I286 WeakPolarHBondContact SD-CD1 3.2Å; M282-I286 HydrophobicContact SD-CG1 3.41Å; M282-I286 WeakPolarHBondContact SD-CG1 3.39Å |
| 283 | Q | 75.3 | Confident | 78.8 | Confident | 33 Ų | 33 | 54.6 Ų | 54.6 | 15% | 0.154 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -57.2 | -37.9 | 175.4 | -81.7 | 179.1 | -17 | 0 | 0 | 112.4 | Y21 L34 H279 H280 P287 | Y21-Q283 HydrophobicContact CD2-CG 4.15Å; Y21-Q283 HydrophobicContact CE2-CB 4.31Å; Y21-Q283 HydrophobicContact CE2-CG 3.32Å; L34-Q283 HydrophobicContact CD1-CB 3.89Å; H279-Q283 WeakPolarHBondContact O-CG 3.12Å; H279-Q283 PolarHBondContact O-N 3.32Å; H280-Q283 PolarHBondContact O-N 3.44Å; Q283-P287 WeakPolarHBondContact O-CD 3.16Å; Q283-P287 WeakPolarHBondContact O-CG 3.47Å |
| 284 | A | 78.4 | Confident | 80.7 | Confident | 26 Ų | 26 | 49.3 Ų | 49.3 | 22% | 0.215 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -81.9 | -40.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | V37 H280 M282 L288 | V37-A284 HydrophobicContact CB-CB 4.25Å; V37-A284 HydrophobicContact CG1-CB 4.01Å; V37-A284 VanDerWaalsContact CG1-O 3.28Å; V37-A284 WeakPolarHBondContact CG1-O 3.38Å; V37-A284 HydrophobicContact CG2-CB 4.21Å; H280-A284 PolarHBondContact O-N 2.99Å; M282-A284 VanDerWaalsContact C-N 3.25Å; M282-A284 PolarHBondContact O-N 3.33Å; A284-L288 WeakPolarHBondContact O-CB 3.37Å; A284-L288 PolarHBondContact O-N 2.99Å |
| 285 | G | 85.7 | Confident | 82.5 | Confident | 5 Ų | 5 | 42.1 Ų | 42.1 | 5% | 0.052 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -71.7 | -41.8 | -171.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | V281 M282 L288 S289 | V281-G285 WeakPolarHBondContact O-CA 3.2Å; V281-G285 PolarHBondContact O-N 3.34Å; M282-G285 PolarHBondContact O-N 3.41Å; G285-L288 PolarHBondContact O-N 2.87Å; G285-S289 WeakPolarHBondContact O-CB 2.92Å; G285-S289 PolarHBondContact O-N 3.28Å; G285-S289 PolarHBondContact O-OG 3.49Å |
| 286 | I | 86.2 | Confident | 84 | Confident | 41 Ų | 41 | 38 Ų | 38 | 21% | 0.21 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.9 | -50.7 | -178.6 | -68.8 | 176.5 | 0 | 0 | 0 | 111.6 | F265 M282 L288 S289 T290 | F265-I286 HydrophobicContact CB-CG1 4.26Å; M282-I286 HydrophobicContact CG-CD1 3.48Å; M282-I286 VanDerWaalsContact CG-CD1 3.48Å; M282-I286 HydrophobicContact CG-CG1 3.9Å; M282-I286 PolarHBondContact O-N 3.26Å; M282-I286 HydrophobicContact SD-CD1 3.47Å; M282-I286 WeakPolarHBondContact SD-CD1 3.2Å; M282-I286 HydrophobicContact SD-CG1 3.41Å; M282-I286 WeakPolarHBondContact SD-CG1 3.39Å; I286-L288 VanDerWaalsContact C-N 3.33Å; I286-L288 PolarHBondContact O-N 3.47Å; I286-S289 WeakPolarHBondContact CA-OG 3.4Å; I286-S289 PolarHBondContact O-N 2.7Å; I286-S289 PolarHBondContact O-OG 2.85Å; I286-T290 VanDerWaalsContact O-CB 3.27Å; I286-T290 WeakPolarHBondContact O-CB 3.31Å; I286-T290 PolarHBondContact O-N 3.5Å; I286-T290 PolarHBondContact O-OG1 3.35Å |
| 287 | P | 86.4 | Confident | 85.5 | Confident | 13 Ų | 13 | 33.8 Ų | 33.8 | 8% | 0.084 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.2 | -39.9 | 178.9 | -23.7 | 35.4 | 0 | 0 | 0 | 112.2 | S41 Y45 Q283 G291 | S41-P287 PolarHBondContact OG-O 3.36Å; Y45-P287 PolarHBondContact OH-O 2.72Å; Q283-P287 WeakPolarHBondContact O-CD 3.16Å; Q283-P287 WeakPolarHBondContact O-CG 3.47Å; P287-G291 PolarHBondContact O-N 3.14Å |
| 288 | L | 90.1 | Very high | 86.6 | Confident | 60 Ų | 60 | 25.8 Ų | 25.8 | 31% | 0.314 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -64.9 | -47.5 | 179.4 | -177.6 | 63.5 | 0 | 0 | 0 | 111.5 | V37 V40 S41 L44 A284 G285 I286 T290 G291 L292 | V37-L288 HydrophobicContact CG1-CB 4.03Å; V37-L288 HydrophobicContact CG1-CD2 4.49Å; V40-L288 HydrophobicContact CG1-CD1 3.81Å; S41-L288 WeakPolarHBondContact OG-CA 3.26Å; S41-L288 PolarHBondContact OG-N 2.97Å; L44-L288 HydrophobicContact CD1-CD1 3.86Å; A284-L288 WeakPolarHBondContact O-CB 3.37Å; A284-L288 PolarHBondContact O-N 2.99Å; G285-L288 PolarHBondContact O-N 2.87Å; I286-L288 VanDerWaalsContact C-N 3.33Å; I286-L288 PolarHBondContact O-N 3.47Å; L288-T290 VanDerWaalsContact C-N 3.35Å; L288-G291 PolarHBondContact O-N 3.26Å; L288-L292 PolarHBondContact O-N 2.86Å |
| 289 | S | 93.9 | Very high | 87.4 | Confident | 2 Ų | 2 | 27.2 Ų | 27.2 | 1% | 0.014 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -67.5 | -34.3 | 179.3 | 62.4 | 0 | 0 | 0 | 0 | 113 | G285 I286 L292 A293 | G285-S289 WeakPolarHBondContact O-CB 2.92Å; G285-S289 PolarHBondContact O-N 3.28Å; G285-S289 PolarHBondContact O-OG 3.49Å; I286-S289 WeakPolarHBondContact CA-OG 3.4Å; I286-S289 PolarHBondContact O-N 2.7Å; I286-S289 PolarHBondContact O-OG 2.85Å; S289-L292 PolarHBondContact O-N 3.45Å; S289-A293 PolarHBondContact O-N 3.07Å |
| 290 | T | 91.1 | Very high | 88.2 | Confident | 12 Ų | 12 | 23.6 Ų | 23.6 | 7% | 0.074 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -63.2 | -42 | 170.5 | -57.7 | 0 | 0 | 0 | 0 | 110.8 | Y45 I286 L288 L292 A293 F294 | Y45-T290 HydrophobicContact CE1-CG2 4.22Å; I286-T290 VanDerWaalsContact O-CB 3.27Å; I286-T290 WeakPolarHBondContact O-CB 3.31Å; I286-T290 PolarHBondContact O-N 3.5Å; I286-T290 PolarHBondContact O-OG1 3.35Å; L288-T290 VanDerWaalsContact C-N 3.35Å; T290-L292 PolarHBondContact O-N 2.85Å; T290-A293 WeakPolarHBondContact O-CB 3.07Å; T290-A293 PolarHBondContact O-N 3.13Å; T290-F294 HydrophobicContact CG2-CD1 4.25Å; T290-F294 HydrophobicContact CG2-CD2 4.4Å; T290-F294 HydrophobicContact CG2-CE1 3.7Å; T290-F294 HydrophobicContact CG2-CE2 3.87Å; T290-F294 HydrophobicContact CG2-CZ 3.48Å; T290-F294 VanDerWaalsContact CG2-CZ 3.48Å; T290-F294 WeakPolarHBondContact O-CD1 3.41Å; T290-F294 WeakPolarHBondContact O-CG 3.43Å; T290-F294 PolarHBondContact O-N 2.86Å |
| 291 | G | 92.8 | Very high | 88.6 | Confident | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59.4 | -43.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | P287 L288 F294 L295 | P287-G291 PolarHBondContact O-N 3.14Å; L288-G291 PolarHBondContact O-N 3.26Å; G291-F294 PolarHBondContact O-N 3.33Å; G291-L295 PolarHBondContact O-N 2.84Å; G291-L295 VanDerWaalsContact O-N 3.16Å |
| 292 | L | 95.4 | Very high | 88.6 | Confident | 49 Ų | 49 | 20.3 Ų | 20.3 | 26% | 0.257 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -62.6 | -43.2 | 173.7 | -68.2 | 174.7 | 0 | 0 | 0 | 111.8 | L44 C258 P261 L288 S289 T290 F294 L295 | L44-L292 HydrophobicContact CD1-CD2 4.4Å; C258-L292 WeakPolarHBondContact CB-O 3.26Å; C258-L292 CarbonylContact O-C 3.52Å; C258-L292 PolarHBondContact SG-O 3.23Å; P261-L292 HydrophobicContact CB-CD1 4.24Å; P261-L292 HydrophobicContact CG-CD1 3.91Å; L288-L292 PolarHBondContact O-N 2.86Å; S289-L292 PolarHBondContact O-N 3.45Å; T290-L292 PolarHBondContact O-N 2.85Å; L292-F294 VanDerWaalsContact C-N 3.3Å; L292-F294 PolarHBondContact O-N 3Å; L292-L295 HydrophobicContact CD2-CD1 4.42Å; L292-L295 PolarHBondContact O-N 2.91Å |
| 293 | A | 94.9 | Very high | 88.6 | Confident | 2 Ų | 2 | 21 Ų | 21 | 2% | 0.017 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -61 | -39 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | C258 W259 Y262 S289 T290 N296 | C258-A293 WeakPolarHBondContact O-CA 3.19Å; C258-A293 PolarHBondContact O-N 2.89Å; W259-A293 HydrophobicContact CD2-CB 4.24Å; W259-A293 HydrophobicContact CE3-CB 4.03Å; W259-A293 HydrophobicContact CH2-CB 4.27Å; W259-A293 HydrophobicContact CZ3-CB 4.03Å; Y262-A293 HydrophobicContact CG-CB 4.49Å; S289-A293 PolarHBondContact O-N 3.07Å; T290-A293 WeakPolarHBondContact O-CB 3.07Å; T290-A293 PolarHBondContact O-N 3.13Å; A293-N296 WeakPolarHBondContact O-CB 3.41Å; A293-N296 PolarHBondContact O-N 2.87Å |
| 294 | F | 94.5 | Very high | 88.6 | Confident | 25 Ų | 25 | 20 Ų | 20 | 11% | 0.11 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -69.8 | -32.3 | 179.5 | -68.8 | -0.2 | 0 | 0 | 0 | 113.2 | Y45 F86 L90 Y93 T290 G291 L292 N296 S297 | Y45-F294 AromaticContact CD1-CD2 3.48Å; Y45-F294 HydrophobicContact CD1-CD2 3.48Å; Y45-F294 VanDerWaalsContact CD1-CD2 3.48Å; Y45-F294 HydrophobicContact CD1-CE2 4.06Å; Y45-F294 HydrophobicContact CD1-CG 4.38Å; Y45-F294 AromaticContact CE1-CD2 3.64Å; Y45-F294 HydrophobicContact CE1-CD2 3.64Å; Y45-F294 AromaticContact CE1-CE2 3.93Å; Y45-F294 HydrophobicContact CE1-CE2 3.93Å; Y45-F294 HydrophobicContact CE1-CG 4.47Å; Y45-F294 HydrophobicContact CG-CD2 4.49Å; F86-F294 HydrophobicContact CE1-CB 4.25Å; F86-F294 HydrophobicContact CE1-CD1 4.14Å; F86-F294 HydrophobicContact CE1-CG 4.12Å; F86-F294 HydrophobicContact CE2-CD1 4.24Å; F86-F294 AromaticContact CE2-CE1 3.98Å; F86-F294 HydrophobicContact CE2-CE1 3.98Å; F86-F294 HydrophobicContact CE2-CE2 4.46Å; F86-F294 HydrophobicContact CE2-CZ 4.1Å; F86-F294 HydrophobicContact CZ-CB 4.16Å; F86-F294 AromaticContact CZ-CD1 3.43Å; F86-F294 HydrophobicContact CZ-CD1 3.43Å; F86-F294 VanDerWaalsContact CZ-CD1 3.43Å; F86-F294 AromaticContact CZ-CD2 3.8Å; F86-F294 HydrophobicContact CZ-CD2 3.8Å; F86-F294 AromaticContact CZ-CE1 3.62Å; F86-F294 HydrophobicContact CZ-CE1 3.62Å; F86-F294 AromaticContact CZ-CE2 3.98Å; F86-F294 HydrophobicContact CZ-CE2 3.98Å; F86-F294 AromaticContact CZ-CG 3.53Å; F86-F294 HydrophobicContact CZ-CG 3.53Å; F86-F294 AromaticContact CZ-CZ 3.89Å; F86-F294 HydrophobicContact CZ-CZ 3.89Å; L90-F294 HydrophobicContact CD1-CD2 3.47Å; L90-F294 VanDerWaalsContact CD1-CD2 3.47Å; L90-F294 HydrophobicContact CD1-CE2 3.56Å; Y93-F294 AromaticContact CD1-CE2 3.67Å; Y93-F294 HydrophobicContact CD1-CE2 3.67Å; Y93-F294 HydrophobicContact CD1-CZ 4.4Å; Y93-F294 AromaticContact CE1-CE2 3.73Å; Y93-F294 HydrophobicContact CE1-CE2 3.73Å; Y93-F294 HydrophobicContact CE1-CZ 4.32Å; Y93-F294 HydrophobicContact CG-CE2 4.39Å; T290-F294 HydrophobicContact CG2-CD1 4.25Å; T290-F294 HydrophobicContact CG2-CD2 4.4Å; T290-F294 HydrophobicContact CG2-CE1 3.7Å; T290-F294 HydrophobicContact CG2-CE2 3.87Å; T290-F294 HydrophobicContact CG2-CZ 3.48Å; T290-F294 VanDerWaalsContact CG2-CZ 3.48Å; T290-F294 WeakPolarHBondContact O-CD1 3.41Å; T290-F294 WeakPolarHBondContact O-CG 3.43Å; T290-F294 PolarHBondContact O-N 2.86Å; G291-F294 PolarHBondContact O-N 3.33Å; L292-F294 VanDerWaalsContact C-N 3.3Å; L292-F294 PolarHBondContact O-N 3Å; F294-N296 PolarHBondContact O-N 2.84Å; F294-N296 VanDerWaalsContact O-N 3.17Å; F294-S297 PolarHBondContact O-N 2.82Å; F294-S297 VanDerWaalsContact O-N 3.13Å |
| 295 | L | 94.5 | Very high | 88.2 | Confident | 29 Ų | 29 | 21 Ų | 21 | 15% | 0.152 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -59.8 | -25.5 | 174.1 | -78.2 | 176.2 | 0 | 0 | 0 | 112.7 | L44 L47 S48 G291 L292 S297 C298 L299 | L44-L295 HydrophobicContact CD2-CD1 3.65Å; L44-L295 HydrophobicContact CD2-CG 4.5Å; L47-L295 HydrophobicContact CB-CD2 4.33Å; S48-L295 WeakPolarHBondContact OG-CA 3.46Å; S48-L295 WeakPolarHBondContact OG-CD2 3.4Å; S48-L295 PolarHBondContact OG-N 2.85Å; G291-L295 PolarHBondContact O-N 2.84Å; G291-L295 VanDerWaalsContact O-N 3.16Å; L292-L295 HydrophobicContact CD2-CD1 4.42Å; L292-L295 PolarHBondContact O-N 2.91Å; L295-S297 PolarHBondContact O-N 3.32Å; L295-S297 VanDerWaalsContact O-N 3.15Å; L295-C298 PolarHBondContact O-N 2.9Å; L295-C298 PolarHBondContact O-SG 3.01Å; L295-L299 VanDerWaalsContact O-CG 3.3Å; L295-L299 WeakPolarHBondContact O-CG 3.36Å; L295-L299 PolarHBondContact O-N 3.37Å |
| 296 | N | 94.3 | Very high | 87.1 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -53 | -37.9 | 175.7 | -173 | 72.2 | 0 | 0 | 0 | 112 | C258 W259 A293 F294 C298 N300 | C258-N296 HydrophobicContact CB-CB 3.85Å; W259-N296 VanDerWaalsContact NE1-CG 3.31Å; W259-N296 PolarHBondContact NE1-ND2 3.41Å; A293-N296 WeakPolarHBondContact O-CB 3.41Å; A293-N296 PolarHBondContact O-N 2.87Å; F294-N296 PolarHBondContact O-N 2.84Å; F294-N296 VanDerWaalsContact O-N 3.17Å; N296-C298 VanDerWaalsContact C-N 3.34Å; N296-C298 PolarHBondContact O-N 3.28Å; N296-N300 PolarHBondContact O-ND2 3.1Å |
| 297 | S | 93.9 | Very high | 85.9 | Confident | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -71.7 | -22.4 | -179.6 | -71.5 | 0 | 0 | 0 | 0 | 113.9 | N56 D83 N120 F294 L295 | N56-S297 PolarHBondContact ND2-O 2.82Å; D83-S297 WeakPolarHBondContact OD1-CA 3.27Å; D83-S297 VanDerWaalsContact OD1-CB 3.24Å; D83-S297 WeakPolarHBondContact OD1-CB 3.48Å; D83-S297 PolarHBondContact OD1-OG 3.03Å; N120-S297 PolarHBondContact ND2-OG 2.94Å; N120-S297 VanDerWaalsContact ND2-OG 3.1Å; F294-S297 PolarHBondContact O-N 2.82Å; F294-S297 VanDerWaalsContact O-N 3.13Å; L295-S297 PolarHBondContact O-N 3.32Å; L295-S297 VanDerWaalsContact O-N 3.15Å |
| 298 | C | 91.8 | Very high | 84.8 | Confident | 2 Ų | 2 | 26.8 Ų | 26.8 | 1% | 0.014 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -96.6 | -23 | 174.6 | 70.9 | 0 | 0 | 0 | 0 | 113.5 | L51 G52 L295 N296 N300 I302 | L51-C298 HydrophobicContact CB-CB 4.04Å; G52-C298 VanDerWaalsContact CA-CB 3.49Å; L295-C298 PolarHBondContact O-N 2.9Å; L295-C298 PolarHBondContact O-SG 3.01Å; N296-C298 VanDerWaalsContact C-N 3.34Å; N296-C298 PolarHBondContact O-N 3.28Å; C298-N300 VanDerWaalsContact C-N 3.34Å; C298-I302 WeakPolarHBondContact O-CD1 3.47Å; C298-I302 WeakPolarHBondContact O-CG1 3.08Å |
| 299 | L | 91 | Very high | 83.3 | Confident | 51 Ų | 51 | 31 Ų | 31 | 27% | 0.267 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -69.1 | -31.7 | 178.4 | -71.5 | 173.8 | 0 | 0 | 0 | 112.5 | A254 L295 I302 L303 | A254-L299 HydrophobicContact CB-CD1 4.21Å; L295-L299 VanDerWaalsContact O-CG 3.3Å; L295-L299 WeakPolarHBondContact O-CG 3.36Å; L295-L299 PolarHBondContact O-N 3.37Å; L299-I302 PolarHBondContact O-N 2.91Å; L299-L303 HydrophobicContact CB-CD1 4.37Å; L299-L303 WeakPolarHBondContact O-CB 3.3Å; L299-L303 VanDerWaalsContact O-CG 3.25Å; L299-L303 WeakPolarHBondContact O-CG 3.46Å; L299-L303 PolarHBondContact O-N 3.08Å |
| 300 | N | 87 | Confident | 81.7 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -52.4 | -59.9 | -178.3 | -74.5 | -27 | 0 | 0 | 0 | 112.9 | D83 N296 C298 I302 L303 Y304 | D83-N300 PolarHBondContact OD2-ND2 3.48Å; N296-N300 PolarHBondContact O-ND2 3.1Å; C298-N300 VanDerWaalsContact C-N 3.34Å; N300-I302 VanDerWaalsContact C-N 3.33Å; N300-I302 PolarHBondContact O-N 3.18Å; N300-L303 PolarHBondContact O-N 3.17Å; N300-Y304 HydrophobicContact CB-CE2 4.15Å; N300-Y304 WeakPolarHBondContact O-CD1 3.04Å; N300-Y304 VanDerWaalsContact O-CD2 3.22Å; N300-Y304 WeakPolarHBondContact O-CD2 3.35Å; N300-Y304 WeakPolarHBondContact O-CE2 3.24Å; N300-Y304 PolarHBondContact O-N 2.79Å; N300-Y304 VanDerWaalsContact O-N 3.09Å |
| 301 | P | 83.8 | Confident | 80.2 | Confident | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.032 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -56 | -41.1 | 174.4 | -26.6 | 32.5 | 0 | 0 | 0 | 114.6 | N56 V59 L303 Y304 V305 | N56-P301 HydrophobicContact CB-CG 4.44Å; N56-P301 VanDerWaalsContact OD1-CG 3.23Å; N56-P301 WeakPolarHBondContact OD1-CG 3.36Å; V59-P301 HydrophobicContact CG2-CB 3.88Å; V59-P301 HydrophobicContact CG2-CG 4.08Å; P301-L303 PolarHBondContact O-N 3.39Å; P301-Y304 PolarHBondContact O-N 3.21Å; P301-V305 VanDerWaalsContact O-CG2 3.23Å; P301-V305 WeakPolarHBondContact O-CG2 3.12Å; P301-V305 PolarHBondContact O-N 2.87Å |
| 302 | I | 80.7 | Confident | 78.9 | Confident | 58 Ų | 58 | 40.2 Ų | 40.2 | 30% | 0.297 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -62.3 | -46.3 | -178.7 | -64.7 | 171.4 | 0 | 0 | 0 | 109.8 | L51 C298 L299 N300 Y304 V305 L306 | L51-I302 HydrophobicContact CD1-CD1 4.45Å; C298-I302 WeakPolarHBondContact O-CD1 3.47Å; C298-I302 WeakPolarHBondContact O-CG1 3.08Å; L299-I302 PolarHBondContact O-N 2.91Å; N300-I302 VanDerWaalsContact C-N 3.33Å; N300-I302 PolarHBondContact O-N 3.18Å; I302-Y304 VanDerWaalsContact C-N 3.31Å; I302-Y304 PolarHBondContact O-N 3.49Å; I302-V305 PolarHBondContact O-N 3.02Å; I302-L306 HydrophobicContact CG2-CD1 3.49Å; I302-L306 VanDerWaalsContact CG2-CD1 3.49Å; I302-L306 HydrophobicContact CG2-CG 4.04Å; I302-L306 WeakPolarHBondContact O-CB 3.26Å; I302-L306 VanDerWaalsContact O-CG 3.3Å; I302-L306 WeakPolarHBondContact O-CG 3.3Å; I302-L306 PolarHBondContact O-N 2.84Å |
| 303 | L | 78.9 | Confident | 77.4 | Confident | 27 Ų | 27 | 40.5 Ų | 40.5 | 14% | 0.141 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.9 | -35.3 | 177.9 | -66.6 | 172.9 | 0 | 0 | 0 | 111.6 | A250 V251 A254 L299 N300 P301 I307 | A250-L303 HydrophobicContact CB-CD2 4.13Å; V251-L303 HydrophobicContact CB-CD1 4.44Å; V251-L303 HydrophobicContact CG2-CB 4.08Å; V251-L303 HydrophobicContact CG2-CD1 3.81Å; A254-L303 HydrophobicContact CB-CD1 3.81Å; L299-L303 HydrophobicContact CB-CD1 4.37Å; L299-L303 WeakPolarHBondContact O-CB 3.3Å; L299-L303 VanDerWaalsContact O-CG 3.25Å; L299-L303 WeakPolarHBondContact O-CG 3.46Å; L299-L303 PolarHBondContact O-N 3.08Å; N300-L303 PolarHBondContact O-N 3.17Å; P301-L303 PolarHBondContact O-N 3.39Å; L303-I307 HydrophobicContact CB-CD1 4.36Å; L303-I307 HydrophobicContact CD2-CD1 3.84Å; L303-I307 WeakPolarHBondContact O-CB 3.17Å; L303-I307 VanDerWaalsContact O-CG1 3.31Å; L303-I307 WeakPolarHBondContact O-CG1 3.29Å; L303-I307 PolarHBondContact O-N 2.89Å |
| 304 | Y | 75.2 | Confident | 76.1 | Confident | 13 Ų | 13 | 46.7 Ų | 46.7 | 5% | 0.051 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -65.4 | -44.7 | 174 | -54.9 | -26.8 | 0 | 0 | 0 | 112.1 | V59 F76 L79 T247 V251 N300 P301 I302 S308 | V59-Y304 HydrophobicContact CG2-CD2 4.29Å; F76-Y304 AromaticContact CD1-CE1 3.79Å; F76-Y304 HydrophobicContact CD1-CE1 3.79Å; F76-Y304 AromaticContact CD1-CE2 3.81Å; F76-Y304 HydrophobicContact CD1-CE2 3.81Å; F76-Y304 AromaticContact CD1-CZ 3.4Å; F76-Y304 VanDerWaalsContact CD1-CZ 3.4Å; F76-Y304 WeakPolarHBondContact CD1-OH 3.14Å; F76-Y304 HydrophobicContact CE1-CD1 4.21Å; F76-Y304 AromaticContact CE1-CE1 3.47Å; F76-Y304 HydrophobicContact CE1-CE1 3.47Å; F76-Y304 VanDerWaalsContact CE1-CE1 3.47Å; F76-Y304 HydrophobicContact CE1-CE2 4.36Å; F76-Y304 AromaticContact CE1-CZ 3.59Å; F76-Y304 HydrophobicContact CZ-CE1 4.45Å; L79-Y304 WeakPolarHBondContact CD2-OH 3.38Å; T247-Y304 HydrophobicContact CG2-CD1 3.96Å; V251-Y304 HydrophobicContact CG2-CE1 3.97Å; N300-Y304 HydrophobicContact CB-CE2 4.15Å; N300-Y304 WeakPolarHBondContact O-CD1 3.04Å; N300-Y304 VanDerWaalsContact O-CD2 3.22Å; N300-Y304 WeakPolarHBondContact O-CD2 3.35Å; N300-Y304 WeakPolarHBondContact O-CE2 3.24Å; N300-Y304 PolarHBondContact O-N 2.79Å; N300-Y304 VanDerWaalsContact O-N 3.09Å; P301-Y304 PolarHBondContact O-N 3.21Å; I302-Y304 VanDerWaalsContact C-N 3.31Å; I302-Y304 PolarHBondContact O-N 3.49Å; Y304-S308 WeakPolarHBondContact O-CB 3.21Å; Y304-S308 PolarHBondContact O-N 3.21Å |
| 305 | V | 69.6 | Low | 74.8 | Confident | 46 Ų | 46 | 48.2 Ų | 48.2 | 28% | 0.279 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -70 | -51.5 | -179.5 | 177.8 | 0 | 0 | 0 | 0 | 110.3 | P301 I302 I307 F311 Q312 | P301-V305 VanDerWaalsContact O-CG2 3.23Å; P301-V305 WeakPolarHBondContact O-CG2 3.12Å; P301-V305 PolarHBondContact O-N 2.87Å; I302-V305 PolarHBondContact O-N 3.02Å; V305-I307 VanDerWaalsContact C-N 3.32Å; V305-I307 PolarHBondContact O-N 3.44Å; V305-F311 HydrophobicContact CB-CD1 4.28Å; V305-F311 HydrophobicContact CB-CE1 4.37Å; V305-F311 HydrophobicContact CG2-CD1 3.75Å; V305-F311 HydrophobicContact CG2-CE1 3.38Å; V305-F311 HydrophobicContact CG2-CZ 4.21Å; V305-Q312 HydrophobicContact CG1-CG 4.49Å; V305-Q312 VanDerWaalsContact O-CD 3.26Å; V305-Q312 WeakPolarHBondContact O-CG 3.41Å; V305-Q312 PolarHBondContact O-NE2 3.14Å |
| 306 | L | 62.4 | Low | 73.9 | Confident | 110 Ų | 110 | 52.9 Ų | 52.9 | 58% | 0.576 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -67.3 | -33.1 | -175.8 | -66.7 | -179.7 | 0 | 0 | 0 | 112.2 | R243 I302 Q312 | R243-L306 PolarHBondContact NH2-O 3.3Å; I302-L306 HydrophobicContact CG2-CD1 3.49Å; I302-L306 VanDerWaalsContact CG2-CD1 3.49Å; I302-L306 HydrophobicContact CG2-CG 4.04Å; I302-L306 WeakPolarHBondContact O-CB 3.26Å; I302-L306 VanDerWaalsContact O-CG 3.3Å; I302-L306 WeakPolarHBondContact O-CG 3.3Å; I302-L306 PolarHBondContact O-N 2.84Å; L306-Q312 PolarHBondContact O-NE2 3.22Å |
| 307 | I | 61.8 | Low | 72.9 | Confident | 36 Ų | 36 | 56 Ų | 56 | 19% | 0.185 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -106.3 | 2.4 | -172.6 | -43.5 | 172.7 | 0 | 0 | 0 | 112 | R243 W246 T247 A250 L303 V305 | R243-I307 WeakPolarHBondContact CD-O 3.28Å; R243-I307 HydrophobicContact CG-CG2 4.22Å; R243-I307 WeakPolarHBondContact CG-O 3.25Å; R243-I307 PolarHBondContact NE-O 3.25Å; W246-I307 HydrophobicContact CB-CG2 4.09Å; T247-I307 HydrophobicContact CG2-CB 4.37Å; T247-I307 VanDerWaalsContact OG1-CG2 3.29Å; T247-I307 WeakPolarHBondContact OG1-CG2 3.16Å; T247-I307 PolarHBondContact OG1-O 3.44Å; A250-I307 HydrophobicContact CB-CD1 3.42Å; A250-I307 VanDerWaalsContact CB-CD1 3.42Å; L303-I307 HydrophobicContact CB-CD1 4.36Å; L303-I307 HydrophobicContact CD2-CD1 3.84Å; L303-I307 WeakPolarHBondContact O-CB 3.17Å; L303-I307 VanDerWaalsContact O-CG1 3.31Å; L303-I307 WeakPolarHBondContact O-CG1 3.29Å; L303-I307 PolarHBondContact O-N 2.89Å; V305-I307 VanDerWaalsContact C-N 3.32Å; V305-I307 PolarHBondContact O-N 3.44Å |
| 308 | S | 64 | Low | 71.9 | Confident | 36 Ų | 36 | 57 Ų | 57 | 25% | 0.252 | 29% | 0.288 | S | S | . | . | trans | -121.7 | 102.1 | 171.4 | -177.1 | 0 | 0 | 0 | 0 | 112.5 | Y304 K310 F311 Q312 | Y304-S308 WeakPolarHBondContact O-CB 3.21Å; Y304-S308 PolarHBondContact O-N 3.21Å; S308-K310 PolarHBondContact O-N 3.42Å; S308-K310 VanDerWaalsContact O-N 3.17Å; S308-F311 CarbonylContact O-C 3.55Å; S308-F311 WeakPolarHBondContact O-CA 3.33Å; S308-F311 WeakPolarHBondContact O-CB 3.38Å; S308-F311 PolarHBondContact O-N 3.43Å; S308-F311 PolarHBondContact OG-N 3.17Å; S308-F311 VanDerWaalsContact OG-N 3.14Å; S308-Q312 WeakPolarHBondContact O-CG 3.47Å; S308-Q312 PolarHBondContact O-N 3.32Å | ||
| 309 | K | 58.6 | Low | 71.3 | Confident | 149 Ų | 149 | 59.9 Ų | 59.9 | 65% | 0.648 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -56.8 | -30.1 | 172.4 | -115.7 | 168.4 | -159.1 | -169.9 | 0 | 112.1 | R243 A313 | R243-K309 VanDerWaalsContact CZ-N 3.28Å; K309-A313 VanDerWaalsContact O-CB 3.24Å; K309-A313 WeakPolarHBondContact O-CB 3.46Å; K309-A313 PolarHBondContact O-N 2.9Å |
| 310 | K | 59.9 | Low | 70.6 | Confident | 153 Ų | 153 | 59.4 Ų | 59.4 | 67% | 0.665 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -71.1 | -40.6 | 175.4 | -167.8 | 177.7 | -178 | 179.4 | 0 | 111.2 | S308 R314 | S308-K310 PolarHBondContact O-N 3.42Å; S308-K310 VanDerWaalsContact O-N 3.17Å; K310-R314 VanDerWaalsContact O-CB 3.26Å; K310-R314 WeakPolarHBondContact O-CB 3.45Å; K310-R314 WeakPolarHBondContact O-CG 3.42Å; K310-R314 PolarHBondContact O-N 3.39Å |
| 311 | F | 59.9 | Low | 70.3 | Confident | 7 Ų | 7 | 65.2 Ų | 65.2 | 3% | 0.031 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64.6 | -48 | 170.7 | -169.3 | -76.8 | 0 | 0 | 0 | 110.2 | M63 W67 V305 S308 A313 R314 F315 | M63-F311 HydrophobicContact CE-CD2 4.18Å; M63-F311 HydrophobicContact CE-CE2 3.96Å; W67-F311 HydrophobicContact CH2-CB 4.32Å; W67-F311 AromaticContact CH2-CD2 3.29Å; W67-F311 HydrophobicContact CH2-CD2 3.29Å; W67-F311 AromaticContact CH2-CE2 3.7Å; W67-F311 HydrophobicContact CH2-CE2 3.7Å; W67-F311 AromaticContact CH2-CG 3.97Å; W67-F311 HydrophobicContact CH2-CG 3.97Å; W67-F311 HydrophobicContact CZ2-CD2 4.22Å; W67-F311 HydrophobicContact CZ2-CE2 4.41Å; W67-F311 AromaticContact CZ3-CD2 3.93Å; W67-F311 HydrophobicContact CZ3-CD2 3.93Å; W67-F311 HydrophobicContact CZ3-CE2 4.25Å; V305-F311 HydrophobicContact CB-CD1 4.28Å; V305-F311 HydrophobicContact CB-CE1 4.37Å; V305-F311 HydrophobicContact CG2-CD1 3.75Å; V305-F311 HydrophobicContact CG2-CE1 3.38Å; V305-F311 HydrophobicContact CG2-CZ 4.21Å; S308-F311 CarbonylContact O-C 3.55Å; S308-F311 WeakPolarHBondContact O-CA 3.33Å; S308-F311 WeakPolarHBondContact O-CB 3.38Å; S308-F311 PolarHBondContact O-N 3.43Å; S308-F311 PolarHBondContact OG-N 3.17Å; S308-F311 VanDerWaalsContact OG-N 3.14Å; F311-A313 PolarHBondContact O-N 3.09Å; F311-R314 PolarHBondContact O-N 3.39Å; F311-F315 HydrophobicContact CD1-CB 4.17Å; F311-F315 HydrophobicContact CE1-CB 4.1Å; F311-F315 HydrophobicContact CE1-CD2 4.17Å; F311-F315 HydrophobicContact CE1-CG 4.33Å; F311-F315 WeakPolarHBondContact O-CB 3.17Å; F311-F315 PolarHBondContact O-N 3.25Å |
| 312 | Q | 65.4 | Low | 70.1 | Confident | 47 Ų | 47 | 69 Ų | 69 | 22% | 0.22 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -55.4 | -51.2 | 176.5 | -67.4 | 173.3 | -10.1 | 0 | 0 | 111.9 | V305 L306 S308 R314 F315 Q316 | V305-Q312 HydrophobicContact CG1-CG 4.49Å; V305-Q312 VanDerWaalsContact O-CD 3.26Å; V305-Q312 WeakPolarHBondContact O-CG 3.41Å; V305-Q312 PolarHBondContact O-NE2 3.14Å; L306-Q312 PolarHBondContact O-NE2 3.22Å; S308-Q312 WeakPolarHBondContact O-CG 3.47Å; S308-Q312 PolarHBondContact O-N 3.32Å; Q312-R314 PolarHBondContact O-N 3.14Å; Q312-F315 PolarHBondContact O-N 2.85Å; Q312-Q316 VanDerWaalsContact O-CB 3.26Å; Q312-Q316 WeakPolarHBondContact O-CB 3.49Å; Q312-Q316 WeakPolarHBondContact O-CG 3.4Å; Q312-Q316 PolarHBondContact O-N 3.42Å |
| 313 | A | 64.1 | Low | 70.2 | Confident | 55 Ų | 55 | 71 Ų | 71 | 46% | 0.455 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.1 | -41.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | K309 F311 S317 | K309-A313 VanDerWaalsContact O-CB 3.24Å; K309-A313 WeakPolarHBondContact O-CB 3.46Å; K309-A313 PolarHBondContact O-N 2.9Å; F311-A313 PolarHBondContact O-N 3.09Å; A313-S317 VanDerWaalsContact O-CB 3.25Å; A313-S317 WeakPolarHBondContact O-CB 3.27Å; A313-S317 PolarHBondContact O-N 2.98Å |
| 314 | R | 66.4 | Low | 70.4 | Confident | 132 Ų | 132 | 77 Ų | 77 | 50% | 0.498 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -67.4 | -40.8 | 176.6 | -70.5 | -99.5 | 178.3 | 159.3 | -4.8 | 111.9 | W67 K310 F311 Q312 S318 | W67-R314 HydrophobicContact CH2-CB 4.37Å; W67-R314 HydrophobicContact CZ2-CB 3.48Å; W67-R314 VanDerWaalsContact CZ2-CB 3.48Å; W67-R314 HydrophobicContact CZ2-CG 4.11Å; K310-R314 VanDerWaalsContact O-CB 3.26Å; K310-R314 WeakPolarHBondContact O-CB 3.45Å; K310-R314 WeakPolarHBondContact O-CG 3.42Å; K310-R314 PolarHBondContact O-N 3.39Å; F311-R314 PolarHBondContact O-N 3.39Å; Q312-R314 PolarHBondContact O-N 3.14Å; R314-S318 WeakPolarHBondContact O-CB 3.47Å; R314-S318 PolarHBondContact O-N 3.32Å; R314-S318 PolarHBondContact O-OG 2.93Å |
| 315 | F | 68.4 | Low | 70.6 | Confident | 57 Ų | 57 | 83.4 Ų | 83.4 | 25% | 0.25 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -63.4 | -53.1 | 176.5 | 179.1 | -98.5 | 0 | 0 | 0 | 110.1 | I58 F62 F311 Q312 S317 S318 V319 | I58-F315 HydrophobicContact CD1-CE2 4.3Å; I58-F315 HydrophobicContact CG2-CD2 4.09Å; I58-F315 HydrophobicContact CG2-CE2 3.67Å; F62-F315 HydrophobicContact CD2-CD2 4.2Å; F62-F315 AromaticContact CE2-CD2 3.41Å; F62-F315 HydrophobicContact CE2-CD2 3.41Å; F62-F315 VanDerWaalsContact CE2-CD2 3.41Å; F62-F315 AromaticContact CE2-CE2 3.83Å; F62-F315 HydrophobicContact CE2-CE2 3.83Å; F62-F315 AromaticContact CZ-CD2 3.93Å; F62-F315 HydrophobicContact CZ-CD2 3.93Å; F311-F315 HydrophobicContact CD1-CB 4.17Å; F311-F315 HydrophobicContact CE1-CB 4.1Å; F311-F315 HydrophobicContact CE1-CD2 4.17Å; F311-F315 HydrophobicContact CE1-CG 4.33Å; F311-F315 WeakPolarHBondContact O-CB 3.17Å; F311-F315 PolarHBondContact O-N 3.25Å; Q312-F315 PolarHBondContact O-N 2.85Å; F315-S317 VanDerWaalsContact C-N 3.35Å; F315-S317 PolarHBondContact O-N 2.89Å; F315-S318 PolarHBondContact O-N 3.29Å; F315-S318 VanDerWaalsContact O-N 3.14Å; F315-V319 HydrophobicContact CD1-CG2 4.18Å; F315-V319 HydrophobicContact CD2-CG2 4.37Å; F315-V319 HydrophobicContact CE1-CG2 3.84Å; F315-V319 HydrophobicContact CE2-CG2 4.02Å; F315-V319 HydrophobicContact CG-CG2 4.43Å; F315-V319 HydrophobicContact CZ-CG2 3.75Å; F315-V319 WeakPolarHBondContact O-CB 3.3Å; F315-V319 VanDerWaalsContact O-CG2 3.32Å; F315-V319 WeakPolarHBondContact O-CG2 3.5Å; F315-V319 PolarHBondContact O-N 2.82Å |
| 316 | Q | 74.9 | Confident | 71 | Confident | 126 Ų | 126 | 84 Ų | 84 | 59% | 0.589 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -57.5 | -44.6 | 176.1 | -73.9 | 173.3 | -9.7 | 0 | 0 | 112 | Q312 S318 A320 | Q312-Q316 VanDerWaalsContact O-CB 3.26Å; Q312-Q316 WeakPolarHBondContact O-CB 3.49Å; Q312-Q316 WeakPolarHBondContact O-CG 3.4Å; Q312-Q316 PolarHBondContact O-N 3.42Å; Q316-S318 VanDerWaalsContact C-N 3.33Å; Q316-S318 PolarHBondContact O-N 3.38Å; Q316-A320 WeakPolarHBondContact O-CB 3.47Å; Q316-A320 PolarHBondContact O-N 3.47Å |
| 317 | S | 73.7 | Confident | 71.8 | Confident | 67 Ų | 67 | 84 Ų | 84 | 47% | 0.469 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.1 | -41.8 | 176.6 | -172.7 | 0 | 0 | 0 | 0 | 112.2 | A313 F315 A320 E321 | A313-S317 VanDerWaalsContact O-CB 3.25Å; A313-S317 WeakPolarHBondContact O-CB 3.27Å; A313-S317 PolarHBondContact O-N 2.98Å; F315-S317 VanDerWaalsContact C-N 3.35Å; F315-S317 PolarHBondContact O-N 2.89Å; S317-A320 PolarHBondContact O-N 3.24Å; S317-E321 PolarHBondContact O-N 3.15Å |
| 318 | S | 72.9 | Confident | 72.7 | Confident | 19 Ų | 19 | 90.8 Ų | 90.8 | 13% | 0.133 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -76.7 | -37.2 | -177.1 | -54.1 | 0 | 0 | 0 | 0 | 112.1 | F62 R314 F315 Q316 A320 E321 I322 | F62-S318 WeakPolarHBondContact CE1-OG 3.16Å; R314-S318 WeakPolarHBondContact O-CB 3.47Å; R314-S318 PolarHBondContact O-N 3.32Å; R314-S318 PolarHBondContact O-OG 2.93Å; F315-S318 PolarHBondContact O-N 3.29Å; F315-S318 VanDerWaalsContact O-N 3.14Å; Q316-S318 VanDerWaalsContact C-N 3.33Å; Q316-S318 PolarHBondContact O-N 3.38Å; S318-A320 VanDerWaalsContact C-N 3.33Å; S318-E321 PolarHBondContact O-N 2.95Å; S318-I322 VanDerWaalsContact O-CG1 3.32Å; S318-I322 WeakPolarHBondContact O-CG1 3.42Å; S318-I322 PolarHBondContact O-N 3Å |
| 319 | V | 77.9 | Confident | 73.4 | Confident | 63 Ų | 63 | 93.8 Ų | 93.8 | 38% | 0.382 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 171 | 171.4 | 0 | 0 | 0 | 0 | 109.9 | F315 E321 I322 L323 | F315-V319 HydrophobicContact CD1-CG2 4.18Å; F315-V319 HydrophobicContact CD2-CG2 4.37Å; F315-V319 HydrophobicContact CE1-CG2 3.84Å; F315-V319 HydrophobicContact CE2-CG2 4.02Å; F315-V319 HydrophobicContact CG-CG2 4.43Å; F315-V319 HydrophobicContact CZ-CG2 3.75Å; F315-V319 WeakPolarHBondContact O-CB 3.3Å; F315-V319 VanDerWaalsContact O-CG2 3.32Å; F315-V319 WeakPolarHBondContact O-CG2 3.5Å; F315-V319 PolarHBondContact O-N 2.82Å; V319-E321 VanDerWaalsContact C-N 3.34Å; V319-E321 PolarHBondContact O-N 3.47Å; V319-I322 PolarHBondContact O-N 3.29Å; V319-L323 VanDerWaalsContact O-CB 3.24Å; V319-L323 WeakPolarHBondContact O-CB 3.38Å; V319-L323 PolarHBondContact O-N 3.29Å |
| 320 | A | 77.9 | Confident | 74.1 | Confident | 41 Ų | 41 | 91.6 Ų | 91.6 | 34% | 0.339 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.9 | -38.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q316 S317 S318 K324 | Q316-A320 WeakPolarHBondContact O-CB 3.47Å; Q316-A320 PolarHBondContact O-N 3.47Å; S317-A320 PolarHBondContact O-N 3.24Å; S318-A320 VanDerWaalsContact C-N 3.33Å; A320-K324 VanDerWaalsContact O-CB 3.29Å; A320-K324 WeakPolarHBondContact O-CB 3.25Å; A320-K324 WeakPolarHBondContact O-CG 3.44Å; A320-K324 PolarHBondContact O-N 2.87Å |
| 321 | E | 80.1 | Confident | 74.9 | Confident | 123 Ų | 123 | 87.7 Ų | 87.7 | 58% | 0.575 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -65.6 | -44.7 | 173.6 | -80.3 | -178.2 | -179.6 | 0 | 0 | 112.5 | S317 S318 V319 K324 Y325 | S317-E321 PolarHBondContact O-N 3.15Å; S318-E321 PolarHBondContact O-N 2.95Å; V319-E321 VanDerWaalsContact C-N 3.34Å; V319-E321 PolarHBondContact O-N 3.47Å; E321-K324 PolarHBondContact O-N 3.35Å; E321-Y325 WeakPolarHBondContact O-CB 3.26Å; E321-Y325 PolarHBondContact O-N 2.74Å |
| 322 | I | 79.8 | Confident | 75.5 | Confident | 84 Ų | 84 | 89.6 Ų | 89.6 | 43% | 0.431 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.9 | -42.8 | 177.7 | -67.2 | 166.5 | 0 | 0 | 0 | 110.7 | S318 V319 K324 Y325 T326 | S318-I322 VanDerWaalsContact O-CG1 3.32Å; S318-I322 WeakPolarHBondContact O-CG1 3.42Å; S318-I322 PolarHBondContact O-N 3Å; V319-I322 PolarHBondContact O-N 3.29Å; I322-K324 VanDerWaalsContact C-N 3.35Å; I322-Y325 PolarHBondContact O-N 2.85Å; I322-T326 PolarHBondContact O-N 3.14Å; I322-T326 PolarHBondContact O-OG1 3.27Å |
| 323 | L | 83.3 | Confident | 75.7 | Confident | 100 Ų | 100 | 91.2 Ų | 91.2 | 52% | 0.524 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.5 | -42.1 | 176.6 | -166.3 | 79.2 | 0 | 0 | 0 | 110.8 | V319 T326 L327 | V319-L323 VanDerWaalsContact O-CB 3.24Å; V319-L323 WeakPolarHBondContact O-CB 3.38Å; V319-L323 PolarHBondContact O-N 3.29Å; L323-T326 WeakPolarHBondContact CA-OG1 3.29Å; L323-T326 PolarHBondContact O-OG1 3.49Å; L323-T326 VanDerWaalsContact O-OG1 3.08Å; L323-L327 HydrophobicContact CD2-CD1 4.29Å; L323-L327 HydrophobicContact CG-CD1 3.96Å; L323-L327 HydrophobicContact CG-CG 4.43Å; L323-L327 VanDerWaalsContact O-CB 3.24Å; L323-L327 WeakPolarHBondContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.28Å; L323-L327 PolarHBondContact O-N 2.91Å |
| 324 | K | 81.4 | Confident | 75.9 | Confident | 154 Ų | 154 | 90.3 Ų | 90.3 | 67% | 0.67 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62.3 | -43.5 | 174.4 | -79 | 174 | -178.3 | -174.1 | 0 | 111.8 | A320 E321 I322 W328 | A320-K324 VanDerWaalsContact O-CB 3.29Å; A320-K324 WeakPolarHBondContact O-CB 3.25Å; A320-K324 WeakPolarHBondContact O-CG 3.44Å; A320-K324 PolarHBondContact O-N 2.87Å; E321-K324 PolarHBondContact O-N 3.35Å; I322-K324 VanDerWaalsContact C-N 3.35Å; K324-W328 VanDerWaalsContact O-CB 3.22Å; K324-W328 WeakPolarHBondContact O-CB 3.46Å; K324-W328 PolarHBondContact O-N 3.48Å |
| 325 | Y | 79.2 | Confident | 75.9 | Confident | 146 Ų | 146 | 87.4 Ų | 87.4 | 57% | 0.573 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -64.1 | -47.2 | 178.6 | -179.4 | -90.2 | 0 | 0 | 0 | 111.7 | E321 I322 W328 E329 | E321-Y325 WeakPolarHBondContact O-CB 3.26Å; E321-Y325 PolarHBondContact O-N 2.74Å; I322-Y325 PolarHBondContact O-N 2.85Å; Y325-W328 WeakPolarHBondContact O-CB 3.39Å; Y325-W328 PolarHBondContact O-N 3.4Å; Y325-E329 WeakPolarHBondContact CE1-OE2 3.26Å; Y325-E329 WeakPolarHBondContact O-CB 3.31Å; Y325-E329 PolarHBondContact O-N 3.38Å |
| 326 | T | 78.4 | Confident | 75.7 | Confident | 59 Ų | 59 | 88.5 Ų | 88.5 | 36% | 0.362 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66 | -41.5 | 177.8 | 41.7 | 0 | 0 | 0 | 0 | 112.4 | I322 L323 W328 E329 V330 | I322-T326 PolarHBondContact O-N 3.14Å; I322-T326 PolarHBondContact O-OG1 3.27Å; L323-T326 WeakPolarHBondContact CA-OG1 3.29Å; L323-T326 PolarHBondContact O-OG1 3.49Å; L323-T326 VanDerWaalsContact O-OG1 3.08Å; T326-W328 VanDerWaalsContact C-N 3.34Å; T326-W328 PolarHBondContact O-N 2.97Å; T326-E329 PolarHBondContact O-N 3.41Å; T326-V330 WeakPolarHBondContact O-CB 3.48Å; T326-V330 VanDerWaalsContact O-CG2 3.26Å; T326-V330 WeakPolarHBondContact O-CG2 3.28Å; T326-V330 PolarHBondContact O-N 2.72Å |
| 327 | L | 79.8 | Confident | 75.3 | Confident | 110 Ų | 110 | 86.3 Ų | 86.3 | 58% | 0.576 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.4 | -39 | 173.3 | -73.8 | 170.6 | 0 | 0 | 0 | 112.1 | L323 S331 | L323-L327 HydrophobicContact CD2-CD1 4.29Å; L323-L327 HydrophobicContact CG-CD1 3.96Å; L323-L327 HydrophobicContact CG-CG 4.43Å; L323-L327 VanDerWaalsContact O-CB 3.24Å; L323-L327 WeakPolarHBondContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.28Å; L323-L327 PolarHBondContact O-N 2.91Å; L327-S331 VanDerWaalsContact O-CB 3.26Å; L327-S331 WeakPolarHBondContact O-CB 3.16Å; L327-S331 PolarHBondContact O-N 3.33Å |
| 328 | W | 81.1 | Confident | 74.8 | Confident | 178 Ų | 178 | 88.3 Ų | 88.3 | 67% | 0.674 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.6 | -45.6 | 174.2 | 177.1 | -97.2 | 0 | 0 | 0 | 111.7 | K324 Y325 T326 S331 C332 | K324-W328 VanDerWaalsContact O-CB 3.22Å; K324-W328 WeakPolarHBondContact O-CB 3.46Å; K324-W328 PolarHBondContact O-N 3.48Å; Y325-W328 WeakPolarHBondContact O-CB 3.39Å; Y325-W328 PolarHBondContact O-N 3.4Å; T326-W328 VanDerWaalsContact C-N 3.34Å; T326-W328 PolarHBondContact O-N 2.97Å; W328-S331 WeakPolarHBondContact O-CB 3.45Å; W328-S331 PolarHBondContact O-N 3.03Å; W328-C332 PolarHBondContact O-N 3.42Å |
| 329 | E | 77.6 | Confident | 74.4 | Confident | 99 Ų | 99 | 94.1 Ų | 94.1 | 46% | 0.463 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 179 | -169.3 | 172.7 | -160.8 | 0 | 0 | 112.2 | Y325 T326 C332 S333 | Y325-E329 WeakPolarHBondContact CE1-OE2 3.26Å; Y325-E329 WeakPolarHBondContact O-CB 3.31Å; Y325-E329 PolarHBondContact O-N 3.38Å; T326-E329 PolarHBondContact O-N 3.41Å; E329-C332 PolarHBondContact O-N 3.37Å; E329-S333 WeakPolarHBondContact O-CB 3.18Å; E329-S333 PolarHBondContact O-N 2.72Å |
| 330 | V | 74.5 | Confident | 73.6 | Confident | 103 Ų | 103 | 96.1 Ų | 96.1 | 62% | 0.624 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.3 | -41.8 | 172.7 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | T326 C332 S333 G334 | T326-V330 WeakPolarHBondContact O-CB 3.48Å; T326-V330 VanDerWaalsContact O-CG2 3.26Å; T326-V330 WeakPolarHBondContact O-CG2 3.28Å; T326-V330 PolarHBondContact O-N 2.72Å; V330-C332 PolarHBondContact O-N 3.36Å; V330-S333 PolarHBondContact O-N 3.16Å; V330-G334 PolarHBondContact O-N 3.02Å |
| 331 | S | 76.6 | Confident | 72.9 | Confident | 72 Ų | 72 | 101.5 Ų | 101.5 | 50% | 0.503 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.7 | -41.7 | 176.4 | -171.1 | 0 | 0 | 0 | 0 | 112.1 | L327 W328 G334 T335 | L327-S331 VanDerWaalsContact O-CB 3.26Å; L327-S331 WeakPolarHBondContact O-CB 3.16Å; L327-S331 PolarHBondContact O-N 3.33Å; W328-S331 WeakPolarHBondContact O-CB 3.45Å; W328-S331 PolarHBondContact O-N 3.03Å; S331-G334 PolarHBondContact O-N 3.17Å; S331-T335 PolarHBondContact O-N 3.06Å; S331-T335 VanDerWaalsContact O-N 3.07Å; S331-T335 PolarHBondContact O-OG1 3.04Å |
| 332 | C | 71.8 | Confident | 72.2 | Confident | 47 Ų | 47 | 100.5 Ų | 100.5 | 32% | 0.318 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.9 | -43.5 | 176.2 | -78.5 | 0 | 0 | 0 | 0 | 112.2 | W328 E329 V330 G334 T335 V336 | W328-C332 PolarHBondContact O-N 3.42Å; E329-C332 PolarHBondContact O-N 3.37Å; V330-C332 PolarHBondContact O-N 3.36Å; C332-G334 VanDerWaalsContact C-N 3.3Å; C332-G334 PolarHBondContact O-N 3.42Å; C332-T335 WeakPolarHBondContact CA-OG1 3.19Å; C332-T335 PolarHBondContact O-N 3.19Å; C332-T335 PolarHBondContact O-OG1 2.78Å; C332-V336 VanDerWaalsContact O-CG2 3.32Å; C332-V336 WeakPolarHBondContact O-CG2 3.47Å; C332-V336 PolarHBondContact O-N 2.93Å |
| 333 | S | 70.1 | Confident | 71.6 | Confident | 81 Ų | 81 | 99.3 Ų | 99.3 | 57% | 0.566 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.5 | -38.6 | 174.2 | -86.2 | 0 | 0 | 0 | 0 | 112.1 | E329 V330 S337 | E329-S333 WeakPolarHBondContact O-CB 3.18Å; E329-S333 PolarHBondContact O-N 2.72Å; V330-S333 PolarHBondContact O-N 3.16Å; S333-S337 WeakPolarHBondContact O-CB 3.33Å; S333-S337 PolarHBondContact O-N 3.3Å; S333-S337 VanDerWaalsContact O-N 3.08Å |
| 334 | G | 67.3 | Low | 70.8 | Confident | 35 Ų | 35 | 100.8 Ų | 100.8 | 36% | 0.361 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.8 | -44.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | V330 S331 C332 S337 E338 | V330-G334 PolarHBondContact O-N 3.02Å; S331-G334 PolarHBondContact O-N 3.17Å; C332-G334 VanDerWaalsContact C-N 3.3Å; C332-G334 PolarHBondContact O-N 3.42Å; G334-S337 PolarHBondContact O-N 3.01Å; G334-E338 PolarHBondContact O-N 3.48Å |
| 335 | T | 67.6 | Low | 69.9 | Low | 71 Ų | 71 | 97.4 Ų | 97.4 | 44% | 0.436 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69 | -37.5 | 179.4 | 16.9 | 0 | 0 | 0 | 0 | 112.8 | S331 C332 E338 Q339 | S331-T335 PolarHBondContact O-N 3.06Å; S331-T335 VanDerWaalsContact O-N 3.07Å; S331-T335 PolarHBondContact O-OG1 3.04Å; C332-T335 WeakPolarHBondContact CA-OG1 3.19Å; C332-T335 PolarHBondContact O-N 3.19Å; C332-T335 PolarHBondContact O-OG1 2.78Å; T335-E338 PolarHBondContact O-N 2.86Å; T335-Q339 WeakPolarHBondContact O-CB 3.37Å; T335-Q339 WeakPolarHBondContact O-CG 3.4Å; T335-Q339 PolarHBondContact O-N 3.41Å |
| 336 | V | 64.8 | Low | 69.1 | Low | 81 Ų | 81 | 97.8 Ų | 97.8 | 49% | 0.491 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.9 | -40.8 | 175.7 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | C332 Q339 L340 | C332-V336 VanDerWaalsContact O-CG2 3.32Å; C332-V336 WeakPolarHBondContact O-CG2 3.47Å; C332-V336 PolarHBondContact O-N 2.93Å; V336-Q339 PolarHBondContact O-N 3.34Å; V336-L340 HydrophobicContact CG1-CD1 4.07Å; V336-L340 PolarHBondContact O-N 2.97Å |
| 337 | S | 64.8 | Low | 68.4 | Low | 80 Ų | 80 | 99.4 Ų | 99.4 | 56% | 0.559 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.3 | -42.9 | 174.9 | -177.5 | 0 | 0 | 0 | 0 | 112.2 | S333 G334 L340 R341 | S333-S337 WeakPolarHBondContact O-CB 3.33Å; S333-S337 PolarHBondContact O-N 3.3Å; S333-S337 VanDerWaalsContact O-N 3.08Å; G334-S337 PolarHBondContact O-N 3.01Å; S337-L340 PolarHBondContact O-N 3.45Å; S337-R341 PolarHBondContact O-N 3.48Å |
| 338 | E | 64.3 | Low | 67.4 | Low | 109 Ų | 109 | 99.6 Ų | 99.6 | 51% | 0.509 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.9 | -37.5 | 175.7 | -76.9 | -173.9 | 154.9 | 0 | 0 | 113.2 | G334 T335 R341 N342 | G334-E338 PolarHBondContact O-N 3.48Å; T335-E338 PolarHBondContact O-N 2.86Å; E338-R341 PolarHBondContact O-N 2.85Å; E338-N342 WeakPolarHBondContact O-CB 3.45Å; E338-N342 PolarHBondContact O-N 3.5Å |
| 339 | Q | 63.3 | Low | 66.1 | Low | 140 Ų | 140 | 94.6 Ų | 94.6 | 65% | 0.654 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67 | -39.9 | 176 | -78.5 | -174.4 | -27.6 | 0 | 0 | 112.5 | T335 V336 N342 S343 | T335-Q339 WeakPolarHBondContact O-CB 3.37Å; T335-Q339 WeakPolarHBondContact O-CG 3.4Å; T335-Q339 PolarHBondContact O-N 3.41Å; V336-Q339 PolarHBondContact O-N 3.34Å; Q339-N342 PolarHBondContact O-N 3.39Å; Q339-S343 WeakPolarHBondContact O-CB 3.47Å; Q339-S343 PolarHBondContact O-N 3.26Å |
| 340 | L | 62.3 | Low | 65.1 | Low | 105 Ų | 105 | 95.3 Ų | 95.3 | 55% | 0.55 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.5 | -45.7 | 173.6 | -88.9 | 155.5 | 0 | 0 | 0 | 111.5 | V336 S337 N342 S343 E344 | V336-L340 HydrophobicContact CG1-CD1 4.07Å; V336-L340 PolarHBondContact O-N 2.97Å; S337-L340 PolarHBondContact O-N 3.45Å; L340-N342 PolarHBondContact O-N 2.93Å; L340-S343 WeakPolarHBondContact O-CB 3.44Å; L340-S343 PolarHBondContact O-N 3.21Å; L340-E344 PolarHBondContact O-N 3.14Å |
| 341 | R | 63.8 | Low | 64.3 | Low | 154 Ų | 154 | 96.6 Ų | 96.6 | 58% | 0.581 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63 | -40 | 177.4 | -163.5 | 174.7 | 70 | -168.3 | -1.5 | 112.4 | S337 E338 T345 | S337-R341 PolarHBondContact O-N 3.48Å; E338-R341 PolarHBondContact O-N 2.85Å; R341-T345 WeakPolarHBondContact O-CB 3.5Å; R341-T345 PolarHBondContact O-N 3.24Å; R341-T345 PolarHBondContact O-OG1 3.37Å |
| 342 | N | 65.1 | Low | 63.5 | Low | 102 Ų | 102 | 99.8 Ų | 99.8 | 55% | 0.545 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.7 | -32 | 175.8 | -81.5 | -9.8 | 0 | 0 | 0 | 112.9 | E338 Q339 L340 K346 | E338-N342 WeakPolarHBondContact O-CB 3.45Å; E338-N342 PolarHBondContact O-N 3.5Å; Q339-N342 PolarHBondContact O-N 3.39Å; L340-N342 PolarHBondContact O-N 2.93Å; N342-K346 WeakPolarHBondContact O-CB 3.36Å; N342-K346 PolarHBondContact O-N 3.17Å |
| 343 | S | 66.1 | Low | 62.8 | Low | 60 Ų | 60 | 102.4 Ų | 102.4 | 42% | 0.42 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.4 | -46.9 | 173.1 | 179.2 | 0 | 0 | 0 | 0 | 111.4 | Q339 L340 T345 K346 N347 | Q339-S343 WeakPolarHBondContact O-CB 3.47Å; Q339-S343 PolarHBondContact O-N 3.26Å; L340-S343 WeakPolarHBondContact O-CB 3.44Å; L340-S343 PolarHBondContact O-N 3.21Å; S343-T345 VanDerWaalsContact C-N 3.35Å; S343-T345 PolarHBondContact O-N 3.16Å; S343-K346 PolarHBondContact O-N 2.83Å; S343-N347 WeakPolarHBondContact O-CB 3.44Å; S343-N347 PolarHBondContact O-N 3.45Å; S343-N347 PolarHBondContact O-ND2 3.31Å |
| 344 | E | 67 | Low | 62 | Low | 131 Ų | 131 | 102.8 Ų | 102.8 | 61% | 0.612 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.1 | -43.1 | 175.3 | -74.1 | 178.2 | 160.2 | 0 | 0 | 111.7 | L340 K346 N347 L348 | L340-E344 PolarHBondContact O-N 3.14Å; E344-K346 PolarHBondContact O-N 2.97Å; E344-N347 PolarHBondContact O-N 3.32Å; E344-L348 WeakPolarHBondContact O-CB 3.42Å; E344-L348 PolarHBondContact O-N 3.14Å |
| 345 | T | 63.6 | Low | 60.8 | Low | 83 Ų | 83 | 112.1 Ų | 112.1 | 51% | 0.509 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.5 | -38.6 | 177.9 | -46.4 | 0 | 0 | 0 | 0 | 111.9 | R341 S343 L348 C349 | R341-T345 WeakPolarHBondContact O-CB 3.5Å; R341-T345 PolarHBondContact O-N 3.24Å; R341-T345 PolarHBondContact O-OG1 3.37Å; S343-T345 VanDerWaalsContact C-N 3.35Å; S343-T345 PolarHBondContact O-N 3.16Å; T345-L348 PolarHBondContact O-N 3.08Å; T345-C349 WeakPolarHBondContact O-CB 3.22Å; T345-C349 PolarHBondContact O-N 3.38Å |
| 346 | K | 62 | Low | 60.5 | Low | 154 Ų | 154 | 114.2 Ų | 114.2 | 67% | 0.67 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.5 | -42.1 | 173.7 | -98.9 | -176.3 | 173.4 | -179.3 | 0 | 112.4 | N342 S343 E344 L348 C349 L350 | N342-K346 WeakPolarHBondContact O-CB 3.36Å; N342-K346 PolarHBondContact O-N 3.17Å; S343-K346 PolarHBondContact O-N 2.83Å; E344-K346 PolarHBondContact O-N 2.97Å; K346-L348 VanDerWaalsContact C-N 3.31Å; K346-C349 PolarHBondContact O-N 3.19Å; K346-L350 WeakPolarHBondContact O-CG 3.5Å; K346-L350 PolarHBondContact O-N 3.44Å |
| 347 | N | 62.5 | Low | 60.3 | Low | 92 Ų | 92 | 115.9 Ų | 115.9 | 49% | 0.492 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -65.9 | -36.3 | 177.6 | -73.8 | -28.2 | 0 | 0 | 0 | 111.5 | S343 E344 L351 | S343-N347 WeakPolarHBondContact O-CB 3.44Å; S343-N347 PolarHBondContact O-N 3.45Å; S343-N347 PolarHBondContact O-ND2 3.31Å; E344-N347 PolarHBondContact O-N 3.32Å; N347-L351 PolarHBondContact O-N 3.05Å |
| 348 | L | 59.7 | Low | 60 | Low | 115 Ų | 115 | 117.9 Ų | 117.9 | 60% | 0.602 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -64.5 | -45 | 173.7 | -139.2 | 86 | 0 | 0 | 0 | 111.8 | E344 T345 K346 L350 L351 E352 | E344-L348 WeakPolarHBondContact O-CB 3.42Å; E344-L348 PolarHBondContact O-N 3.14Å; T345-L348 PolarHBondContact O-N 3.08Å; K346-L348 VanDerWaalsContact C-N 3.31Å; L348-L350 PolarHBondContact O-N 3.35Å; L348-L351 WeakPolarHBondContact O-CB 3.46Å; L348-L351 PolarHBondContact O-N 3.38Å; L348-E352 PolarHBondContact O-N 3.3Å |
| 349 | C | 54 | Low | 59.8 | Low | 73 Ų | 73 | 118.4 Ų | 118.4 | 49% | 0.493 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -66.8 | -36 | 179.7 | -165.7 | 0 | 0 | 0 | 0 | 112.4 | T345 K346 L351 E352 T353 | T345-C349 WeakPolarHBondContact O-CB 3.22Å; T345-C349 PolarHBondContact O-N 3.38Å; K346-C349 PolarHBondContact O-N 3.19Å; C349-L351 VanDerWaalsContact C-N 3.31Å; C349-L351 PolarHBondContact O-N 3.21Å; C349-E352 PolarHBondContact O-N 3.34Å; C349-T353 PolarHBondContact O-N 3.06Å; C349-T353 PolarHBondContact O-OG1 3.45Å |
| 350 | L | 56.8 | Low | 59.6 | Low | 113 Ų | 113 | 117.1 Ų | 117.1 | 59% | 0.592 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -65.8 | -33.6 | 173.5 | -76.5 | 169.7 | 0 | 0 | 0 | 112.7 | K346 L348 T353 | K346-L350 WeakPolarHBondContact O-CG 3.5Å; K346-L350 PolarHBondContact O-N 3.44Å; L348-L350 PolarHBondContact O-N 3.35Å; L350-T353 WeakPolarHBondContact CA-OG1 3.48Å; L350-T353 PolarHBondContact O-OG1 3.22Å |
| 351 | L | 56.7 | Low | 59.4 | Low | 131 Ų | 131 | 117.9 Ų | 117.9 | 69% | 0.686 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -69.8 | -36.1 | 176.6 | -113.5 | 137.7 | 0 | 0 | 0 | 112.4 | N347 L348 C349 | N347-L351 PolarHBondContact O-N 3.05Å; L348-L351 WeakPolarHBondContact O-CB 3.46Å; L348-L351 PolarHBondContact O-N 3.38Å; C349-L351 VanDerWaalsContact C-N 3.31Å; C349-L351 PolarHBondContact O-N 3.21Å |
| 352 | E | 59 | Low | 59.1 | Low | 138 Ų | 138 | 115.3 Ų | 115.3 | 65% | 0.645 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -72.5 | -29.5 | 176 | -74.6 | -179.3 | 157.1 | 0 | 0 | 113.2 | L348 C349 A354 | L348-E352 PolarHBondContact O-N 3.3Å; C349-E352 PolarHBondContact O-N 3.34Å; E352-A354 VanDerWaalsContact C-N 3.32Å; E352-A354 PolarHBondContact O-N 2.97Å |
| 353 | T | 57.9 | Low | 58.6 | Low | 103 Ų | 103 | 116.3 Ų | 116.3 | 63% | 0.632 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -7 | 177 | 48.1 | 0 | 0 | 0 | 0 | 115 | C349 L350 | C349-T353 PolarHBondContact O-N 3.06Å; C349-T353 PolarHBondContact O-OG1 3.45Å; L350-T353 WeakPolarHBondContact CA-OG1 3.48Å; L350-T353 PolarHBondContact O-OG1 3.22Å |
| 354 | A | 52.7 | Low | 58 | Low | 88 Ų | 88 | 121 Ų | 121 | 73% | 0.727 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.3 | 2.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | E352 | E352-A354 VanDerWaalsContact C-N 3.32Å; E352-A354 PolarHBondContact O-N 2.97Å |
| 355 | Q | 43.6 | Very low | 57.1 | Low | 231 Ų | 231 | 120.1 Ų | 120.1 | 100% | 1.079 | 65% | 0.648 | S | S | * | * | trans | -101.4 | 0 | 167.1 | -72.4 | -176.8 | -47.2 | 0 | 0 | 109.9 |
Retrieved 355 of 355 residues in 77.4 ms
(Link to these results)