| 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 | 37.3 | Very low | 37.4 | Very low | 233 Ų | 233 | 147.2 Ų | 147.2 | 100% | 1.148 | 83% | 0.831 | S | S | * | * | 0 | 78.6 | 0 | -87.1 | 178.4 | 166.4 | 0 | 0 | 105.2 | |||||
| 2 | D | 32.4 | Very low | 37.9 | Very low | 158 Ų | 158 | 148.5 Ų | 148.5 | 85% | 0.845 | 83% | 0.834 | S | S | * | * | trans | -109.9 | 97.3 | -168.3 | -56.9 | -24.9 | 0 | 0 | 0 | 107.8 | N4 | D2-N4 PolarHBondContact O-N 3.18Å; D2-N4 VanDerWaalsContact O-N 3.15Å | ||
| 3 | G | 35.9 | Very low | 38.9 | Very low | 80 Ų | 80 | 144.9 Ų | 144.9 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -74.1 | 96.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | A5 | G3-A5 PolarHBondContact O-N 3.38Å; G3-A5 VanDerWaalsContact O-N 3.15Å | ||
| 4 | N | 35.8 | Very low | 40.4 | Very low | 160 Ų | 160 | 143.8 Ų | 143.8 | 86% | 0.856 | 82% | 0.822 | S | S | * | * | trans | -76.4 | 95.6 | 175.1 | -134.8 | 0.8 | 0 | 0 | 0 | 109.4 | D2 T6 | D2-N4 PolarHBondContact O-N 3.18Å; D2-N4 VanDerWaalsContact O-N 3.15Å; N4-T6 PolarHBondContact O-N 2.89Å | ||
| 5 | A | 40 | Very low | 42.7 | Very low | 92 Ų | 92 | 136.5 Ų | 136.5 | 76% | 0.76 | 78% | 0.783 | S | S | * | * | trans | -71.6 | 106.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | G3 L7 | G3-A5 PolarHBondContact O-N 3.38Å; G3-A5 VanDerWaalsContact O-N 3.15Å; A5-L7 PolarHBondContact O-N 3.04Å | ||
| 6 | T | 38.6 | Very low | 45.1 | Very low | 126 Ų | 126 | 131.9 Ų | 131.9 | 77% | 0.773 | 76% | 0.761 | S | S | * | * | trans | -64 | 100.8 | 170.6 | 35 | 0 | 0 | 0 | 0 | 109.7 | N4 Q8 | N4-T6 PolarHBondContact O-N 2.89Å; T6-Q8 VanDerWaalsContact C-N 3.3Å; T6-Q8 PolarHBondContact O-N 3.2Å | ||
| 7 | L | 37.7 | Very low | 47.4 | Very low | 162 Ų | 162 | 126.1 Ų | 126.1 | 85% | 0.848 | 72% | 0.724 | S | S | * | * | trans | -61.3 | 92.5 | 164.8 | -119.5 | 158.6 | 0 | 0 | 0 | 107.9 | A5 L9 | A5-L7 PolarHBondContact O-N 3.04Å; L7-L9 PolarHBondContact O-N 3.38Å | ||
| 8 | Q | 36.1 | Very low | 49.4 | Very low | 154 Ų | 154 | 122.1 Ų | 122.1 | 72% | 0.72 | 70% | 0.7 | S | S | * | * | trans | -62.5 | 102.2 | 168 | -75.3 | -171.8 | -20.4 | 0 | 0 | 108.1 | T6 F10 | T6-Q8 VanDerWaalsContact C-N 3.3Å; T6-Q8 PolarHBondContact O-N 3.2Å; Q8-F10 PolarHBondContact O-N 3.5Å | ||
| 9 | L | 39.6 | Very low | 51.5 | Low | 163 Ų | 163 | 118.8 Ų | 118.8 | 85% | 0.853 | 68% | 0.68 | S | S | * | * | trans | -58.6 | 103 | 162.4 | -95.6 | 107.1 | 0 | 0 | 0 | 107.7 | L7 | L7-L9 PolarHBondContact O-N 3.38Š| ||
| 10 | F | 37 | Very low | 53.4 | Low | 181 Ų | 181 | 116 Ų | 116 | 79% | 0.794 | 67% | 0.671 | S | S | * | * | trans | -54 | 128.3 | 161.8 | -70 | -82.6 | 0 | 0 | 0 | 107.8 | Q8 N12 | Q8-F10 PolarHBondContact O-N 3.5Å; F10-N12 PolarHBondContact O-N 2.9Å | ||
| 11 | P | 41.4 | Very low | 55.3 | Low | 110 Ų | 110 | 112.2 Ų | 112.2 | 71% | 0.714 | 65% | 0.647 | S | S | * | * | trans | -58.2 | 131.7 | 176.4 | 23.8 | -30.7 | 0 | 0 | 0 | 107.6 | S13 | P11-S13 PolarHBondContact O-N 2.81Š| ||
| 12 | N | 42.5 | Very low | 57.9 | Low | 163 Ų | 163 | 102.3 Ų | 102.3 | 87% | 0.872 | 60% | 0.598 | S | S | * | * | trans | -51.3 | 92.4 | 170.1 | -106.7 | -25 | 0 | 0 | 0 | 108 | F10 T14 | F10-N12 PolarHBondContact O-N 2.9Å; N12-T14 VanDerWaalsContact C-N 3.3Å; N12-T14 PolarHBondContact O-N 2.9Å | ||
| 13 | S | 51.4 | Low | 60.9 | Low | 102 Ų | 102 | 96.3 Ų | 96.3 | 71% | 0.713 | 57% | 0.567 | S | S | * | * | trans | -69.7 | 96.2 | 175.6 | 40.9 | 0 | 0 | 0 | 0 | 106 | P11 C15 | P11-S13 PolarHBondContact O-N 2.81Å; S13-C15 PolarHBondContact O-N 3.15Å | ||
| 14 | T | 60 | Low | 63.6 | Low | 129 Ų | 129 | 98 Ų | 98 | 79% | 0.791 | 56% | 0.556 | S | S | * | * | trans | -52.6 | 111.2 | 173.9 | 31 | 0 | 0 | 0 | 0 | 108.2 | N12 S16 | N12-T14 VanDerWaalsContact C-N 3.3Å; N12-T14 PolarHBondContact O-N 2.9Å; T14-S16 PolarHBondContact O-N 2.99Å | ||
| 15 | C | 74.3 | Confident | 66.5 | Low | 35 Ų | 35 | 93.6 Ų | 93.6 | 24% | 0.236 | 54% | 0.535 | C | S | . | . | trans | -72.5 | 74.3 | 179.4 | -164 | 0 | 0 | 0 | 0 | 110.2 | S13 K171 C268 | S13-C15 PolarHBondContact O-N 3.15Å; C15-K171 PolarHBondContact O-NZ 3.31Å; C15-C268 WeakPolarHBondContact CA-SG 3.47Å; C15-C268 HydrophobicContact CB-CB 3.88Å; C15-C268 WeakPolarHBondContact CB-SG 3.49Å; C15-C268 WeakPolarHBondContact SG-CA 3.16Å; C15-C268 WeakPolarHBondContact SG-CB 3.31Å; C15-C268 CovalentContact SG-SG 2.05Å; C15-C268 PolarHBondContact SG-SG 3.47Å | ||
| 16 | S | 81.9 | Confident | 69.2 | Low | 62 Ų | 62 | 89.2 Ų | 89.2 | 43% | 0.434 | 50% | 0.499 | S | S | . | . | trans | -80 | 133.9 | -175.6 | -174 | 0 | 0 | 0 | 0 | 111 | T14 D18 L272 | T14-S16 PolarHBondContact O-N 2.99Å; S16-D18 VanDerWaalsContact C-N 3.31Å; S16-D18 PolarHBondContact OG-N 3.45Å; S16-L272 WeakPolarHBondContact O-CD2 3.5Å | ||
| 17 | R | 84.1 | Confident | 72 | Confident | 34 Ų | 34 | 83.8 Ų | 83.8 | 13% | 0.128 | 47% | 0.465 | C | S | . | . | trans | -90.9 | 0.3 | 174.5 | -68.6 | 177.4 | 178.4 | 172.3 | -1.9 | 112.2 | N19 K22 Y256 L272 F275 | R17-N19 PolarHBondContact O-N 3.36Å; R17-K22 HydrophobicContact CB-CD 4.44Å; R17-K22 VanDerWaalsContact O-CD 3.28Å; R17-K22 WeakPolarHBondContact O-CD 3.3Å; R17-Y256 PolarHBondContact NH1-OH 3.13Å; R17-L272 HydrophobicContact CG-CD2 3.94Å; R17-F275 HydrophobicContact CB-CD1 4.06Å; R17-F275 HydrophobicContact CB-CE1 3.77Å; R17-F275 HydrophobicContact CB-CZ 4.11Å; R17-F275 HydrophobicContact CG-CD1 3.95Å; R17-F275 HydrophobicContact CG-CD2 4.46Å; R17-F275 HydrophobicContact CG-CE1 4.14Å; R17-F275 HydrophobicContact CG-CG 4.12Å; R17-F275 HydrophobicContact CG-CZ 4.48Å | ||
| 18 | D | 83.2 | Confident | 74.9 | Confident | 53 Ų | 53 | 80.4 Ų | 80.4 | 28% | 0.283 | 45% | 0.452 | S | S | . | . | trans | -85.4 | 97.6 | -174.5 | -66.7 | -6.3 | 0 | 0 | 0 | 108.7 | S16 K22 T23 N84 | S16-D18 VanDerWaalsContact C-N 3.31Å; S16-D18 PolarHBondContact OG-N 3.45Å; D18-K22 IonicContact OD1-NZ 2.76Å; D18-K22 PolarHBondContact OD1-NZ 3.39Å; D18-T23 HydrophobicContact CB-CG2 4.42Å; D18-N84 PolarHBondContact OD2-ND2 3.45Å | ||
| 19 | N | 88.4 | Confident | 77.8 | Confident | 61 Ų | 61 | 76 Ų | 76 | 33% | 0.326 | 43% | 0.433 | S | S | . | . | S | Bend | trans | -131.6 | 166.5 | 173.9 | 66.5 | 7.3 | 0 | 0 | 0 | 109.5 | R17 F21 K22 T23 Q276 | R17-N19 PolarHBondContact O-N 3.36Å; N19-F21 PolarHBondContact O-N 3Å; N19-F21 VanDerWaalsContact O-N 3.08Å; N19-F21 WeakPolarHBondContact OD1-CB 3.47Å; N19-F21 PolarHBondContact OD1-N 3.34Å; N19-K22 PolarHBondContact O-N 3.39Å; N19-K22 PolarHBondContact OD1-N 3.3Å; N19-T23 PolarHBondContact O-N 3.18Å; N19-T23 PolarHBondContact O-OG1 3.17Å; N19-T23 VanDerWaalsContact O-OG1 3.05Å; N19-Q276 PolarHBondContact ND2-OE1 3.06Å |
| 20 | A | 91.3 | Very high | 80.6 | Confident | 61 Ų | 61 | 68.3 Ų | 68.3 | 50% | 0.504 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -55.8 | -30.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L24 V25 | A20-L24 HydrophobicContact CB-CD1 4.45Å; A20-L24 WeakPolarHBondContact O-CA 3.47Å; A20-L24 WeakPolarHBondContact O-CB 3Å; A20-L24 PolarHBondContact O-N 3.33Å; A20-V25 PolarHBondContact O-N 3.14Å; A20-V25 VanDerWaalsContact O-N 3.08Å |
| 21 | F | 92.6 | Very high | 83.5 | Confident | 37 Ų | 37 | 61.8 Ų | 61.8 | 16% | 0.162 | 37% | 0.369 | C | S | . | . | I | π-helix | trans | -62.2 | -49.7 | 175.1 | 176 | -106.5 | 0 | 0 | 0 | 111.7 | N19 V25 L26 Q276 E279 S280 | N19-F21 PolarHBondContact O-N 3Å; N19-F21 VanDerWaalsContact O-N 3.08Å; N19-F21 WeakPolarHBondContact OD1-CB 3.47Å; N19-F21 PolarHBondContact OD1-N 3.34Å; F21-V25 HydrophobicContact CD2-CB 4.12Å; F21-V25 HydrophobicContact CD2-CG1 4.15Å; F21-V25 HydrophobicContact CE2-CG1 4.37Å; F21-V25 WeakPolarHBondContact O-CB 3.48Å; F21-V25 PolarHBondContact O-N 2.95Å; F21-L26 HydrophobicContact CD1-CD1 4.29Å; F21-L26 HydrophobicContact CD1-CG 4.45Å; F21-L26 HydrophobicContact CE1-CD1 3.88Å; F21-L26 HydrophobicContact CE1-CD2 4.22Å; F21-L26 HydrophobicContact CE1-CG 4.06Å; F21-L26 HydrophobicContact CE2-CD2 4.21Å; F21-L26 HydrophobicContact CE2-CG 4.39Å; F21-L26 HydrophobicContact CZ-CD1 4.28Å; F21-L26 HydrophobicContact CZ-CD2 3.76Å; F21-L26 HydrophobicContact CZ-CG 4.02Å; F21-L26 WeakPolarHBondContact O-CG 3.32Å; F21-L26 PolarHBondContact O-N 3.27Å; F21-Q276 HydrophobicContact CD1-CG 3.87Å; F21-Q276 VanDerWaalsContact CD1-NE2 3.26Å; F21-Q276 HydrophobicContact CE1-CG 3.84Å; F21-Q276 HydrophobicContact CZ-CG 4.5Å; F21-E279 HydrophobicContact CE1-CB 3.98Å; F21-S280 WeakPolarHBondContact CZ-OG 3.4Å |
| 22 | K | 92.5 | Very high | 86.2 | Confident | 26 Ų | 26 | 60 Ų | 60 | 11% | 0.113 | 36% | 0.358 | C | S | . | . | I | π-helix | trans | -70.3 | -45.2 | 177.3 | -176.4 | -165.4 | 161.9 | -160.4 | 0 | 112.2 | R17 D18 N19 P27 D82 F275 | R17-K22 HydrophobicContact CB-CD 4.44Å; R17-K22 VanDerWaalsContact O-CD 3.28Å; R17-K22 WeakPolarHBondContact O-CD 3.3Å; D18-K22 IonicContact OD1-NZ 2.76Å; D18-K22 PolarHBondContact OD1-NZ 3.39Å; N19-K22 PolarHBondContact O-N 3.39Å; N19-K22 PolarHBondContact OD1-N 3.3Å; K22-P27 WeakPolarHBondContact O-CD 3.39Å; K22-D82 HydrophobicContact CG-CB 4.35Å; K22-F275 HydrophobicContact CB-CE1 4.42Å; K22-F275 HydrophobicContact CD-CE1 4.27Å; K22-F275 HydrophobicContact CD-CZ 3.94Å; K22-F275 HydrophobicContact CG-CE1 4.49Å; K22-F275 HydrophobicContact CG-CZ 4.18Å |
| 23 | T | 93.8 | Very high | 88.8 | Confident | 32 Ų | 32 | 52.8 Ų | 52.8 | 20% | 0.196 | 32% | 0.32 | C | S | . | . | I | π-helix | trans | -87.7 | -18.1 | -168 | 59.1 | 0 | 0 | 0 | 0 | 114.7 | D18 N19 D82 | D18-T23 HydrophobicContact CB-CG2 4.42Å; N19-T23 PolarHBondContact O-N 3.18Å; N19-T23 PolarHBondContact O-OG1 3.17Å; N19-T23 VanDerWaalsContact O-OG1 3.05Å; T23-D82 WeakPolarHBondContact CA-O 3.25Å |
| 24 | L | 94.6 | Very high | 91 | Very high | 114 Ų | 114 | 50.2 Ų | 50.2 | 60% | 0.597 | 30% | 0.296 | S | S | * | . | I | π-helix | trans | -124.8 | -57.5 | -179.6 | -59.5 | 174.6 | 0 | 0 | 0 | 111.9 | A20 P27 V28 | A20-L24 HydrophobicContact CB-CD1 4.45Å; A20-L24 WeakPolarHBondContact O-CA 3.47Å; A20-L24 WeakPolarHBondContact O-CB 3Å; A20-L24 PolarHBondContact O-N 3.33Å; L24-P27 WeakPolarHBondContact O-CD 3.34Å; L24-V28 WeakPolarHBondContact O-CG2 3.49Å; L24-V28 PolarHBondContact O-N 2.64Å |
| 25 | V | 96.6 | Very high | 92.8 | Very high | 68 Ų | 68 | 49.5 Ų | 49.5 | 41% | 0.412 | 29% | 0.286 | S | S | . | . | I | π-helix | trans | -63 | -52 | -171.3 | -179.8 | 0 | 0 | 0 | 0 | 111.4 | A20 F21 V28 L29 | A20-V25 PolarHBondContact O-N 3.14Å; A20-V25 VanDerWaalsContact O-N 3.08Å; F21-V25 HydrophobicContact CD2-CB 4.12Å; F21-V25 HydrophobicContact CD2-CG1 4.15Å; F21-V25 HydrophobicContact CE2-CG1 4.37Å; F21-V25 WeakPolarHBondContact O-CB 3.48Å; F21-V25 PolarHBondContact O-N 2.95Å; V25-V28 PolarHBondContact O-N 3.47Å; V25-L29 HydrophobicContact CG1-CD1 3.83Å; V25-L29 HydrophobicContact CG1-CG 4.35Å; V25-L29 WeakPolarHBondContact O-CB 3.39Å; V25-L29 VanDerWaalsContact O-CG 3.25Å; V25-L29 WeakPolarHBondContact O-CG 3.47Å; V25-L29 PolarHBondContact O-N 3.23Å |
| 26 | L | 96.4 | Very high | 93.9 | Very high | 1 Ų | 1 | 51.3 Ų | 51.3 | 1% | 0.005 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.8 | -48.7 | 179 | -68.9 | 177.3 | 0 | 0 | 0 | 112.5 | F21 V28 L29 Y30 E279 F283 | F21-L26 HydrophobicContact CD1-CD1 4.29Å; F21-L26 HydrophobicContact CD1-CG 4.45Å; F21-L26 HydrophobicContact CE1-CD1 3.88Å; F21-L26 HydrophobicContact CE1-CD2 4.22Å; F21-L26 HydrophobicContact CE1-CG 4.06Å; F21-L26 HydrophobicContact CE2-CD2 4.21Å; F21-L26 HydrophobicContact CE2-CG 4.39Å; F21-L26 HydrophobicContact CZ-CD1 4.28Å; F21-L26 HydrophobicContact CZ-CD2 3.76Å; F21-L26 HydrophobicContact CZ-CG 4.02Å; F21-L26 WeakPolarHBondContact O-CG 3.32Å; F21-L26 PolarHBondContact O-N 3.27Å; L26-V28 VanDerWaalsContact C-N 3.35Å; L26-V28 PolarHBondContact O-N 3.11Å; L26-L29 PolarHBondContact O-N 3.43Å; L26-Y30 HydrophobicContact CB-CD2 4.42Å; L26-Y30 HydrophobicContact CD2-CE2 4.31Å; L26-Y30 WeakPolarHBondContact O-CD2 3.49Å; L26-Y30 PolarHBondContact O-N 3.12Å; L26-E279 HydrophobicContact CD1-CB 3.66Å; L26-E279 HydrophobicContact CD1-CG 3.98Å; L26-F283 HydrophobicContact CD2-CB 4.37Å |
| 27 | P | 97.1 | Very high | 94.5 | Very high | 11 Ų | 11 | 48.4 Ų | 48.4 | 7% | 0.071 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -52.1 | -46.4 | 173.9 | -35.6 | 39.3 | 0 | 0 | 0 | 114.3 | K22 L24 S31 V79 D82 | K22-P27 WeakPolarHBondContact O-CD 3.39Å; L24-P27 WeakPolarHBondContact O-CD 3.34Å; P27-S31 VanDerWaalsContact O-CB 3.3Å; P27-S31 WeakPolarHBondContact O-CB 3.38Å; P27-S31 PolarHBondContact O-N 3.35Å; P27-S31 PolarHBondContact O-OG 2.73Å; P27-V79 HydrophobicContact CB-CG1 4.03Å; P27-D82 HydrophobicContact CG-CB 4.16Å |
| 28 | V | 97.8 | Very high | 95.1 | Very high | 92 Ų | 92 | 50 Ų | 50 | 56% | 0.558 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -61.9 | -48.7 | 177.3 | 169.9 | 0 | 0 | 0 | 0 | 110.6 | L24 V25 L26 S31 C32 | L24-V28 WeakPolarHBondContact O-CG2 3.49Å; L24-V28 PolarHBondContact O-N 2.64Å; V25-V28 PolarHBondContact O-N 3.47Å; L26-V28 VanDerWaalsContact C-N 3.35Å; L26-V28 PolarHBondContact O-N 3.11Å; V28-S31 WeakPolarHBondContact O-CB 3.49Å; V28-S31 PolarHBondContact O-N 3.45Å; V28-C32 PolarHBondContact O-N 3.09Å; V28-C32 PolarHBondContact O-SG 3.34Å; V28-C32 VanDerWaalsContact O-SG 3.4Å |
| 29 | L | 97.8 | Very high | 95.7 | Very high | 61 Ų | 61 | 51 Ų | 51 | 32% | 0.319 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.8 | -45.2 | -179 | -71.8 | 177.5 | 0 | 0 | 0 | 112.8 | V25 L26 S31 C32 L33 F283 | V25-L29 HydrophobicContact CG1-CD1 3.83Å; V25-L29 HydrophobicContact CG1-CG 4.35Å; V25-L29 WeakPolarHBondContact O-CB 3.39Å; V25-L29 VanDerWaalsContact O-CG 3.25Å; V25-L29 WeakPolarHBondContact O-CG 3.47Å; V25-L29 PolarHBondContact O-N 3.23Å; L26-L29 PolarHBondContact O-N 3.43Å; L29-S31 VanDerWaalsContact C-N 3.32Å; L29-S31 PolarHBondContact O-N 2.95Å; L29-C32 PolarHBondContact O-N 3.26Å; L29-L33 PolarHBondContact O-N 3.03Å; L29-F283 HydrophobicContact CB-CD2 4Å; L29-F283 HydrophobicContact CB-CE2 3.44Å; L29-F283 VanDerWaalsContact CB-CE2 3.44Å; L29-F283 HydrophobicContact CB-CZ 3.77Å; L29-F283 HydrophobicContact CD1-CD1 4.26Å; L29-F283 HydrophobicContact CD1-CD2 4.47Å; L29-F283 HydrophobicContact CD1-CE1 4.03Å; L29-F283 HydrophobicContact CD1-CE2 4.26Å; L29-F283 HydrophobicContact CD1-CG 4.48Å; L29-F283 HydrophobicContact CD1-CZ 4.03Å; L29-F283 HydrophobicContact CD2-CZ 4.02Å; L29-F283 HydrophobicContact CG-CE2 4.3Å; L29-F283 HydrophobicContact CG-CZ 4.17Å |
| 30 | Y | 98.1 | Very high | 96 | Very high | 1 Ų | 1 | 50.5 Ų | 50.5 | 0% | 0.004 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -69.4 | -28.3 | 176.3 | -84.1 | -81.2 | 0 | 0 | 0 | 112.8 | L26 L33 F34 F75 K78 F102 F283 S286 | L26-Y30 HydrophobicContact CB-CD2 4.42Å; L26-Y30 HydrophobicContact CD2-CE2 4.31Å; L26-Y30 WeakPolarHBondContact O-CD2 3.49Å; L26-Y30 PolarHBondContact O-N 3.12Å; Y30-L33 HydrophobicContact CD1-CD1 4.09Å; Y30-L33 HydrophobicContact CE1-CD1 4.3Å; Y30-L33 PolarHBondContact O-N 3.37Å; Y30-F34 WeakPolarHBondContact O-CB 3.33Å; Y30-F34 PolarHBondContact O-N 2.73Å; Y30-F75 HydrophobicContact CD1-CB 4.31Å; Y30-F75 AromaticContact CD1-CD1 3.82Å; Y30-F75 HydrophobicContact CD1-CD1 3.82Å; Y30-F75 HydrophobicContact CD1-CD2 4.44Å; Y30-F75 HydrophobicContact CD1-CE1 4.25Å; Y30-F75 AromaticContact CD1-CG 3.94Å; Y30-F75 HydrophobicContact CD1-CG 3.94Å; Y30-F75 HydrophobicContact CE1-CD1 4.08Å; Y30-F75 HydrophobicContact CE1-CE1 4.16Å; Y30-K78 HydrophobicContact CD1-CD 4.26Å; Y30-K78 HydrophobicContact CD2-CD 4.25Å; Y30-K78 HydrophobicContact CE1-CD 3.91Å; Y30-K78 HydrophobicContact CE2-CD 3.93Å; Y30-K78 HydrophobicContact CG-CD 4.42Å; Y30-K78 WeakPolarHBondContact OH-CE 3.17Å; Y30-F102 HydrophobicContact CE1-CE2 4.38Å; Y30-F283 HydrophobicContact CD2-CD2 4.19Å; Y30-F283 HydrophobicContact CE2-CB 4.19Å; Y30-F283 AromaticContact CE2-CD2 3.91Å; Y30-F283 HydrophobicContact CE2-CD2 3.91Å; Y30-F283 WeakPolarHBondContact OH-CA 3.4Å; Y30-F283 PolarHBondContact OH-N 3.36Å; Y30-S286 WeakPolarHBondContact CE1-OG 3.4Å; Y30-S286 PolarHBondContact OH-OG 3.07Å |
| 31 | S | 97.9 | Very high | 96.1 | Very high | 44 Ų | 44 | 47.7 Ų | 47.7 | 31% | 0.308 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -66 | -44.1 | 172 | -60.4 | 0 | 0 | 0 | 0 | 111 | P27 V28 L29 F34 L35 | P27-S31 VanDerWaalsContact O-CB 3.3Å; P27-S31 WeakPolarHBondContact O-CB 3.38Å; P27-S31 PolarHBondContact O-N 3.35Å; P27-S31 PolarHBondContact O-OG 2.73Å; V28-S31 WeakPolarHBondContact O-CB 3.49Å; V28-S31 PolarHBondContact O-N 3.45Å; L29-S31 VanDerWaalsContact C-N 3.32Å; L29-S31 PolarHBondContact O-N 2.95Å; S31-F34 WeakPolarHBondContact O-CB 3.47Å; S31-F34 PolarHBondContact O-N 3.22Å; S31-L35 WeakPolarHBondContact O-CG 3.2Å; S31-L35 PolarHBondContact O-N 3.47Å |
| 32 | C | 97.9 | Very high | 96.2 | Very high | 73 Ų | 73 | 49 Ų | 49 | 49% | 0.493 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -60.3 | -46.3 | 172.4 | -66.3 | 0 | 0 | 0 | 0 | 111.6 | V28 L29 F34 L35 V36 | V28-C32 PolarHBondContact O-N 3.09Å; V28-C32 PolarHBondContact O-SG 3.34Å; V28-C32 VanDerWaalsContact O-SG 3.4Å; L29-C32 PolarHBondContact O-N 3.26Å; C32-F34 VanDerWaalsContact C-N 3.28Å; C32-F34 PolarHBondContact O-N 3.1Å; C32-L35 PolarHBondContact O-N 3.12Å; C32-V36 WeakPolarHBondContact O-CG2 3.43Å; C32-V36 PolarHBondContact O-N 3.23Å |
| 33 | L | 97 | Very high | 96.2 | Very high | 11 Ų | 11 | 50.8 Ų | 50.8 | 6% | 0.058 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59 | -39.6 | 175.4 | -74.1 | -178 | 0 | 0 | 0 | 112.4 | L29 Y30 G37 F75 F283 L287 V290 | L29-L33 PolarHBondContact O-N 3.03Å; Y30-L33 HydrophobicContact CD1-CD1 4.09Å; Y30-L33 HydrophobicContact CE1-CD1 4.3Å; Y30-L33 PolarHBondContact O-N 3.37Å; L33-G37 VanDerWaalsContact O-CA 3.27Å; L33-G37 WeakPolarHBondContact O-CA 3.41Å; L33-G37 PolarHBondContact O-N 3.43Å; L33-F75 HydrophobicContact CB-CD2 3.9Å; L33-F75 HydrophobicContact CB-CE2 3.79Å; L33-F75 HydrophobicContact CD1-CE2 4.39Å; L33-F283 HydrophobicContact CD1-CD2 3.73Å; L33-F283 HydrophobicContact CD1-CE2 3.3Å; L33-F283 HydrophobicContact CD1-CZ 4.21Å; L33-F283 HydrophobicContact CD2-CE2 4.46Å; L33-F283 HydrophobicContact CG-CE2 3.76Å; L33-F283 HydrophobicContact CG-CZ 4.39Å; L33-L287 HydrophobicContact CD2-CD2 3.58Å; L33-L287 HydrophobicContact CD2-CG 4.27Å; L33-V290 HydrophobicContact CD2-CG2 3.8Å |
| 34 | F | 98 | Very high | 96.2 | Very high | 49 Ų | 49 | 49.3 Ų | 49.3 | 22% | 0.215 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.7 | -49 | 178.2 | 174.6 | -110.6 | 0 | 0 | 0 | 111.4 | Y30 S31 C32 L38 T72 F75 P76 | Y30-F34 WeakPolarHBondContact O-CB 3.33Å; Y30-F34 PolarHBondContact O-N 2.73Å; S31-F34 WeakPolarHBondContact O-CB 3.47Å; S31-F34 PolarHBondContact O-N 3.22Å; C32-F34 VanDerWaalsContact C-N 3.28Å; C32-F34 PolarHBondContact O-N 3.1Å; F34-L38 HydrophobicContact CE1-CD2 4.33Å; F34-L38 HydrophobicContact CE2-CD2 4.32Å; F34-L38 HydrophobicContact CZ-CD2 3.87Å; F34-L38 WeakPolarHBondContact O-CB 3.39Å; F34-L38 PolarHBondContact O-N 3.21Å; F34-T72 HydrophobicContact CD2-CG2 3.96Å; F34-T72 WeakPolarHBondContact CD2-O 3.33Å; F34-T72 HydrophobicContact CE2-CG2 4.47Å; F34-F75 HydrophobicContact CB-CB 4.1Å; F34-F75 HydrophobicContact CB-CD2 4.29Å; F34-P76 HydrophobicContact CD1-CG 4.18Å; F34-P76 HydrophobicContact CD2-CG 3.57Å; F34-P76 HydrophobicContact CE1-CG 4.09Å; F34-P76 HydrophobicContact CE2-CG 3.47Å; F34-P76 VanDerWaalsContact CE2-CG 3.47Å; F34-P76 HydrophobicContact CG-CG 3.92Å; F34-P76 HydrophobicContact CZ-CG 3.74Å |
| 35 | L | 97.7 | Very high | 96.1 | Very high | 113 Ų | 113 | 46 Ų | 46 | 59% | 0.592 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -63.6 | -48.3 | -178.7 | -65.6 | 176 | 0 | 0 | 0 | 112.1 | S31 C32 S39 | S31-L35 WeakPolarHBondContact O-CG 3.2Å; S31-L35 PolarHBondContact O-N 3.47Å; C32-L35 PolarHBondContact O-N 3.12Å; L35-S39 WeakPolarHBondContact O-CB 3.43Å; L35-S39 PolarHBondContact O-N 3.49Å; L35-S39 PolarHBondContact O-OG 3.5Å |
| 36 | V | 96.7 | Very high | 96 | Very high | 74 Ų | 74 | 47.5 Ų | 47.5 | 45% | 0.448 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -69.3 | -46.4 | -180 | -175.5 | 0 | 0 | 0 | 0 | 110.4 | C32 L38 S39 L40 V290 | C32-V36 WeakPolarHBondContact O-CG2 3.43Å; C32-V36 PolarHBondContact O-N 3.23Å; V36-L38 PolarHBondContact O-N 3.23Å; V36-S39 PolarHBondContact O-N 2.97Å; V36-L40 HydrophobicContact CG1-CD1 3.88Å; V36-L40 HydrophobicContact CG1-CG 4.25Å; V36-L40 WeakPolarHBondContact O-CG 3.43Å; V36-L40 PolarHBondContact O-N 3.14Å; V36-V290 HydrophobicContact CB-CG1 4.1Å; V36-V290 HydrophobicContact CG1-CG1 3.44Å; V36-V290 VanDerWaalsContact CG1-CG1 3.44Å |
| 37 | G | 95.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.2 | -44.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L33 S39 N41 | L33-G37 VanDerWaalsContact O-CA 3.27Å; L33-G37 WeakPolarHBondContact O-CA 3.41Å; L33-G37 PolarHBondContact O-N 3.43Å; G37-S39 VanDerWaalsContact C-N 3.32Å; G37-S39 PolarHBondContact O-N 3.13Å; G37-N41 WeakPolarHBondContact O-CB 3.38Å; G37-N41 PolarHBondContact O-N 3.3Å; G37-N41 PolarHBondContact O-ND2 2.94Å |
| 38 | L | 96.3 | Very high | 95.3 | Very high | 68 Ų | 68 | 47 Ų | 47 | 36% | 0.356 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 178.4 | -177.7 | 65.3 | 0 | 0 | 0 | 110.4 | F34 V36 S42 T72 | F34-L38 HydrophobicContact CE1-CD2 4.33Å; F34-L38 HydrophobicContact CE2-CD2 4.32Å; F34-L38 HydrophobicContact CZ-CD2 3.87Å; F34-L38 WeakPolarHBondContact O-CB 3.39Å; F34-L38 PolarHBondContact O-N 3.21Å; V36-L38 PolarHBondContact O-N 3.23Å; L38-S42 WeakPolarHBondContact O-CB 3.19Å; L38-S42 PolarHBondContact O-N 2.76Å; L38-S42 PolarHBondContact O-OG 3.43Å; L38-T72 HydrophobicContact CB-CG2 4.24Å |
| 39 | S | 95.3 | Very high | 94.7 | Very high | 73 Ų | 73 | 49.8 Ų | 49.8 | 51% | 0.51 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.6 | -53.3 | 179.1 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | L35 V36 G37 S42 V43 | L35-S39 WeakPolarHBondContact O-CB 3.43Å; L35-S39 PolarHBondContact O-N 3.49Å; L35-S39 PolarHBondContact O-OG 3.5Å; V36-S39 PolarHBondContact O-N 2.97Å; G37-S39 VanDerWaalsContact C-N 3.32Å; G37-S39 PolarHBondContact O-N 3.13Å; S39-S42 PolarHBondContact O-N 2.72Å; S39-V43 WeakPolarHBondContact O-CG2 3.4Å; S39-V43 PolarHBondContact O-N 3.39Å |
| 40 | L | 94.4 | Very high | 94.3 | Very high | 52 Ų | 52 | 53.9 Ų | 53.9 | 27% | 0.272 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -67.3 | -42.6 | -177.7 | -67.1 | -178 | 0 | 0 | 0 | 112.4 | V36 V43 A44 V290 P293 | V36-L40 HydrophobicContact CG1-CD1 3.88Å; V36-L40 HydrophobicContact CG1-CG 4.25Å; V36-L40 WeakPolarHBondContact O-CG 3.43Å; V36-L40 PolarHBondContact O-N 3.14Å; L40-V43 PolarHBondContact O-N 3.15Å; L40-A44 WeakPolarHBondContact O-CB 3.2Å; L40-A44 PolarHBondContact O-N 3.05Å; L40-V290 HydrophobicContact CD1-CG1 3.66Å; L40-V290 WeakPolarHBondContact CD1-O 3.46Å; L40-P293 HydrophobicContact CB-CB 3.85Å; L40-P293 HydrophobicContact CB-CG 3.84Å; L40-P293 HydrophobicContact CD1-CB 4.47Å |
| 41 | N | 94.8 | Very high | 93.8 | Very high | 2 Ų | 2 | 54.3 Ų | 54.3 | 1% | 0.011 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -70.5 | -32.1 | 179.3 | -73 | -57.1 | 0 | 0 | 0 | 112.2 | G37 A44 V45 D68 V69 T72 A289 P293 | G37-N41 WeakPolarHBondContact O-CB 3.38Å; G37-N41 PolarHBondContact O-N 3.3Å; G37-N41 PolarHBondContact O-ND2 2.94Å; N41-A44 PolarHBondContact O-N 2.71Å; N41-V45 WeakPolarHBondContact O-CB 3.24Å; N41-V45 VanDerWaalsContact O-CG2 3.31Å; N41-V45 WeakPolarHBondContact O-CG2 3.31Å; N41-V45 PolarHBondContact O-N 2.92Å; N41-D68 WeakPolarHBondContact OD1-CB 3.32Å; N41-V69 HydrophobicContact CB-CG2 3.8Å; N41-T72 PolarHBondContact ND2-OG1 3.17Å; N41-A289 PolarHBondContact ND2-O 3.28Å; N41-P293 WeakPolarHBondContact OD1-CG 3.11Å |
| 42 | S | 94.3 | Very high | 93.4 | Very high | 64 Ų | 64 | 55.9 Ų | 55.9 | 45% | 0.448 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.8 | -44 | 172.6 | -63.5 | 0 | 0 | 0 | 0 | 111.8 | L38 S39 A44 V45 W46 | L38-S42 WeakPolarHBondContact O-CB 3.19Å; L38-S42 PolarHBondContact O-N 2.76Å; L38-S42 PolarHBondContact O-OG 3.43Å; S39-S42 PolarHBondContact O-N 2.72Å; S42-A44 VanDerWaalsContact C-N 3.33Å; S42-A44 PolarHBondContact O-N 2.84Å; S42-V45 PolarHBondContact O-N 2.9Å; S42-W46 WeakPolarHBondContact O-CB 3.39Å; S42-W46 PolarHBondContact O-N 2.92Å |
| 43 | V | 92.8 | Very high | 92.9 | Very high | 64 Ų | 64 | 54.1 Ų | 54.1 | 39% | 0.388 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.8 | -43.5 | 173 | 175 | 0 | 0 | 0 | 0 | 110.6 | S39 L40 W46 V47 L307 | S39-V43 WeakPolarHBondContact O-CG2 3.4Å; S39-V43 PolarHBondContact O-N 3.39Å; L40-V43 PolarHBondContact O-N 3.15Å; V43-W46 PolarHBondContact O-N 3.32Å; V43-V47 HydrophobicContact CG1-CG2 4.45Å; V43-V47 WeakPolarHBondContact O-CG2 3.46Å; V43-V47 PolarHBondContact O-N 2.98Å; V43-L307 HydrophobicContact CG1-CD1 3.86Å |
| 44 | A | 92.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61 | -47.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112 | L40 N41 S42 V47 F48 V65 Y296 F303 | L40-A44 WeakPolarHBondContact O-CB 3.2Å; L40-A44 PolarHBondContact O-N 3.05Å; N41-A44 PolarHBondContact O-N 2.71Å; S42-A44 VanDerWaalsContact C-N 3.33Å; S42-A44 PolarHBondContact O-N 2.84Å; A44-V47 PolarHBondContact O-N 3.2Å; A44-F48 HydrophobicContact CB-CD2 4.36Å; A44-F48 WeakPolarHBondContact O-CB 3.16Å; A44-F48 WeakPolarHBondContact O-CD2 3.44Å; A44-F48 PolarHBondContact O-N 2.84Å; A44-V65 HydrophobicContact CB-CG1 4.26Å; A44-V65 HydrophobicContact CB-CG2 4.18Å; A44-Y296 HydrophobicContact CB-CD2 4.48Å; A44-F303 HydrophobicContact CB-CE2 4.38Å |
| 45 | V | 94.1 | Very high | 92 | Very high | 44 Ų | 44 | 62 Ų | 62 | 27% | 0.267 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -53.4 | -56.7 | 172.8 | 165.4 | 0 | 0 | 0 | 0 | 109.8 | N41 S42 V47 F48 F49 V65 V69 | N41-V45 WeakPolarHBondContact O-CB 3.24Å; N41-V45 VanDerWaalsContact O-CG2 3.31Å; N41-V45 WeakPolarHBondContact O-CG2 3.31Å; N41-V45 PolarHBondContact O-N 2.92Å; S42-V45 PolarHBondContact O-N 2.9Å; V45-V47 VanDerWaalsContact C-N 3.25Å; V45-V47 PolarHBondContact O-N 3.15Å; V45-V47 VanDerWaalsContact O-N 3.16Å; V45-F48 PolarHBondContact O-N 2.98Å; V45-F49 HydrophobicContact CB-CD2 4.39Å; V45-F49 HydrophobicContact CB-CE2 4.48Å; V45-F49 HydrophobicContact CG1-CD2 3.65Å; V45-F49 HydrophobicContact CG1-CE2 3.7Å; V45-F49 WeakPolarHBondContact O-CB 3.44Å; V45-F49 WeakPolarHBondContact O-CD2 3.48Å; V45-F49 PolarHBondContact O-N 3.32Å; V45-V65 HydrophobicContact CB-CG1 4.46Å; V45-V65 HydrophobicContact CG2-CG1 3.53Å; V45-V69 HydrophobicContact CG2-CG2 3.68Å |
| 46 | W | 92.5 | Very high | 91.6 | Very high | 100 Ų | 100 | 57.3 Ų | 57.3 | 38% | 0.379 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -55.8 | -39.9 | -176.7 | -179.3 | 73.3 | 0 | 0 | 0 | 113.4 | S42 V43 T310 L311 | S42-W46 WeakPolarHBondContact O-CB 3.39Å; S42-W46 PolarHBondContact O-N 2.92Å; V43-W46 PolarHBondContact O-N 3.32Å; W46-T310 HydrophobicContact CE3-CG2 4.43Å; W46-T310 VanDerWaalsContact CH2-CB 3.49Å; W46-T310 HydrophobicContact CH2-CG2 2.99Å; W46-T310 HydrophobicContact CZ2-CG2 3.15Å; W46-T310 HydrophobicContact CZ3-CG2 3.67Å; W46-L311 HydrophobicContact CZ3-CD2 4.39Å |
| 47 | V | 90.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -72.3 | -51 | 176.4 | 174.5 | 0 | 0 | 0 | 0 | 111.8 | V43 A44 V45 F49 R50 I51 F303 T306 L307 | V43-V47 HydrophobicContact CG1-CG2 4.45Å; V43-V47 WeakPolarHBondContact O-CG2 3.46Å; V43-V47 PolarHBondContact O-N 2.98Å; A44-V47 PolarHBondContact O-N 3.2Å; V45-V47 VanDerWaalsContact C-N 3.25Å; V45-V47 PolarHBondContact O-N 3.15Å; V45-V47 VanDerWaalsContact O-N 3.16Å; V47-F49 VanDerWaalsContact C-N 3.31Å; V47-F49 PolarHBondContact O-N 3Å; V47-R50 PolarHBondContact O-N 3.35Å; V47-R50 VanDerWaalsContact O-N 3.07Å; V47-I51 HydrophobicContact CG1-CD1 3.87Å; V47-I51 WeakPolarHBondContact O-CG1 3.33Å; V47-I51 PolarHBondContact O-N 2.85Å; V47-F303 HydrophobicContact CB-CD2 4.09Å; V47-F303 HydrophobicContact CB-CE2 3.76Å; V47-F303 HydrophobicContact CB-CZ 4.45Å; V47-F303 HydrophobicContact CG1-CD2 3.52Å; V47-F303 HydrophobicContact CG1-CE2 3.72Å; V47-F303 HydrophobicContact CG1-CG 4.17Å; V47-F303 HydrophobicContact CG1-CZ 4.5Å; V47-F303 HydrophobicContact CG2-CE2 4.28Å; V47-F303 HydrophobicContact CG2-CZ 4.5Å; V47-T306 HydrophobicContact CG1-CG2 4.01Å; V47-L307 HydrophobicContact CG2-CB 4.14Å; V47-L307 HydrophobicContact CG2-CD1 3.8Å |
| 48 | F | 88.9 | Confident | 90.9 | Very high | 2 Ų | 2 | 55.4 Ų | 55.4 | 1% | 0.009 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67 | -30.3 | -174.5 | -83.7 | -66.9 | 0 | 0 | 0 | 113.3 | A44 V45 R50 I51 I58 L61 K62 V65 Y296 F303 | A44-F48 HydrophobicContact CB-CD2 4.36Å; A44-F48 WeakPolarHBondContact O-CB 3.16Å; A44-F48 WeakPolarHBondContact O-CD2 3.44Å; A44-F48 PolarHBondContact O-N 2.84Å; V45-F48 PolarHBondContact O-N 2.98Å; F48-R50 PolarHBondContact O-N 3.16Å; F48-I51 HydrophobicContact CD1-CD1 4.18Å; F48-I51 HydrophobicContact CE1-CD1 4.49Å; F48-I51 PolarHBondContact O-N 3.31Å; F48-I51 VanDerWaalsContact O-N 3.12Å; F48-I58 HydrophobicContact CE1-CD1 4.11Å; F48-L61 HydrophobicContact CE1-CB 3.98Å; F48-L61 HydrophobicContact CE1-CD1 3.92Å; F48-L61 HydrophobicContact CZ-CB 3.98Å; F48-L61 HydrophobicContact CZ-CD1 3.84Å; F48-K62 HydrophobicContact CB-CG 4.16Å; F48-K62 HydrophobicContact CD1-CG 4.35Å; F48-K62 HydrophobicContact CG-CG 4.46Å; F48-K62 WeakPolarHBondContact O-CE 3.42Å; F48-K62 PolarHBondContact O-NZ 2.97Å; F48-V65 HydrophobicContact CD2-CG2 3.62Å; F48-V65 HydrophobicContact CE2-CG2 3.77Å; F48-Y296 AromaticContact CE2-CD2 3.58Å; F48-Y296 HydrophobicContact CE2-CD2 3.58Å; F48-Y296 HydrophobicContact CE2-CE2 4.1Å; F48-Y296 AromaticContact CE2-CG 3.99Å; F48-Y296 HydrophobicContact CE2-CG 3.99Å; F48-Y296 HydrophobicContact CZ-CD2 4.15Å; F48-Y296 HydrophobicContact CZ-CG 4.08Å; F48-F303 AromaticContact CD2-CD2 3.99Å; F48-F303 HydrophobicContact CD2-CD2 3.99Å; F48-F303 HydrophobicContact CD2-CE2 4.02Å; F48-F303 HydrophobicContact CE1-CD2 4.24Å; F48-F303 AromaticContact CE2-CD2 3.48Å; F48-F303 HydrophobicContact CE2-CD2 3.48Å; F48-F303 VanDerWaalsContact CE2-CD2 3.48Å; F48-F303 AromaticContact CE2-CE2 3.68Å; F48-F303 HydrophobicContact CE2-CE2 3.68Å; F48-F303 HydrophobicContact CZ-CB 4.47Å; F48-F303 AromaticContact CZ-CD2 3.61Å; F48-F303 HydrophobicContact CZ-CD2 3.61Å; F48-F303 HydrophobicContact CZ-CE2 4.28Å; F48-F303 HydrophobicContact CZ-CG 4.39Å |
| 49 | F | 85.3 | Confident | 90.8 | Very high | 151 Ų | 151 | 52.5 Ų | 52.5 | 66% | 0.662 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -67.2 | -23.4 | 174.6 | -85.5 | -98.1 | 0 | 0 | 0 | 112.7 | V45 V47 | V45-F49 HydrophobicContact CB-CD2 4.39Å; V45-F49 HydrophobicContact CB-CE2 4.48Å; V45-F49 HydrophobicContact CG1-CD2 3.65Å; V45-F49 HydrophobicContact CG1-CE2 3.7Å; V45-F49 WeakPolarHBondContact O-CB 3.44Å; V45-F49 WeakPolarHBondContact O-CD2 3.48Å; V45-F49 PolarHBondContact O-N 3.32Å; V47-F49 VanDerWaalsContact C-N 3.31Å; V47-F49 PolarHBondContact O-N 3Å |
| 50 | R | 89.2 | Confident | 90.7 | Very high | 146 Ų | 146 | 49.1 Ų | 49.1 | 55% | 0.551 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -83.9 | -14.4 | 171.8 | -62.8 | -175.6 | -176.1 | -144.6 | -2 | 113.9 | V47 F48 T306 | V47-R50 PolarHBondContact O-N 3.35Å; V47-R50 VanDerWaalsContact O-N 3.07Å; F48-R50 PolarHBondContact O-N 3.16Å; R50-T306 HydrophobicContact CB-CG2 4.17Å |
| 51 | I | 88.1 | Confident | 90.6 | Very high | 11 Ų | 11 | 46.8 Ų | 46.8 | 6% | 0.056 | 23% | 0.226 | C | C | . | . | S | Bend | trans | -91.7 | 122.4 | -179.6 | -61.7 | 171 | 0 | 0 | 0 | 109.4 | V47 F48 I58 K62 T306 | V47-I51 HydrophobicContact CG1-CD1 3.87Å; V47-I51 WeakPolarHBondContact O-CG1 3.33Å; V47-I51 PolarHBondContact O-N 2.85Å; F48-I51 HydrophobicContact CD1-CD1 4.18Å; F48-I51 HydrophobicContact CE1-CD1 4.49Å; F48-I51 PolarHBondContact O-N 3.31Å; F48-I51 VanDerWaalsContact O-N 3.12Å; I51-I58 HydrophobicContact CG2-CD1 4.21Å; I51-I58 HydrophobicContact CG2-CG1 4.44Å; I51-I58 HydrophobicContact CG2-CG2 4.08Å; I51-K62 WeakPolarHBondContact O-CE 3.4Å; I51-K62 PolarHBondContact O-NZ 3.1Å; I51-T306 HydrophobicContact CG1-CG2 4.08Å; I51-T306 WeakPolarHBondContact CG1-OG1 3.08Å |
| 52 | P | 88.6 | Confident | 90.5 | Very high | 76 Ų | 76 | 49.1 Ų | 49.1 | 49% | 0.494 | 24% | 0.236 | S | C | . | . | trans | -69.5 | 142.4 | 176.8 | 29.7 | -35 | 0 | 0 | 0 | 111 | R54 | P52-R54 HydrophobicContact CB-CG 4.13Å; P52-R54 HydrophobicContact CG-CG 4.22Å; P52-R54 PolarHBondContact O-N 2.97Å | ||
| 53 | S | 88.8 | Confident | 90.6 | Very high | 37 Ų | 37 | 47.3 Ų | 47.3 | 26% | 0.259 | 22% | 0.222 | S | C | . | . | trans | -77 | 61.3 | -177 | -56.1 | 0 | 0 | 0 | 0 | 112.7 | K62 | S53-K62 PolarHBondContact OG-NZ 3.07Š| ||
| 54 | R | 87.1 | Confident | 90.7 | Very high | 195 Ų | 195 | 44.3 Ų | 44.3 | 74% | 0.736 | 20% | 0.203 | S | C | * | . | trans | -88 | -2.7 | -176.3 | -65.5 | -170.7 | 177.8 | 179.2 | -0 | 114.6 | P52 | P52-R54 HydrophobicContact CB-CG 4.13Å; P52-R54 HydrophobicContact CG-CG 4.22Å; P52-R54 PolarHBondContact O-N 2.97Å | ||
| 55 | S | 87.9 | Confident | 90.8 | Very high | 31 Ų | 31 | 44.4 Ų | 44.4 | 22% | 0.217 | 20% | 0.204 | C | C | . | . | S | Bend | trans | -138.4 | 152.5 | 177.4 | 79.3 | 0 | 0 | 0 | 0 | 112 | F57 I58 I59 | S55-F57 PolarHBondContact O-N 3.41Å; S55-I58 PolarHBondContact O-N 2.57Å; S55-I58 WeakPolarHBondContact OG-CG1 3.37Å; S55-I58 PolarHBondContact OG-N 2.73Å; S55-I59 WeakPolarHBondContact O-CG1 3.38Å; S55-I59 PolarHBondContact O-N 2.99Å; S55-I59 VanDerWaalsContact O-N 3.12Å |
| 56 | H | 90.1 | Very high | 90.9 | Very high | 13 Ų | 13 | 45.2 Ų | 45.2 | 6% | 0.06 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -55.6 | -40.8 | 175.8 | -53 | 157.8 | 0 | 0 | 0 | 111.8 | I58 I59 Y60 D119 R139 | H56-I58 PolarHBondContact O-N 3.17Å; H56-I59 PolarHBondContact O-N 2.98Å; H56-Y60 HydrophobicContact CB-CE2 4.27Å; H56-Y60 WeakPolarHBondContact O-CD2 3.27Å; H56-Y60 PolarHBondContact O-N 3.19Å; H56-D119 WeakPolarHBondContact CB-OD1 3.49Å; H56-D119 IonicContact CE1-OD1 2.76Å; H56-D119 IonicContact CG-OD1 3.51Å; H56-D119 IonicContact ND1-OD1 2.76Å; H56-D119 PolarHBondContact ND1-OD1 2.89Å; H56-R139 HydrophobicContact CB-CG 4.2Å; H56-R139 WeakPolarHBondContact CD2-CG 3.5Å |
| 57 | F | 87.4 | Confident | 91.2 | Very high | 28 Ų | 28 | 40.5 Ų | 40.5 | 12% | 0.123 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.8 | -48 | 178.3 | -177.4 | -119 | 0 | 0 | 0 | 111.7 | S55 I59 Y60 L61 I116 L299 C300 | S55-F57 PolarHBondContact O-N 3.41Å; F57-I59 VanDerWaalsContact C-N 3.33Å; F57-I59 PolarHBondContact O-N 3.31Å; F57-Y60 PolarHBondContact O-N 2.85Å; F57-L61 HydrophobicContact CD1-CD1 3.76Å; F57-L61 HydrophobicContact CD1-CG 4.49Å; F57-L61 HydrophobicContact CD2-CD1 4.37Å; F57-L61 HydrophobicContact CD2-CG 4.31Å; F57-L61 HydrophobicContact CE1-CD1 3.37Å; F57-L61 HydrophobicContact CE1-CG 4.29Å; F57-L61 HydrophobicContact CE2-CD1 4.01Å; F57-L61 HydrophobicContact CE2-CD2 4.14Å; F57-L61 HydrophobicContact CE2-CG 4.08Å; F57-L61 HydrophobicContact CG-CD1 4.26Å; F57-L61 HydrophobicContact CZ-CD1 3.51Å; F57-L61 HydrophobicContact CZ-CD2 4.19Å; F57-L61 HydrophobicContact CZ-CG 4.08Å; F57-L61 WeakPolarHBondContact O-CB 3.28Å; F57-L61 VanDerWaalsContact O-CG 3.27Å; F57-L61 WeakPolarHBondContact O-CG 3.39Å; F57-L61 PolarHBondContact O-N 3.41Å; F57-I116 HydrophobicContact CD2-CG1 4.25Å; F57-I116 HydrophobicContact CD2-CG2 3.89Å; F57-I116 HydrophobicContact CE2-CD1 4.39Å; F57-I116 HydrophobicContact CE2-CG2 3.78Å; F57-L299 HydrophobicContact CZ-CB 4.39Å; F57-C300 HydrophobicContact CE1-CB 4.02Å |
| 58 | I | 90.3 | Very high | 91.4 | Very high | 6 Ų | 6 | 40.5 Ų | 40.5 | 3% | 0.031 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.9 | -36.9 | 178 | -64.3 | -64.4 | 0 | 0 | 0 | 111.8 | F48 I51 S55 H56 L61 K62 | F48-I58 HydrophobicContact CE1-CD1 4.11Å; I51-I58 HydrophobicContact CG2-CD1 4.21Å; I51-I58 HydrophobicContact CG2-CG1 4.44Å; I51-I58 HydrophobicContact CG2-CG2 4.08Å; S55-I58 PolarHBondContact O-N 2.57Å; S55-I58 WeakPolarHBondContact OG-CG1 3.37Å; S55-I58 PolarHBondContact OG-N 2.73Å; H56-I58 PolarHBondContact O-N 3.17Å; I58-L61 HydrophobicContact CD1-CD1 4.44Å; I58-K62 HydrophobicContact CG2-CD 4.43Å; I58-K62 WeakPolarHBondContact O-CG 3.36Å; I58-K62 PolarHBondContact O-N 2.9Å |
| 59 | I | 93.7 | Very high | 91.8 | Very high | 8 Ų | 8 | 42.2 Ų | 42.2 | 4% | 0.041 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.2 | -49.1 | 175.8 | -67 | 166.1 | 0 | 0 | 0 | 110.3 | S55 H56 F57 K62 N63 L136 R139 K140 | S55-I59 WeakPolarHBondContact O-CG1 3.38Å; S55-I59 PolarHBondContact O-N 2.99Å; S55-I59 VanDerWaalsContact O-N 3.12Å; H56-I59 PolarHBondContact O-N 2.98Å; F57-I59 VanDerWaalsContact C-N 3.33Å; F57-I59 PolarHBondContact O-N 3.31Å; I59-K62 PolarHBondContact O-N 3.24Å; I59-N63 PolarHBondContact O-N 2.93Å; I59-N63 PolarHBondContact O-ND2 3.36Å; I59-L136 HydrophobicContact CD1-CB 4.47Å; I59-L136 HydrophobicContact CD1-CD2 3.69Å; I59-R139 HydrophobicContact CD1-CB 4.26Å; I59-K140 HydrophobicContact CD1-CG 4.07Å; I59-K140 HydrophobicContact CG2-CG 4.46Å |
| 60 | Y | 93.5 | Very high | 92.4 | Very high | 1 Ų | 1 | 37.2 Ų | 37.2 | 0% | 0.004 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.7 | -42.9 | -179.3 | -58.4 | -29 | 0 | 0 | 0 | 112.1 | H56 F57 K62 N63 I64 F112 L115 I116 D119 R139 | H56-Y60 HydrophobicContact CB-CE2 4.27Å; H56-Y60 WeakPolarHBondContact O-CD2 3.27Å; H56-Y60 PolarHBondContact O-N 3.19Å; F57-Y60 PolarHBondContact O-N 2.85Å; Y60-K62 VanDerWaalsContact C-N 3.31Å; Y60-K62 PolarHBondContact O-N 3.18Å; Y60-N63 WeakPolarHBondContact O-CB 3.34Å; Y60-N63 PolarHBondContact O-N 3.21Å; Y60-I64 WeakPolarHBondContact O-CG1 3.48Å; Y60-I64 PolarHBondContact O-N 2.84Å; Y60-F112 AromaticContact CD1-CD1 3.64Å; Y60-F112 HydrophobicContact CD1-CD1 3.64Å; Y60-F112 AromaticContact CD1-CE1 3.73Å; Y60-F112 HydrophobicContact CD1-CE1 3.73Å; Y60-F112 HydrophobicContact CE1-CD1 4.46Å; Y60-F112 HydrophobicContact CE1-CE1 4.35Å; Y60-F112 AromaticContact CG-CD1 3.99Å; Y60-F112 HydrophobicContact CG-CD1 3.99Å; Y60-L115 HydrophobicContact CD2-CB 4.11Å; Y60-L115 HydrophobicContact CE1-CB 4.43Å; Y60-L115 HydrophobicContact CE1-CD1 4.25Å; Y60-L115 HydrophobicContact CE2-CB 3.83Å; Y60-I116 HydrophobicContact CD2-CG1 3.81Å; Y60-I116 HydrophobicContact CG-CG1 4.21Å; Y60-D119 HydrophobicContact CE2-CB 4.24Å; Y60-R139 HydrophobicContact CE1-CB 4.19Å; Y60-R139 WeakPolarHBondContact OH-CD 3.48Å; Y60-R139 PolarHBondContact OH-NE 3.49Å |
| 61 | L | 91.7 | Very high | 92.8 | Very high | 4 Ų | 4 | 30.5 Ų | 30.5 | 2% | 0.021 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -57.8 | -41.4 | 176.3 | -72.1 | -178.6 | 0 | 0 | 0 | 112.8 | F48 F57 I58 N63 I64 V65 I116 Y296 C300 | F48-L61 HydrophobicContact CE1-CB 3.98Å; F48-L61 HydrophobicContact CE1-CD1 3.92Å; F48-L61 HydrophobicContact CZ-CB 3.98Å; F48-L61 HydrophobicContact CZ-CD1 3.84Å; F57-L61 HydrophobicContact CD1-CD1 3.76Å; F57-L61 HydrophobicContact CD1-CG 4.49Å; F57-L61 HydrophobicContact CD2-CD1 4.37Å; F57-L61 HydrophobicContact CD2-CG 4.31Å; F57-L61 HydrophobicContact CE1-CD1 3.37Å; F57-L61 HydrophobicContact CE1-CG 4.29Å; F57-L61 HydrophobicContact CE2-CD1 4.01Å; F57-L61 HydrophobicContact CE2-CD2 4.14Å; F57-L61 HydrophobicContact CE2-CG 4.08Å; F57-L61 HydrophobicContact CG-CD1 4.26Å; F57-L61 HydrophobicContact CZ-CD1 3.51Å; F57-L61 HydrophobicContact CZ-CD2 4.19Å; F57-L61 HydrophobicContact CZ-CG 4.08Å; F57-L61 WeakPolarHBondContact O-CB 3.28Å; F57-L61 VanDerWaalsContact O-CG 3.27Å; F57-L61 WeakPolarHBondContact O-CG 3.39Å; F57-L61 PolarHBondContact O-N 3.41Å; I58-L61 HydrophobicContact CD1-CD1 4.44Å; L61-N63 VanDerWaalsContact C-N 3.27Å; L61-N63 PolarHBondContact O-N 3.42Å; L61-I64 PolarHBondContact O-N 3.3Å; L61-V65 WeakPolarHBondContact O-CG2 3.23Å; L61-V65 PolarHBondContact O-N 3.34Å; L61-I116 HydrophobicContact CD2-CD1 3.95Å; L61-I116 HydrophobicContact CG-CD1 4.49Å; L61-Y296 HydrophobicContact CD2-CD1 3.51Å; L61-Y296 HydrophobicContact CD2-CE1 3.36Å; L61-C300 HydrophobicContact CD1-CB 4.37Å |
| 62 | K | 94.1 | Very high | 93.3 | Very high | 50 Ų | 50 | 30 Ų | 30 | 22% | 0.217 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -60.3 | -37.7 | 175.2 | -76.7 | -178.5 | 177.9 | -168.7 | 0 | 112.6 | F48 I51 S53 I58 I59 Y60 V66 | F48-K62 HydrophobicContact CB-CG 4.16Å; F48-K62 HydrophobicContact CD1-CG 4.35Å; F48-K62 HydrophobicContact CG-CG 4.46Å; F48-K62 WeakPolarHBondContact O-CE 3.42Å; F48-K62 PolarHBondContact O-NZ 2.97Å; I51-K62 WeakPolarHBondContact O-CE 3.4Å; I51-K62 PolarHBondContact O-NZ 3.1Å; S53-K62 PolarHBondContact OG-NZ 3.07Å; I58-K62 HydrophobicContact CG2-CD 4.43Å; I58-K62 WeakPolarHBondContact O-CG 3.36Å; I58-K62 PolarHBondContact O-N 2.9Å; I59-K62 PolarHBondContact O-N 3.24Å; Y60-K62 VanDerWaalsContact C-N 3.31Å; Y60-K62 PolarHBondContact O-N 3.18Å; K62-V66 VanDerWaalsContact O-CG2 3.31Å; K62-V66 WeakPolarHBondContact O-CG2 3.45Å; K62-V66 PolarHBondContact O-N 3.19Å; K62-V66 VanDerWaalsContact O-N 3.07Å |
| 63 | N | 95.9 | Very high | 93.7 | Very high | 27 Ų | 27 | 30.5 Ų | 30.5 | 14% | 0.144 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -69.1 | -39.1 | 176.9 | -75.4 | -90.5 | 0 | 0 | 0 | 111.9 | I59 Y60 L61 V66 A67 F112 W147 | I59-N63 PolarHBondContact O-N 2.93Å; I59-N63 PolarHBondContact O-ND2 3.36Å; Y60-N63 WeakPolarHBondContact O-CB 3.34Å; Y60-N63 PolarHBondContact O-N 3.21Å; L61-N63 VanDerWaalsContact C-N 3.27Å; L61-N63 PolarHBondContact O-N 3.42Å; N63-V66 PolarHBondContact O-N 3.35Å; N63-A67 WeakPolarHBondContact O-CB 3.36Å; N63-A67 PolarHBondContact O-N 3.06Å; N63-F112 HydrophobicContact CB-CD1 4.21Å; N63-F112 HydrophobicContact CB-CD2 3.62Å; N63-F112 HydrophobicContact CB-CE1 3.9Å; N63-F112 HydrophobicContact CB-CE2 3.28Å; N63-F112 HydrophobicContact CB-CG 4.1Å; N63-F112 HydrophobicContact CB-CZ 3.43Å; N63-F112 VanDerWaalsContact CB-CZ 3.43Å; N63-F112 VanDerWaalsContact CG-CZ 3.4Å; N63-W147 PolarHBondContact OD1-NE1 3.45Å |
| 64 | I | 94.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.4 | -47.5 | 174.8 | -59.1 | 176.2 | 0 | 0 | 0 | 109.8 | Y60 L61 V66 A67 D68 F112 F113 I116 D292 Y296 | Y60-I64 WeakPolarHBondContact O-CG1 3.48Å; Y60-I64 PolarHBondContact O-N 2.84Å; L61-I64 PolarHBondContact O-N 3.3Å; I64-V66 VanDerWaalsContact C-N 3.3Å; I64-V66 PolarHBondContact O-N 3.34Å; I64-A67 CarbonylContact O-C 3.54Å; I64-A67 WeakPolarHBondContact O-CA 3.47Å; I64-A67 WeakPolarHBondContact O-CB 3.3Å; I64-A67 PolarHBondContact O-N 2.95Å; I64-D68 WeakPolarHBondContact CG2-OD2 3.46Å; I64-D68 VanDerWaalsContact O-CG 3.25Å; I64-D68 PolarHBondContact O-N 3Å; I64-F112 HydrophobicContact CD1-CB 3.86Å; I64-F112 HydrophobicContact CG1-CB 3.5Å; I64-F112 HydrophobicContact CG1-CG 4.32Å; I64-F113 HydrophobicContact CD1-CD2 4.47Å; I64-F113 HydrophobicContact CD1-CE2 4.41Å; I64-F113 HydrophobicContact CD1-CZ 4.47Å; I64-I116 HydrophobicContact CD1-CD1 3.55Å; I64-D292 WeakPolarHBondContact CG2-OD2 3.46Å; I64-Y296 WeakPolarHBondContact CB-OH 3.16Å; I64-Y296 WeakPolarHBondContact CG2-OH 3.28Å |
| 65 | V | 95.2 | Very high | 94.6 | Very high | 2 Ų | 2 | 19.8 Ų | 19.8 | 1% | 0.012 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -55.8 | -43.6 | 175.9 | 171.8 | 0 | 0 | 0 | 0 | 112.2 | A44 V45 F48 L61 A67 D68 V69 Y296 | A44-V65 HydrophobicContact CB-CG1 4.26Å; A44-V65 HydrophobicContact CB-CG2 4.18Å; V45-V65 HydrophobicContact CB-CG1 4.46Å; V45-V65 HydrophobicContact CG2-CG1 3.53Å; F48-V65 HydrophobicContact CD2-CG2 3.62Å; F48-V65 HydrophobicContact CE2-CG2 3.77Å; L61-V65 WeakPolarHBondContact O-CG2 3.23Å; L61-V65 PolarHBondContact O-N 3.34Å; V65-A67 VanDerWaalsContact C-N 3.34Å; V65-D68 PolarHBondContact O-N 2.81Å; V65-V69 VanDerWaalsContact O-CG2 3.26Å; V65-V69 WeakPolarHBondContact O-CG2 3.26Å; V65-V69 PolarHBondContact O-N 3.03Å; V65-Y296 HydrophobicContact CG2-CD2 4.3Å; V65-Y296 HydrophobicContact CG2-CE2 3.5Å; V65-Y296 VanDerWaalsContact CG2-CE2 3.5Å |
| 66 | V | 96.4 | Very high | 95.1 | Very high | 62 Ų | 62 | 20.2 Ų | 20.2 | 38% | 0.376 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -63.1 | -42.9 | 175.8 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | K62 N63 I64 V70 W147 | K62-V66 VanDerWaalsContact O-CG2 3.31Å; K62-V66 WeakPolarHBondContact O-CG2 3.45Å; K62-V66 PolarHBondContact O-N 3.19Å; K62-V66 VanDerWaalsContact O-N 3.07Å; N63-V66 PolarHBondContact O-N 3.35Å; I64-V66 VanDerWaalsContact C-N 3.3Å; I64-V66 PolarHBondContact O-N 3.34Å; V66-V70 VanDerWaalsContact O-CG2 3.3Å; V66-V70 WeakPolarHBondContact O-CG2 3.5Å; V66-V70 PolarHBondContact O-N 3.43Å; V66-W147 HydrophobicContact CB-CZ2 4.44Å; V66-W147 HydrophobicContact CG1-CH2 4.09Å; V66-W147 HydrophobicContact CG1-CZ2 3.91Å |
| 67 | A | 96.9 | Very high | 95.4 | Very high | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -63.1 | -43.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | N63 I64 V65 V70 M71 T105 I108 W147 | N63-A67 WeakPolarHBondContact O-CB 3.36Å; N63-A67 PolarHBondContact O-N 3.06Å; I64-A67 CarbonylContact O-C 3.54Å; I64-A67 WeakPolarHBondContact O-CA 3.47Å; I64-A67 WeakPolarHBondContact O-CB 3.3Å; I64-A67 PolarHBondContact O-N 2.95Å; V65-A67 VanDerWaalsContact C-N 3.34Å; A67-V70 PolarHBondContact O-N 2.76Å; A67-M71 WeakPolarHBondContact O-CB 3.02Å; A67-M71 PolarHBondContact O-N 3.39Å; A67-T105 HydrophobicContact CB-CG2 4.31Å; A67-T105 WeakPolarHBondContact O-CB 3.28Å; A67-T105 WeakPolarHBondContact O-CG2 3.17Å; A67-I108 HydrophobicContact CB-CB 4.16Å; A67-I108 HydrophobicContact CB-CG2 3.72Å; A67-W147 HydrophobicContact CB-CZ2 4.42Å |
| 68 | D | 96.1 | Very high | 95.8 | Very high | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -65.8 | -40.2 | 179.8 | -63.7 | -23.6 | 0 | 0 | 0 | 111.8 | N41 I64 V65 M71 T72 S109 A289 D292 Y296 | N41-D68 WeakPolarHBondContact OD1-CB 3.32Å; I64-D68 WeakPolarHBondContact CG2-OD2 3.46Å; I64-D68 VanDerWaalsContact O-CG 3.25Å; I64-D68 PolarHBondContact O-N 3Å; V65-D68 PolarHBondContact O-N 2.81Å; D68-M71 PolarHBondContact O-N 2.91Å; D68-T72 VanDerWaalsContact O-CB 3.26Å; D68-T72 WeakPolarHBondContact O-CB 3.3Å; D68-T72 PolarHBondContact O-N 3.44Å; D68-T72 PolarHBondContact O-OG1 3.28Å; D68-S109 PolarHBondContact OD1-OG 3.04Å; D68-A289 HydrophobicContact CB-CB 4.24Å; D68-D292 WeakPolarHBondContact OD2-CB 3.5Å; D68-Y296 PolarHBondContact OD2-OH 2.93Å |
| 69 | V | 97.1 | Very high | 96.1 | Very high | 39 Ų | 39 | 23.9 Ų | 23.9 | 24% | 0.236 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.7 | -51.6 | 172.9 | 170 | 0 | 0 | 0 | 0 | 110.1 | N41 V45 V65 M71 T72 L73 | N41-V69 HydrophobicContact CB-CG2 3.8Å; V45-V69 HydrophobicContact CG2-CG2 3.68Å; V65-V69 VanDerWaalsContact O-CG2 3.26Å; V65-V69 WeakPolarHBondContact O-CG2 3.26Å; V65-V69 PolarHBondContact O-N 3.03Å; V69-M71 VanDerWaalsContact C-N 3.31Å; V69-M71 PolarHBondContact O-N 3.04Å; V69-T72 PolarHBondContact O-N 3.31Å; V69-L73 HydrophobicContact CG1-CD1 4.03Å; V69-L73 HydrophobicContact CG1-CG 4.46Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.38Å; V69-L73 PolarHBondContact O-N 3.42Å |
| 70 | V | 97.7 | Very high | 96.2 | Very high | 45 Ų | 45 | 27.2 Ų | 27.2 | 27% | 0.273 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -61.4 | -42.4 | -179.7 | 173.7 | 0 | 0 | 0 | 0 | 110.4 | V66 A67 L73 T74 T105 | V66-V70 VanDerWaalsContact O-CG2 3.3Å; V66-V70 WeakPolarHBondContact O-CG2 3.5Å; V66-V70 PolarHBondContact O-N 3.43Å; A67-V70 PolarHBondContact O-N 2.76Å; V70-L73 PolarHBondContact O-N 3.3Å; V70-T74 WeakPolarHBondContact O-CG2 3.31Å; V70-T74 PolarHBondContact O-N 3.37Å; V70-T105 HydrophobicContact CB-CG2 3.71Å; V70-T105 HydrophobicContact CG1-CG2 3.57Å |
| 71 | M | 97.7 | Very high | 96.2 | Very high | 6 Ų | 6 | 27.9 Ų | 27.9 | 3% | 0.03 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.1 | -50.1 | 174.3 | -173.6 | -179.7 | -74.8 | 0 | 0 | 111.5 | A67 D68 V69 L73 T74 F75 F102 T105 M106 A289 | A67-M71 WeakPolarHBondContact O-CB 3.02Å; A67-M71 PolarHBondContact O-N 3.39Å; D68-M71 PolarHBondContact O-N 2.91Å; V69-M71 VanDerWaalsContact C-N 3.31Å; V69-M71 PolarHBondContact O-N 3.04Å; M71-L73 VanDerWaalsContact C-N 3.27Å; M71-L73 PolarHBondContact O-N 2.92Å; M71-T74 WeakPolarHBondContact O-CB 3.43Å; M71-T74 PolarHBondContact O-N 2.62Å; M71-T74 PolarHBondContact O-OG1 3.37Å; M71-F75 HydrophobicContact CG-CE1 3.66Å; M71-F75 HydrophobicContact CG-CZ 3.91Å; M71-F75 WeakPolarHBondContact O-CD1 3.34Å; M71-F75 WeakPolarHBondContact O-CE1 3.28Å; M71-F75 HydrophobicContact SD-CE1 4.33Å; M71-F75 HydrophobicContact SD-CZ 4.25Å; M71-F102 HydrophobicContact CG-CD2 4.02Å; M71-F102 HydrophobicContact CG-CE2 4.16Å; M71-F102 HydrophobicContact SD-CE2 4.3Å; M71-T105 WeakPolarHBondContact CB-OG1 3.42Å; M71-M106 HydrophobicContact CE-CB 3.51Å; M71-M106 HydrophobicContact CE-CG 4.19Å; M71-M106 VanDerWaalsContact CE-N 3.28Å; M71-A289 HydrophobicContact SD-CB 3.89Å |
| 72 | T | 97.8 | Very high | 96.2 | Very high | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.006 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -57.9 | -41.6 | -179.2 | -59.8 | 0 | 0 | 0 | 0 | 111 | F34 L38 N41 D68 V69 T74 F75 | F34-T72 HydrophobicContact CD2-CG2 3.96Å; F34-T72 WeakPolarHBondContact CD2-O 3.33Å; F34-T72 HydrophobicContact CE2-CG2 4.47Å; L38-T72 HydrophobicContact CB-CG2 4.24Å; N41-T72 PolarHBondContact ND2-OG1 3.17Å; D68-T72 VanDerWaalsContact O-CB 3.26Å; D68-T72 WeakPolarHBondContact O-CB 3.3Å; D68-T72 PolarHBondContact O-N 3.44Å; D68-T72 PolarHBondContact O-OG1 3.28Å; V69-T72 PolarHBondContact O-N 3.31Å; T72-T74 PolarHBondContact O-N 2.86Å; T72-F75 HydrophobicContact CG2-CD2 4.39Å; T72-F75 WeakPolarHBondContact O-CB 3.5Å; T72-F75 WeakPolarHBondContact O-CG 3.48Å; T72-F75 PolarHBondContact O-N 2.93Å; T72-F75 VanDerWaalsContact O-N 3.08Å |
| 73 | L | 97.6 | Very high | 96.1 | Very high | 86 Ų | 86 | 27.2 Ų | 27.2 | 45% | 0.45 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -65.4 | -16.2 | 177 | -67.6 | 174.5 | 0 | 0 | 0 | 113.5 | V69 V70 M71 F77 | V69-L73 HydrophobicContact CG1-CD1 4.03Å; V69-L73 HydrophobicContact CG1-CG 4.46Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.38Å; V69-L73 PolarHBondContact O-N 3.42Å; V70-L73 PolarHBondContact O-N 3.3Å; M71-L73 VanDerWaalsContact C-N 3.27Å; M71-L73 PolarHBondContact O-N 2.92Å; L73-F77 WeakPolarHBondContact O-CE2 3.22Å |
| 74 | T | 97.9 | Very high | 95.6 | Very high | 6 Ų | 6 | 29.2 Ų | 29.2 | 4% | 0.037 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -80.8 | -20.4 | 173.5 | 72.5 | 0 | 0 | 0 | 0 | 113.7 | V70 M71 T72 F77 K78 S98 L101 F102 | V70-T74 WeakPolarHBondContact O-CG2 3.31Å; V70-T74 PolarHBondContact O-N 3.37Å; M71-T74 WeakPolarHBondContact O-CB 3.43Å; M71-T74 PolarHBondContact O-N 2.62Å; M71-T74 PolarHBondContact O-OG1 3.37Å; T72-T74 PolarHBondContact O-N 2.86Å; T74-F77 PolarHBondContact O-N 2.95Å; T74-K78 PolarHBondContact O-N 3Å; T74-S98 WeakPolarHBondContact CB-OG 3.44Å; T74-L101 HydrophobicContact CG2-CB 4.06Å; T74-F102 HydrophobicContact CG2-CB 4.39Å |
| 75 | F | 97.6 | Very high | 95.2 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -61.8 | -42.5 | -173.9 | -61.3 | -14.4 | 0 | 0 | 0 | 113.7 | Y30 L33 F34 M71 T72 F77 K78 V79 F102 A289 | Y30-F75 HydrophobicContact CD1-CB 4.31Å; Y30-F75 AromaticContact CD1-CD1 3.82Å; Y30-F75 HydrophobicContact CD1-CD1 3.82Å; Y30-F75 HydrophobicContact CD1-CD2 4.44Å; Y30-F75 HydrophobicContact CD1-CE1 4.25Å; Y30-F75 AromaticContact CD1-CG 3.94Å; Y30-F75 HydrophobicContact CD1-CG 3.94Å; Y30-F75 HydrophobicContact CE1-CD1 4.08Å; Y30-F75 HydrophobicContact CE1-CE1 4.16Å; L33-F75 HydrophobicContact CB-CD2 3.9Å; L33-F75 HydrophobicContact CB-CE2 3.79Å; L33-F75 HydrophobicContact CD1-CE2 4.39Å; F34-F75 HydrophobicContact CB-CB 4.1Å; F34-F75 HydrophobicContact CB-CD2 4.29Å; M71-F75 HydrophobicContact CG-CE1 3.66Å; M71-F75 HydrophobicContact CG-CZ 3.91Å; M71-F75 WeakPolarHBondContact O-CD1 3.34Å; M71-F75 WeakPolarHBondContact O-CE1 3.28Å; M71-F75 HydrophobicContact SD-CE1 4.33Å; M71-F75 HydrophobicContact SD-CZ 4.25Å; T72-F75 HydrophobicContact CG2-CD2 4.39Å; T72-F75 WeakPolarHBondContact O-CB 3.5Å; T72-F75 WeakPolarHBondContact O-CG 3.48Å; T72-F75 PolarHBondContact O-N 2.93Å; T72-F75 VanDerWaalsContact O-N 3.08Å; F75-F77 VanDerWaalsContact C-N 3.27Å; F75-F77 PolarHBondContact O-N 3.42Å; F75-K78 WeakPolarHBondContact O-CA 3.34Å; F75-K78 WeakPolarHBondContact O-CB 3Å; F75-K78 PolarHBondContact O-N 3.37Å; F75-V79 WeakPolarHBondContact O-CG2 3.37Å; F75-V79 PolarHBondContact O-N 3.29Å; F75-F102 HydrophobicContact CD1-CD2 4.33Å; F75-F102 HydrophobicContact CD1-CE2 4.31Å; F75-F102 AromaticContact CE1-CD2 3.96Å; F75-F102 HydrophobicContact CE1-CD2 3.96Å; F75-F102 AromaticContact CE1-CE2 3.68Å; F75-F102 HydrophobicContact CE1-CE2 3.68Å; F75-A289 HydrophobicContact CZ-CB 4.49Å |
| 76 | P | 97.1 | Very high | 94.9 | Very high | 41 Ų | 41 | 36.9 Ų | 36.9 | 27% | 0.266 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -57.8 | -39.4 | 177.8 | -25.9 | 35.9 | 0 | 0 | 0 | 112.9 | F34 K78 V79 L80 | F34-P76 HydrophobicContact CD1-CG 4.18Å; F34-P76 HydrophobicContact CD2-CG 3.57Å; F34-P76 HydrophobicContact CE1-CG 4.09Å; F34-P76 HydrophobicContact CE2-CG 3.47Å; F34-P76 VanDerWaalsContact CE2-CG 3.47Å; F34-P76 HydrophobicContact CG-CG 3.92Å; F34-P76 HydrophobicContact CZ-CG 3.74Å; P76-K78 VanDerWaalsContact C-N 3.34Å; P76-K78 PolarHBondContact O-N 3.48Å; P76-V79 PolarHBondContact O-N 2.92Å; P76-L80 WeakPolarHBondContact O-CB 3.24Å; P76-L80 VanDerWaalsContact O-CG 3.31Å; P76-L80 WeakPolarHBondContact O-CG 3.33Å; P76-L80 PolarHBondContact O-N 3.09Å |
| 77 | F | 97.2 | Very high | 94.7 | Very high | 73 Ų | 73 | 37.2 Ų | 37.2 | 32% | 0.32 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -67.5 | -36.3 | 177.4 | -57.7 | -76 | 0 | 0 | 0 | 112 | L73 T74 F75 S81 F93 V94 | L73-F77 WeakPolarHBondContact O-CE2 3.22Å; T74-F77 PolarHBondContact O-N 2.95Å; F75-F77 VanDerWaalsContact C-N 3.27Å; F75-F77 PolarHBondContact O-N 3.42Å; F77-S81 VanDerWaalsContact O-CB 3.31Å; F77-S81 WeakPolarHBondContact O-CB 3.12Å; F77-S81 PolarHBondContact O-N 3.49Å; F77-F93 AromaticContact CD1-CD1 4Å; F77-F93 HydrophobicContact CD1-CD1 4Å; F77-F93 AromaticContact CD1-CE1 3.82Å; F77-F93 HydrophobicContact CD1-CE1 3.82Å; F77-F93 HydrophobicContact CD2-CE1 4.18Å; F77-F93 HydrophobicContact CE1-CD1 4.23Å; F77-F93 AromaticContact CE1-CE1 3.81Å; F77-F93 HydrophobicContact CE1-CE1 3.81Å; F77-F93 HydrophobicContact CE2-CE1 4.17Å; F77-F93 HydrophobicContact CG-CD1 4.39Å; F77-F93 HydrophobicContact CG-CE1 4.01Å; F77-F93 AromaticContact CZ-CE1 3.98Å; F77-F93 HydrophobicContact CZ-CE1 3.98Å; F77-V94 HydrophobicContact CB-CG2 3.67Å; F77-V94 WeakPolarHBondContact O-CG2 3.38Å |
| 78 | K | 95.8 | Very high | 94.4 | Very high | 28 Ų | 28 | 40 Ų | 40 | 12% | 0.122 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.5 | -45.5 | 173.1 | -176.8 | 166.8 | 173.6 | 53.5 | 0 | 111.4 | Y30 T74 F75 P76 L80 S81 D82 E279 | Y30-K78 HydrophobicContact CD1-CD 4.26Å; Y30-K78 HydrophobicContact CD2-CD 4.25Å; Y30-K78 HydrophobicContact CE1-CD 3.91Å; Y30-K78 HydrophobicContact CE2-CD 3.93Å; Y30-K78 HydrophobicContact CG-CD 4.42Å; Y30-K78 WeakPolarHBondContact OH-CE 3.17Å; T74-K78 PolarHBondContact O-N 3Å; F75-K78 WeakPolarHBondContact O-CA 3.34Å; F75-K78 WeakPolarHBondContact O-CB 3Å; F75-K78 PolarHBondContact O-N 3.37Å; P76-K78 VanDerWaalsContact C-N 3.34Å; P76-K78 PolarHBondContact O-N 3.48Å; K78-L80 PolarHBondContact O-N 2.91Å; K78-S81 PolarHBondContact O-N 3.42Å; K78-D82 VanDerWaalsContact CG-OD2 3.3Å; K78-D82 WeakPolarHBondContact CG-OD2 3.15Å; K78-D82 IonicContact NZ-OD2 3.94Å; K78-D82 PolarHBondContact NZ-OD2 3.12Å; K78-D82 WeakPolarHBondContact O-CB 3.49Å; K78-D82 PolarHBondContact O-N 2.59Å; K78-E279 IonicContact NZ-OE2 3.94Å; K78-E279 PolarHBondContact NZ-OE2 2.96Å |
| 79 | V | 97 | Very high | 94.3 | Very high | 23 Ų | 23 | 45.9 Ų | 45.9 | 14% | 0.139 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56.5 | -50.7 | 175.4 | 171.3 | 0 | 0 | 0 | 0 | 111 | P27 F75 P76 S81 D82 S83 | P27-V79 HydrophobicContact CB-CG1 4.03Å; F75-V79 WeakPolarHBondContact O-CG2 3.37Å; F75-V79 PolarHBondContact O-N 3.29Å; P76-V79 PolarHBondContact O-N 2.92Å; V79-S81 VanDerWaalsContact C-N 3.35Å; V79-S81 PolarHBondContact O-N 3.25Å; V79-D82 PolarHBondContact O-N 3.08Å; V79-S83 VanDerWaalsContact O-CB 3.27Å; V79-S83 WeakPolarHBondContact O-CB 3.38Å; V79-S83 PolarHBondContact O-N 2.64Å; V79-S83 PolarHBondContact O-OG 3.5Å |
| 80 | L | 95.1 | Very high | 94.1 | Very high | 78 Ų | 78 | 46 Ų | 46 | 41% | 0.408 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -61.6 | -42.3 | 179.2 | -71.6 | 170.9 | 0 | 0 | 0 | 111.9 | P76 K78 S83 A86 | P76-L80 WeakPolarHBondContact O-CB 3.24Å; P76-L80 VanDerWaalsContact O-CG 3.31Å; P76-L80 WeakPolarHBondContact O-CG 3.33Å; P76-L80 PolarHBondContact O-N 3.09Å; K78-L80 PolarHBondContact O-N 2.91Å; L80-S83 PolarHBondContact O-OG 3.47Å; L80-S83 VanDerWaalsContact O-OG 3.13Å; L80-A86 VanDerWaalsContact C-CB 3.5Å; L80-A86 HydrophobicContact CB-CB 4.09Å; L80-A86 WeakPolarHBondContact O-CB 3.35Å; L80-A86 PolarHBondContact O-N 3.38Å |
| 81 | S | 93 | Very high | 93.9 | Very high | 14 Ų | 14 | 45.3 Ų | 45.3 | 10% | 0.098 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -70.4 | -40.3 | 179.7 | 179.1 | 0 | 0 | 0 | 0 | 113.1 | F77 K78 V79 | F77-S81 VanDerWaalsContact O-CB 3.31Å; F77-S81 WeakPolarHBondContact O-CB 3.12Å; F77-S81 PolarHBondContact O-N 3.49Å; K78-S81 PolarHBondContact O-N 3.42Å; V79-S81 VanDerWaalsContact C-N 3.35Å; V79-S81 PolarHBondContact O-N 3.25Å |
| 82 | D | 92.7 | Very high | 93.8 | Very high | 18 Ų | 18 | 46.6 Ų | 46.6 | 10% | 0.096 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -79.7 | -29.7 | -174.8 | -72.4 | -17.9 | 0 | 0 | 0 | 112.1 | K22 T23 P27 K78 V79 N84 | K22-D82 HydrophobicContact CG-CB 4.35Å; T23-D82 WeakPolarHBondContact CA-O 3.25Å; P27-D82 HydrophobicContact CG-CB 4.16Å; K78-D82 VanDerWaalsContact CG-OD2 3.3Å; K78-D82 WeakPolarHBondContact CG-OD2 3.15Å; K78-D82 IonicContact NZ-OD2 3.94Å; K78-D82 PolarHBondContact NZ-OD2 3.12Å; K78-D82 WeakPolarHBondContact O-CB 3.49Å; K78-D82 PolarHBondContact O-N 2.59Å; V79-D82 PolarHBondContact O-N 3.08Å; D82-N84 PolarHBondContact O-N 2.95Å |
| 83 | S | 92 | Very high | 93.7 | Very high | 23 Ų | 23 | 50.1 Ų | 50.1 | 16% | 0.161 | 27% | 0.265 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | -1.4 | 174.4 | 57.8 | 0 | 0 | 0 | 0 | 114.7 | V79 L80 M85 | V79-S83 VanDerWaalsContact O-CB 3.27Å; V79-S83 WeakPolarHBondContact O-CB 3.38Å; V79-S83 PolarHBondContact O-N 2.64Å; V79-S83 PolarHBondContact O-OG 3.5Å; L80-S83 PolarHBondContact O-OG 3.47Å; L80-S83 VanDerWaalsContact O-OG 3.13Å; S83-M85 PolarHBondContact O-N 3.22Å; S83-M85 VanDerWaalsContact O-N 3.08Å |
| 84 | N | 85.1 | Confident | 93.6 | Very high | 69 Ų | 69 | 46.3 Ų | 46.3 | 37% | 0.369 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.3 | 14.3 | -172.4 | -75.2 | -12.2 | 0 | 0 | 0 | 114.6 | D18 D82 | D18-N84 PolarHBondContact OD2-ND2 3.45Å; D82-N84 PolarHBondContact O-N 2.95Å |
| 85 | M | 85.8 | Confident | 93.5 | Very high | 152 Ų | 152 | 46.5 Ų | 46.5 | 75% | 0.749 | 25% | 0.246 | S | C | * | . | trans | -86.2 | -18.8 | 175.8 | -60.4 | -175.8 | 76.4 | 0 | 0 | 112.6 | S83 | S83-M85 PolarHBondContact O-N 3.22Å; S83-M85 VanDerWaalsContact O-N 3.08Å | ||
| 86 | A | 89.8 | Confident | 93.4 | Very high | 11 Ų | 11 | 50.3 Ų | 50.3 | 9% | 0.091 | 26% | 0.261 | C | S | . | . | S | Bend | trans | -71.5 | 132.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L80 I90 R91 | L80-A86 VanDerWaalsContact C-CB 3.5Å; L80-A86 HydrophobicContact CB-CB 4.09Å; L80-A86 WeakPolarHBondContact O-CB 3.35Å; L80-A86 PolarHBondContact O-N 3.38Å; A86-I90 HydrophobicContact CB-CB 4.02Å; A86-I90 HydrophobicContact CB-CG2 3.89Å; A86-R91 HydrophobicContact CB-CG 3.79Å |
| 87 | P | 91.9 | Very high | 93.4 | Very high | 68 Ų | 68 | 50.7 Ų | 50.7 | 44% | 0.442 | 26% | 0.262 | S | S | . | . | trans | -57.2 | 157.8 | 164.2 | -23.6 | 33.8 | 0 | 0 | 0 | 112.4 | H89 I90 R91 | P87-H89 WeakPolarHBondContact CB-CE1 3.26Å; P87-H89 WeakPolarHBondContact CB-ND1 3.37Å; P87-H89 PolarHBondContact O-N 3.22Å; P87-H89 VanDerWaalsContact O-N 3.12Å; P87-I90 PolarHBondContact O-N 3.34Å; P87-R91 PolarHBondContact O-N 3.06Å | ||
| 88 | S | 91.3 | Very high | 93.4 | Very high | 60 Ų | 60 | 47.4 Ų | 47.4 | 42% | 0.42 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -53.4 | -37.4 | -178.8 | -59.1 | 0 | 0 | 0 | 0 | 113.6 | R91 I92 | S88-R91 PolarHBondContact O-N 2.98Å; S88-I92 WeakPolarHBondContact O-CD1 3.32Å; S88-I92 WeakPolarHBondContact O-CG1 3.44Å; S88-I92 PolarHBondContact O-N 2.79Å |
| 89 | H | 92.2 | Very high | 93.4 | Very high | 123 Ų | 123 | 48 Ų | 48 | 57% | 0.569 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -66.7 | -37 | 179.6 | 64.5 | -95.3 | 0 | 0 | 0 | 112.9 | P87 I92 F93 | P87-H89 WeakPolarHBondContact CB-CE1 3.26Å; P87-H89 WeakPolarHBondContact CB-ND1 3.37Å; P87-H89 PolarHBondContact O-N 3.22Å; P87-H89 VanDerWaalsContact O-N 3.12Å; H89-I92 PolarHBondContact O-N 2.94Å; H89-F93 PolarHBondContact O-N 3.1Å |
| 90 | I | 94.3 | Very high | 93.4 | Very high | 40 Ų | 40 | 48 Ų | 48 | 21% | 0.205 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.9 | -42.4 | 174.4 | -62.6 | -58.5 | 0 | 0 | 0 | 110.3 | A86 P87 I92 F93 V94 | A86-I90 HydrophobicContact CB-CB 4.02Å; A86-I90 HydrophobicContact CB-CG2 3.89Å; P87-I90 PolarHBondContact O-N 3.34Å; I90-I92 VanDerWaalsContact C-N 3.32Å; I90-I92 PolarHBondContact O-N 3.35Å; I90-F93 WeakPolarHBondContact O-CB 3.19Å; I90-F93 PolarHBondContact O-N 3.34Å; I90-F93 VanDerWaalsContact O-N 3.16Å; I90-V94 WeakPolarHBondContact O-CG2 3.22Å; I90-V94 PolarHBondContact O-N 3.46Å |
| 91 | R | 93.5 | Very high | 93.6 | Very high | 31 Ų | 31 | 47.2 Ų | 47.2 | 12% | 0.117 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.4 | -38.6 | 175.6 | -69.5 | 174.7 | 56.7 | -158 | -3.2 | 112.1 | A86 P87 S88 V94 C95 P168 F170 | A86-R91 HydrophobicContact CB-CG 3.79Å; P87-R91 PolarHBondContact O-N 3.06Å; S88-R91 PolarHBondContact O-N 2.98Å; R91-V94 PolarHBondContact O-N 3.33Å; R91-C95 PolarHBondContact O-N 2.96Å; R91-C95 VanDerWaalsContact O-N 3.1Å; R91-C95 PolarHBondContact O-SG 3.27Å; R91-C95 VanDerWaalsContact O-SG 3.32Å; R91-P168 PolarHBondContact NH1-O 3.36Å; R91-P168 PolarHBondContact NH2-O 2.99Å; R91-F170 HydrophobicContact CB-CE1 4.4Å; R91-F170 HydrophobicContact CB-CE2 4.18Å; R91-F170 HydrophobicContact CB-CZ 3.57Å; R91-F170 PolarHBondContact NH2-O 3.43Å |
| 92 | I | 94.9 | Very high | 93.8 | Very high | 33 Ų | 33 | 47 Ų | 47 | 17% | 0.169 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.5 | -46.6 | 172 | -69.1 | 161.2 | 0 | 0 | 0 | 110.5 | S88 H89 I90 V94 C95 R96 P165 F170 L175 | S88-I92 WeakPolarHBondContact O-CD1 3.32Å; S88-I92 WeakPolarHBondContact O-CG1 3.44Å; S88-I92 PolarHBondContact O-N 2.79Å; H89-I92 PolarHBondContact O-N 2.94Å; I90-I92 VanDerWaalsContact C-N 3.32Å; I90-I92 PolarHBondContact O-N 3.35Å; I92-V94 VanDerWaalsContact C-N 3.29Å; I92-V94 PolarHBondContact O-N 3.14Å; I92-C95 PolarHBondContact O-N 3.5Å; I92-R96 HydrophobicContact CG2-CG 4.28Å; I92-R96 WeakPolarHBondContact O-CB 3.25Å; I92-R96 WeakPolarHBondContact O-CG 3.45Å; I92-R96 PolarHBondContact O-N 2.87Å; I92-P165 HydrophobicContact CD1-CG 4.16Å; I92-F170 HydrophobicContact CG1-CE2 4.44Å; I92-F170 HydrophobicContact CG1-CZ 3.95Å; I92-L175 HydrophobicContact CB-CD2 4.32Å; I92-L175 HydrophobicContact CG1-CD2 3.91Å; I92-L175 HydrophobicContact CG2-CD2 4.21Å |
| 93 | F | 95.8 | Very high | 94 | Very high | 75 Ų | 75 | 47.9 Ų | 47.9 | 33% | 0.329 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -58.4 | -40.6 | 175.7 | 172.7 | -97.9 | 0 | 0 | 0 | 111.9 | F77 H89 I90 C95 R96 V97 S98 | F77-F93 AromaticContact CD1-CD1 4Å; F77-F93 HydrophobicContact CD1-CD1 4Å; F77-F93 AromaticContact CD1-CE1 3.82Å; F77-F93 HydrophobicContact CD1-CE1 3.82Å; F77-F93 HydrophobicContact CD2-CE1 4.18Å; F77-F93 HydrophobicContact CE1-CD1 4.23Å; F77-F93 AromaticContact CE1-CE1 3.81Å; F77-F93 HydrophobicContact CE1-CE1 3.81Å; F77-F93 HydrophobicContact CE2-CE1 4.17Å; F77-F93 HydrophobicContact CG-CD1 4.39Å; F77-F93 HydrophobicContact CG-CE1 4.01Å; F77-F93 AromaticContact CZ-CE1 3.98Å; F77-F93 HydrophobicContact CZ-CE1 3.98Å; H89-F93 PolarHBondContact O-N 3.1Å; I90-F93 WeakPolarHBondContact O-CB 3.19Å; I90-F93 PolarHBondContact O-N 3.34Å; I90-F93 VanDerWaalsContact O-N 3.16Å; F93-C95 PolarHBondContact O-N 2.83Å; F93-R96 PolarHBondContact O-N 3.46Å; F93-V97 HydrophobicContact CD2-CB 3.96Å; F93-V97 HydrophobicContact CD2-CG2 4.03Å; F93-V97 HydrophobicContact CE2-CB 3.65Å; F93-V97 HydrophobicContact CE2-CG1 3.78Å; F93-V97 HydrophobicContact CE2-CG2 3.98Å; F93-V97 HydrophobicContact CZ-CB 4.09Å; F93-V97 HydrophobicContact CZ-CG1 3.98Å; F93-V97 WeakPolarHBondContact O-CA 3.47Å; F93-V97 PolarHBondContact O-N 2.85Å; F93-S98 PolarHBondContact O-N 3.21Å; F93-S98 VanDerWaalsContact O-N 3.17Å |
| 94 | V | 96.2 | Very high | 94.3 | Very high | 7 Ų | 7 | 47 Ų | 47 | 4% | 0.042 | 25% | 0.245 | C | C | . | . | I | π-helix | trans | -59.5 | -47.5 | 175.4 | 168.4 | 0 | 0 | 0 | 0 | 111.4 | F77 I90 R91 I92 S98 S99 | F77-V94 HydrophobicContact CB-CG2 3.67Å; F77-V94 WeakPolarHBondContact O-CG2 3.38Å; I90-V94 WeakPolarHBondContact O-CG2 3.22Å; I90-V94 PolarHBondContact O-N 3.46Å; R91-V94 PolarHBondContact O-N 3.33Å; I92-V94 VanDerWaalsContact C-N 3.29Å; I92-V94 PolarHBondContact O-N 3.14Å; V94-S98 PolarHBondContact O-N 3.42Å; V94-S99 VanDerWaalsContact O-CB 3.23Å; V94-S99 WeakPolarHBondContact O-CB 3.35Å; V94-S99 PolarHBondContact O-N 2.89Å; V94-S99 PolarHBondContact O-OG 3.04Å |
| 95 | C | 95.3 | Very high | 94.8 | Very high | 9 Ų | 9 | 43.8 Ų | 43.8 | 6% | 0.061 | 23% | 0.228 | C | C | . | . | I | π-helix | trans | -67.1 | -36.3 | 180 | -66.5 | 0 | 0 | 0 | 0 | 113.7 | R91 I92 F93 C172 L175 | R91-C95 PolarHBondContact O-N 2.96Å; R91-C95 VanDerWaalsContact O-N 3.1Å; R91-C95 PolarHBondContact O-SG 3.27Å; R91-C95 VanDerWaalsContact O-SG 3.32Å; I92-C95 PolarHBondContact O-N 3.5Å; F93-C95 PolarHBondContact O-N 2.83Å; C95-C172 WeakPolarHBondContact CA-SG 3.39Å; C95-C172 HydrophobicContact CB-CB 3.54Å; C95-C172 WeakPolarHBondContact CB-SG 3.37Å; C95-C172 WeakPolarHBondContact SG-CA 3.31Å; C95-C172 WeakPolarHBondContact SG-CB 3.44Å; C95-C172 CovalentContact SG-SG 2.04Å; C95-C172 PolarHBondContact SG-SG 3Å; C95-L175 HydrophobicContact CB-CD2 4.22Å |
| 96 | R | 95.7 | Very high | 95.3 | Very high | 80 Ų | 80 | 36.5 Ų | 36.5 | 30% | 0.302 | 19% | 0.192 | S | C | . | . | I | π-helix | trans | -85.2 | -38.8 | -175.5 | -70.2 | -179.2 | 178.8 | 176.4 | 1.7 | 112.9 | I92 F93 V100 V158 T161 R162 K163 | I92-R96 HydrophobicContact CG2-CG 4.28Å; I92-R96 WeakPolarHBondContact O-CB 3.25Å; I92-R96 WeakPolarHBondContact O-CG 3.45Å; I92-R96 PolarHBondContact O-N 2.87Å; F93-R96 PolarHBondContact O-N 3.46Å; R96-V100 WeakPolarHBondContact O-CG2 3.2Å; R96-V158 WeakPolarHBondContact O-CG1 3.48Å; R96-V158 WeakPolarHBondContact O-CG2 3.35Å; R96-T161 HydrophobicContact CG-CG2 3.83Å; R96-T161 PolarHBondContact NE-O 3.26Å; R96-T161 PolarHBondContact NH2-O 3.41Å; R96-R162 PolarHBondContact NH2-O 3.5Å; R96-K163 PolarHBondContact NH2-O 3.34Å |
| 97 | V | 96.3 | Very high | 95.7 | Very high | 49 Ų | 49 | 36.4 Ų | 36.4 | 30% | 0.297 | 19% | 0.189 | S | C | . | . | I | π-helix | trans | -124.7 | -61.8 | -167.3 | -176.3 | 0 | 0 | 0 | 0 | 111.1 | F93 S99 V100 L101 | F93-V97 HydrophobicContact CD2-CB 3.96Å; F93-V97 HydrophobicContact CD2-CG2 4.03Å; F93-V97 HydrophobicContact CE2-CB 3.65Å; F93-V97 HydrophobicContact CE2-CG1 3.78Å; F93-V97 HydrophobicContact CE2-CG2 3.98Å; F93-V97 HydrophobicContact CZ-CB 4.09Å; F93-V97 HydrophobicContact CZ-CG1 3.98Å; F93-V97 WeakPolarHBondContact O-CA 3.47Å; F93-V97 PolarHBondContact O-N 2.85Å; V97-S99 PolarHBondContact O-N 3.3Å; V97-V100 WeakPolarHBondContact O-CB 3.26Å; V97-V100 PolarHBondContact O-N 3.19Å; V97-L101 HydrophobicContact CG1-CD1 3.86Å; V97-L101 HydrophobicContact CG1-CG 4.31Å; V97-L101 PolarHBondContact O-N 3.35Å |
| 98 | S | 97.9 | Very high | 96 | Very high | 5 Ų | 5 | 33.1 Ų | 33.1 | 4% | 0.035 | 17% | 0.168 | C | C | . | . | I | π-helix | trans | -60.9 | -46.1 | -168.9 | -163.6 | 0 | 0 | 0 | 0 | 113 | T74 F93 V94 V100 L101 F102 | T74-S98 WeakPolarHBondContact CB-OG 3.44Å; F93-S98 PolarHBondContact O-N 3.21Å; F93-S98 VanDerWaalsContact O-N 3.17Å; V94-S98 PolarHBondContact O-N 3.42Å; S98-V100 VanDerWaalsContact C-N 3.31Å; S98-V100 PolarHBondContact O-N 2.97Å; S98-L101 PolarHBondContact O-N 2.99Å; S98-F102 WeakPolarHBondContact O-CB 3.39Å; S98-F102 PolarHBondContact O-N 3.46Å |
| 99 | S | 96.6 | Very high | 96.1 | Very high | 40 Ų | 40 | 30.3 Ų | 30.3 | 28% | 0.28 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -66.9 | -34 | 177.2 | -71.6 | 0 | 0 | 0 | 0 | 112.1 | V94 V97 F102 Y103 | V94-S99 VanDerWaalsContact O-CB 3.23Å; V94-S99 WeakPolarHBondContact O-CB 3.35Å; V94-S99 PolarHBondContact O-N 2.89Å; V94-S99 PolarHBondContact O-OG 3.04Å; V97-S99 PolarHBondContact O-N 3.3Å; S99-F102 PolarHBondContact O-N 3.12Å; S99-Y103 WeakPolarHBondContact O-CD2 3.19Å; S99-Y103 PolarHBondContact O-N 2.97Å; S99-Y103 VanDerWaalsContact O-N 3.11Å |
| 100 | V | 96.9 | Very high | 96.3 | Very high | 24 Ų | 24 | 24.4 Ų | 24.4 | 15% | 0.145 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -67.2 | -45.8 | 177.2 | -180 | 0 | 0 | 0 | 0 | 110.2 | R96 V97 S98 F102 Y103 L104 C154 V158 | R96-V100 WeakPolarHBondContact O-CG2 3.2Å; V97-V100 WeakPolarHBondContact O-CB 3.26Å; V97-V100 PolarHBondContact O-N 3.19Å; S98-V100 VanDerWaalsContact C-N 3.31Å; S98-V100 PolarHBondContact O-N 2.97Å; V100-F102 PolarHBondContact O-N 3.48Å; V100-Y103 PolarHBondContact O-N 2.91Å; V100-L104 VanDerWaalsContact O-CB 3.29Å; V100-L104 WeakPolarHBondContact O-CB 3.35Å; V100-L104 PolarHBondContact O-N 3.35Å; V100-C154 HydrophobicContact CG1-CB 3.68Å; V100-V158 HydrophobicContact CB-CG2 4.31Å; V100-V158 HydrophobicContact CG1-CG2 3.94Å; V100-V158 HydrophobicContact CG2-CG2 4.19Å |
| 101 | L | 97.8 | Very high | 96.4 | Very high | 61 Ų | 61 | 24.2 Ų | 24.2 | 32% | 0.319 | 12% | 0.12 | S | C | . | . | H | α-helix | trans | -61.2 | -42.7 | 174.9 | -71.1 | 177.7 | 0 | 0 | 0 | 112 | T74 V97 S98 Y103 L104 T105 | T74-L101 HydrophobicContact CG2-CB 4.06Å; V97-L101 HydrophobicContact CG1-CD1 3.86Å; V97-L101 HydrophobicContact CG1-CG 4.31Å; V97-L101 PolarHBondContact O-N 3.35Å; S98-L101 PolarHBondContact O-N 2.99Å; L101-Y103 PolarHBondContact O-N 2.96Å; L101-L104 HydrophobicContact CD2-CD2 4.36Å; L101-L104 WeakPolarHBondContact O-CB 3.47Å; L101-L104 PolarHBondContact O-N 3.35Å; L101-T105 WeakPolarHBondContact O-CG2 3.38Å; L101-T105 PolarHBondContact O-N 3.35Å; L101-T105 PolarHBondContact O-OG1 3.46Å |
| 102 | F | 97.9 | Very high | 96.5 | Very high | 8 Ų | 8 | 22.8 Ų | 22.8 | 4% | 0.035 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -54.7 | -50.4 | 175 | 174.5 | -74.2 | 0 | 0 | 0 | 111.4 | Y30 M71 T74 F75 S98 S99 V100 T105 M106 L282 S286 | Y30-F102 HydrophobicContact CE1-CE2 4.38Å; M71-F102 HydrophobicContact CG-CD2 4.02Å; M71-F102 HydrophobicContact CG-CE2 4.16Å; M71-F102 HydrophobicContact SD-CE2 4.3Å; T74-F102 HydrophobicContact CG2-CB 4.39Å; F75-F102 HydrophobicContact CD1-CD2 4.33Å; F75-F102 HydrophobicContact CD1-CE2 4.31Å; F75-F102 AromaticContact CE1-CD2 3.96Å; F75-F102 HydrophobicContact CE1-CD2 3.96Å; F75-F102 AromaticContact CE1-CE2 3.68Å; F75-F102 HydrophobicContact CE1-CE2 3.68Å; S98-F102 WeakPolarHBondContact O-CB 3.39Å; S98-F102 PolarHBondContact O-N 3.46Å; S99-F102 PolarHBondContact O-N 3.12Å; V100-F102 PolarHBondContact O-N 3.48Å; F102-T105 PolarHBondContact O-OG1 3.38Å; F102-M106 PolarHBondContact O-N 3.08Å; F102-M106 VanDerWaalsContact O-N 3.14Å; F102-L282 HydrophobicContact CD1-CD1 4.41Å; F102-L282 HydrophobicContact CE1-CD1 3.37Å; F102-L282 HydrophobicContact CE1-CG 4.16Å; F102-L282 HydrophobicContact CZ-CD1 3.69Å; F102-L282 HydrophobicContact CZ-CG 4.09Å; F102-S286 WeakPolarHBondContact CE2-OG 3.38Å; F102-S286 WeakPolarHBondContact CZ-OG 3.46Å |
| 103 | Y | 97.1 | Very high | 96.3 | Very high | 37 Ų | 37 | 21.8 Ų | 21.8 | 15% | 0.145 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -71 | -39.3 | -178.8 | -73.8 | -64.1 | 0 | 0 | 0 | 111.6 | S99 V100 L101 T105 M106 Y107 F249 R253 L282 | S99-Y103 WeakPolarHBondContact O-CD2 3.19Å; S99-Y103 PolarHBondContact O-N 2.97Å; S99-Y103 VanDerWaalsContact O-N 3.11Å; V100-Y103 PolarHBondContact O-N 2.91Å; L101-Y103 PolarHBondContact O-N 2.96Å; Y103-T105 PolarHBondContact O-N 3.28Å; Y103-M106 HydrophobicContact CD1-CE 4.11Å; Y103-M106 WeakPolarHBondContact O-CB 3.41Å; Y103-M106 PolarHBondContact O-N 3.27Å; Y103-Y107 WeakPolarHBondContact O-CD2 3.41Å; Y103-Y107 PolarHBondContact O-N 2.87Å; Y103-Y107 VanDerWaalsContact O-N 3.07Å; Y103-F249 HydrophobicContact CD1-CZ 4.42Å; Y103-F249 HydrophobicContact CE1-CE1 4.36Å; Y103-F249 HydrophobicContact CE1-CE2 4.31Å; Y103-F249 AromaticContact CE1-CZ 3.63Å; Y103-F249 HydrophobicContact CE1-CZ 3.63Å; Y103-R253 VanDerWaalsContact CZ-NH1 3.28Å; Y103-R253 PolarHBondContact OH-NH1 3.45Å; Y103-L282 HydrophobicContact CE1-CD1 3.67Å; Y103-L282 WeakPolarHBondContact OH-CD2 3.28Å |
| 104 | L | 97.4 | Very high | 96.2 | Very high | 6 Ų | 6 | 18.3 Ų | 18.3 | 3% | 0.031 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -53.8 | -52.7 | 175.6 | -179.3 | 102.4 | 0 | 0 | 0 | 110.7 | V100 L101 M106 Y107 I108 W147 L150 L151 C154 | V100-L104 VanDerWaalsContact O-CB 3.29Å; V100-L104 WeakPolarHBondContact O-CB 3.35Å; V100-L104 PolarHBondContact O-N 3.35Å; L101-L104 HydrophobicContact CD2-CD2 4.36Å; L101-L104 WeakPolarHBondContact O-CB 3.47Å; L101-L104 PolarHBondContact O-N 3.35Å; L104-M106 VanDerWaalsContact C-N 3.34Å; L104-M106 PolarHBondContact O-N 3.28Å; L104-Y107 PolarHBondContact O-N 3.5Å; L104-I108 HydrophobicContact CD2-CD1 3.86Å; L104-I108 HydrophobicContact CG-CD1 3.85Å; L104-I108 VanDerWaalsContact O-CG1 3.26Å; L104-I108 WeakPolarHBondContact O-CG1 3.48Å; L104-I108 PolarHBondContact O-N 2.98Å; L104-W147 HydrophobicContact CD2-CE3 4.48Å; L104-W147 HydrophobicContact CD2-CZ3 4.09Å; L104-L150 HydrophobicContact CD1-CB 3.72Å; L104-L150 WeakPolarHBondContact CD1-O 3.41Å; L104-L150 HydrophobicContact CG-CB 4.46Å; L104-L151 HydrophobicContact CD1-CD2 4Å; L104-L151 HydrophobicContact CD1-CG 4.22Å; L104-L151 HydrophobicContact CD2-CD2 3.85Å; L104-L151 HydrophobicContact CD2-CG 4.48Å; L104-C154 HydrophobicContact CD1-CB 4.12Å |
| 105 | T | 97.3 | Very high | 96.1 | Very high | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66.8 | -35.3 | -178.5 | 52 | 0 | 0 | 0 | 0 | 112.5 | A67 V70 M71 L101 F102 Y103 Y107 I108 S109 | A67-T105 HydrophobicContact CB-CG2 4.31Å; A67-T105 WeakPolarHBondContact O-CB 3.28Å; A67-T105 WeakPolarHBondContact O-CG2 3.17Å; V70-T105 HydrophobicContact CB-CG2 3.71Å; V70-T105 HydrophobicContact CG1-CG2 3.57Å; M71-T105 WeakPolarHBondContact CB-OG1 3.42Å; L101-T105 WeakPolarHBondContact O-CG2 3.38Å; L101-T105 PolarHBondContact O-N 3.35Å; L101-T105 PolarHBondContact O-OG1 3.46Å; F102-T105 PolarHBondContact O-OG1 3.38Å; Y103-T105 PolarHBondContact O-N 3.28Å; T105-Y107 PolarHBondContact O-N 3.28Å; T105-I108 WeakPolarHBondContact O-CB 3.07Å; T105-I108 PolarHBondContact O-N 3.44Å; T105-S109 PolarHBondContact O-N 2.85Å; T105-S109 PolarHBondContact O-OG 3.45Å |
| 106 | M | 96.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -56.5 | -48.6 | 172 | -169.6 | -170.4 | 71.7 | 0 | 0 | 111.6 | M71 F102 Y103 L104 I108 S109 I110 F246 F249 S285 | M71-M106 HydrophobicContact CE-CB 3.51Å; M71-M106 HydrophobicContact CE-CG 4.19Å; M71-M106 VanDerWaalsContact CE-N 3.28Å; F102-M106 PolarHBondContact O-N 3.08Å; F102-M106 VanDerWaalsContact O-N 3.14Å; Y103-M106 HydrophobicContact CD1-CE 4.11Å; Y103-M106 WeakPolarHBondContact O-CB 3.41Å; Y103-M106 PolarHBondContact O-N 3.27Å; L104-M106 VanDerWaalsContact C-N 3.34Å; L104-M106 PolarHBondContact O-N 3.28Å; M106-I108 VanDerWaalsContact C-N 3.35Å; M106-S109 PolarHBondContact O-N 3.36Å; M106-I110 HydrophobicContact CE-CD1 4.37Å; M106-I110 HydrophobicContact CG-CD1 4.19Å; M106-I110 WeakPolarHBondContact O-CD1 3.45Å; M106-I110 WeakPolarHBondContact O-CG1 3.49Å; M106-I110 PolarHBondContact O-N 3.48Å; M106-F246 HydrophobicContact CG-CD1 4.3Å; M106-F246 HydrophobicContact CG-CE1 3.8Å; M106-F249 HydrophobicContact CE-CD1 4.16Å; M106-F249 HydrophobicContact CE-CE1 3.73Å; M106-F249 HydrophobicContact SD-CD1 4.2Å; M106-F249 HydrophobicContact SD-CE1 4.14Å; M106-S285 PolarHBondContact SD-OG 3.43Å; M106-S285 VanDerWaalsContact SD-OG 3.34Å |
| 107 | Y | 97.4 | Very high | 95.7 | Very high | 8 Ų | 8 | 15.7 Ų | 15.7 | 3% | 0.031 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -70.1 | -31.2 | 178.7 | -75.8 | -68.3 | 0 | 0 | 0 | 113 | Y103 L104 T105 I110 L111 C191 I194 H250 | Y103-Y107 WeakPolarHBondContact O-CD2 3.41Å; Y103-Y107 PolarHBondContact O-N 2.87Å; Y103-Y107 VanDerWaalsContact O-N 3.07Å; L104-Y107 PolarHBondContact O-N 3.5Å; T105-Y107 PolarHBondContact O-N 3.28Å; Y107-I110 HydrophobicContact CD1-CD1 4.05Å; Y107-I110 HydrophobicContact CE1-CD1 4.18Å; Y107-I110 PolarHBondContact O-N 2.94Å; Y107-L111 WeakPolarHBondContact O-CB 3.3Å; Y107-L111 WeakPolarHBondContact O-CG 3.26Å; Y107-L111 PolarHBondContact O-N 2.93Å; Y107-C191 HydrophobicContact CD1-CB 4.4Å; Y107-C191 HydrophobicContact CD2-CB 4.36Å; Y107-C191 WeakPolarHBondContact CD2-SG 3.45Å; Y107-C191 HydrophobicContact CE1-CB 3.68Å; Y107-C191 WeakPolarHBondContact CE1-O 3.45Å; Y107-C191 HydrophobicContact CE2-CB 3.65Å; Y107-C191 WeakPolarHBondContact CE2-SG 3.16Å; Y107-C191 VanDerWaalsContact CZ-SG 3.58Å; Y107-C191 WeakPolarHBondContact OH-CB 3.24Å; Y107-I194 HydrophobicContact CD1-CG2 4.18Å; Y107-H250 AromaticContact CE1-NE2 3.4Å; Y107-H250 WeakPolarHBondContact CE1-NE2 3.47Å; Y107-H250 AromaticContact CZ-NE2 3.55Å; Y107-H250 PolarHBondContact OH-NE2 3.28Å |
| 108 | I | 97.4 | Very high | 95.5 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -60.8 | -50.8 | 171.1 | -71.5 | 165.9 | 0 | 0 | 0 | 110.2 | A67 L104 T105 M106 I110 L111 F112 W147 L150 | A67-I108 HydrophobicContact CB-CB 4.16Å; A67-I108 HydrophobicContact CB-CG2 3.72Å; L104-I108 HydrophobicContact CD2-CD1 3.86Å; L104-I108 HydrophobicContact CG-CD1 3.85Å; L104-I108 VanDerWaalsContact O-CG1 3.26Å; L104-I108 WeakPolarHBondContact O-CG1 3.48Å; L104-I108 PolarHBondContact O-N 2.98Å; T105-I108 WeakPolarHBondContact O-CB 3.07Å; T105-I108 PolarHBondContact O-N 3.44Å; M106-I108 VanDerWaalsContact C-N 3.35Å; I108-I110 PolarHBondContact O-N 3.16Å; I108-L111 PolarHBondContact O-N 2.78Å; I108-F112 HydrophobicContact CG2-CD2 3.55Å; I108-F112 HydrophobicContact CG2-CE2 3.59Å; I108-F112 VanDerWaalsContact O-CD2 3.22Å; I108-F112 WeakPolarHBondContact O-CD2 3.37Å; I108-F112 PolarHBondContact O-N 2.94Å; I108-W147 HydrophobicContact CD1-CD2 3.57Å; I108-W147 HydrophobicContact CD1-CE3 3.26Å; I108-W147 HydrophobicContact CD1-CG 4.45Å; I108-W147 HydrophobicContact CD1-CH2 3.48Å; I108-W147 VanDerWaalsContact CD1-CH2 3.48Å; I108-W147 HydrophobicContact CD1-CZ2 3.77Å; I108-W147 HydrophobicContact CD1-CZ3 3.21Å; I108-W147 HydrophobicContact CG1-CD2 4.42Å; I108-W147 HydrophobicContact CG1-CE3 4.48Å; I108-W147 HydrophobicContact CG2-CZ2 3.91Å; I108-L150 HydrophobicContact CB-CD1 4.39Å; I108-L150 HydrophobicContact CD1-CD1 4.46Å; I108-L150 HydrophobicContact CG1-CD1 3.44Å; I108-L150 VanDerWaalsContact CG1-CD1 3.44Å |
| 109 | S | 94.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -58.8 | -46.1 | 177.7 | -61.1 | 0 | 0 | 0 | 0 | 111 | D68 T105 M106 L111 F112 F113 | D68-S109 PolarHBondContact OD1-OG 3.04Å; T105-S109 PolarHBondContact O-N 2.85Å; T105-S109 PolarHBondContact O-OG 3.45Å; M106-S109 PolarHBondContact O-N 3.36Å; S109-L111 PolarHBondContact O-N 3.49Å; S109-F112 PolarHBondContact O-N 2.89Å; S109-F113 WeakPolarHBondContact O-CD2 3.33Å; S109-F113 PolarHBondContact O-N 2.88Å |
| 110 | I | 95.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -56.2 | -50.2 | 175.9 | -69.6 | 161.4 | 0 | 0 | 0 | 111.8 | M106 Y107 I108 F112 F113 G114 F195 N198 F242 F246 | M106-I110 HydrophobicContact CE-CD1 4.37Å; M106-I110 HydrophobicContact CG-CD1 4.19Å; M106-I110 WeakPolarHBondContact O-CD1 3.45Å; M106-I110 WeakPolarHBondContact O-CG1 3.49Å; M106-I110 PolarHBondContact O-N 3.48Å; Y107-I110 HydrophobicContact CD1-CD1 4.05Å; Y107-I110 HydrophobicContact CE1-CD1 4.18Å; Y107-I110 PolarHBondContact O-N 2.94Å; I108-I110 PolarHBondContact O-N 3.16Å; I110-F112 PolarHBondContact O-N 3.39Å; I110-F113 WeakPolarHBondContact O-CB 3.35Å; I110-F113 PolarHBondContact O-N 3.36Å; I110-G114 PolarHBondContact O-N 3.32Å; I110-G114 VanDerWaalsContact O-N 3.08Å; I110-F195 HydrophobicContact CD1-CD2 4.09Å; I110-F195 HydrophobicContact CG2-CD2 4.24Å; I110-N198 HydrophobicContact CG2-CB 4Å; I110-N198 PolarHBondContact O-ND2 3.42Å; I110-N198 PolarHBondContact O-OD1 3.42Å; I110-F242 HydrophobicContact CB-CE2 4.48Å; I110-F242 HydrophobicContact CG1-CE2 4.19Å; I110-F242 HydrophobicContact CG2-CE2 4.37Å; I110-F242 HydrophobicContact CG2-CZ 4.22Å; I110-F246 HydrophobicContact CD1-CD1 3.84Å; I110-F246 HydrophobicContact CD1-CE1 4.06Å; I110-F246 HydrophobicContact CD1-CG 4.32Å; I110-F246 HydrophobicContact CG1-CD1 3.95Å; I110-F246 HydrophobicContact CG1-CD2 4.33Å; I110-F246 HydrophobicContact CG1-CE1 3.9Å; I110-F246 HydrophobicContact CG1-CE2 4.28Å; I110-F246 HydrophobicContact CG1-CG 4.17Å; I110-F246 HydrophobicContact CG1-CZ 4.05Å |
| 111 | L | 97 | Very high | 94.2 | Very high | 36 Ų | 36 | 15.3 Ų | 15.3 | 19% | 0.188 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -61.8 | -44 | 180 | -77.5 | 175.2 | 0 | 0 | 0 | 111.8 | Y107 I108 S109 F113 G114 L115 V146 L150 I194 | Y107-L111 WeakPolarHBondContact O-CB 3.3Å; Y107-L111 WeakPolarHBondContact O-CG 3.26Å; Y107-L111 PolarHBondContact O-N 2.93Å; I108-L111 PolarHBondContact O-N 2.78Å; S109-L111 PolarHBondContact O-N 3.49Å; L111-F113 PolarHBondContact O-N 3.48Å; L111-G114 PolarHBondContact O-N 2.91Å; L111-L115 WeakPolarHBondContact O-CG 3.43Å; L111-L115 PolarHBondContact O-N 2.9Å; L111-V146 HydrophobicContact CB-CG1 4.15Å; L111-V146 HydrophobicContact CD1-CG1 3.67Å; L111-L150 HydrophobicContact CD1-CD1 3.86Å; L111-L150 HydrophobicContact CD1-CG 4.34Å; L111-I194 HydrophobicContact CD1-CG2 4.34Å; L111-I194 HydrophobicContact CD2-CG2 3.65Å; L111-I194 HydrophobicContact CG-CG2 3.89Å |
| 112 | F | 95.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -68.1 | -33.1 | 177.7 | -78.2 | -64.1 | 0 | 0 | 0 | 113 | Y60 N63 I64 I108 S109 I110 L115 I116 V146 W147 | Y60-F112 AromaticContact CD1-CD1 3.64Å; Y60-F112 HydrophobicContact CD1-CD1 3.64Å; Y60-F112 AromaticContact CD1-CE1 3.73Å; Y60-F112 HydrophobicContact CD1-CE1 3.73Å; Y60-F112 HydrophobicContact CE1-CD1 4.46Å; Y60-F112 HydrophobicContact CE1-CE1 4.35Å; Y60-F112 AromaticContact CG-CD1 3.99Å; Y60-F112 HydrophobicContact CG-CD1 3.99Å; N63-F112 HydrophobicContact CB-CD1 4.21Å; N63-F112 HydrophobicContact CB-CD2 3.62Å; N63-F112 HydrophobicContact CB-CE1 3.9Å; N63-F112 HydrophobicContact CB-CE2 3.28Å; N63-F112 HydrophobicContact CB-CG 4.1Å; N63-F112 HydrophobicContact CB-CZ 3.43Å; N63-F112 VanDerWaalsContact CB-CZ 3.43Å; N63-F112 VanDerWaalsContact CG-CZ 3.4Å; I64-F112 HydrophobicContact CD1-CB 3.86Å; I64-F112 HydrophobicContact CG1-CB 3.5Å; I64-F112 HydrophobicContact CG1-CG 4.32Å; I108-F112 HydrophobicContact CG2-CD2 3.55Å; I108-F112 HydrophobicContact CG2-CE2 3.59Å; I108-F112 VanDerWaalsContact O-CD2 3.22Å; I108-F112 WeakPolarHBondContact O-CD2 3.37Å; I108-F112 PolarHBondContact O-N 2.94Å; S109-F112 PolarHBondContact O-N 2.89Å; I110-F112 PolarHBondContact O-N 3.39Å; F112-L115 HydrophobicContact CD1-CD1 3.93Å; F112-L115 HydrophobicContact CE1-CD1 4.11Å; F112-L115 PolarHBondContact O-N 2.93Å; F112-I116 WeakPolarHBondContact O-CB 3.36Å; F112-I116 VanDerWaalsContact O-CG1 3.25Å; F112-I116 WeakPolarHBondContact O-CG1 3.37Å; F112-I116 PolarHBondContact O-N 3.36Å; F112-V146 HydrophobicContact CE2-CG1 4.19Å; F112-V146 HydrophobicContact CZ-CB 4.45Å; F112-V146 HydrophobicContact CZ-CG1 4.4Å; F112-W147 AromaticContact CE2-NE1 3.95Å |
| 113 | F | 91.3 | Very high | 93.2 | Very high | 13 Ų | 13 | 22 Ų | 22 | 6% | 0.057 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.4 | -45.6 | 169.8 | -90.7 | -63.2 | 0 | 0 | 0 | 112.5 | I64 S109 I110 L111 I116 S117 V238 F242 D292 I295 | I64-F113 HydrophobicContact CD1-CD2 4.47Å; I64-F113 HydrophobicContact CD1-CE2 4.41Å; I64-F113 HydrophobicContact CD1-CZ 4.47Å; S109-F113 WeakPolarHBondContact O-CD2 3.33Å; S109-F113 PolarHBondContact O-N 2.88Å; I110-F113 WeakPolarHBondContact O-CB 3.35Å; I110-F113 PolarHBondContact O-N 3.36Å; L111-F113 PolarHBondContact O-N 3.48Å; F113-I116 PolarHBondContact O-N 3.44Å; F113-S117 WeakPolarHBondContact O-CB 3.41Å; F113-S117 PolarHBondContact O-N 2.89Å; F113-S117 PolarHBondContact O-OG 3.45Å; F113-V238 HydrophobicContact CE1-CG1 4.11Å; F113-F242 HydrophobicContact CB-CD2 4.13Å; F113-F242 HydrophobicContact CB-CE2 4.03Å; F113-F242 HydrophobicContact CD2-CD2 4.12Å; F113-F242 HydrophobicContact CD2-CE2 4.41Å; F113-F242 HydrophobicContact CG-CD2 4.09Å; F113-F242 HydrophobicContact CG-CE2 4.4Å; F113-D292 WeakPolarHBondContact CE2-OD2 3.21Å; F113-D292 WeakPolarHBondContact CZ-OD1 3.25Å; F113-I295 HydrophobicContact CZ-CD1 4.45Å |
| 114 | G | 93.3 | Very high | 92.6 | Very high | 1 Ų | 1 | 22.7 Ų | 22.7 | 1% | 0.01 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.1 | -43.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | I110 L111 I116 S117 I118 N198 | I110-G114 PolarHBondContact O-N 3.32Å; I110-G114 VanDerWaalsContact O-N 3.08Å; L111-G114 PolarHBondContact O-N 2.91Å; G114-I116 PolarHBondContact O-N 2.87Å; G114-S117 WeakPolarHBondContact O-CB 3.29Å; G114-S117 PolarHBondContact O-N 3.22Å; G114-S117 VanDerWaalsContact O-N 3.16Å; G114-I118 VanDerWaalsContact O-CG1 3.31Å; G114-I118 WeakPolarHBondContact O-CG1 3.29Å; G114-I118 PolarHBondContact O-N 3.1Å; G114-N198 WeakPolarHBondContact CA-ND2 3.33Å |
| 115 | L | 94.6 | Very high | 92.1 | Very high | 30 Ų | 30 | 25.9 Ų | 25.9 | 16% | 0.157 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -64.1 | -37.9 | 177.5 | -70 | 176.6 | 0 | 0 | 0 | 112.9 | Y60 L111 F112 S117 D119 L142 V146 | Y60-L115 HydrophobicContact CD2-CB 4.11Å; Y60-L115 HydrophobicContact CE1-CB 4.43Å; Y60-L115 HydrophobicContact CE1-CD1 4.25Å; Y60-L115 HydrophobicContact CE2-CB 3.83Å; L111-L115 WeakPolarHBondContact O-CG 3.43Å; L111-L115 PolarHBondContact O-N 2.9Å; F112-L115 HydrophobicContact CD1-CD1 3.93Å; F112-L115 HydrophobicContact CE1-CD1 4.11Å; F112-L115 PolarHBondContact O-N 2.93Å; L115-S117 VanDerWaalsContact C-N 3.34Å; L115-D119 WeakPolarHBondContact O-CB 3.42Å; L115-D119 PolarHBondContact O-N 3.41Å; L115-L142 HydrophobicContact CD1-CD2 4.23Å; L115-L142 HydrophobicContact CD1-CG 4.45Å; L115-L142 HydrophobicContact CD2-CD2 4.02Å; L115-V146 HydrophobicContact CD1-CG2 4.46Å |
| 116 | I | 91.1 | Very high | 91.4 | Very high | 8 Ų | 8 | 29.6 Ų | 29.6 | 4% | 0.041 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.9 | -45 | 172.2 | -73.4 | 168.5 | 0 | 0 | 0 | 110.1 | F57 Y60 L61 I64 F112 F113 G114 D119 R120 | F57-I116 HydrophobicContact CD2-CG1 4.25Å; F57-I116 HydrophobicContact CD2-CG2 3.89Å; F57-I116 HydrophobicContact CE2-CD1 4.39Å; F57-I116 HydrophobicContact CE2-CG2 3.78Å; Y60-I116 HydrophobicContact CD2-CG1 3.81Å; Y60-I116 HydrophobicContact CG-CG1 4.21Å; L61-I116 HydrophobicContact CD2-CD1 3.95Å; L61-I116 HydrophobicContact CG-CD1 4.49Å; I64-I116 HydrophobicContact CD1-CD1 3.55Å; F112-I116 WeakPolarHBondContact O-CB 3.36Å; F112-I116 VanDerWaalsContact O-CG1 3.25Å; F112-I116 WeakPolarHBondContact O-CG1 3.37Å; F112-I116 PolarHBondContact O-N 3.36Å; F113-I116 PolarHBondContact O-N 3.44Å; G114-I116 PolarHBondContact O-N 2.87Å; I116-D119 PolarHBondContact O-N 3.13Å; I116-R120 WeakPolarHBondContact O-CB 3.46Å; I116-R120 WeakPolarHBondContact O-CG 3.4Å; I116-R120 PolarHBondContact O-N 3.42Å |
| 117 | S | 89.9 | Confident | 90.4 | Very high | 4 Ų | 4 | 34 Ų | 34 | 3% | 0.028 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -62.3 | -44.2 | 179.9 | -58.3 | 0 | 0 | 0 | 0 | 111.8 | F113 G114 L115 R120 C121 Y206 | F113-S117 WeakPolarHBondContact O-CB 3.41Å; F113-S117 PolarHBondContact O-N 2.89Å; F113-S117 PolarHBondContact O-OG 3.45Å; G114-S117 WeakPolarHBondContact O-CB 3.29Å; G114-S117 PolarHBondContact O-N 3.22Å; G114-S117 VanDerWaalsContact O-N 3.16Å; L115-S117 VanDerWaalsContact C-N 3.34Å; S117-R120 PolarHBondContact O-N 2.92Å; S117-C121 WeakPolarHBondContact O-CB 3.45Å; S117-C121 PolarHBondContact O-N 3.16Å; S117-Y206 WeakPolarHBondContact OG-CE2 3.05Å |
| 118 | I | 92.1 | Very high | 89.3 | Confident | 51 Ų | 51 | 43.3 Ų | 43.3 | 26% | 0.262 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.9 | -43.3 | 175.1 | -66.3 | 164.4 | 0 | 0 | 0 | 111.3 | G114 R120 C121 R122 A201 | G114-I118 VanDerWaalsContact O-CG1 3.31Å; G114-I118 WeakPolarHBondContact O-CG1 3.29Å; G114-I118 PolarHBondContact O-N 3.1Å; I118-R120 VanDerWaalsContact C-N 3.34Å; I118-R120 PolarHBondContact O-N 3.37Å; I118-C121 PolarHBondContact O-N 2.96Å; I118-R122 HydrophobicContact CG2-CG 4.49Å; I118-R122 WeakPolarHBondContact O-CB 3.49Å; I118-R122 WeakPolarHBondContact O-CG 3.5Å; I118-R122 PolarHBondContact O-N 2.85Å; I118-A201 HydrophobicContact CD1-CB 4.48Å |
| 119 | D | 89.8 | Confident | 88 | Confident | 6 Ų | 6 | 50.6 Ų | 50.6 | 3% | 0.032 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -61.9 | -42.6 | 177.6 | -174.8 | 71 | 0 | 0 | 0 | 111.6 | H56 Y60 L115 I116 R122 K123 | H56-D119 WeakPolarHBondContact CB-OD1 3.49Å; H56-D119 IonicContact CE1-OD1 2.76Å; H56-D119 IonicContact CG-OD1 3.51Å; H56-D119 IonicContact ND1-OD1 2.76Å; H56-D119 PolarHBondContact ND1-OD1 2.89Å; Y60-D119 HydrophobicContact CE2-CB 4.24Å; L115-D119 WeakPolarHBondContact O-CB 3.42Å; L115-D119 PolarHBondContact O-N 3.41Å; I116-D119 PolarHBondContact O-N 3.13Å; D119-R122 PolarHBondContact O-N 3.44Å; D119-K123 WeakPolarHBondContact O-CG 3.2Å; D119-K123 PolarHBondContact O-N 3.49Å; D119-K123 IonicContact OD1-NZ 3.92Å; D119-K123 WeakPolarHBondContact OD2-CE 3.07Å; D119-K123 IonicContact OD2-NZ 2.72Å; D119-K123 PolarHBondContact OD2-NZ 3.31Å |
| 120 | R | 86.5 | Confident | 86.8 | Confident | 45 Ų | 45 | 53.2 Ų | 53.2 | 17% | 0.17 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.4 | -49 | 175.5 | -75.7 | -176 | 170.9 | -159.7 | -6.5 | 111.7 | I116 S117 I118 R122 K123 T124 I209 | I116-R120 WeakPolarHBondContact O-CB 3.46Å; I116-R120 WeakPolarHBondContact O-CG 3.4Å; I116-R120 PolarHBondContact O-N 3.42Å; S117-R120 PolarHBondContact O-N 2.92Å; I118-R120 VanDerWaalsContact C-N 3.34Å; I118-R120 PolarHBondContact O-N 3.37Å; R120-R122 VanDerWaalsContact C-N 3.32Å; R120-R122 PolarHBondContact O-N 3.3Å; R120-K123 PolarHBondContact O-N 2.94Å; R120-K123 VanDerWaalsContact O-N 3.15Å; R120-T124 PolarHBondContact O-N 3.43Å; R120-T124 PolarHBondContact O-OG1 3.15Å; R120-T124 VanDerWaalsContact O-OG1 3.09Å; R120-I209 HydrophobicContact CB-CD1 4.31Å |
| 121 | C | 88.4 | Confident | 86 | Confident | 8 Ų | 8 | 56.5 Ų | 56.5 | 5% | 0.054 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -55.7 | -47.6 | 177.2 | -179.3 | 0 | 0 | 0 | 0 | 111.4 | S117 I118 K123 T124 L125 C205 I209 | S117-C121 WeakPolarHBondContact O-CB 3.45Å; S117-C121 PolarHBondContact O-N 3.16Å; I118-C121 PolarHBondContact O-N 2.96Å; C121-K123 PolarHBondContact O-N 2.97Å; C121-T124 PolarHBondContact O-N 2.76Å; C121-L125 WeakPolarHBondContact O-CB 3.45Å; C121-L125 VanDerWaalsContact O-CG 3.3Å; C121-L125 WeakPolarHBondContact O-CG 3.37Å; C121-L125 PolarHBondContact O-N 3.23Å; C121-L125 VanDerWaalsContact SG-CD1 3.56Å; C121-C205 HydrophobicContact CB-CB 3.67Å; C121-I209 HydrophobicContact CB-CD1 4.13Å; C121-I209 HydrophobicContact CB-CG1 4.25Å |
| 122 | R | 88.9 | Confident | 85.5 | Confident | 130 Ų | 130 | 58.7 Ų | 58.7 | 49% | 0.491 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.9 | -40.5 | 177.3 | -74.1 | 178.2 | 176.4 | -169 | 2.2 | 113.1 | I118 D119 R120 M126 | I118-R122 HydrophobicContact CG2-CG 4.49Å; I118-R122 WeakPolarHBondContact O-CB 3.49Å; I118-R122 WeakPolarHBondContact O-CG 3.5Å; I118-R122 PolarHBondContact O-N 2.85Å; D119-R122 PolarHBondContact O-N 3.44Å; R120-R122 VanDerWaalsContact C-N 3.32Å; R120-R122 PolarHBondContact O-N 3.3Å; R122-M126 WeakPolarHBondContact O-CB 3.41Å; R122-M126 PolarHBondContact O-N 2.81Å |
| 123 | K | 86.1 | Confident | 85 | Confident | 79 Ų | 79 | 63.5 Ų | 63.5 | 34% | 0.343 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -69.3 | -38.9 | 177.9 | -77.8 | 172.5 | 175.5 | 161.6 | 0 | 112.5 | D119 R120 C121 M126 P127 | D119-K123 WeakPolarHBondContact O-CG 3.2Å; D119-K123 PolarHBondContact O-N 3.49Å; D119-K123 IonicContact OD1-NZ 3.92Å; D119-K123 WeakPolarHBondContact OD2-CE 3.07Å; D119-K123 IonicContact OD2-NZ 2.72Å; D119-K123 PolarHBondContact OD2-NZ 3.31Å; R120-K123 PolarHBondContact O-N 2.94Å; R120-K123 VanDerWaalsContact O-N 3.15Å; C121-K123 PolarHBondContact O-N 2.97Å; K123-M126 CarbonylContact O-C 3.49Å; K123-P127 WeakPolarHBondContact O-CA 3.38Å |
| 124 | T | 84.4 | Confident | 84.9 | Confident | 52 Ų | 52 | 66 Ų | 66 | 32% | 0.319 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.2 | -43.4 | 176.8 | -58.3 | 0 | 0 | 0 | 0 | 111.3 | R120 C121 I209 E212 | R120-T124 PolarHBondContact O-N 3.43Å; R120-T124 PolarHBondContact O-OG1 3.15Å; R120-T124 VanDerWaalsContact O-OG1 3.09Å; C121-T124 PolarHBondContact O-N 2.76Å; T124-I209 HydrophobicContact CG2-CG1 4.42Å; T124-I209 HydrophobicContact CG2-CG2 4.44Å; T124-E212 HydrophobicContact CG2-CB 4.35Å; T124-E212 HydrophobicContact CG2-CG 4.33Å |
| 125 | L | 86.1 | Confident | 84.7 | Confident | 73 Ų | 73 | 70 Ų | 70 | 38% | 0.382 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -80.4 | -23.4 | -178.5 | -61.8 | 175.5 | 0 | 0 | 0 | 113.5 | C121 L208 E212 | C121-L125 WeakPolarHBondContact O-CB 3.45Å; C121-L125 VanDerWaalsContact O-CG 3.3Å; C121-L125 WeakPolarHBondContact O-CG 3.37Å; C121-L125 PolarHBondContact O-N 3.23Å; C121-L125 VanDerWaalsContact SG-CD1 3.56Å; L125-L208 HydrophobicContact CD1-CB 4.23Å; L125-L208 HydrophobicContact CD1-CD1 4.13Å; L125-E212 HydrophobicContact CD2-CB 3.98Å; L125-E212 HydrophobicContact CD2-CG 4.2Å |
| 126 | M | 83.9 | Confident | 84.5 | Confident | 78 Ų | 78 | 70 Ų | 70 | 38% | 0.384 | 37% | 0.368 | S | S | . | . | trans | -134.7 | 71.8 | -179.5 | -62.8 | -172.7 | -73.7 | 0 | 0 | 111.6 | R122 K123 F128 R129 | R122-M126 WeakPolarHBondContact O-CB 3.41Å; R122-M126 PolarHBondContact O-N 2.81Å; K123-M126 CarbonylContact O-C 3.49Å; M126-F128 PolarHBondContact O-N 3.4Å; M126-R129 PolarHBondContact O-N 3.22Å; M126-R129 PolarHBondContact SD-NH1 3.44Å | ||
| 127 | P | 75.8 | Confident | 84.5 | Confident | 92 Ų | 92 | 72.2 Ų | 72.2 | 60% | 0.597 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -24.6 | -172.3 | 24 | -33.7 | 0 | 0 | 0 | 114.1 | K123 R129 | K123-P127 WeakPolarHBondContact O-CA 3.38Å; P127-R129 VanDerWaalsContact C-N 3.32Å; P127-R129 PolarHBondContact O-N 3.4Å |
| 128 | F | 72.3 | Confident | 84.6 | Confident | 203 Ų | 203 | 79.9 Ų | 79.9 | 89% | 0.89 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83 | 0.3 | -176.9 | -56.6 | -70.2 | 0 | 0 | 0 | 114.7 | M126 G130 | M126-F128 PolarHBondContact O-N 3.4Å; F128-G130 PolarHBondContact O-N 2.69Å |
| 129 | R | 70.5 | Confident | 84.7 | Confident | 154 Ų | 154 | 79.3 Ų | 79.3 | 58% | 0.581 | 41% | 0.411 | S | S | * | . | trans | -91.8 | 95.6 | 176.7 | -90.5 | 179.3 | 163.7 | 159.9 | -5 | 111.2 | M126 P127 | M126-R129 PolarHBondContact O-N 3.22Å; M126-R129 PolarHBondContact SD-NH1 3.44Å; P127-R129 VanDerWaalsContact C-N 3.32Å; P127-R129 PolarHBondContact O-N 3.4Å | ||
| 130 | G | 70 | Confident | 84.9 | Confident | 55 Ų | 55 | 84.9 Ų | 84.9 | 57% | 0.567 | 43% | 0.434 | S | S | * | . | trans | -63.3 | 165.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115 | F128 R135 | F128-G130 PolarHBondContact O-N 2.69Å; G130-R135 PolarHBondContact O-NH1 3.4Å | ||
| 131 | T | 78.1 | Confident | 85.4 | Confident | 69 Ų | 69 | 90.3 Ų | 90.3 | 42% | 0.423 | 46% | 0.46 | S | S | . | . | trans | -87.9 | 132.8 | 169.1 | 50 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 132 | N | 86.2 | Confident | 85.8 | Confident | 81 Ų | 81 | 92.6 Ų | 92.6 | 43% | 0.433 | 47% | 0.471 | S | S | . | . | trans | -128.3 | 169.6 | 173.5 | 70 | 14.5 | 0 | 0 | 0 | 110.7 | A134 R135 L136 | N132-A134 PolarHBondContact O-N 2.92Å; N132-A134 PolarHBondContact OD1-N 3.44Å; N132-R135 PolarHBondContact O-N 2.88Å; N132-R135 VanDerWaalsContact OD1-CB 3.31Å; N132-R135 WeakPolarHBondContact OD1-CB 3.24Å; N132-R135 WeakPolarHBondContact OD1-CD 3.32Å; N132-R135 WeakPolarHBondContact OD1-CG 3.13Å; N132-R135 PolarHBondContact OD1-N 3.27Å; N132-L136 PolarHBondContact O-N 2.87Å | ||
| 133 | S | 86.3 | Confident | 86.2 | Confident | 102 Ų | 102 | 86.6 Ų | 86.6 | 71% | 0.713 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -57.5 | -44.7 | -175.9 | -172.1 | 0 | 0 | 0 | 0 | 112.8 | R135 L136 A137 | S133-R135 PolarHBondContact O-N 3.08Å; S133-L136 WeakPolarHBondContact O-CB 3.4Å; S133-L136 PolarHBondContact O-N 2.82Å; S133-A137 PolarHBondContact O-N 2.81Å |
| 134 | A | 89.4 | Confident | 86.8 | Confident | 65 Ų | 65 | 84.4 Ų | 84.4 | 54% | 0.537 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61.2 | -39.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | N132 A137 R138 | N132-A134 PolarHBondContact O-N 2.92Å; N132-A134 PolarHBondContact OD1-N 3.44Å; A134-A137 PolarHBondContact O-N 3.44Å; A134-R138 PolarHBondContact O-N 2.88Å |
| 135 | R | 87.9 | Confident | 87.4 | Confident | 84 Ų | 84 | 84 Ų | 84 | 32% | 0.317 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 175.8 | -72 | 170.5 | -175.6 | -147.8 | -1.7 | 111.7 | G130 N132 S133 R138 R139 | G130-R135 PolarHBondContact O-NH1 3.4Å; N132-R135 PolarHBondContact O-N 2.88Å; N132-R135 VanDerWaalsContact OD1-CB 3.31Å; N132-R135 WeakPolarHBondContact OD1-CB 3.24Å; N132-R135 WeakPolarHBondContact OD1-CD 3.32Å; N132-R135 WeakPolarHBondContact OD1-CG 3.13Å; N132-R135 PolarHBondContact OD1-N 3.27Å; S133-R135 PolarHBondContact O-N 3.08Å; R135-R138 PolarHBondContact O-N 3.31Å; R135-R139 WeakPolarHBondContact O-CG 3.19Å; R135-R139 PolarHBondContact O-N 3.32Å |
| 136 | L | 90.4 | Very high | 88 | Confident | 30 Ų | 30 | 81.3 Ų | 81.3 | 16% | 0.157 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -62.5 | -45.6 | 174.2 | -71.9 | 164.9 | 0 | 0 | 0 | 111.3 | I59 N132 S133 R138 R139 K140 | I59-L136 HydrophobicContact CD1-CB 4.47Å; I59-L136 HydrophobicContact CD1-CD2 3.69Å; N132-L136 PolarHBondContact O-N 2.87Å; S133-L136 WeakPolarHBondContact O-CB 3.4Å; S133-L136 PolarHBondContact O-N 2.82Å; L136-R138 VanDerWaalsContact C-N 3.33Å; L136-R138 PolarHBondContact O-N 2.96Å; L136-R139 PolarHBondContact O-N 3.1Å; L136-R139 VanDerWaalsContact O-N 3.13Å; L136-K140 WeakPolarHBondContact O-CG 3.15Å; L136-K140 PolarHBondContact O-N 2.91Å |
| 137 | A | 91.2 | Very high | 88.7 | Confident | 56 Ų | 56 | 79.9 Ų | 79.9 | 46% | 0.463 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -58.4 | -45 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | S133 A134 R139 K140 F141 | S133-A137 PolarHBondContact O-N 2.81Å; A134-A137 PolarHBondContact O-N 3.44Å; A137-R139 VanDerWaalsContact C-N 3.29Å; A137-R139 PolarHBondContact O-N 3.34Å; A137-K140 WeakPolarHBondContact O-CB 3.17Å; A137-K140 PolarHBondContact O-N 2.97Å; A137-K140 VanDerWaalsContact O-N 3.15Å; A137-F141 PolarHBondContact O-N 2.96Å |
| 138 | R | 93.1 | Very high | 89.7 | Confident | 165 Ų | 165 | 78.8 Ų | 78.8 | 62% | 0.623 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -58.9 | -37.7 | 175.1 | -165.7 | -174.2 | -54.1 | -177.8 | 0.8 | 112.8 | A134 R135 L136 L142 | A134-R138 PolarHBondContact O-N 2.88Å; R135-R138 PolarHBondContact O-N 3.31Å; L136-R138 VanDerWaalsContact C-N 3.33Å; L136-R138 PolarHBondContact O-N 2.96Å; R138-L142 WeakPolarHBondContact O-CB 3.29Å; R138-L142 PolarHBondContact O-N 3.29Å |
| 139 | R | 93.3 | Very high | 91 | Very high | 39 Ų | 39 | 74.1 Ų | 74.1 | 15% | 0.147 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -72.9 | -33.8 | 177 | -62.7 | -34.3 | -170.1 | 162.8 | 0.3 | 112.8 | H56 I59 Y60 R135 L136 A137 S143 | H56-R139 HydrophobicContact CB-CG 4.2Å; H56-R139 WeakPolarHBondContact CD2-CG 3.5Å; I59-R139 HydrophobicContact CD1-CB 4.26Å; Y60-R139 HydrophobicContact CE1-CB 4.19Å; Y60-R139 WeakPolarHBondContact OH-CD 3.48Å; Y60-R139 PolarHBondContact OH-NE 3.49Å; R135-R139 WeakPolarHBondContact O-CG 3.19Å; R135-R139 PolarHBondContact O-N 3.32Å; L136-R139 PolarHBondContact O-N 3.1Å; L136-R139 VanDerWaalsContact O-N 3.13Å; A137-R139 VanDerWaalsContact C-N 3.29Å; A137-R139 PolarHBondContact O-N 3.34Å; R139-S143 WeakPolarHBondContact O-CB 3.44Å; R139-S143 PolarHBondContact O-N 3.02Å; R139-S143 PolarHBondContact O-OG 3.27Å |
| 140 | K | 94.3 | Very high | 92.3 | Very high | 122 Ų | 122 | 66.8 Ų | 66.8 | 53% | 0.53 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.7 | -47 | 170.8 | -68.4 | 179.3 | 178.3 | -178.3 | 0 | 111 | I59 L136 A137 L142 S143 G144 | I59-K140 HydrophobicContact CD1-CG 4.07Å; I59-K140 HydrophobicContact CG2-CG 4.46Å; L136-K140 WeakPolarHBondContact O-CG 3.15Å; L136-K140 PolarHBondContact O-N 2.91Å; A137-K140 WeakPolarHBondContact O-CB 3.17Å; A137-K140 PolarHBondContact O-N 2.97Å; A137-K140 VanDerWaalsContact O-N 3.15Å; K140-L142 PolarHBondContact O-N 2.89Å; K140-S143 WeakPolarHBondContact O-CB 3.43Å; K140-S143 PolarHBondContact O-N 3.14Å; K140-S143 VanDerWaalsContact O-N 3.14Å; K140-G144 PolarHBondContact O-N 3.45Å |
| 141 | F | 96.6 | Very high | 93.6 | Very high | 160 Ų | 160 | 68.3 Ų | 68.3 | 70% | 0.702 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -58.9 | -48.3 | 175.1 | 179.5 | -97.5 | 0 | 0 | 0 | 111.7 | A137 S143 G144 A145 | A137-F141 PolarHBondContact O-N 2.96Å; F141-S143 PolarHBondContact O-N 3.24Å; F141-G144 PolarHBondContact O-N 2.81Å; F141-G144 VanDerWaalsContact O-N 3.13Å; F141-A145 WeakPolarHBondContact O-CB 3.47Å; F141-A145 PolarHBondContact O-N 3.46Å |
| 142 | L | 96.9 | Very high | 94.5 | Very high | 56 Ų | 56 | 70 Ų | 70 | 29% | 0.293 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -56.9 | -39.5 | 175.2 | 179.6 | 61.8 | 0 | 0 | 0 | 112.2 | L115 R138 K140 A145 V146 | L115-L142 HydrophobicContact CD1-CD2 4.23Å; L115-L142 HydrophobicContact CD1-CG 4.45Å; L115-L142 HydrophobicContact CD2-CD2 4.02Å; R138-L142 WeakPolarHBondContact O-CB 3.29Å; R138-L142 PolarHBondContact O-N 3.29Å; K140-L142 PolarHBondContact O-N 2.89Å; L142-A145 PolarHBondContact O-N 3.23Å; L142-V146 WeakPolarHBondContact O-CG2 3.29Å; L142-V146 PolarHBondContact O-N 3.23Å |
| 143 | S | 97.3 | Very high | 95 | Very high | 3 Ų | 3 | 66.9 Ų | 66.9 | 2% | 0.021 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 176.9 | -54.3 | 0 | 0 | 0 | 0 | 111 | R139 K140 F141 A145 V146 W147 | R139-S143 WeakPolarHBondContact O-CB 3.44Å; R139-S143 PolarHBondContact O-N 3.02Å; R139-S143 PolarHBondContact O-OG 3.27Å; K140-S143 WeakPolarHBondContact O-CB 3.43Å; K140-S143 PolarHBondContact O-N 3.14Å; K140-S143 VanDerWaalsContact O-N 3.14Å; F141-S143 PolarHBondContact O-N 3.24Å; S143-A145 VanDerWaalsContact C-N 3.31Å; S143-A145 PolarHBondContact O-N 3.44Å; S143-V146 PolarHBondContact O-N 2.92Å; S143-W147 VanDerWaalsContact O-CD1 3.31Å; S143-W147 PolarHBondContact O-N 3.42Å |
| 144 | G | 97.8 | Very high | 95.4 | Very high | 34 Ų | 34 | 62.7 Ų | 62.7 | 35% | 0.351 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.8 | -37.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | K140 F141 W147 S148 | K140-G144 PolarHBondContact O-N 3.45Å; F141-G144 PolarHBondContact O-N 2.81Å; F141-G144 VanDerWaalsContact O-N 3.13Å; G144-W147 PolarHBondContact O-N 3.33Å; G144-S148 WeakPolarHBondContact O-CB 3.45Å; G144-S148 PolarHBondContact O-N 3.36Å; G144-S148 PolarHBondContact O-OG 3.47Å |
| 145 | A | 98.1 | Very high | 95.6 | Very high | 42 Ų | 42 | 64.2 Ų | 64.2 | 35% | 0.347 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -65.3 | -41 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | F141 L142 S143 S148 F149 | F141-A145 WeakPolarHBondContact O-CB 3.47Å; F141-A145 PolarHBondContact O-N 3.46Å; L142-A145 PolarHBondContact O-N 3.23Å; S143-A145 VanDerWaalsContact C-N 3.31Å; S143-A145 PolarHBondContact O-N 3.44Å; A145-S148 PolarHBondContact O-N 2.9Å; A145-F149 VanDerWaalsContact O-CB 3.23Å; A145-F149 WeakPolarHBondContact O-CB 3.27Å; A145-F149 PolarHBondContact O-N 3.1Å |
| 146 | V | 98.2 | Very high | 96 | Very high | 17 Ų | 17 | 62 Ų | 62 | 10% | 0.103 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.7 | -48.6 | 174.7 | 166 | 0 | 0 | 0 | 0 | 111.2 | L111 F112 L115 L142 S143 L150 | L111-V146 HydrophobicContact CB-CG1 4.15Å; L111-V146 HydrophobicContact CD1-CG1 3.67Å; F112-V146 HydrophobicContact CE2-CG1 4.19Å; F112-V146 HydrophobicContact CZ-CB 4.45Å; F112-V146 HydrophobicContact CZ-CG1 4.4Å; L115-V146 HydrophobicContact CD1-CG2 4.46Å; L142-V146 WeakPolarHBondContact O-CG2 3.29Å; L142-V146 PolarHBondContact O-N 3.23Å; S143-V146 PolarHBondContact O-N 2.92Å; V146-L150 HydrophobicContact CG1-CD1 4.4Å; V146-L150 PolarHBondContact O-N 3.23Å; V146-L150 VanDerWaalsContact O-N 3.12Å |
| 147 | W | 98.3 | Very high | 96 | Very high | 49 Ų | 49 | 61 Ų | 61 | 19% | 0.186 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -59.5 | -49.6 | 176.2 | -84.7 | 96.5 | 0 | 0 | 0 | 111.8 | N63 V66 A67 L104 I108 F112 S143 G144 F149 L150 L151 | N63-W147 PolarHBondContact OD1-NE1 3.45Å; V66-W147 HydrophobicContact CB-CZ2 4.44Å; V66-W147 HydrophobicContact CG1-CH2 4.09Å; V66-W147 HydrophobicContact CG1-CZ2 3.91Å; A67-W147 HydrophobicContact CB-CZ2 4.42Å; L104-W147 HydrophobicContact CD2-CE3 4.48Å; L104-W147 HydrophobicContact CD2-CZ3 4.09Å; I108-W147 HydrophobicContact CD1-CD2 3.57Å; I108-W147 HydrophobicContact CD1-CE3 3.26Å; I108-W147 HydrophobicContact CD1-CG 4.45Å; I108-W147 HydrophobicContact CD1-CH2 3.48Å; I108-W147 VanDerWaalsContact CD1-CH2 3.48Å; I108-W147 HydrophobicContact CD1-CZ2 3.77Å; I108-W147 HydrophobicContact CD1-CZ3 3.21Å; I108-W147 HydrophobicContact CG1-CD2 4.42Å; I108-W147 HydrophobicContact CG1-CE3 4.48Å; I108-W147 HydrophobicContact CG2-CZ2 3.91Å; F112-W147 AromaticContact CE2-NE1 3.95Å; S143-W147 VanDerWaalsContact O-CD1 3.31Å; S143-W147 PolarHBondContact O-N 3.42Å; G144-W147 PolarHBondContact O-N 3.33Å; W147-F149 PolarHBondContact O-N 3.19Å; W147-L150 PolarHBondContact O-N 3.42Å; W147-L151 WeakPolarHBondContact O-CB 3.44Å; W147-L151 VanDerWaalsContact O-CG 3.25Å; W147-L151 WeakPolarHBondContact O-CG 3.3Å; W147-L151 PolarHBondContact O-N 3.4Å |
| 148 | S | 98.3 | Very high | 96.2 | Very high | 68 Ų | 68 | 60.6 Ų | 60.6 | 48% | 0.476 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.9 | -44.9 | -177.9 | -55.7 | 0 | 0 | 0 | 0 | 111.5 | G144 A145 L150 L151 V152 | G144-S148 WeakPolarHBondContact O-CB 3.45Å; G144-S148 PolarHBondContact O-N 3.36Å; G144-S148 PolarHBondContact O-OG 3.47Å; A145-S148 PolarHBondContact O-N 2.9Å; S148-L150 PolarHBondContact O-N 3.1Å; S148-L151 PolarHBondContact O-N 3.24Å; S148-V152 WeakPolarHBondContact O-CB 3.35Å; S148-V152 VanDerWaalsContact O-CG2 3.28Å; S148-V152 WeakPolarHBondContact O-CG2 3.36Å; S148-V152 PolarHBondContact O-N 3.25Å |
| 149 | F | 98.1 | Very high | 96.3 | Very high | 105 Ų | 105 | 57.4 Ų | 57.4 | 46% | 0.461 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -58.3 | -49.2 | 177.3 | 168.3 | -106.1 | 0 | 0 | 0 | 111.9 | A145 W147 V152 L153 V190 I194 | A145-F149 VanDerWaalsContact O-CB 3.23Å; A145-F149 WeakPolarHBondContact O-CB 3.27Å; A145-F149 PolarHBondContact O-N 3.1Å; W147-F149 PolarHBondContact O-N 3.19Å; F149-V152 PolarHBondContact O-N 3.07Å; F149-L153 HydrophobicContact CE1-CD2 4.5Å; F149-L153 HydrophobicContact CZ-CD2 4.41Å; F149-L153 WeakPolarHBondContact O-CB 3.38Å; F149-L153 PolarHBondContact O-N 3.43Å; F149-V190 HydrophobicContact CZ-CG1 4.42Å; F149-I194 HydrophobicContact CE1-CD1 3.93Å |
| 150 | L | 97.9 | Very high | 96.5 | Very high | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.005 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -68.5 | -37 | -180 | -70.8 | 178.6 | 0 | 0 | 0 | 112.2 | L104 I108 L111 V146 W147 S148 L153 C154 I194 | L104-L150 HydrophobicContact CD1-CB 3.72Å; L104-L150 WeakPolarHBondContact CD1-O 3.41Å; L104-L150 HydrophobicContact CG-CB 4.46Å; I108-L150 HydrophobicContact CB-CD1 4.39Å; I108-L150 HydrophobicContact CD1-CD1 4.46Å; I108-L150 HydrophobicContact CG1-CD1 3.44Å; I108-L150 VanDerWaalsContact CG1-CD1 3.44Å; L111-L150 HydrophobicContact CD1-CD1 3.86Å; L111-L150 HydrophobicContact CD1-CG 4.34Å; V146-L150 HydrophobicContact CG1-CD1 4.4Å; V146-L150 PolarHBondContact O-N 3.23Å; V146-L150 VanDerWaalsContact O-N 3.12Å; W147-L150 PolarHBondContact O-N 3.42Å; S148-L150 PolarHBondContact O-N 3.1Å; L150-L153 HydrophobicContact CD2-CD2 4.28Å; L150-L153 PolarHBondContact O-N 3.37Å; L150-C154 WeakPolarHBondContact O-CB 3.33Å; L150-C154 PolarHBondContact O-N 3Å; L150-C154 PolarHBondContact O-SG 3.37Å; L150-C154 VanDerWaalsContact O-SG 3.35Å; L150-I194 HydrophobicContact CD2-CD1 4.14Å |
| 151 | L | 97.2 | Very high | 96.5 | Very high | 87 Ų | 87 | 51.3 Ų | 51.3 | 46% | 0.455 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.5 | -47.5 | 174.7 | -75.9 | 168.6 | 0 | 0 | 0 | 111.2 | L104 W147 S148 L153 C154 L155 | L104-L151 HydrophobicContact CD1-CD2 4Å; L104-L151 HydrophobicContact CD1-CG 4.22Å; L104-L151 HydrophobicContact CD2-CD2 3.85Å; L104-L151 HydrophobicContact CD2-CG 4.48Å; W147-L151 WeakPolarHBondContact O-CB 3.44Å; W147-L151 VanDerWaalsContact O-CG 3.25Å; W147-L151 WeakPolarHBondContact O-CG 3.3Å; W147-L151 PolarHBondContact O-N 3.4Å; S148-L151 PolarHBondContact O-N 3.24Å; L151-L153 VanDerWaalsContact C-N 3.34Å; L151-L153 PolarHBondContact O-N 3.43Å; L151-C154 PolarHBondContact O-N 3.04Å; L151-L155 WeakPolarHBondContact O-CB 3.38Å; L151-L155 PolarHBondContact O-N 2.96Å |
| 152 | V | 97.6 | Very high | 96.3 | Very high | 104 Ų | 104 | 51.3 Ų | 51.3 | 63% | 0.63 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -61.7 | -42.7 | 176.4 | 170.4 | 0 | 0 | 0 | 0 | 111.1 | S148 F149 C154 L155 P156 | S148-V152 WeakPolarHBondContact O-CB 3.35Å; S148-V152 VanDerWaalsContact O-CG2 3.28Å; S148-V152 WeakPolarHBondContact O-CG2 3.36Å; S148-V152 PolarHBondContact O-N 3.25Å; F149-V152 PolarHBondContact O-N 3.07Å; V152-C154 VanDerWaalsContact C-N 3.32Å; V152-C154 PolarHBondContact O-N 2.94Å; V152-L155 PolarHBondContact O-N 3.02Å; V152-P156 WeakPolarHBondContact O-CD 3.41Å |
| 153 | L | 96.4 | Very high | 96.2 | Very high | 16 Ų | 16 | 53 Ų | 53 | 8% | 0.084 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 177.8 | -176 | 65.9 | 0 | 0 | 0 | 112.1 | F149 L150 L151 W183 V187 V190 | F149-L153 HydrophobicContact CE1-CD2 4.5Å; F149-L153 HydrophobicContact CZ-CD2 4.41Å; F149-L153 WeakPolarHBondContact O-CB 3.38Å; F149-L153 PolarHBondContact O-N 3.43Å; L150-L153 HydrophobicContact CD2-CD2 4.28Å; L150-L153 PolarHBondContact O-N 3.37Å; L151-L153 VanDerWaalsContact C-N 3.34Å; L151-L153 PolarHBondContact O-N 3.43Å; L153-W183 HydrophobicContact CD1-CZ2 4.34Å; L153-W183 PolarHBondContact O-NE1 3.41Å; L153-W183 VanDerWaalsContact O-NE1 3.07Å; L153-V187 HydrophobicContact CD1-CG2 3.88Å; L153-V187 HydrophobicContact CD2-CG1 4.41Å; L153-V187 HydrophobicContact CG-CG1 4.23Å; L153-V187 HydrophobicContact CG-CG2 3.99Å; L153-V187 WeakPolarHBondContact O-CG2 3.48Å; L153-V190 HydrophobicContact CD1-CG1 4.27Å; L153-V190 HydrophobicContact CD2-CB 4.31Å; L153-V190 HydrophobicContact CD2-CG1 3.68Å |
| 154 | C | 94.8 | Very high | 96 | Very high | 14 Ų | 14 | 56.4 Ų | 56.4 | 10% | 0.095 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -82.5 | -22.5 | -178.3 | -70.3 | 0 | 0 | 0 | 0 | 114 | V100 L104 L150 L151 V152 N157 V158 | V100-C154 HydrophobicContact CG1-CB 3.68Å; L104-C154 HydrophobicContact CD1-CB 4.12Å; L150-C154 WeakPolarHBondContact O-CB 3.33Å; L150-C154 PolarHBondContact O-N 3Å; L150-C154 PolarHBondContact O-SG 3.37Å; L150-C154 VanDerWaalsContact O-SG 3.35Å; L151-C154 PolarHBondContact O-N 3.04Å; V152-C154 VanDerWaalsContact C-N 3.32Å; V152-C154 PolarHBondContact O-N 2.94Å; C154-N157 VanDerWaalsContact O-CB 3.24Å; C154-N157 WeakPolarHBondContact O-CB 3.43Å; C154-N157 PolarHBondContact O-N 3.48Å; C154-V158 PolarHBondContact O-N 2.87Å |
| 155 | L | 95 | Very high | 95.6 | Very high | 96 Ų | 96 | 56.9 Ų | 56.9 | 50% | 0.503 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -58 | -45.9 | -173.6 | 179.1 | 65.1 | 0 | 0 | 0 | 113.8 | L151 V152 N157 V158 I159 | L151-L155 WeakPolarHBondContact O-CB 3.38Å; L151-L155 PolarHBondContact O-N 2.96Å; V152-L155 PolarHBondContact O-N 3.02Å; L155-N157 PolarHBondContact O-N 3.35Å; L155-V158 WeakPolarHBondContact O-CB 3.48Å; L155-V158 PolarHBondContact O-N 3.33Å; L155-I159 HydrophobicContact CD1-CD1 4.04Å; L155-I159 HydrophobicContact CD1-CG1 4.31Å; L155-I159 HydrophobicContact CD2-CD1 4.35Å; L155-I159 HydrophobicContact CG-CD1 3.79Å; L155-I159 HydrophobicContact CG-CG1 4.45Å; L155-I159 PolarHBondContact O-N 3Å; L155-I159 VanDerWaalsContact O-N 3.1Å |
| 156 | P | 94.9 | Very high | 95.1 | Very high | 37 Ų | 37 | 61.6 Ų | 61.6 | 24% | 0.24 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -65 | -27.1 | 177.6 | -18.3 | 30.1 | 0 | 0 | 0 | 112.4 | V152 V158 I159 L160 W183 | V152-P156 WeakPolarHBondContact O-CD 3.41Å; P156-V158 VanDerWaalsContact C-N 3.25Å; P156-V158 PolarHBondContact O-N 3.29Å; P156-I159 PolarHBondContact O-N 3.07Å; P156-L160 HydrophobicContact CB-CD1 4.14Å; P156-L160 WeakPolarHBondContact O-CB 3.41Å; P156-L160 WeakPolarHBondContact O-CG 3.27Å; P156-L160 PolarHBondContact O-N 2.83Å; P156-W183 HydrophobicContact CB-CD2 4.3Å; P156-W183 HydrophobicContact CB-CG 4.11Å; P156-W183 HydrophobicContact CG-CZ2 3.99Å |
| 157 | N | 91.6 | Very high | 94.5 | Very high | 9 Ų | 9 | 63.1 Ų | 63.1 | 5% | 0.048 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -63.4 | -32.7 | 173 | -99.4 | -58.4 | 0 | 0 | 0 | 112.1 | C154 L155 T161 K176 V187 | C154-N157 VanDerWaalsContact O-CB 3.24Å; C154-N157 WeakPolarHBondContact O-CB 3.43Å; C154-N157 PolarHBondContact O-N 3.48Å; L155-N157 PolarHBondContact O-N 3.35Å; N157-T161 WeakPolarHBondContact O-CB 3.41Å; N157-T161 PolarHBondContact O-OG1 2.99Å; N157-K176 PolarHBondContact O-NZ 3.27Å; N157-K176 PolarHBondContact OD1-NZ 3.36Å; N157-V187 WeakPolarHBondContact ND2-CG2 3.28Å |
| 158 | V | 94.9 | Very high | 93.6 | Very high | 49 Ų | 49 | 64.9 Ų | 64.9 | 30% | 0.297 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -71.4 | -53.9 | 173.4 | -176.5 | 0 | 0 | 0 | 0 | 109.7 | R96 V100 C154 L155 P156 L160 T161 | R96-V158 WeakPolarHBondContact O-CG1 3.48Å; R96-V158 WeakPolarHBondContact O-CG2 3.35Å; V100-V158 HydrophobicContact CB-CG2 4.31Å; V100-V158 HydrophobicContact CG1-CG2 3.94Å; V100-V158 HydrophobicContact CG2-CG2 4.19Å; C154-V158 PolarHBondContact O-N 2.87Å; L155-V158 WeakPolarHBondContact O-CB 3.48Å; L155-V158 PolarHBondContact O-N 3.33Å; P156-V158 VanDerWaalsContact C-N 3.25Å; P156-V158 PolarHBondContact O-N 3.29Å; V158-L160 VanDerWaalsContact C-N 3.35Å; V158-L160 PolarHBondContact O-N 3.37Å; V158-T161 PolarHBondContact O-N 2.85Å |
| 159 | I | 95.9 | Very high | 92.8 | Very high | 97 Ų | 97 | 69.8 Ų | 69.8 | 50% | 0.497 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.1 | -39.8 | -174.3 | -62.8 | 171.2 | 0 | 0 | 0 | 112 | L155 P156 T161 | L155-I159 HydrophobicContact CD1-CD1 4.04Å; L155-I159 HydrophobicContact CD1-CG1 4.31Å; L155-I159 HydrophobicContact CD2-CD1 4.35Å; L155-I159 HydrophobicContact CG-CD1 3.79Å; L155-I159 HydrophobicContact CG-CG1 4.45Å; L155-I159 PolarHBondContact O-N 3Å; L155-I159 VanDerWaalsContact O-N 3.1Å; P156-I159 PolarHBondContact O-N 3.07Å; I159-T161 VanDerWaalsContact C-N 3.31Å; I159-T161 PolarHBondContact O-N 2.94Å |
| 160 | L | 95.9 | Very high | 92.3 | Very high | 32 Ų | 32 | 65.5 Ų | 65.5 | 17% | 0.168 | 35% | 0.354 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | -4.3 | -177 | -60.3 | 171.6 | 0 | 0 | 0 | 113.3 | P156 V158 R162 T177 A179 G180 W183 | P156-L160 HydrophobicContact CB-CD1 4.14Å; P156-L160 WeakPolarHBondContact O-CB 3.41Å; P156-L160 WeakPolarHBondContact O-CG 3.27Å; P156-L160 PolarHBondContact O-N 2.83Å; V158-L160 VanDerWaalsContact C-N 3.35Å; V158-L160 PolarHBondContact O-N 3.37Å; L160-R162 PolarHBondContact O-N 3.2Å; L160-T177 PolarHBondContact O-N 3.44Å; L160-T177 PolarHBondContact O-OG1 3.16Å; L160-A179 HydrophobicContact CD1-CB 4.42Å; L160-G180 VanDerWaalsContact CB-CA 3.48Å; L160-W183 HydrophobicContact CD1-CB 4.18Å |
| 161 | T | 94.4 | Very high | 91.8 | Very high | 1 Ų | 1 | 68.4 Ų | 68.4 | 1% | 0.006 | 37% | 0.366 | C | S | . | . | trans | -88.6 | 57.6 | 171.6 | -53.1 | 0 | 0 | 0 | 0 | 110.3 | R96 N157 V158 I159 L175 K176 | R96-T161 HydrophobicContact CG-CG2 3.83Å; R96-T161 PolarHBondContact NE-O 3.26Å; R96-T161 PolarHBondContact NH2-O 3.41Å; N157-T161 WeakPolarHBondContact O-CB 3.41Å; N157-T161 PolarHBondContact O-OG1 2.99Å; V158-T161 PolarHBondContact O-N 2.85Å; I159-T161 VanDerWaalsContact C-N 3.31Å; I159-T161 PolarHBondContact O-N 2.94Å; T161-L175 CarbonylContact C-O 3.19Å; T161-L175 WeakPolarHBondContact CA-O 3.41Å; T161-L175 HydrophobicContact CG2-CB 3.58Å; T161-L175 HydrophobicContact CG2-CD2 4.48Å; T161-K176 HydrophobicContact CG2-CG 4.16Å; T161-K176 WeakPolarHBondContact OG1-CG 3.47Å; T161-K176 PolarHBondContact OG1-NZ 3.36Å | ||
| 162 | R | 93.1 | Very high | 91.5 | Very high | 160 Ų | 160 | 66.6 Ų | 66.6 | 60% | 0.604 | 36% | 0.361 | S | S | * | . | trans | -108.1 | -8.9 | -169.4 | 66.3 | -178.1 | -176.7 | -138.8 | 2.7 | 115.9 | R96 L160 L175 T177 | R96-R162 PolarHBondContact NH2-O 3.5Å; L160-R162 PolarHBondContact O-N 3.2Å; R162-L175 PolarHBondContact N-O 3.26Å; R162-L175 VanDerWaalsContact N-O 3.11Å; R162-T177 HydrophobicContact CG-CG2 3.92Å | ||
| 163 | K | 94.7 | Very high | 91.2 | Very high | 93 Ų | 93 | 62.6 Ų | 62.6 | 40% | 0.404 | 34% | 0.338 | S | S | . | . | P | Polyproline II helix | trans | -65.4 | 149.3 | 178 | -65.8 | -179.5 | 176.1 | 160.5 | 0 | 110.7 | R96 L175 K176 | R96-K163 PolarHBondContact NH2-O 3.34Å; K163-L175 WeakPolarHBondContact CB-O 3.43Å; K163-L175 PolarHBondContact N-O 3.48Å; K163-K176 VanDerWaalsContact CD-O 3.29Å; K163-K176 WeakPolarHBondContact CD-O 3.5Å; K163-K176 VanDerWaalsContact CE-O 3.28Å; K163-K176 WeakPolarHBondContact CE-O 3.41Å; K163-K176 PolarHBondContact NZ-O 2.99Å |
| 164 | A | 92.3 | Very high | 91 | Very high | 74 Ų | 74 | 65.3 Ų | 65.3 | 61% | 0.612 | 35% | 0.352 | S | S | * | . | P | Polyproline II helix | trans | -78.3 | 147.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | T166 | A164-T166 PolarHBondContact O-N 3.44Š|
| 165 | P | 90.2 | Very high | 90.9 | Very high | 44 Ų | 44 | 64.7 Ų | 64.7 | 29% | 0.286 | 35% | 0.348 | S | S | . | . | P | Polyproline II helix | trans | -65.3 | 133.1 | 173.5 | 29.1 | -34.3 | 0 | 0 | 0 | 110.1 | I92 F170 | I92-P165 HydrophobicContact CD1-CG 4.16Å; P165-F170 HydrophobicContact CB-CB 4.15Å; P165-F170 HydrophobicContact CB-CD1 3.41Å; P165-F170 VanDerWaalsContact CB-CD1 3.41Å; P165-F170 HydrophobicContact CB-CD2 4.46Å; P165-F170 HydrophobicContact CB-CE1 3.8Å; P165-F170 HydrophobicContact CB-CG 3.76Å; P165-F170 HydrophobicContact CB-CZ 4.45Å; P165-F170 HydrophobicContact CG-CD1 4.32Å; P165-F170 HydrophobicContact CG-CE1 4.24Å |
| 166 | T | 86.8 | Confident | 90.9 | Very high | 141 Ų | 141 | 60.8 Ų | 60.8 | 87% | 0.865 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -90.7 | -9.7 | 178.4 | 52.3 | 0 | 0 | 0 | 0 | 113.1 | A164 | A164-T166 PolarHBondContact O-N 3.44Š|
| 167 | S | 85.4 | Confident | 90.9 | Very high | 49 Ų | 49 | 60 Ų | 60 | 34% | 0.343 | 32% | 0.321 | S | S | . | . | S | Bend | trans | -149.6 | 151.6 | -176.8 | 167.3 | 0 | 0 | 0 | 0 | 109.8 | Y169 F170 | S167-Y169 PolarHBondContact O-N 3.49Å; S167-Y169 PolarHBondContact OG-N 3.37Å; S167-Y169 VanDerWaalsContact OG-N 3.1Å; S167-F170 WeakPolarHBondContact O-CD1 3.39Å |
| 168 | P | 80.7 | Confident | 91 | Very high | 86 Ų | 86 | 67.3 Ų | 67.3 | 56% | 0.558 | 36% | 0.355 | S | S | * | . | S | Bend | trans | -57.9 | -25.4 | 169.3 | 22.8 | -32.6 | 0 | 0 | 0 | 112.6 | R91 F170 | R91-P168 PolarHBondContact NH1-O 3.36Å; R91-P168 PolarHBondContact NH2-O 2.99Å; P168-F170 PolarHBondContact O-N 2.72Å |
| 169 | Y | 81.5 | Confident | 91 | Very high | 171 Ų | 171 | 67.8 Ų | 67.8 | 67% | 0.671 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -102.5 | 62.2 | -179.5 | -56.5 | -79.4 | 0 | 0 | 0 | 111.9 | S167 | S167-Y169 PolarHBondContact O-N 3.49Å; S167-Y169 PolarHBondContact OG-N 3.37Å; S167-Y169 VanDerWaalsContact OG-N 3.1Å |
| 170 | F | 87.4 | Confident | 91 | Very high | 15 Ų | 15 | 63.1 Ų | 63.1 | 7% | 0.066 | 34% | 0.34 | C | S | . | . | trans | -95.1 | 153.4 | 178.7 | 70.1 | -93.5 | 0 | 0 | 0 | 114.1 | R91 I92 P165 S167 P168 L175 | R91-F170 HydrophobicContact CB-CE1 4.4Å; R91-F170 HydrophobicContact CB-CE2 4.18Å; R91-F170 HydrophobicContact CB-CZ 3.57Å; R91-F170 PolarHBondContact NH2-O 3.43Å; I92-F170 HydrophobicContact CG1-CE2 4.44Å; I92-F170 HydrophobicContact CG1-CZ 3.95Å; P165-F170 HydrophobicContact CB-CB 4.15Å; P165-F170 HydrophobicContact CB-CD1 3.41Å; P165-F170 VanDerWaalsContact CB-CD1 3.41Å; P165-F170 HydrophobicContact CB-CD2 4.46Å; P165-F170 HydrophobicContact CB-CE1 3.8Å; P165-F170 HydrophobicContact CB-CG 3.76Å; P165-F170 HydrophobicContact CB-CZ 4.45Å; P165-F170 HydrophobicContact CG-CD1 4.32Å; P165-F170 HydrophobicContact CG-CE1 4.24Å; S167-F170 WeakPolarHBondContact O-CD1 3.39Å; P168-F170 PolarHBondContact O-N 2.72Å; F170-L175 HydrophobicContact CB-CD1 4.29Å; F170-L175 HydrophobicContact CD2-CD1 3.21Å; F170-L175 HydrophobicContact CD2-CD2 4.49Å; F170-L175 HydrophobicContact CD2-CG 4.47Å; F170-L175 HydrophobicContact CE2-CD1 3.64Å; F170-L175 HydrophobicContact CE2-CD2 4.08Å; F170-L175 HydrophobicContact CG-CD1 3.94Å | ||
| 171 | K | 87.8 | Confident | 90.8 | Very high | 61 Ų | 61 | 64 Ų | 64 | 27% | 0.265 | 34% | 0.344 | S | S | . | . | trans | -104.3 | 157.7 | 170 | -62 | 158.4 | -176.9 | 165.7 | 0 | 109.7 | C15 S173 D174 L175 | C15-K171 PolarHBondContact O-NZ 3.31Å; K171-S173 PolarHBondContact O-N 2.92Å; K171-S173 VanDerWaalsContact O-N 3.16Å; K171-D174 WeakPolarHBondContact CB-OD2 3.43Å; K171-D174 PolarHBondContact N-OD2 2.9Å; K171-D174 WeakPolarHBondContact O-CB 3.37Å; K171-D174 PolarHBondContact O-N 3.01Å; K171-L175 WeakPolarHBondContact O-CD1 3.41Å | ||
| 172 | C | 91.3 | Very high | 90.8 | Very high | 49 Ų | 49 | 70.6 Ų | 70.6 | 33% | 0.331 | 37% | 0.374 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61 | -26.7 | 178 | -60.2 | 0 | 0 | 0 | 0 | 114.3 | C95 D174 L175 | C95-C172 WeakPolarHBondContact CA-SG 3.39Å; C95-C172 HydrophobicContact CB-CB 3.54Å; C95-C172 WeakPolarHBondContact CB-SG 3.37Å; C95-C172 WeakPolarHBondContact SG-CA 3.31Å; C95-C172 WeakPolarHBondContact SG-CB 3.44Å; C95-C172 CovalentContact SG-SG 2.04Å; C95-C172 PolarHBondContact SG-SG 3Å; C172-D174 PolarHBondContact O-N 3.3Å; C172-L175 PolarHBondContact O-N 2.88Å |
| 173 | S | 90.6 | Very high | 90.9 | Very high | 21 Ų | 21 | 66.6 Ų | 66.6 | 15% | 0.147 | 36% | 0.359 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -32 | 172.7 | 45.9 | 0 | 0 | 0 | 0 | 112.4 | K171 L175 K176 | K171-S173 PolarHBondContact O-N 2.92Å; K171-S173 VanDerWaalsContact O-N 3.16Å; S173-L175 PolarHBondContact O-N 2.96Å; S173-K176 WeakPolarHBondContact O-CB 3.35Å; S173-K176 PolarHBondContact O-N 2.94Å |
| 174 | D | 91.1 | Very high | 90.8 | Very high | 73 Ų | 73 | 63.5 Ų | 63.5 | 39% | 0.39 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -22.2 | -173.6 | -47.8 | -17.9 | 0 | 0 | 0 | 110.7 | K171 C172 K176 | K171-D174 WeakPolarHBondContact CB-OD2 3.43Å; K171-D174 PolarHBondContact N-OD2 2.9Å; K171-D174 WeakPolarHBondContact O-CB 3.37Å; K171-D174 PolarHBondContact O-N 3.01Å; C172-D174 PolarHBondContact O-N 3.3Å; D174-K176 VanDerWaalsContact C-N 3.32Å |
| 175 | L | 94.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.9 | -7.9 | 176.7 | -78.6 | 65.6 | 0 | 0 | 0 | 112.8 | I92 C95 T161 R162 K163 F170 K171 C172 S173 | I92-L175 HydrophobicContact CB-CD2 4.32Å; I92-L175 HydrophobicContact CG1-CD2 3.91Å; I92-L175 HydrophobicContact CG2-CD2 4.21Å; C95-L175 HydrophobicContact CB-CD2 4.22Å; T161-L175 CarbonylContact C-O 3.19Å; T161-L175 WeakPolarHBondContact CA-O 3.41Å; T161-L175 HydrophobicContact CG2-CB 3.58Å; T161-L175 HydrophobicContact CG2-CD2 4.48Å; R162-L175 PolarHBondContact N-O 3.26Å; R162-L175 VanDerWaalsContact N-O 3.11Å; K163-L175 WeakPolarHBondContact CB-O 3.43Å; K163-L175 PolarHBondContact N-O 3.48Å; F170-L175 HydrophobicContact CB-CD1 4.29Å; F170-L175 HydrophobicContact CD2-CD1 3.21Å; F170-L175 HydrophobicContact CD2-CD2 4.49Å; F170-L175 HydrophobicContact CD2-CG 4.47Å; F170-L175 HydrophobicContact CE2-CD1 3.64Å; F170-L175 HydrophobicContact CE2-CD2 4.08Å; F170-L175 HydrophobicContact CG-CD1 3.94Å; K171-L175 WeakPolarHBondContact O-CD1 3.41Å; C172-L175 PolarHBondContact O-N 2.88Å; S173-L175 PolarHBondContact O-N 2.96Å |
| 176 | K | 94.9 | Very high | 91 | Very high | 14 Ų | 14 | 61.7 Ų | 61.7 | 6% | 0.061 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -88.8 | 140.7 | -177.7 | -70.1 | -179.9 | 177.8 | -67.1 | 0 | 111.9 | N157 T161 K163 S173 D174 L181 H184 | N157-K176 PolarHBondContact O-NZ 3.27Å; N157-K176 PolarHBondContact OD1-NZ 3.36Å; T161-K176 HydrophobicContact CG2-CG 4.16Å; T161-K176 WeakPolarHBondContact OG1-CG 3.47Å; T161-K176 PolarHBondContact OG1-NZ 3.36Å; K163-K176 VanDerWaalsContact CD-O 3.29Å; K163-K176 WeakPolarHBondContact CD-O 3.5Å; K163-K176 VanDerWaalsContact CE-O 3.28Å; K163-K176 WeakPolarHBondContact CE-O 3.41Å; K163-K176 PolarHBondContact NZ-O 2.99Å; S173-K176 WeakPolarHBondContact O-CB 3.35Å; S173-K176 PolarHBondContact O-N 2.94Å; D174-K176 VanDerWaalsContact C-N 3.32Å; K176-L181 HydrophobicContact CB-CD2 4.02Å; K176-L181 HydrophobicContact CB-CG 3.96Å; K176-L181 HydrophobicContact CD-CD2 4.08Å; K176-H184 HydrophobicContact CD-CB 4.26Å |
| 177 | T | 95.2 | Very high | 91.4 | Very high | 20 Ų | 20 | 55.4 Ų | 55.4 | 12% | 0.123 | 29% | 0.285 | C | S | . | . | trans | -66.8 | 167.4 | 163.7 | 62.2 | 0 | 0 | 0 | 0 | 110.6 | L160 R162 A179 G180 L181 | L160-T177 PolarHBondContact O-N 3.44Å; L160-T177 PolarHBondContact O-OG1 3.16Å; R162-T177 HydrophobicContact CG-CG2 3.92Å; T177-A179 VanDerWaalsContact C-N 3.34Å; T177-A179 PolarHBondContact O-N 2.87Å; T177-G180 CarbonylContact O-C 3.51Å; T177-G180 WeakPolarHBondContact O-CA 3.48Å; T177-G180 PolarHBondContact O-N 2.96Å; T177-G180 PolarHBondContact OG1-N 3.35Å; T177-L181 PolarHBondContact O-N 3.05Å | ||
| 178 | E | 92.8 | Very high | 91.9 | Very high | 164 Ų | 164 | 53.6 Ų | 53.6 | 77% | 0.766 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -59 | -46.8 | 175 | -65.8 | 178.2 | 177.9 | 0 | 0 | 111.2 | G180 L181 F182 | E178-G180 PolarHBondContact O-N 2.94Å; E178-L181 PolarHBondContact O-N 3.32Å; E178-L181 VanDerWaalsContact O-N 3.1Å; E178-F182 PolarHBondContact O-N 3.28Å |
| 179 | A | 95.7 | Very high | 92.5 | Very high | 58 Ų | 58 | 54.3 Ų | 54.3 | 48% | 0.479 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -56.9 | -35.4 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L160 T177 W183 | L160-A179 HydrophobicContact CD1-CB 4.42Å; T177-A179 VanDerWaalsContact C-N 3.34Å; T177-A179 PolarHBondContact O-N 2.87Å; A179-W183 WeakPolarHBondContact O-CB 3.23Å; A179-W183 PolarHBondContact O-N 3.28Å |
| 180 | G | 94.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.6 | -35.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | L160 T177 E178 H184 | L160-G180 VanDerWaalsContact CB-CA 3.48Å; T177-G180 CarbonylContact O-C 3.51Å; T177-G180 WeakPolarHBondContact O-CA 3.48Å; T177-G180 PolarHBondContact O-N 2.96Å; T177-G180 PolarHBondContact OG1-N 3.35Å; E178-G180 PolarHBondContact O-N 2.94Å; G180-H184 WeakPolarHBondContact O-CB 3.41Å; G180-H184 PolarHBondContact O-N 3.17Å |
| 181 | L | 92.6 | Very high | 93.7 | Very high | 49 Ų | 49 | 47.9 Ų | 47.9 | 26% | 0.257 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -70.4 | -43 | 173.6 | -71.7 | 171.3 | 0 | 0 | 0 | 111.1 | K176 T177 E178 H184 E185 | K176-L181 HydrophobicContact CB-CD2 4.02Å; K176-L181 HydrophobicContact CB-CG 3.96Å; K176-L181 HydrophobicContact CD-CD2 4.08Å; T177-L181 PolarHBondContact O-N 3.05Å; E178-L181 PolarHBondContact O-N 3.32Å; E178-L181 VanDerWaalsContact O-N 3.1Å; L181-H184 WeakPolarHBondContact O-CB 3.41Å; L181-H184 PolarHBondContact O-N 3.08Å; L181-E185 PolarHBondContact O-N 3.06Å |
| 182 | F | 93.7 | Very high | 94.1 | Very high | 141 Ų | 141 | 45.6 Ų | 45.6 | 62% | 0.618 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -59.6 | -50.5 | 173.7 | 177.1 | -100.3 | 0 | 0 | 0 | 111.4 | E178 H184 E185 V186 | E178-F182 PolarHBondContact O-N 3.28Å; F182-H184 VanDerWaalsContact C-N 3.25Å; F182-H184 PolarHBondContact O-N 2.77Å; F182-E185 WeakPolarHBondContact O-CB 3.45Å; F182-E185 PolarHBondContact O-N 3.39Å; F182-E185 VanDerWaalsContact O-N 3.11Å; F182-V186 HydrophobicContact CD1-CG2 4.27Å; F182-V186 HydrophobicContact CE1-CG2 3.84Å; F182-V186 HydrophobicContact CE2-CG2 4.43Å; F182-V186 HydrophobicContact CZ-CG2 3.93Å; F182-V186 WeakPolarHBondContact O-CG2 3.3Å; F182-V186 PolarHBondContact O-N 3.44Å |
| 183 | W | 95.3 | Very high | 94.4 | Very high | 76 Ų | 76 | 48.4 Ų | 48.4 | 29% | 0.288 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.2 | -34.5 | 176.3 | -168.8 | -102.2 | 0 | 0 | 0 | 112.2 | L153 P156 L160 A179 V186 V187 | L153-W183 HydrophobicContact CD1-CZ2 4.34Å; L153-W183 PolarHBondContact O-NE1 3.41Å; L153-W183 VanDerWaalsContact O-NE1 3.07Å; P156-W183 HydrophobicContact CB-CD2 4.3Å; P156-W183 HydrophobicContact CB-CG 4.11Å; P156-W183 HydrophobicContact CG-CZ2 3.99Å; L160-W183 HydrophobicContact CD1-CB 4.18Å; A179-W183 WeakPolarHBondContact O-CB 3.23Å; A179-W183 PolarHBondContact O-N 3.28Å; W183-V186 HydrophobicContact CE3-CG1 4.48Å; W183-V186 HydrophobicContact CZ3-CG1 4.41Å; W183-V186 PolarHBondContact O-N 3.25Å; W183-V187 HydrophobicContact CD2-CG2 4.43Å; W183-V187 HydrophobicContact CG-CG2 4.35Å; W183-V187 HydrophobicContact CZ2-CG2 4.42Å; W183-V187 VanDerWaalsContact NE1-CG2 3.29Å; W183-V187 WeakPolarHBondContact O-CB 3.06Å; W183-V187 VanDerWaalsContact O-CG2 3.32Å; W183-V187 WeakPolarHBondContact O-CG2 3.49Å; W183-V187 PolarHBondContact O-N 2.93Å |
| 184 | H | 92.9 | Very high | 94.8 | Very high | 28 Ų | 28 | 48.5 Ų | 48.5 | 13% | 0.13 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.9 | -44.7 | 173.4 | -173.7 | 69.9 | 0 | 0 | 0 | 111.7 | K176 G180 L181 F182 N188 | K176-H184 HydrophobicContact CD-CB 4.26Å; G180-H184 WeakPolarHBondContact O-CB 3.41Å; G180-H184 PolarHBondContact O-N 3.17Å; L181-H184 WeakPolarHBondContact O-CB 3.41Å; L181-H184 PolarHBondContact O-N 3.08Å; F182-H184 VanDerWaalsContact C-N 3.25Å; F182-H184 PolarHBondContact O-N 2.77Å; H184-N188 PolarHBondContact CD2-ND2 3.16Å; H184-N188 PolarHBondContact CE1-ND2 2.95Å; H184-N188 PolarHBondContact NE2-ND2 3.2Å; H184-N188 WeakPolarHBondContact O-CB 3.28Å; H184-N188 PolarHBondContact O-N 2.94Å; H184-N188 PolarHBondContact O-ND2 2.86Å |
| 185 | E | 93.1 | Very high | 95.1 | Very high | 35 Ų | 35 | 45 Ų | 45 | 16% | 0.164 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.5 | -48.5 | 174.3 | -170.1 | 162.6 | 164.1 | 0 | 0 | 111.2 | L181 F182 V187 N188 H189 T261 R262 | L181-E185 PolarHBondContact O-N 3.06Å; F182-E185 WeakPolarHBondContact O-CB 3.45Å; F182-E185 PolarHBondContact O-N 3.39Å; F182-E185 VanDerWaalsContact O-N 3.11Å; E185-V187 PolarHBondContact O-N 3.35Å; E185-N188 PolarHBondContact O-N 3.47Å; E185-H189 PolarHBondContact O-CD2 3.1Å; E185-H189 PolarHBondContact O-N 3.24Å; E185-H189 IonicContact OE1-NE2 3.88Å; E185-T261 HydrophobicContact CB-CG2 4.37Å; E185-T261 WeakPolarHBondContact OE2-CB 3.38Å; E185-T261 WeakPolarHBondContact OE2-CG2 3.25Å; E185-T261 PolarHBondContact OE2-OG1 3.08Å; E185-R262 IonicContact OE1-NE 3.24Å; E185-R262 IonicContact OE1-NH2 2.68Å; E185-R262 PolarHBondContact OE1-NH2 3.17Å |
| 186 | V | 94.7 | Very high | 95.2 | Very high | 44 Ų | 44 | 48.6 Ų | 48.6 | 27% | 0.267 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -56.9 | -49.9 | 177.2 | 173.1 | 0 | 0 | 0 | 0 | 111.8 | F182 W183 N188 H189 V190 | F182-V186 HydrophobicContact CD1-CG2 4.27Å; F182-V186 HydrophobicContact CE1-CG2 3.84Å; F182-V186 HydrophobicContact CE2-CG2 4.43Å; F182-V186 HydrophobicContact CZ-CG2 3.93Å; F182-V186 WeakPolarHBondContact O-CG2 3.3Å; F182-V186 PolarHBondContact O-N 3.44Å; W183-V186 HydrophobicContact CE3-CG1 4.48Å; W183-V186 HydrophobicContact CZ3-CG1 4.41Å; W183-V186 PolarHBondContact O-N 3.25Å; V186-N188 VanDerWaalsContact C-N 3.32Å; V186-N188 PolarHBondContact O-N 3.42Å; V186-H189 PolarHBondContact O-N 3.16Å; V186-H189 VanDerWaalsContact O-N 3.13Å; V186-V190 HydrophobicContact CG1-CG2 4.41Å; V186-V190 WeakPolarHBondContact O-CG2 3.36Å; V186-V190 PolarHBondContact O-N 3.02Å |
| 187 | V | 95.3 | Very high | 95.3 | Very high | 10 Ų | 10 | 50 Ų | 50 | 6% | 0.061 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.4 | -42.6 | 178.7 | 170.4 | 0 | 0 | 0 | 0 | 110.9 | L153 N157 W183 E185 H189 V190 C191 | L153-V187 HydrophobicContact CD1-CG2 3.88Å; L153-V187 HydrophobicContact CD2-CG1 4.41Å; L153-V187 HydrophobicContact CG-CG1 4.23Å; L153-V187 HydrophobicContact CG-CG2 3.99Å; L153-V187 WeakPolarHBondContact O-CG2 3.48Å; N157-V187 WeakPolarHBondContact ND2-CG2 3.28Å; W183-V187 HydrophobicContact CD2-CG2 4.43Å; W183-V187 HydrophobicContact CG-CG2 4.35Å; W183-V187 HydrophobicContact CZ2-CG2 4.42Å; W183-V187 VanDerWaalsContact NE1-CG2 3.29Å; W183-V187 WeakPolarHBondContact O-CB 3.06Å; W183-V187 VanDerWaalsContact O-CG2 3.32Å; W183-V187 WeakPolarHBondContact O-CG2 3.49Å; W183-V187 PolarHBondContact O-N 2.93Å; E185-V187 PolarHBondContact O-N 3.35Å; V187-H189 VanDerWaalsContact C-N 3.31Å; V187-H189 PolarHBondContact O-N 2.85Å; V187-V190 PolarHBondContact O-N 3.47Å; V187-C191 WeakPolarHBondContact O-CB 3.42Å; V187-C191 PolarHBondContact O-N 2.83Å; V187-C191 PolarHBondContact O-SG 3.38Å |
| 188 | N | 94.3 | Very high | 95.3 | Very high | 11 Ų | 11 | 49.6 Ų | 49.6 | 6% | 0.059 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 175.2 | -76.8 | -59.7 | 0 | 0 | 0 | 111.4 | H184 E185 V186 C191 Q192 R253 T257 | H184-N188 PolarHBondContact CD2-ND2 3.16Å; H184-N188 PolarHBondContact CE1-ND2 2.95Å; H184-N188 PolarHBondContact NE2-ND2 3.2Å; H184-N188 WeakPolarHBondContact O-CB 3.28Å; H184-N188 PolarHBondContact O-N 2.94Å; H184-N188 PolarHBondContact O-ND2 2.86Å; E185-N188 PolarHBondContact O-N 3.47Å; V186-N188 VanDerWaalsContact C-N 3.32Å; V186-N188 PolarHBondContact O-N 3.42Å; N188-C191 WeakPolarHBondContact O-CB 3.5Å; N188-C191 PolarHBondContact O-N 3.02Å; N188-Q192 VanDerWaalsContact O-CG 3.31Å; N188-Q192 WeakPolarHBondContact O-CG 3.47Å; N188-Q192 PolarHBondContact O-N 2.6Å; N188-R253 VanDerWaalsContact OD1-CZ 3.25Å; N188-R253 PolarHBondContact OD1-NE 2.78Å; N188-R253 PolarHBondContact OD1-NH2 3.31Å; N188-T257 HydrophobicContact CB-CG2 4.12Å |
| 189 | H | 94.8 | Very high | 95.4 | Very high | 100 Ų | 100 | 42.4 Ų | 42.4 | 46% | 0.463 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.5 | -45.5 | 175.6 | -77.6 | -64.1 | 0 | 0 | 0 | 113 | E185 V186 V187 C191 Q192 V193 | E185-H189 PolarHBondContact O-CD2 3.1Å; E185-H189 PolarHBondContact O-N 3.24Å; E185-H189 IonicContact OE1-NE2 3.88Å; V186-H189 PolarHBondContact O-N 3.16Å; V186-H189 VanDerWaalsContact O-N 3.13Å; V187-H189 VanDerWaalsContact C-N 3.31Å; V187-H189 PolarHBondContact O-N 2.85Å; H189-C191 VanDerWaalsContact C-N 3.28Å; H189-C191 PolarHBondContact O-N 2.96Å; H189-Q192 WeakPolarHBondContact O-CB 3.48Å; H189-Q192 PolarHBondContact O-N 3.17Å; H189-Q192 VanDerWaalsContact O-N 3.12Å; H189-V193 PolarHBondContact O-N 3.5Å |
| 190 | V | 96.9 | Very high | 95.4 | Very high | 47 Ų | 47 | 43.4 Ų | 43.4 | 29% | 0.285 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -58.6 | -44.3 | 175.4 | 172.4 | 0 | 0 | 0 | 0 | 110.6 | F149 L153 V186 V187 Q192 V193 I194 | F149-V190 HydrophobicContact CZ-CG1 4.42Å; L153-V190 HydrophobicContact CD1-CG1 4.27Å; L153-V190 HydrophobicContact CD2-CB 4.31Å; L153-V190 HydrophobicContact CD2-CG1 3.68Å; V186-V190 HydrophobicContact CG1-CG2 4.41Å; V186-V190 WeakPolarHBondContact O-CG2 3.36Å; V186-V190 PolarHBondContact O-N 3.02Å; V187-V190 PolarHBondContact O-N 3.47Å; V190-Q192 VanDerWaalsContact C-N 3.32Å; V190-Q192 PolarHBondContact O-N 3.49Å; V190-V193 PolarHBondContact O-N 3.44Å; V190-I194 HydrophobicContact CG1-CD1 3.91Å; V190-I194 HydrophobicContact CG1-CG1 4.46Å; V190-I194 WeakPolarHBondContact O-CG1 3.26Å; V190-I194 PolarHBondContact O-N 2.82Å |
| 191 | C | 96.9 | Very high | 95.4 | Very high | 5 Ų | 5 | 44.8 Ų | 44.8 | 3% | 0.034 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.3 | -38 | 174.9 | -82.6 | 0 | 0 | 0 | 0 | 113.3 | Y107 V187 N188 H189 F195 | Y107-C191 HydrophobicContact CD1-CB 4.4Å; Y107-C191 HydrophobicContact CD2-CB 4.36Å; Y107-C191 WeakPolarHBondContact CD2-SG 3.45Å; Y107-C191 HydrophobicContact CE1-CB 3.68Å; Y107-C191 WeakPolarHBondContact CE1-O 3.45Å; Y107-C191 HydrophobicContact CE2-CB 3.65Å; Y107-C191 WeakPolarHBondContact CE2-SG 3.16Å; Y107-C191 VanDerWaalsContact CZ-SG 3.58Å; Y107-C191 WeakPolarHBondContact OH-CB 3.24Å; V187-C191 WeakPolarHBondContact O-CB 3.42Å; V187-C191 PolarHBondContact O-N 2.83Å; V187-C191 PolarHBondContact O-SG 3.38Å; N188-C191 WeakPolarHBondContact O-CB 3.5Å; N188-C191 PolarHBondContact O-N 3.02Å; H189-C191 VanDerWaalsContact C-N 3.28Å; H189-C191 PolarHBondContact O-N 2.96Å; C191-F195 WeakPolarHBondContact O-CB 3.32Å; C191-F195 PolarHBondContact O-N 3.22Å |
| 192 | Q | 96.3 | Very high | 95.4 | Very high | 13 Ų | 13 | 42.6 Ų | 42.6 | 6% | 0.061 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64 | -47.6 | 172.1 | -67.9 | -64.9 | -20.2 | 0 | 0 | 111.3 | N188 H189 V190 I194 F195 W196 H250 I254 | N188-Q192 VanDerWaalsContact O-CG 3.31Å; N188-Q192 WeakPolarHBondContact O-CG 3.47Å; N188-Q192 PolarHBondContact O-N 2.6Å; H189-Q192 WeakPolarHBondContact O-CB 3.48Å; H189-Q192 PolarHBondContact O-N 3.17Å; H189-Q192 VanDerWaalsContact O-N 3.12Å; V190-Q192 VanDerWaalsContact C-N 3.32Å; V190-Q192 PolarHBondContact O-N 3.49Å; Q192-I194 VanDerWaalsContact C-N 3.29Å; Q192-I194 PolarHBondContact O-N 3.06Å; Q192-F195 PolarHBondContact O-N 3.11Å; Q192-F195 VanDerWaalsContact O-N 3.14Å; Q192-W196 PolarHBondContact O-N 3.36Å; Q192-H250 PolarHBondContact NE2-O 2.74Å; Q192-H250 PolarHBondContact OE1-O 2.91Å; Q192-I254 HydrophobicContact CG-CD1 4.33Å; Q192-I254 HydrophobicContact CG-CG1 3.98Å |
| 193 | V | 97.5 | Very high | 95.3 | Very high | 107 Ų | 107 | 39.4 Ų | 39.4 | 65% | 0.648 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -58.3 | -43.8 | 177.4 | 174.2 | 0 | 0 | 0 | 0 | 111 | H189 V190 F195 G197 | H189-V193 PolarHBondContact O-N 3.5Å; V190-V193 PolarHBondContact O-N 3.44Å; V193-F195 PolarHBondContact O-N 3.48Å; V193-G197 PolarHBondContact O-N 3.35Å |
| 194 | I | 97.8 | Very high | 95.2 | Very high | 24 Ų | 24 | 40.2 Ų | 40.2 | 12% | 0.123 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57.3 | -50.2 | 175.1 | -71.2 | 166.7 | 0 | 0 | 0 | 110.6 | Y107 L111 F149 L150 V190 Q192 N198 | Y107-I194 HydrophobicContact CD1-CG2 4.18Å; L111-I194 HydrophobicContact CD1-CG2 4.34Å; L111-I194 HydrophobicContact CD2-CG2 3.65Å; L111-I194 HydrophobicContact CG-CG2 3.89Å; F149-I194 HydrophobicContact CE1-CD1 3.93Å; L150-I194 HydrophobicContact CD2-CD1 4.14Å; V190-I194 HydrophobicContact CG1-CD1 3.91Å; V190-I194 HydrophobicContact CG1-CG1 4.46Å; V190-I194 WeakPolarHBondContact O-CG1 3.26Å; V190-I194 PolarHBondContact O-N 2.82Å; Q192-I194 VanDerWaalsContact C-N 3.29Å; Q192-I194 PolarHBondContact O-N 3.06Å; I194-N198 WeakPolarHBondContact O-CB 3.43Å; I194-N198 PolarHBondContact O-N 3.21Å |
| 195 | F | 97.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.3 | -53.4 | -177.7 | 174.8 | -103.4 | 0 | 0 | 0 | 112.6 | I110 C191 Q192 V193 G197 N198 L199 F242 F246 V247 H250 | I110-F195 HydrophobicContact CD1-CD2 4.09Å; I110-F195 HydrophobicContact CG2-CD2 4.24Å; C191-F195 WeakPolarHBondContact O-CB 3.32Å; C191-F195 PolarHBondContact O-N 3.22Å; Q192-F195 PolarHBondContact O-N 3.11Å; Q192-F195 VanDerWaalsContact O-N 3.14Å; V193-F195 PolarHBondContact O-N 3.48Å; F195-G197 VanDerWaalsContact C-N 3.35Å; F195-G197 PolarHBondContact O-N 3.07Å; F195-N198 WeakPolarHBondContact O-CB 3.43Å; F195-N198 PolarHBondContact O-N 3.01Å; F195-L199 HydrophobicContact CE1-CD2 4.31Å; F195-L199 HydrophobicContact CZ-CD2 4.44Å; F195-L199 WeakPolarHBondContact O-CB 3.33Å; F195-L199 PolarHBondContact O-N 2.96Å; F195-F242 HydrophobicContact CE2-CE1 4.23Å; F195-F242 HydrophobicContact CE2-CZ 4.08Å; F195-F246 HydrophobicContact CD2-CB 4.35Å; F195-F246 HydrophobicContact CE2-CB 3.45Å; F195-F246 VanDerWaalsContact CE2-CB 3.45Å; F195-F246 HydrophobicContact CE2-CG 4.46Å; F195-F246 HydrophobicContact CZ-CB 4.02Å; F195-V247 HydrophobicContact CE1-CG2 4.36Å; F195-V247 HydrophobicContact CZ-CB 4.27Å; F195-V247 HydrophobicContact CZ-CG2 3.73Å; F195-H250 WeakPolarHBondContact CB-CD2 3.45Å; F195-H250 HydrophobicContact CD1-CB 3.38Å; F195-H250 AromaticContact CD1-CD2 3.59Å; F195-H250 AromaticContact CD1-CG 3.28Å; F195-H250 AromaticContact CD1-ND1 3.81Å; F195-H250 AromaticContact CD2-CD2 3.89Å; F195-H250 AromaticContact CD2-CE1 3.45Å; F195-H250 VanDerWaalsContact CD2-CE1 3.45Å; F195-H250 WeakPolarHBondContact CD2-CE1 3.13Å; F195-H250 AromaticContact CD2-CG 3.8Å; F195-H250 AromaticContact CD2-ND1 3.52Å; F195-H250 AromaticContact CD2-NE2 3.71Å; F195-H250 HydrophobicContact CE1-CB 3.51Å; F195-H250 AromaticContact CE1-CG 3.66Å; F195-H250 AromaticContact CE1-ND1 3.91Å; F195-H250 AromaticContact CE2-CE1 3.92Å; F195-H250 AromaticContact CE2-ND1 3.66Å; F195-H250 HydrophobicContact CG-CB 4.01Å; F195-H250 AromaticContact CG-CD2 3.28Å; F195-H250 WeakPolarHBondContact CG-CD2 3.41Å; F195-H250 AromaticContact CG-CE1 3.69Å; F195-H250 AromaticContact CG-CG 3.35Å; F195-H250 AromaticContact CG-ND1 3.61Å; F195-H250 AromaticContact CG-NE2 3.54Å; F195-H250 HydrophobicContact CZ-CB 4.25Å; F195-H250 AromaticContact CZ-ND1 3.83Å |
| 196 | W | 96.4 | Very high | 94.9 | Very high | 74 Ų | 74 | 38.2 Ų | 38.2 | 28% | 0.28 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -65.3 | -39.3 | -177.7 | -66.8 | 111.7 | 0 | 0 | 0 | 111.8 | Q192 L199 V200 V247 H250 F251 | Q192-W196 PolarHBondContact O-N 3.36Å; W196-L199 HydrophobicContact CE3-CD2 3.7Å; W196-L199 HydrophobicContact CZ3-CD2 3.57Å; W196-L199 PolarHBondContact O-N 3.17Å; W196-V200 VanDerWaalsContact O-CG2 3.3Å; W196-V200 WeakPolarHBondContact O-CG2 3.17Å; W196-V200 PolarHBondContact O-N 3.46Å; W196-V247 HydrophobicContact CH2-CG1 4.38Å; W196-H250 HydrophobicContact CZ2-CB 4.34Å; W196-F251 HydrophobicContact CH2-CD1 4.24Å; W196-F251 AromaticContact CH2-CD2 3.8Å; W196-F251 HydrophobicContact CH2-CD2 3.8Å; W196-F251 AromaticContact CH2-CE1 3.87Å; W196-F251 HydrophobicContact CH2-CE1 3.87Å; W196-F251 AromaticContact CH2-CE2 3.43Å; W196-F251 HydrophobicContact CH2-CE2 3.43Å; W196-F251 VanDerWaalsContact CH2-CE2 3.43Å; W196-F251 HydrophobicContact CH2-CG 4.19Å; W196-F251 AromaticContact CH2-CZ 3.45Å; W196-F251 HydrophobicContact CH2-CZ 3.45Å; W196-F251 VanDerWaalsContact CH2-CZ 3.45Å; W196-F251 HydrophobicContact CZ2-CD1 4.18Å; W196-F251 HydrophobicContact CZ2-CD2 4.26Å; W196-F251 HydrophobicContact CZ2-CE1 4.14Å; W196-F251 HydrophobicContact CZ2-CE2 4.26Å; W196-F251 HydrophobicContact CZ2-CG 4.24Å; W196-F251 HydrophobicContact CZ2-CZ 4.18Å; W196-F251 HydrophobicContact CZ3-CE2 4.31Å; W196-F251 HydrophobicContact CZ3-CZ 4.23Å |
| 197 | G | 97.2 | Very high | 94.6 | Very high | 43 Ų | 43 | 39.3 Ų | 39.3 | 44% | 0.443 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -62.9 | -41.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V193 F195 A201 | V193-G197 PolarHBondContact O-N 3.35Å; F195-G197 VanDerWaalsContact C-N 3.35Å; F195-G197 PolarHBondContact O-N 3.07Å; G197-A201 WeakPolarHBondContact O-CB 3.32Å; G197-A201 PolarHBondContact O-N 3.36Å |
| 198 | N | 95.9 | Very high | 94.3 | Very high | 13 Ų | 13 | 42.1 Ų | 42.1 | 7% | 0.07 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.3 | -46 | 175 | -167.8 | -77.1 | 0 | 0 | 0 | 111.7 | I110 G114 I194 F195 V200 A201 V202 | I110-N198 HydrophobicContact CG2-CB 4Å; I110-N198 PolarHBondContact O-ND2 3.42Å; I110-N198 PolarHBondContact O-OD1 3.42Å; G114-N198 WeakPolarHBondContact CA-ND2 3.33Å; I194-N198 WeakPolarHBondContact O-CB 3.43Å; I194-N198 PolarHBondContact O-N 3.21Å; F195-N198 WeakPolarHBondContact O-CB 3.43Å; F195-N198 PolarHBondContact O-N 3.01Å; N198-V200 PolarHBondContact O-N 3.48Å; N198-A201 WeakPolarHBondContact O-CB 3.43Å; N198-A201 PolarHBondContact O-N 2.89Å; N198-A201 VanDerWaalsContact O-N 3.16Å; N198-V202 VanDerWaalsContact O-CG2 3.29Å; N198-V202 WeakPolarHBondContact O-CG2 3.34Å; N198-V202 PolarHBondContact O-N 3.23Å |
| 199 | L | 94.9 | Very high | 94 | Very high | 12 Ų | 12 | 42.2 Ų | 42.2 | 6% | 0.063 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -57.7 | -47.4 | 177.6 | -175.2 | 68.6 | 0 | 0 | 0 | 111.5 | F195 W196 A201 V202 I203 F242 F243 V247 | F195-L199 HydrophobicContact CE1-CD2 4.31Å; F195-L199 HydrophobicContact CZ-CD2 4.44Å; F195-L199 WeakPolarHBondContact O-CB 3.33Å; F195-L199 PolarHBondContact O-N 2.96Å; W196-L199 HydrophobicContact CE3-CD2 3.7Å; W196-L199 HydrophobicContact CZ3-CD2 3.57Å; W196-L199 PolarHBondContact O-N 3.17Å; L199-A201 PolarHBondContact O-N 3.11Å; L199-V202 PolarHBondContact O-N 3.49Å; L199-I203 HydrophobicContact CG-CD1 4.05Å; L199-I203 VanDerWaalsContact O-CG1 3.31Å; L199-I203 WeakPolarHBondContact O-CG1 3.38Å; L199-I203 PolarHBondContact O-N 3.19Å; L199-F242 HydrophobicContact CD1-CD1 4.32Å; L199-F242 HydrophobicContact CD1-CE1 3.83Å; L199-F243 HydrophobicContact CD1-CD1 4.08Å; L199-F243 HydrophobicContact CD1-CD2 4.48Å; L199-F243 HydrophobicContact CD1-CE1 3.56Å; L199-F243 HydrophobicContact CD1-CE2 4.02Å; L199-F243 HydrophobicContact CD1-CZ 3.53Å; L199-F243 HydrophobicContact CG-CE1 4.4Å; L199-F243 HydrophobicContact CG-CZ 4.46Å; L199-V247 HydrophobicContact CD1-CG2 4.22Å; L199-V247 HydrophobicContact CD2-CG2 4.19Å |
| 200 | V | 95.4 | Very high | 93.5 | Very high | 80 Ų | 80 | 39.5 Ų | 39.5 | 49% | 0.485 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -59.9 | -46 | 175.6 | 169 | 0 | 0 | 0 | 0 | 110.9 | W196 N198 V202 I203 I204 | W196-V200 VanDerWaalsContact O-CG2 3.3Å; W196-V200 WeakPolarHBondContact O-CG2 3.17Å; W196-V200 PolarHBondContact O-N 3.46Å; N198-V200 PolarHBondContact O-N 3.48Å; V200-V202 VanDerWaalsContact C-N 3.33Å; V200-V202 PolarHBondContact O-N 3.49Å; V200-I203 PolarHBondContact O-N 3.37Å; V200-I204 HydrophobicContact CG1-CD1 3.68Å; V200-I204 HydrophobicContact CG1-CG1 4.39Å; V200-I204 VanDerWaalsContact O-CG1 3.3Å; V200-I204 WeakPolarHBondContact O-CG1 3.19Å; V200-I204 PolarHBondContact O-N 3.18Å |
| 201 | A | 94.7 | Very high | 92.9 | Very high | 28 Ų | 28 | 44 Ų | 44 | 23% | 0.231 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.8 | -41.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I118 G197 N198 L199 C205 | I118-A201 HydrophobicContact CD1-CB 4.48Å; G197-A201 WeakPolarHBondContact O-CB 3.32Å; G197-A201 PolarHBondContact O-N 3.36Å; N198-A201 WeakPolarHBondContact O-CB 3.43Å; N198-A201 PolarHBondContact O-N 2.89Å; N198-A201 VanDerWaalsContact O-N 3.16Å; L199-A201 PolarHBondContact O-N 3.11Å; A201-C205 VanDerWaalsContact O-CB 3.26Å; A201-C205 WeakPolarHBondContact O-CB 3.46Å; A201-C205 PolarHBondContact O-N 3.04Å; A201-C205 PolarHBondContact O-SG 3.37Å |
| 202 | V | 91.9 | Very high | 92.4 | Very high | 3 Ų | 3 | 46.6 Ų | 46.6 | 2% | 0.018 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.2 | -50 | 175.6 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | N198 L199 V200 I204 C205 Y206 L239 | N198-V202 VanDerWaalsContact O-CG2 3.29Å; N198-V202 WeakPolarHBondContact O-CG2 3.34Å; N198-V202 PolarHBondContact O-N 3.23Å; L199-V202 PolarHBondContact O-N 3.49Å; V200-V202 VanDerWaalsContact C-N 3.33Å; V200-V202 PolarHBondContact O-N 3.49Å; V202-I204 PolarHBondContact O-N 2.58Å; V202-C205 PolarHBondContact O-N 2.87Å; V202-Y206 HydrophobicContact CG1-CD2 4.06Å; V202-Y206 HydrophobicContact CG1-CE2 4.12Å; V202-Y206 VanDerWaalsContact O-CD2 3.27Å; V202-Y206 WeakPolarHBondContact O-CD2 3.32Å; V202-Y206 PolarHBondContact O-N 2.9Å; V202-L239 HydrophobicContact CG1-CD2 3.24Å |
| 203 | I | 91.8 | Very high | 91.5 | Very high | 74 Ų | 74 | 47.7 Ų | 47.7 | 38% | 0.379 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -55.7 | -53.7 | 178.1 | -70.3 | 166.4 | 0 | 0 | 0 | 110.3 | L199 V200 C205 Y206 T207 F243 | L199-I203 HydrophobicContact CG-CD1 4.05Å; L199-I203 VanDerWaalsContact O-CG1 3.31Å; L199-I203 WeakPolarHBondContact O-CG1 3.38Å; L199-I203 PolarHBondContact O-N 3.19Å; V200-I203 PolarHBondContact O-N 3.37Å; I203-C205 VanDerWaalsContact C-N 3.33Å; I203-C205 PolarHBondContact O-N 3.33Å; I203-Y206 PolarHBondContact O-N 3.05Å; I203-T207 PolarHBondContact O-N 3.22Å; I203-T207 PolarHBondContact O-OG1 3.38Å; I203-F243 HydrophobicContact CD1-CE1 4.3Å; I203-F243 HydrophobicContact CD1-CZ 3.93Å; I203-F243 HydrophobicContact CG1-CZ 3.68Å |
| 204 | I | 93.4 | Very high | 90.7 | Very high | 93 Ų | 93 | 50.6 Ų | 50.6 | 48% | 0.477 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -56.7 | -48.5 | 179.9 | -68.1 | 168.7 | 0 | 0 | 0 | 110.5 | V200 V202 Y206 T207 L208 | V200-I204 HydrophobicContact CG1-CD1 3.68Å; V200-I204 HydrophobicContact CG1-CG1 4.39Å; V200-I204 VanDerWaalsContact O-CG1 3.3Å; V200-I204 WeakPolarHBondContact O-CG1 3.19Å; V200-I204 PolarHBondContact O-N 3.18Å; V202-I204 PolarHBondContact O-N 2.58Å; I204-Y206 VanDerWaalsContact C-N 3.32Å; I204-Y206 PolarHBondContact O-N 2.97Å; I204-T207 PolarHBondContact O-N 3.32Å; I204-L208 HydrophobicContact CG2-CD1 3.96Å; I204-L208 HydrophobicContact CG2-CG 4.4Å; I204-L208 VanDerWaalsContact O-CG 3.28Å; I204-L208 WeakPolarHBondContact O-CG 3.38Å; I204-L208 PolarHBondContact O-N 2.84Å |
| 205 | C | 91.6 | Very high | 89.9 | Confident | 11 Ų | 11 | 54.1 Ų | 54.1 | 7% | 0.074 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -57 | -45.5 | -179.7 | -76.7 | 0 | 0 | 0 | 0 | 112 | C121 A201 V202 I203 L208 I209 | C121-C205 HydrophobicContact CB-CB 3.67Å; A201-C205 VanDerWaalsContact O-CB 3.26Å; A201-C205 WeakPolarHBondContact O-CB 3.46Å; A201-C205 PolarHBondContact O-N 3.04Å; A201-C205 PolarHBondContact O-SG 3.37Å; V202-C205 PolarHBondContact O-N 2.87Å; I203-C205 VanDerWaalsContact C-N 3.33Å; I203-C205 PolarHBondContact O-N 3.33Å; C205-L208 PolarHBondContact O-N 2.99Å; C205-I209 WeakPolarHBondContact O-CD1 3.4Å; C205-I209 WeakPolarHBondContact O-CG1 3.18Å; C205-I209 PolarHBondContact O-N 2.89Å |
| 206 | Y | 87.1 | Confident | 88.9 | Confident | 11 Ų | 11 | 55.8 Ų | 55.8 | 4% | 0.043 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -78.4 | -30 | -177.1 | -82.1 | -109.3 | 0 | 0 | 0 | 113.4 | S117 V202 I203 I204 L208 I209 S210 V235 L239 | S117-Y206 WeakPolarHBondContact OG-CE2 3.05Å; V202-Y206 HydrophobicContact CG1-CD2 4.06Å; V202-Y206 HydrophobicContact CG1-CE2 4.12Å; V202-Y206 VanDerWaalsContact O-CD2 3.27Å; V202-Y206 WeakPolarHBondContact O-CD2 3.32Å; V202-Y206 PolarHBondContact O-N 2.9Å; I203-Y206 PolarHBondContact O-N 3.05Å; I204-Y206 VanDerWaalsContact C-N 3.32Å; I204-Y206 PolarHBondContact O-N 2.97Å; Y206-L208 VanDerWaalsContact C-N 3.34Å; Y206-I209 PolarHBondContact O-N 3.25Å; Y206-S210 VanDerWaalsContact O-CB 3.29Å; Y206-S210 WeakPolarHBondContact O-CB 3.28Å; Y206-S210 PolarHBondContact O-N 3.41Å; Y206-S210 PolarHBondContact O-OG 3Å; Y206-V235 HydrophobicContact CD1-CG1 3.78Å; Y206-V235 HydrophobicContact CE1-CB 4.41Å; Y206-V235 HydrophobicContact CE1-CG1 3.12Å; Y206-L239 HydrophobicContact CD1-CD1 3.11Å; Y206-L239 HydrophobicContact CD1-CD2 4.09Å; Y206-L239 HydrophobicContact CD1-CG 3.69Å; Y206-L239 HydrophobicContact CD2-CD1 4.13Å; Y206-L239 HydrophobicContact CD2-CD2 3.83Å; Y206-L239 HydrophobicContact CD2-CG 4.35Å; Y206-L239 HydrophobicContact CE1-CD1 3.4Å; Y206-L239 VanDerWaalsContact CE1-CD1 3.4Å; Y206-L239 HydrophobicContact CE1-CD2 3.77Å; Y206-L239 HydrophobicContact CE1-CG 3.38Å; Y206-L239 HydrophobicContact CE2-CD1 4.43Å; Y206-L239 HydrophobicContact CE2-CD2 3.59Å; Y206-L239 HydrophobicContact CE2-CG 4.18Å; Y206-L239 HydrophobicContact CG-CD1 3.47Å; Y206-L239 VanDerWaalsContact CG-CD1 3.47Å; Y206-L239 HydrophobicContact CG-CD2 4.07Å; Y206-L239 HydrophobicContact CG-CG 4.11Å |
| 207 | T | 88.8 | Confident | 87.7 | Confident | 67 Ų | 67 | 59.4 Ų | 59.4 | 41% | 0.411 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.7 | -45.5 | 167.4 | -57 | 0 | 0 | 0 | 0 | 110.5 | I203 I204 S210 K211 | I203-T207 PolarHBondContact O-N 3.22Å; I203-T207 PolarHBondContact O-OG1 3.38Å; I204-T207 PolarHBondContact O-N 3.32Å; T207-S210 PolarHBondContact O-N 3.27Å; T207-K211 HydrophobicContact CG2-CD 4.37Å; T207-K211 WeakPolarHBondContact O-CB 3.41Å; T207-K211 WeakPolarHBondContact O-CG 3.49Å; T207-K211 PolarHBondContact O-N 2.92Å |
| 208 | L | 90.3 | Very high | 86.7 | Confident | 69 Ų | 69 | 60.6 Ų | 60.6 | 36% | 0.361 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 177.7 | -68.1 | 174.9 | 0 | 0 | 0 | 112.3 | L125 I204 C205 Y206 S210 K211 E212 | L125-L208 HydrophobicContact CD1-CB 4.23Å; L125-L208 HydrophobicContact CD1-CD1 4.13Å; I204-L208 HydrophobicContact CG2-CD1 3.96Å; I204-L208 HydrophobicContact CG2-CG 4.4Å; I204-L208 VanDerWaalsContact O-CG 3.28Å; I204-L208 WeakPolarHBondContact O-CG 3.38Å; I204-L208 PolarHBondContact O-N 2.84Å; C205-L208 PolarHBondContact O-N 2.99Å; Y206-L208 VanDerWaalsContact C-N 3.34Å; L208-S210 VanDerWaalsContact C-N 3.34Å; L208-S210 PolarHBondContact O-N 2.87Å; L208-K211 PolarHBondContact O-N 2.88Å; L208-E212 PolarHBondContact O-N 3.2Å |
| 209 | I | 86.4 | Confident | 85.7 | Confident | 13 Ų | 13 | 68.3 Ų | 68.3 | 7% | 0.067 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -58.3 | -48 | 174.4 | -70.5 | 163.2 | 0 | 0 | 0 | 110.1 | R120 C121 T124 C205 Y206 K211 E212 L213 | R120-I209 HydrophobicContact CB-CD1 4.31Å; C121-I209 HydrophobicContact CB-CD1 4.13Å; C121-I209 HydrophobicContact CB-CG1 4.25Å; T124-I209 HydrophobicContact CG2-CG1 4.42Å; T124-I209 HydrophobicContact CG2-CG2 4.44Å; C205-I209 WeakPolarHBondContact O-CD1 3.4Å; C205-I209 WeakPolarHBondContact O-CG1 3.18Å; C205-I209 PolarHBondContact O-N 2.89Å; Y206-I209 PolarHBondContact O-N 3.25Å; I209-K211 PolarHBondContact O-N 3.42Å; I209-E212 PolarHBondContact O-N 3Å; I209-L213 HydrophobicContact CG2-CD1 3.64Å; I209-L213 HydrophobicContact CG2-CG 4.26Å; I209-L213 WeakPolarHBondContact O-CB 3.42Å; I209-L213 WeakPolarHBondContact O-CG 3.31Å; I209-L213 PolarHBondContact O-N 3.32Å |
| 210 | S | 84.2 | Confident | 84.4 | Confident | 42 Ų | 42 | 71.3 Ų | 71.3 | 29% | 0.294 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | -178.9 | -57.4 | 0 | 0 | 0 | 0 | 111.8 | Y206 T207 L208 L213 Y214 | Y206-S210 VanDerWaalsContact O-CB 3.29Å; Y206-S210 WeakPolarHBondContact O-CB 3.28Å; Y206-S210 PolarHBondContact O-N 3.41Å; Y206-S210 PolarHBondContact O-OG 3Å; T207-S210 PolarHBondContact O-N 3.27Å; L208-S210 VanDerWaalsContact C-N 3.34Å; L208-S210 PolarHBondContact O-N 2.87Å; S210-L213 PolarHBondContact O-N 3.01Å; S210-Y214 WeakPolarHBondContact O-CB 3.31Å; S210-Y214 PolarHBondContact O-N 3.49Å |
| 211 | K | 86.1 | Confident | 82.6 | Confident | 141 Ų | 141 | 77.1 Ų | 77.1 | 61% | 0.613 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -61.8 | -46.8 | 175.3 | -77.1 | -178.6 | 176.5 | -175.6 | 0 | 112.1 | T207 L208 I209 L213 Y214 K215 | T207-K211 HydrophobicContact CG2-CD 4.37Å; T207-K211 WeakPolarHBondContact O-CB 3.41Å; T207-K211 WeakPolarHBondContact O-CG 3.49Å; T207-K211 PolarHBondContact O-N 2.92Å; L208-K211 PolarHBondContact O-N 2.88Å; I209-K211 PolarHBondContact O-N 3.42Å; K211-L213 VanDerWaalsContact C-N 3.35Å; K211-Y214 PolarHBondContact O-N 3.45Å; K211-K215 WeakPolarHBondContact O-CB 3.47Å; K211-K215 PolarHBondContact O-N 3.41Å |
| 212 | E | 85 | Confident | 80.5 | Confident | 60 Ų | 60 | 80.6 Ų | 80.6 | 28% | 0.28 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.1 | -38.2 | 179.8 | -171.6 | 55.4 | -146.5 | 0 | 0 | 111.6 | T124 L125 L208 I209 K215 S216 | T124-E212 HydrophobicContact CG2-CB 4.35Å; T124-E212 HydrophobicContact CG2-CG 4.33Å; L125-E212 HydrophobicContact CD2-CB 3.98Å; L125-E212 HydrophobicContact CD2-CG 4.2Å; L208-E212 PolarHBondContact O-N 3.2Å; I209-E212 PolarHBondContact O-N 3Å; E212-K215 PolarHBondContact O-N 3.4Å; E212-S216 WeakPolarHBondContact O-CB 3.4Å; E212-S216 PolarHBondContact O-N 2.98Å |
| 213 | L | 78.6 | Confident | 78.5 | Confident | 37 Ų | 37 | 88.6 Ų | 88.6 | 19% | 0.194 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -64.7 | -42.7 | 174.7 | -72 | 171.7 | 0 | 0 | 0 | 112.2 | I209 S210 K211 S216 Y217 M231 N232 | I209-L213 HydrophobicContact CG2-CD1 3.64Å; I209-L213 HydrophobicContact CG2-CG 4.26Å; I209-L213 WeakPolarHBondContact O-CB 3.42Å; I209-L213 WeakPolarHBondContact O-CG 3.31Å; I209-L213 PolarHBondContact O-N 3.32Å; S210-L213 PolarHBondContact O-N 3.01Å; K211-L213 VanDerWaalsContact C-N 3.35Å; L213-S216 PolarHBondContact O-N 3.14Å; L213-Y217 WeakPolarHBondContact O-CB 3.31Å; L213-Y217 PolarHBondContact O-N 3.44Å; L213-M231 HydrophobicContact CD2-CE 4.41Å; L213-N232 WeakPolarHBondContact CD1-OD1 3.49Å |
| 214 | Y | 79.5 | Confident | 76.6 | Confident | 168 Ų | 168 | 88.7 Ų | 88.7 | 66% | 0.659 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -62.5 | -46.3 | 175.2 | -177.6 | -98.6 | 0 | 0 | 0 | 111.1 | S210 K211 S216 Y217 S218 | S210-Y214 WeakPolarHBondContact O-CB 3.31Å; S210-Y214 PolarHBondContact O-N 3.49Å; K211-Y214 PolarHBondContact O-N 3.45Å; Y214-S216 PolarHBondContact O-N 2.99Å; Y214-Y217 WeakPolarHBondContact O-CB 3.35Å; Y214-Y217 PolarHBondContact O-N 3.17Å; Y214-Y217 VanDerWaalsContact O-N 3.13Å; Y214-S218 PolarHBondContact O-N 3.41Å; Y214-S218 PolarHBondContact O-OG 3.19Å |
| 215 | K | 81.6 | Confident | 74.6 | Confident | 98 Ų | 98 | 88.6 Ų | 88.6 | 43% | 0.426 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.9 | -43.9 | 176.2 | -171.4 | -176.8 | -172.8 | -175.4 | 0 | 112.3 | K211 E212 R219 | K211-K215 WeakPolarHBondContact O-CB 3.47Å; K211-K215 PolarHBondContact O-N 3.41Å; E212-K215 PolarHBondContact O-N 3.4Å; K215-R219 VanDerWaalsContact CE-CZ 3.45Å; K215-R219 VanDerWaalsContact CE-NH2 3.26Å; K215-R219 VanDerWaalsContact O-CG 3.28Å; K215-R219 WeakPolarHBondContact O-CG 3.5Å; K215-R219 PolarHBondContact O-N 2.88Å; K215-R219 VanDerWaalsContact O-N 3.15Å |
| 216 | S | 77 | Confident | 72.7 | Confident | 35 Ų | 35 | 94.6 Ų | 94.6 | 25% | 0.245 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -61.8 | -43.8 | 173.7 | 175.5 | 0 | 0 | 0 | 0 | 111 | E212 L213 Y214 R219 T220 K228 | E212-S216 WeakPolarHBondContact O-CB 3.4Å; E212-S216 PolarHBondContact O-N 2.98Å; L213-S216 PolarHBondContact O-N 3.14Å; Y214-S216 PolarHBondContact O-N 2.99Å; S216-R219 PolarHBondContact O-N 2.9Å; S216-T220 WeakPolarHBondContact O-CB 3.3Å; S216-T220 PolarHBondContact O-N 3.13Å; S216-T220 VanDerWaalsContact O-N 3.08Å; S216-T220 PolarHBondContact O-OG1 2.94Å; S216-K228 PolarHBondContact OG-NZ 3.02Å |
| 217 | Y | 70.9 | Confident | 70.9 | Confident | 150 Ų | 150 | 96.6 Ų | 96.6 | 59% | 0.588 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.1 | -49.6 | 177.4 | 178.5 | -100 | 0 | 0 | 0 | 112.1 | L213 Y214 R219 T220 | L213-Y217 WeakPolarHBondContact O-CB 3.31Å; L213-Y217 PolarHBondContact O-N 3.44Å; Y214-Y217 WeakPolarHBondContact O-CB 3.35Å; Y214-Y217 PolarHBondContact O-N 3.17Å; Y214-Y217 VanDerWaalsContact O-N 3.13Å; Y217-R219 PolarHBondContact O-N 3.02Å; Y217-T220 PolarHBondContact O-N 3.12Å; Y217-T220 VanDerWaalsContact O-N 3.12Å |
| 218 | S | 74.9 | Confident | 69.1 | Low | 68 Ų | 68 | 97.4 Ų | 97.4 | 48% | 0.476 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.9 | -31.3 | 177.7 | -57.2 | 0 | 0 | 0 | 0 | 113.1 | Y214 | Y214-S218 PolarHBondContact O-N 3.41Å; Y214-S218 PolarHBondContact O-OG 3.19Å |
| 219 | R | 76.1 | Confident | 67.4 | Low | 175 Ų | 175 | 103.5 Ų | 103.5 | 66% | 0.66 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -78.8 | -25.8 | 177.4 | -74 | 171.1 | 171 | -174.8 | -11.9 | 114.1 | K215 S216 Y217 | K215-R219 VanDerWaalsContact CE-CZ 3.45Å; K215-R219 VanDerWaalsContact CE-NH2 3.26Å; K215-R219 VanDerWaalsContact O-CG 3.28Å; K215-R219 WeakPolarHBondContact O-CG 3.5Å; K215-R219 PolarHBondContact O-N 2.88Å; K215-R219 VanDerWaalsContact O-N 3.15Å; S216-R219 PolarHBondContact O-N 2.9Å; Y217-R219 PolarHBondContact O-N 3.02Å |
| 220 | T | 67.6 | Low | 65.7 | Low | 74 Ų | 74 | 109 Ų | 109 | 45% | 0.454 | 53% | 0.529 | S | S | . | . | trans | -115.1 | 44.7 | -166.6 | -25.3 | 0 | 0 | 0 | 0 | 111.9 | S216 Y217 S222 | S216-T220 WeakPolarHBondContact O-CB 3.3Å; S216-T220 PolarHBondContact O-N 3.13Å; S216-T220 VanDerWaalsContact O-N 3.08Å; S216-T220 PolarHBondContact O-OG1 2.94Å; Y217-T220 PolarHBondContact O-N 3.12Å; Y217-T220 VanDerWaalsContact O-N 3.12Å; T220-S222 PolarHBondContact O-N 2.9Å | ||
| 221 | K | 56.3 | Low | 64.2 | Low | 202 Ų | 202 | 111.8 Ų | 111.8 | 88% | 0.878 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.6 | 7.9 | -165.4 | -142.7 | -178.7 | -177.1 | -176.1 | 0 | 118.5 | ||
| 222 | S | 52.3 | Low | 63 | Low | 102 Ų | 102 | 107.2 Ų | 107.2 | 71% | 0.713 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -151.7 | 20.1 | -170.1 | 64.9 | 0 | 0 | 0 | 0 | 119.3 | T220 | T220-S222 PolarHBondContact O-N 2.9Š|
| 223 | H | 49.7 | Very low | 62.1 | Low | 171 Ų | 171 | 107 Ų | 107 | 79% | 0.792 | 53% | 0.53 | S | S | * | . | S | Bend | trans | -143.4 | 113.3 | 171.7 | -113.9 | -86.8 | 0 | 0 | 0 | 116.2 | ||
| 224 | C | 50.2 | Low | 61.6 | Low | 75 Ų | 75 | 107.2 Ų | 107.2 | 51% | 0.507 | 53% | 0.531 | S | S | . | . | trans | 62.4 | 78.8 | 166.1 | -139.8 | 0 | 0 | 0 | 0 | 117.9 | E226 | C224-E226 PolarHBondContact O-N 2.95Š| ||
| 225 | P | 53.2 | Low | 61.1 | Low | 91 Ų | 91 | 100.2 Ų | 100.2 | 59% | 0.591 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.6 | -34.5 | 177.7 | -18.7 | 30.9 | 0 | 0 | 0 | 114.1 | R229 | P225-R229 VanDerWaalsContact O-CB 3.24Å; P225-R229 WeakPolarHBondContact O-CB 3.31Å; P225-R229 PolarHBondContact O-N 3.34Å |
| 226 | E | 50.8 | Low | 60.8 | Low | 138 Ų | 138 | 100.6 Ų | 100.6 | 65% | 0.645 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -73.6 | -42.4 | -166.3 | -67.1 | -175.9 | 148.5 | 0 | 0 | 113.8 | C224 R229 K230 | C224-E226 PolarHBondContact O-N 2.95Å; E226-R229 PolarHBondContact O-N 3.24Å; E226-K230 WeakPolarHBondContact O-CB 3.3Å; E226-K230 PolarHBondContact O-N 2.69Å |
| 227 | A | 48.8 | Very low | 60.8 | Low | 52 Ų | 52 | 103 Ų | 103 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.7 | -38.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | M231 | A227-M231 PolarHBondContact O-N 3.12Å |
| 228 | K | 51.1 | Low | 61 | Low | 84 Ų | 84 | 96.2 Ų | 96.2 | 37% | 0.365 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -70.8 | -39.7 | 174 | -86.1 | -176.4 | 176.5 | 180 | 0 | 112 | S216 N232 | S216-K228 PolarHBondContact OG-NZ 3.02Å; K228-N232 PolarHBondContact O-N 3.17Å; K228-N232 PolarHBondContact O-ND2 3.37Å; K228-N232 PolarHBondContact O-OD1 3.42Å |
| 229 | R | 54.2 | Low | 61.2 | Low | 197 Ų | 197 | 94 Ų | 94 | 74% | 0.743 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -63.2 | -41.3 | 176 | -167.9 | 175.2 | 110.2 | -176.5 | 3 | 112.3 | P225 E226 N232 A233 | P225-R229 VanDerWaalsContact O-CB 3.24Å; P225-R229 WeakPolarHBondContact O-CB 3.31Å; P225-R229 PolarHBondContact O-N 3.34Å; E226-R229 PolarHBondContact O-N 3.24Å; R229-N232 PolarHBondContact O-N 3.33Å; R229-A233 PolarHBondContact O-N 2.93Å; R229-A233 VanDerWaalsContact O-N 3.1Å |
| 230 | K | 51.5 | Low | 61.6 | Low | 128 Ų | 128 | 88 Ų | 88 | 56% | 0.557 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -70.2 | -37.7 | 179.7 | -164.5 | 170.6 | -175.4 | 172.2 | 0 | 113.1 | E226 N232 A233 N234 | E226-K230 WeakPolarHBondContact O-CB 3.3Å; E226-K230 PolarHBondContact O-N 2.69Å; K230-N232 VanDerWaalsContact C-N 3.31Å; K230-N232 PolarHBondContact O-N 3.04Å; K230-A233 PolarHBondContact O-N 2.98Å; K230-N234 PolarHBondContact O-N 3.33Å |
| 231 | M | 53.1 | Low | 62.4 | Low | 101 Ų | 101 | 85.7 Ų | 85.7 | 50% | 0.498 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.2 | -39.1 | 171.7 | -179 | -177.3 | 66.8 | 0 | 0 | 111.7 | L213 A227 V235 | L213-M231 HydrophobicContact CD2-CE 4.41Å; A227-M231 PolarHBondContact O-N 3.12Å; M231-V235 WeakPolarHBondContact O-CG2 3.46Å |
| 232 | N | 60.2 | Low | 63.7 | Low | 45 Ų | 45 | 76.3 Ų | 76.3 | 24% | 0.241 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -68 | -42.5 | 178.7 | -67.7 | -6.6 | 0 | 0 | 0 | 111.8 | L213 K228 R229 K230 N234 V235 F236 | L213-N232 WeakPolarHBondContact CD1-OD1 3.49Å; K228-N232 PolarHBondContact O-N 3.17Å; K228-N232 PolarHBondContact O-ND2 3.37Å; K228-N232 PolarHBondContact O-OD1 3.42Å; R229-N232 PolarHBondContact O-N 3.33Å; K230-N232 VanDerWaalsContact C-N 3.31Å; K230-N232 PolarHBondContact O-N 3.04Å; N232-N234 PolarHBondContact O-N 2.9Å; N232-V235 PolarHBondContact O-N 3.48Å; N232-F236 HydrophobicContact CB-CD2 4.48Å; N232-F236 HydrophobicContact CB-CE2 4.48Å; N232-F236 WeakPolarHBondContact O-CD2 3.4Å; N232-F236 PolarHBondContact O-N 2.92Å |
| 233 | A | 67.4 | Low | 65.5 | Low | 56 Ų | 56 | 74.9 Ų | 74.9 | 46% | 0.463 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.4 | -45.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | R229 K230 V235 F236 L237 | R229-A233 PolarHBondContact O-N 2.93Å; R229-A233 VanDerWaalsContact O-N 3.1Å; K230-A233 PolarHBondContact O-N 2.98Å; A233-V235 VanDerWaalsContact C-N 3.26Å; A233-V235 PolarHBondContact O-N 3.05Å; A233-F236 PolarHBondContact O-N 2.94Å; A233-L237 WeakPolarHBondContact O-CB 3.31Å; A233-L237 PolarHBondContact O-N 3.49Å |
| 234 | N | 67.4 | Low | 67.4 | Low | 41 Ų | 41 | 70.9 Ų | 70.9 | 22% | 0.219 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.2 | -33.4 | 179.6 | -66.3 | -2.8 | 0 | 0 | 0 | 112 | K230 N232 V238 F298 L299 | K230-N234 PolarHBondContact O-N 3.33Å; N232-N234 PolarHBondContact O-N 2.9Å; N234-V238 WeakPolarHBondContact O-CG2 3.5Å; N234-V238 PolarHBondContact O-N 2.98Å; N234-F298 HydrophobicContact CB-CB 4.46Å; N234-F298 PolarHBondContact ND2-O 2.9Å; N234-L299 HydrophobicContact CB-CD2 3.78Å |
| 235 | V | 68.8 | Low | 69.4 | Low | 22 Ų | 22 | 67.4 Ų | 67.4 | 13% | 0.133 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -71.5 | -41.9 | -180 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | Y206 M231 N232 A233 L239 L299 | Y206-V235 HydrophobicContact CD1-CG1 3.78Å; Y206-V235 HydrophobicContact CE1-CB 4.41Å; Y206-V235 HydrophobicContact CE1-CG1 3.12Å; M231-V235 WeakPolarHBondContact O-CG2 3.46Å; N232-V235 PolarHBondContact O-N 3.48Å; A233-V235 VanDerWaalsContact C-N 3.26Å; A233-V235 PolarHBondContact O-N 3.05Å; V235-L239 PolarHBondContact O-N 2.89Å; V235-L299 HydrophobicContact CG2-CD2 4.11Å |
| 236 | F | 74.9 | Confident | 71.4 | Confident | 106 Ų | 106 | 63.2 Ų | 63.2 | 47% | 0.465 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -68.8 | -35.5 | 172.1 | -79 | -73.5 | 0 | 0 | 0 | 113.2 | N232 A233 V238 L239 A240 | N232-F236 HydrophobicContact CB-CD2 4.48Å; N232-F236 HydrophobicContact CB-CE2 4.48Å; N232-F236 WeakPolarHBondContact O-CD2 3.4Å; N232-F236 PolarHBondContact O-N 2.92Å; A233-F236 PolarHBondContact O-N 2.94Å; F236-V238 VanDerWaalsContact C-N 3.31Å; F236-V238 PolarHBondContact O-N 3.43Å; F236-L239 HydrophobicContact CD1-CD1 4.29Å; F236-L239 WeakPolarHBondContact O-CB 3.43Å; F236-L239 PolarHBondContact O-N 3.32Å; F236-A240 PolarHBondContact O-N 3.1Å |
| 237 | L | 78.3 | Confident | 73.5 | Confident | 86 Ų | 86 | 57.7 Ų | 57.7 | 45% | 0.45 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -58.4 | -44.7 | 174.9 | 178.9 | 66.3 | 0 | 0 | 0 | 111.4 | A233 L239 A240 V241 | A233-L237 WeakPolarHBondContact O-CB 3.31Å; A233-L237 PolarHBondContact O-N 3.49Å; L237-L239 VanDerWaalsContact C-N 3.32Å; L237-L239 PolarHBondContact O-N 3.49Å; L237-A240 WeakPolarHBondContact O-CB 3.35Å; L237-A240 PolarHBondContact O-N 3.43Å; L237-V241 WeakPolarHBondContact O-CG2 3.2Å; L237-V241 PolarHBondContact O-N 3.48Å |
| 238 | V | 75 | Confident | 75.8 | Confident | 6 Ų | 6 | 57.2 Ų | 57.2 | 4% | 0.036 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.7 | -37.9 | -179.4 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | F113 N234 F236 F242 I295 L299 | F113-V238 HydrophobicContact CE1-CG1 4.11Å; N234-V238 WeakPolarHBondContact O-CG2 3.5Å; N234-V238 PolarHBondContact O-N 2.98Å; F236-V238 VanDerWaalsContact C-N 3.31Å; F236-V238 PolarHBondContact O-N 3.43Å; V238-F242 PolarHBondContact O-N 3.01Å; V238-I295 HydrophobicContact CB-CG2 4.48Å; V238-I295 HydrophobicContact CG1-CD1 4.15Å; V238-I295 HydrophobicContact CG1-CG1 4.42Å; V238-I295 HydrophobicContact CG1-CG2 3.97Å; V238-I295 HydrophobicContact CG2-CB 4.21Å; V238-I295 HydrophobicContact CG2-CD1 4.4Å; V238-I295 HydrophobicContact CG2-CG1 3.81Å; V238-I295 HydrophobicContact CG2-CG2 3.68Å; V238-L299 HydrophobicContact CB-CD1 4.26Å; V238-L299 HydrophobicContact CG1-CD1 4.2Å; V238-L299 HydrophobicContact CG2-CD1 3.5Å; V238-L299 VanDerWaalsContact CG2-CD1 3.5Å; V238-L299 HydrophobicContact CG2-CD2 4.16Å; V238-L299 HydrophobicContact CG2-CG 3.82Å |
| 239 | L | 79.1 | Confident | 77.9 | Confident | 21 Ų | 21 | 53.2 Ų | 53.2 | 11% | 0.11 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -61.3 | -51.6 | 169.7 | -73.1 | -178.7 | 0 | 0 | 0 | 111.3 | V202 Y206 V235 F236 L237 V241 F242 F243 | V202-L239 HydrophobicContact CG1-CD2 3.24Å; Y206-L239 HydrophobicContact CD1-CD1 3.11Å; Y206-L239 HydrophobicContact CD1-CD2 4.09Å; Y206-L239 HydrophobicContact CD1-CG 3.69Å; Y206-L239 HydrophobicContact CD2-CD1 4.13Å; Y206-L239 HydrophobicContact CD2-CD2 3.83Å; Y206-L239 HydrophobicContact CD2-CG 4.35Å; Y206-L239 HydrophobicContact CE1-CD1 3.4Å; Y206-L239 VanDerWaalsContact CE1-CD1 3.4Å; Y206-L239 HydrophobicContact CE1-CD2 3.77Å; Y206-L239 HydrophobicContact CE1-CG 3.38Å; Y206-L239 HydrophobicContact CE2-CD1 4.43Å; Y206-L239 HydrophobicContact CE2-CD2 3.59Å; Y206-L239 HydrophobicContact CE2-CG 4.18Å; Y206-L239 HydrophobicContact CG-CD1 3.47Å; Y206-L239 VanDerWaalsContact CG-CD1 3.47Å; Y206-L239 HydrophobicContact CG-CD2 4.07Å; Y206-L239 HydrophobicContact CG-CG 4.11Å; V235-L239 PolarHBondContact O-N 2.89Å; F236-L239 HydrophobicContact CD1-CD1 4.29Å; F236-L239 WeakPolarHBondContact O-CB 3.43Å; F236-L239 PolarHBondContact O-N 3.32Å; L237-L239 VanDerWaalsContact C-N 3.32Å; L237-L239 PolarHBondContact O-N 3.49Å; L239-V241 PolarHBondContact O-N 3.2Å; L239-F242 WeakPolarHBondContact O-CB 3.41Å; L239-F242 PolarHBondContact O-N 3.34Å; L239-F243 HydrophobicContact CB-CD2 4.49Å; L239-F243 VanDerWaalsContact O-CD2 3.26Å; L239-F243 WeakPolarHBondContact O-CD2 3.45Å; L239-F243 PolarHBondContact O-N 2.9Å |
| 240 | A | 84.1 | Confident | 80 | Confident | 50 Ų | 50 | 43.8 Ų | 43.8 | 41% | 0.413 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -54.7 | -43.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | F236 L237 F243 V244 | F236-A240 PolarHBondContact O-N 3.1Å; L237-A240 WeakPolarHBondContact O-CB 3.35Å; L237-A240 PolarHBondContact O-N 3.43Å; A240-F243 PolarHBondContact O-N 2.95Å; A240-V244 WeakPolarHBondContact O-CB 3.49Å; A240-V244 VanDerWaalsContact O-CG2 3.26Å; A240-V244 WeakPolarHBondContact O-CG2 3.3Å; A240-V244 PolarHBondContact O-N 3.34Å |
| 241 | V | 84.5 | Confident | 82 | Confident | 25 Ų | 25 | 43.7 Ų | 43.7 | 15% | 0.152 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.1 | -50.2 | 173.8 | 170.9 | 0 | 0 | 0 | 0 | 111.7 | L237 L239 F243 V244 C245 L291 I295 | L237-V241 WeakPolarHBondContact O-CG2 3.2Å; L237-V241 PolarHBondContact O-N 3.48Å; L239-V241 PolarHBondContact O-N 3.2Å; V241-F243 VanDerWaalsContact C-N 3.33Å; V241-F243 PolarHBondContact O-N 3.26Å; V241-V244 PolarHBondContact O-N 3.3Å; V241-C245 VanDerWaalsContact O-CB 3.28Å; V241-C245 WeakPolarHBondContact O-CB 3.43Å; V241-C245 PolarHBondContact O-N 3.45Å; V241-C245 PolarHBondContact O-SG 2.76Å; V241-L291 HydrophobicContact CG1-CB 3.97Å; V241-L291 HydrophobicContact CG1-CD1 3.52Å; V241-L291 HydrophobicContact CG1-CG 4.37Å; V241-L291 HydrophobicContact CG2-CD1 4.45Å; V241-I295 HydrophobicContact CB-CD1 4.41Å; V241-I295 HydrophobicContact CG1-CD1 4.07Å |
| 242 | F | 83.8 | Confident | 84 | Confident | 6 Ų | 6 | 40 Ų | 40 | 3% | 0.026 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57 | -45.4 | 177.8 | 179.7 | -91.6 | 0 | 0 | 0 | 112.1 | I110 F113 F195 L199 V238 L239 F246 | I110-F242 HydrophobicContact CB-CE2 4.48Å; I110-F242 HydrophobicContact CG1-CE2 4.19Å; I110-F242 HydrophobicContact CG2-CE2 4.37Å; I110-F242 HydrophobicContact CG2-CZ 4.22Å; F113-F242 HydrophobicContact CB-CD2 4.13Å; F113-F242 HydrophobicContact CB-CE2 4.03Å; F113-F242 HydrophobicContact CD2-CD2 4.12Å; F113-F242 HydrophobicContact CD2-CE2 4.41Å; F113-F242 HydrophobicContact CG-CD2 4.09Å; F113-F242 HydrophobicContact CG-CE2 4.4Å; F195-F242 HydrophobicContact CE2-CE1 4.23Å; F195-F242 HydrophobicContact CE2-CZ 4.08Å; L199-F242 HydrophobicContact CD1-CD1 4.32Å; L199-F242 HydrophobicContact CD1-CE1 3.83Å; V238-F242 PolarHBondContact O-N 3.01Å; L239-F242 WeakPolarHBondContact O-CB 3.41Å; L239-F242 PolarHBondContact O-N 3.34Å; F242-F246 HydrophobicContact CB-CD2 4.46Å; F242-F246 AromaticContact CD2-CD2 3.3Å; F242-F246 HydrophobicContact CD2-CD2 3.3Å; F242-F246 AromaticContact CD2-CE2 3.51Å; F242-F246 HydrophobicContact CD2-CE2 3.51Å; F242-F246 HydrophobicContact CD2-CG 4.48Å; F242-F246 AromaticContact CE2-CD2 3.47Å; F242-F246 HydrophobicContact CE2-CD2 3.47Å; F242-F246 VanDerWaalsContact CE2-CD2 3.47Å; F242-F246 AromaticContact CE2-CE2 3.78Å; F242-F246 HydrophobicContact CE2-CE2 3.78Å; F242-F246 HydrophobicContact CE2-CG 4.34Å; F242-F246 AromaticContact CG-CD2 3.87Å; F242-F246 HydrophobicContact CG-CD2 3.87Å; F242-F246 HydrophobicContact CG-CE2 4.39Å; F242-F246 HydrophobicContact CZ-CD2 4.18Å; F242-F246 WeakPolarHBondContact O-CB 3.02Å; F242-F246 VanDerWaalsContact O-CD2 3.32Å; F242-F246 WeakPolarHBondContact O-CD2 3.03Å; F242-F246 PolarHBondContact O-N 2.04Å |
| 243 | F | 88.9 | Confident | 85.7 | Confident | 72 Ų | 72 | 38.2 Ų | 38.2 | 32% | 0.316 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.8 | -50.6 | 179.2 | -86.7 | -98.8 | 0 | 0 | 0 | 111.7 | L199 I203 L239 A240 V241 C245 V247 P248 | L199-F243 HydrophobicContact CD1-CD1 4.08Å; L199-F243 HydrophobicContact CD1-CD2 4.48Å; L199-F243 HydrophobicContact CD1-CE1 3.56Å; L199-F243 HydrophobicContact CD1-CE2 4.02Å; L199-F243 HydrophobicContact CD1-CZ 3.53Å; L199-F243 HydrophobicContact CG-CE1 4.4Å; L199-F243 HydrophobicContact CG-CZ 4.46Å; I203-F243 HydrophobicContact CD1-CE1 4.3Å; I203-F243 HydrophobicContact CD1-CZ 3.93Å; I203-F243 HydrophobicContact CG1-CZ 3.68Å; L239-F243 HydrophobicContact CB-CD2 4.49Å; L239-F243 VanDerWaalsContact O-CD2 3.26Å; L239-F243 WeakPolarHBondContact O-CD2 3.45Å; L239-F243 PolarHBondContact O-N 2.9Å; A240-F243 PolarHBondContact O-N 2.95Å; V241-F243 VanDerWaalsContact C-N 3.33Å; V241-F243 PolarHBondContact O-N 3.26Å; F243-C245 PolarHBondContact O-N 3.32Å; F243-V247 HydrophobicContact CB-CG2 4.42Å; F243-V247 HydrophobicContact CD1-CG2 3.89Å; F243-V247 HydrophobicContact CG-CG2 4.39Å; F243-V247 VanDerWaalsContact O-CB 3.25Å; F243-V247 WeakPolarHBondContact O-CB 3.3Å; F243-V247 WeakPolarHBondContact O-CG2 3.36Å; F243-V247 PolarHBondContact O-N 3.3Å; F243-V247 VanDerWaalsContact O-N 3.1Å; F243-P248 WeakPolarHBondContact O-CD 3.05Å |
| 244 | V | 90.6 | Very high | 86.7 | Confident | 86 Ų | 86 | 38.8 Ų | 38.8 | 52% | 0.521 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -64 | -41.5 | -178.1 | 171 | 0 | 0 | 0 | 0 | 111.2 | A240 V241 P248 L284 | A240-V244 WeakPolarHBondContact O-CB 3.49Å; A240-V244 VanDerWaalsContact O-CG2 3.26Å; A240-V244 WeakPolarHBondContact O-CG2 3.3Å; A240-V244 PolarHBondContact O-N 3.34Å; V241-V244 PolarHBondContact O-N 3.3Å; V244-P248 VanDerWaalsContact O-CD 3.3Å; V244-P248 WeakPolarHBondContact O-CD 3.32Å; V244-P248 WeakPolarHBondContact O-CG 3.19Å; V244-L284 HydrophobicContact CG1-CD1 4.22Å; V244-L284 VanDerWaalsContact O-CD2 3.26Å; V244-L284 WeakPolarHBondContact O-CD2 3.44Å; V244-L284 WeakPolarHBondContact O-CG 3.5Å |
| 245 | C | 92.4 | Very high | 87.9 | Confident | 3 Ų | 3 | 38.5 Ų | 38.5 | 2% | 0.02 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -72.4 | -47.7 | -179.1 | -74.1 | 0 | 0 | 0 | 0 | 112.6 | V241 F243 L284 S285 N288 | V241-C245 VanDerWaalsContact O-CB 3.28Å; V241-C245 WeakPolarHBondContact O-CB 3.43Å; V241-C245 PolarHBondContact O-N 3.45Å; V241-C245 PolarHBondContact O-SG 2.76Å; F243-C245 PolarHBondContact O-N 3.32Å; C245-L284 PolarHBondContact SG-O 3.09Å; C245-L284 VanDerWaalsContact SG-O 3.34Å; C245-S285 WeakPolarHBondContact O-CA 3.49Å; C245-S285 WeakPolarHBondContact O-CB 3.49Å; C245-S285 PolarHBondContact O-N 2.71Å; C245-N288 HydrophobicContact CB-CB 4.34Å |
| 246 | F | 94 | Very high | 88.9 | Confident | 2 Ų | 2 | 37.9 Ų | 37.9 | 1% | 0.009 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -98.1 | -36 | -166.6 | -64 | -66.2 | 0 | 0 | 0 | 115.1 | M106 I110 F195 F242 F249 H250 S285 N288 | M106-F246 HydrophobicContact CG-CD1 4.3Å; M106-F246 HydrophobicContact CG-CE1 3.8Å; I110-F246 HydrophobicContact CD1-CD1 3.84Å; I110-F246 HydrophobicContact CD1-CE1 4.06Å; I110-F246 HydrophobicContact CD1-CG 4.32Å; I110-F246 HydrophobicContact CG1-CD1 3.95Å; I110-F246 HydrophobicContact CG1-CD2 4.33Å; I110-F246 HydrophobicContact CG1-CE1 3.9Å; I110-F246 HydrophobicContact CG1-CE2 4.28Å; I110-F246 HydrophobicContact CG1-CG 4.17Å; I110-F246 HydrophobicContact CG1-CZ 4.05Å; F195-F246 HydrophobicContact CD2-CB 4.35Å; F195-F246 HydrophobicContact CE2-CB 3.45Å; F195-F246 VanDerWaalsContact CE2-CB 3.45Å; F195-F246 HydrophobicContact CE2-CG 4.46Å; F195-F246 HydrophobicContact CZ-CB 4.02Å; F242-F246 HydrophobicContact CB-CD2 4.46Å; F242-F246 AromaticContact CD2-CD2 3.3Å; F242-F246 HydrophobicContact CD2-CD2 3.3Å; F242-F246 AromaticContact CD2-CE2 3.51Å; F242-F246 HydrophobicContact CD2-CE2 3.51Å; F242-F246 HydrophobicContact CD2-CG 4.48Å; F242-F246 AromaticContact CE2-CD2 3.47Å; F242-F246 HydrophobicContact CE2-CD2 3.47Å; F242-F246 VanDerWaalsContact CE2-CD2 3.47Å; F242-F246 AromaticContact CE2-CE2 3.78Å; F242-F246 HydrophobicContact CE2-CE2 3.78Å; F242-F246 HydrophobicContact CE2-CG 4.34Å; F242-F246 AromaticContact CG-CD2 3.87Å; F242-F246 HydrophobicContact CG-CD2 3.87Å; F242-F246 HydrophobicContact CG-CE2 4.39Å; F242-F246 HydrophobicContact CZ-CD2 4.18Å; F242-F246 WeakPolarHBondContact O-CB 3.02Å; F242-F246 VanDerWaalsContact O-CD2 3.32Å; F242-F246 WeakPolarHBondContact O-CD2 3.03Å; F242-F246 PolarHBondContact O-N 2.04Å; F246-F249 PolarHBondContact O-N 3.48Å; F246-H250 PolarHBondContact O-N 2.93Å; F246-H250 PolarHBondContact O-ND1 2.81Å; F246-S285 VanDerWaalsContact CD1-OG 3.23Å; F246-S285 WeakPolarHBondContact CD1-OG 3.47Å; F246-S285 WeakPolarHBondContact CE1-OG 3.41Å; F246-N288 HydrophobicContact CE1-CB 4.24Å; F246-N288 HydrophobicContact CE2-CB 4.02Å; F246-N288 VanDerWaalsContact CE2-OD1 3.3Å; F246-N288 WeakPolarHBondContact CE2-OD1 3.44Å; F246-N288 HydrophobicContact CZ-CB 3.56Å |
| 247 | V | 95.3 | Very high | 89.6 | Confident | 23 Ų | 23 | 33.1 Ų | 33.1 | 14% | 0.139 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.8 | -46.5 | -173.3 | 176.7 | 0 | 0 | 0 | 0 | 112.5 | F195 W196 L199 F243 F249 H250 F251 | F195-V247 HydrophobicContact CE1-CG2 4.36Å; F195-V247 HydrophobicContact CZ-CB 4.27Å; F195-V247 HydrophobicContact CZ-CG2 3.73Å; W196-V247 HydrophobicContact CH2-CG1 4.38Å; L199-V247 HydrophobicContact CD1-CG2 4.22Å; L199-V247 HydrophobicContact CD2-CG2 4.19Å; F243-V247 HydrophobicContact CB-CG2 4.42Å; F243-V247 HydrophobicContact CD1-CG2 3.89Å; F243-V247 HydrophobicContact CG-CG2 4.39Å; F243-V247 VanDerWaalsContact O-CB 3.25Å; F243-V247 WeakPolarHBondContact O-CB 3.3Å; F243-V247 WeakPolarHBondContact O-CG2 3.36Å; F243-V247 PolarHBondContact O-N 3.3Å; F243-V247 VanDerWaalsContact O-N 3.1Å; V247-F249 VanDerWaalsContact C-N 3.31Å; V247-F249 PolarHBondContact O-N 2.93Å; V247-H250 PolarHBondContact O-N 3.42Å; V247-F251 HydrophobicContact CG1-CD2 3.62Å; V247-F251 HydrophobicContact CG1-CE2 3.51Å; V247-F251 WeakPolarHBondContact O-CD2 3.38Å; V247-F251 PolarHBondContact O-N 3.33Å |
| 248 | P | 96.6 | Very high | 90 | Very high | 41 Ų | 41 | 31.7 Ų | 31.7 | 27% | 0.266 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -59 | -41.5 | -179.2 | -26.1 | 37 | 0 | 0 | 0 | 112.8 | F243 V244 H250 V252 T281 L284 | F243-P248 WeakPolarHBondContact O-CD 3.05Å; V244-P248 VanDerWaalsContact O-CD 3.3Å; V244-P248 WeakPolarHBondContact O-CD 3.32Å; V244-P248 WeakPolarHBondContact O-CG 3.19Å; P248-H250 PolarHBondContact O-N 3.07Å; P248-V252 WeakPolarHBondContact O-CG2 3.26Å; P248-V252 PolarHBondContact O-N 3.34Å; P248-T281 HydrophobicContact CB-CG2 3.75Å; P248-L284 HydrophobicContact CB-CD2 4.36Å; P248-L284 HydrophobicContact CG-CD2 4.03Å |
| 249 | F | 97.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62 | -45.2 | 179 | 171.7 | -102.4 | 0 | 0 | 0 | 111.9 | Y103 M106 F246 V247 F251 V252 R253 K278 L282 | Y103-F249 HydrophobicContact CD1-CZ 4.42Å; Y103-F249 HydrophobicContact CE1-CE1 4.36Å; Y103-F249 HydrophobicContact CE1-CE2 4.31Å; Y103-F249 AromaticContact CE1-CZ 3.63Å; Y103-F249 HydrophobicContact CE1-CZ 3.63Å; M106-F249 HydrophobicContact CE-CD1 4.16Å; M106-F249 HydrophobicContact CE-CE1 3.73Å; M106-F249 HydrophobicContact SD-CD1 4.2Å; M106-F249 HydrophobicContact SD-CE1 4.14Å; F246-F249 PolarHBondContact O-N 3.48Å; V247-F249 VanDerWaalsContact C-N 3.31Å; V247-F249 PolarHBondContact O-N 2.93Å; F249-F251 PolarHBondContact O-N 3.19Å; F249-V252 PolarHBondContact O-N 3.42Å; F249-R253 HydrophobicContact CE1-CB 4.23Å; F249-R253 HydrophobicContact CE1-CG 4.25Å; F249-R253 HydrophobicContact CE2-CB 4.36Å; F249-R253 HydrophobicContact CZ-CB 4.06Å; F249-R253 HydrophobicContact CZ-CG 3.95Å; F249-R253 WeakPolarHBondContact O-CB 3.23Å; F249-R253 PolarHBondContact O-N 3.41Å; F249-K278 HydrophobicContact CE2-CD 4.29Å; F249-K278 HydrophobicContact CE2-CG 4.11Å; F249-L282 HydrophobicContact CD2-CB 3.93Å; F249-L282 HydrophobicContact CD2-CD1 3.98Å; F249-L282 HydrophobicContact CE2-CB 4.05Å; F249-L282 HydrophobicContact CE2-CD1 3.63Å; F249-L282 HydrophobicContact CE2-CG 4.39Å; F249-L282 HydrophobicContact CZ-CD1 4.06Å |
| 250 | H | 96.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -69.2 | -35.7 | -175 | -73 | 82.9 | 0 | 0 | 0 | 112.5 | Y107 Q192 F195 W196 F246 V247 P248 | Y107-H250 AromaticContact CE1-NE2 3.4Å; Y107-H250 WeakPolarHBondContact CE1-NE2 3.47Å; Y107-H250 AromaticContact CZ-NE2 3.55Å; Y107-H250 PolarHBondContact OH-NE2 3.28Å; Q192-H250 PolarHBondContact NE2-O 2.74Å; Q192-H250 PolarHBondContact OE1-O 2.91Å; F195-H250 WeakPolarHBondContact CB-CD2 3.45Å; F195-H250 HydrophobicContact CD1-CB 3.38Å; F195-H250 AromaticContact CD1-CD2 3.59Å; F195-H250 AromaticContact CD1-CG 3.28Å; F195-H250 AromaticContact CD1-ND1 3.81Å; F195-H250 AromaticContact CD2-CD2 3.89Å; F195-H250 AromaticContact CD2-CE1 3.45Å; F195-H250 VanDerWaalsContact CD2-CE1 3.45Å; F195-H250 WeakPolarHBondContact CD2-CE1 3.13Å; F195-H250 AromaticContact CD2-CG 3.8Å; F195-H250 AromaticContact CD2-ND1 3.52Å; F195-H250 AromaticContact CD2-NE2 3.71Å; F195-H250 HydrophobicContact CE1-CB 3.51Å; F195-H250 AromaticContact CE1-CG 3.66Å; F195-H250 AromaticContact CE1-ND1 3.91Å; F195-H250 AromaticContact CE2-CE1 3.92Å; F195-H250 AromaticContact CE2-ND1 3.66Å; F195-H250 HydrophobicContact CG-CB 4.01Å; F195-H250 AromaticContact CG-CD2 3.28Å; F195-H250 WeakPolarHBondContact CG-CD2 3.41Å; F195-H250 AromaticContact CG-CE1 3.69Å; F195-H250 AromaticContact CG-CG 3.35Å; F195-H250 AromaticContact CG-ND1 3.61Å; F195-H250 AromaticContact CG-NE2 3.54Å; F195-H250 HydrophobicContact CZ-CB 4.25Å; F195-H250 AromaticContact CZ-ND1 3.83Å; W196-H250 HydrophobicContact CZ2-CB 4.34Å; F246-H250 PolarHBondContact O-N 2.93Å; F246-H250 PolarHBondContact O-ND1 2.81Å; V247-H250 PolarHBondContact O-N 3.42Å; P248-H250 PolarHBondContact O-N 3.07Å |
| 251 | F | 94.7 | Very high | 90.5 | Very high | 125 Ų | 125 | 32 Ų | 32 | 55% | 0.548 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -60.7 | -48.7 | 169.9 | -87.1 | -66.4 | 0 | 0 | 0 | 112.3 | W196 V247 F249 R253 P255 | W196-F251 HydrophobicContact CH2-CD1 4.24Å; W196-F251 AromaticContact CH2-CD2 3.8Å; W196-F251 HydrophobicContact CH2-CD2 3.8Å; W196-F251 AromaticContact CH2-CE1 3.87Å; W196-F251 HydrophobicContact CH2-CE1 3.87Å; W196-F251 AromaticContact CH2-CE2 3.43Å; W196-F251 HydrophobicContact CH2-CE2 3.43Å; W196-F251 VanDerWaalsContact CH2-CE2 3.43Å; W196-F251 HydrophobicContact CH2-CG 4.19Å; W196-F251 AromaticContact CH2-CZ 3.45Å; W196-F251 HydrophobicContact CH2-CZ 3.45Å; W196-F251 VanDerWaalsContact CH2-CZ 3.45Å; W196-F251 HydrophobicContact CZ2-CD1 4.18Å; W196-F251 HydrophobicContact CZ2-CD2 4.26Å; W196-F251 HydrophobicContact CZ2-CE1 4.14Å; W196-F251 HydrophobicContact CZ2-CE2 4.26Å; W196-F251 HydrophobicContact CZ2-CG 4.24Å; W196-F251 HydrophobicContact CZ2-CZ 4.18Å; W196-F251 HydrophobicContact CZ3-CE2 4.31Å; W196-F251 HydrophobicContact CZ3-CZ 4.23Å; V247-F251 HydrophobicContact CG1-CD2 3.62Å; V247-F251 HydrophobicContact CG1-CE2 3.51Å; V247-F251 WeakPolarHBondContact O-CD2 3.38Å; V247-F251 PolarHBondContact O-N 3.33Å; F249-F251 PolarHBondContact O-N 3.19Å; F251-R253 VanDerWaalsContact C-N 3.34Å; F251-R253 PolarHBondContact O-N 2.84Å; F251-P255 WeakPolarHBondContact O-CD 3.49Å |
| 252 | V | 95.7 | Very high | 90.3 | Very high | 23 Ų | 23 | 36 Ų | 36 | 14% | 0.139 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -72.1 | -28.2 | -177.1 | 174.4 | 0 | 0 | 0 | 0 | 112.6 | P248 F249 I254 P255 Y256 L277 K278 T281 | P248-V252 WeakPolarHBondContact O-CG2 3.26Å; P248-V252 PolarHBondContact O-N 3.34Å; F249-V252 PolarHBondContact O-N 3.42Å; V252-I254 VanDerWaalsContact C-N 3.28Å; V252-I254 PolarHBondContact O-N 3.4Å; V252-P255 VanDerWaalsContact O-CD 3.25Å; V252-P255 WeakPolarHBondContact O-CD 3.42Å; V252-P255 WeakPolarHBondContact O-CG 3.48Å; V252-Y256 WeakPolarHBondContact O-CB 3.3Å; V252-Y256 PolarHBondContact O-N 3.28Å; V252-L277 HydrophobicContact CG1-CB 3.68Å; V252-L277 HydrophobicContact CG2-CB 4.39Å; V252-K278 HydrophobicContact CG1-CB 4Å; V252-T281 HydrophobicContact CG2-CG2 4.01Å |
| 253 | R | 94.1 | Very high | 89.5 | Confident | 9 Ų | 9 | 37.4 Ų | 37.4 | 3% | 0.034 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.9 | -32.6 | -176.6 | -179.1 | 59.1 | 171.2 | -145.2 | -3.5 | 113 | Y103 N188 F249 F251 T257 | Y103-R253 VanDerWaalsContact CZ-NH1 3.28Å; Y103-R253 PolarHBondContact OH-NH1 3.45Å; N188-R253 VanDerWaalsContact OD1-CZ 3.25Å; N188-R253 PolarHBondContact OD1-NE 2.78Å; N188-R253 PolarHBondContact OD1-NH2 3.31Å; F249-R253 HydrophobicContact CE1-CB 4.23Å; F249-R253 HydrophobicContact CE1-CG 4.25Å; F249-R253 HydrophobicContact CE2-CB 4.36Å; F249-R253 HydrophobicContact CZ-CB 4.06Å; F249-R253 HydrophobicContact CZ-CG 3.95Å; F249-R253 WeakPolarHBondContact O-CB 3.23Å; F249-R253 PolarHBondContact O-N 3.41Å; F251-R253 VanDerWaalsContact C-N 3.34Å; F251-R253 PolarHBondContact O-N 2.84Å; R253-T257 WeakPolarHBondContact O-CB 3.46Å; R253-T257 PolarHBondContact O-N 3.01Å; R253-T257 PolarHBondContact O-OG1 3.22Å |
| 254 | I | 90 | Very high | 88.6 | Confident | 67 Ų | 67 | 41 Ų | 41 | 34% | 0.344 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.2 | -62.9 | 179.7 | -60.4 | 171 | 0 | 0 | 0 | 111 | Q192 V252 Y256 T257 M258 | Q192-I254 HydrophobicContact CG-CD1 4.33Å; Q192-I254 HydrophobicContact CG-CG1 3.98Å; V252-I254 VanDerWaalsContact C-N 3.28Å; V252-I254 PolarHBondContact O-N 3.4Å; I254-Y256 VanDerWaalsContact C-N 3.27Å; I254-Y256 PolarHBondContact O-N 2.92Å; I254-T257 PolarHBondContact O-N 3.19Å; I254-T257 VanDerWaalsContact O-N 3.09Å; I254-M258 WeakPolarHBondContact O-CG 3.29Å; I254-M258 PolarHBondContact O-N 3.2Å; I254-M258 VanDerWaalsContact O-N 3.11Å |
| 255 | P | 90.8 | Very high | 87.9 | Confident | 36 Ų | 36 | 42.8 Ų | 42.8 | 23% | 0.234 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.1 | -32.4 | -179.7 | 25.5 | -35 | 0 | 0 | 0 | 112.5 | F251 V252 T257 M258 S259 F274 | F251-P255 WeakPolarHBondContact O-CD 3.49Å; V252-P255 VanDerWaalsContact O-CD 3.25Å; V252-P255 WeakPolarHBondContact O-CD 3.42Å; V252-P255 WeakPolarHBondContact O-CG 3.48Å; P255-T257 PolarHBondContact O-N 2.78Å; P255-M258 PolarHBondContact O-N 3.1Å; P255-S259 PolarHBondContact O-N 2.96Å; P255-F274 HydrophobicContact CB-CD1 3.95Å; P255-F274 HydrophobicContact CB-CE1 3.56Å; P255-F274 HydrophobicContact CB-CE2 4.19Å; P255-F274 HydrophobicContact CB-CG 4.45Å; P255-F274 HydrophobicContact CB-CZ 3.7Å; P255-F274 HydrophobicContact CG-CD1 4.02Å; P255-F274 HydrophobicContact CG-CE1 3.76Å; P255-F274 HydrophobicContact CG-CZ 4.38Å |
| 256 | Y | 91.1 | Very high | 87.4 | Confident | 8 Ų | 8 | 44.2 Ų | 44.2 | 3% | 0.031 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -60.8 | -45.4 | 172.8 | 177.3 | -99.8 | 0 | 0 | 0 | 112.3 | R17 V252 I254 M258 S259 Q260 F274 F275 K278 | R17-Y256 PolarHBondContact NH1-OH 3.13Å; V252-Y256 WeakPolarHBondContact O-CB 3.3Å; V252-Y256 PolarHBondContact O-N 3.28Å; I254-Y256 VanDerWaalsContact C-N 3.27Å; I254-Y256 PolarHBondContact O-N 2.92Å; Y256-M258 VanDerWaalsContact C-N 3.35Å; Y256-M258 PolarHBondContact O-N 2.97Å; Y256-S259 WeakPolarHBondContact O-CB 3.26Å; Y256-S259 PolarHBondContact O-N 2.88Å; Y256-S259 PolarHBondContact O-OG 3.1Å; Y256-Q260 HydrophobicContact CD1-CG 4.48Å; Y256-Q260 HydrophobicContact CE1-CG 4.01Å; Y256-Q260 HydrophobicContact CE2-CG 4.49Å; Y256-Q260 WeakPolarHBondContact O-CG 3.48Å; Y256-Q260 PolarHBondContact O-N 3.49Å; Y256-F274 HydrophobicContact CD2-CB 4.23Å; Y256-F274 WeakPolarHBondContact CD2-O 3.39Å; Y256-F275 HydrophobicContact CE2-CB 4Å; Y256-F275 HydrophobicContact CE2-CD2 4.1Å; Y256-K278 HydrophobicContact CD1-CB 4.38Å; Y256-K278 HydrophobicContact CD1-CD 4.38Å; Y256-K278 HydrophobicContact CD1-CG 3.93Å; Y256-K278 HydrophobicContact CD2-CB 3.94Å; Y256-K278 HydrophobicContact CD2-CG 4.37Å; Y256-K278 HydrophobicContact CE1-CD 4.34Å; Y256-K278 HydrophobicContact CE1-CG 4.38Å; Y256-K278 HydrophobicContact CE2-CB 4.46Å; Y256-K278 HydrophobicContact CG-CB 3.86Å; Y256-K278 HydrophobicContact CG-CG 3.91Å |
| 257 | T | 88.4 | Confident | 87 | Confident | 7 Ų | 7 | 48.8 Ų | 48.8 | 4% | 0.043 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 179.4 | -55.6 | 0 | 0 | 0 | 0 | 110.5 | N188 R253 I254 P255 S259 Q260 T261 | N188-T257 HydrophobicContact CB-CG2 4.12Å; R253-T257 WeakPolarHBondContact O-CB 3.46Å; R253-T257 PolarHBondContact O-N 3.01Å; R253-T257 PolarHBondContact O-OG1 3.22Å; I254-T257 PolarHBondContact O-N 3.19Å; I254-T257 VanDerWaalsContact O-N 3.09Å; P255-T257 PolarHBondContact O-N 2.78Å; T257-S259 VanDerWaalsContact C-N 3.3Å; T257-S259 PolarHBondContact O-N 2.99Å; T257-Q260 WeakPolarHBondContact O-CB 3.49Å; T257-Q260 PolarHBondContact O-N 2.98Å; T257-T261 PolarHBondContact O-N 3.18Å; T257-T261 VanDerWaalsContact O-N 3.09Å; T257-T261 PolarHBondContact O-OG1 3.32Å |
| 258 | M | 86.6 | Confident | 86.6 | Confident | 56 Ų | 56 | 49.8 Ų | 49.8 | 28% | 0.276 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -59.7 | -40 | 175.1 | -60.6 | -167.7 | 85.6 | 0 | 0 | 112.1 | I254 P255 Y256 Q260 T261 R262 F266 | I254-M258 WeakPolarHBondContact O-CG 3.29Å; I254-M258 PolarHBondContact O-N 3.2Å; I254-M258 VanDerWaalsContact O-N 3.11Å; P255-M258 PolarHBondContact O-N 3.1Å; Y256-M258 VanDerWaalsContact C-N 3.35Å; Y256-M258 PolarHBondContact O-N 2.97Å; M258-Q260 PolarHBondContact O-N 3.11Å; M258-T261 PolarHBondContact O-N 3.04Å; M258-R262 WeakPolarHBondContact O-CB 3.28Å; M258-R262 PolarHBondContact O-N 2.74Å; M258-F266 HydrophobicContact CB-CE2 4Å; M258-F266 HydrophobicContact CB-CZ 3.85Å |
| 259 | S | 85.6 | Confident | 86.2 | Confident | 2 Ų | 2 | 56.1 Ų | 56.1 | 1% | 0.014 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.6 | -19.2 | 176.1 | 83.8 | 0 | 0 | 0 | 0 | 114 | P255 Y256 T257 | P255-S259 PolarHBondContact O-N 2.96Å; Y256-S259 WeakPolarHBondContact O-CB 3.26Å; Y256-S259 PolarHBondContact O-N 2.88Å; Y256-S259 PolarHBondContact O-OG 3.1Å; T257-S259 VanDerWaalsContact C-N 3.3Å; T257-S259 PolarHBondContact O-N 2.99Å |
| 260 | Q | 81.5 | Confident | 85.9 | Confident | 41 Ų | 41 | 59.2 Ų | 59.2 | 19% | 0.192 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -91.7 | -36.3 | 176.4 | -60.7 | -138.3 | -88.6 | 0 | 0 | 112.8 | Y256 T257 M258 | Y256-Q260 HydrophobicContact CD1-CG 4.48Å; Y256-Q260 HydrophobicContact CE1-CG 4.01Å; Y256-Q260 HydrophobicContact CE2-CG 4.49Å; Y256-Q260 WeakPolarHBondContact O-CG 3.48Å; Y256-Q260 PolarHBondContact O-N 3.49Å; T257-Q260 WeakPolarHBondContact O-CB 3.49Å; T257-Q260 PolarHBondContact O-N 2.98Å; M258-Q260 PolarHBondContact O-N 3.11Å |
| 261 | T | 81.9 | Confident | 85.4 | Confident | 40 Ų | 40 | 63 Ų | 63 | 25% | 0.245 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -95.5 | -23 | -174.4 | 62.6 | 0 | 0 | 0 | 0 | 113.6 | E185 T257 M258 | E185-T261 HydrophobicContact CB-CG2 4.37Å; E185-T261 WeakPolarHBondContact OE2-CB 3.38Å; E185-T261 WeakPolarHBondContact OE2-CG2 3.25Å; E185-T261 PolarHBondContact OE2-OG1 3.08Å; T257-T261 PolarHBondContact O-N 3.18Å; T257-T261 VanDerWaalsContact O-N 3.09Å; T257-T261 PolarHBondContact O-OG1 3.32Å; M258-T261 PolarHBondContact O-N 3.04Å |
| 262 | R | 80.8 | Confident | 85.2 | Confident | 110 Ų | 110 | 59.6 Ų | 59.6 | 42% | 0.415 | 31% | 0.31 | S | S | . | . | trans | -117.2 | 66.7 | -176.2 | -54.8 | -172.3 | -170.4 | -170.2 | 1 | 111.6 | E185 M258 V264 L265 F266 | E185-R262 IonicContact OE1-NE 3.24Å; E185-R262 IonicContact OE1-NH2 2.68Å; E185-R262 PolarHBondContact OE1-NH2 3.17Å; M258-R262 WeakPolarHBondContact O-CB 3.28Å; M258-R262 PolarHBondContact O-N 2.74Å; R262-V264 PolarHBondContact O-N 3.13Å; R262-L265 HydrophobicContact CB-CD1 4.29Å; R262-L265 PolarHBondContact O-N 3.4Å; R262-F266 HydrophobicContact CB-CE2 4.49Å; R262-F266 WeakPolarHBondContact O-CD2 3.22Å | ||
| 263 | G | 66.4 | Low | 85 | Confident | 35 Ų | 35 | 63.8 Ų | 63.8 | 36% | 0.361 | 33% | 0.326 | S | S | . | . | G | 310 helix | trans | -57 | -27.2 | -169.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | L265 R271 | G263-L265 VanDerWaalsContact C-N 3.29Å; G263-L265 PolarHBondContact O-N 3.23Å; G263-R271 VanDerWaalsContact C-NH2 3.31Å; G263-R271 PolarHBondContact O-NH2 3.39Å |
| 264 | V | 70.1 | Confident | 84.9 | Confident | 148 Ų | 148 | 64.9 Ų | 64.9 | 90% | 0.897 | 33% | 0.332 | S | S | * | . | G | 310 helix | trans | -71.5 | -23.7 | -177.1 | -176 | 0 | 0 | 0 | 0 | 112.7 | R262 | R262-V264 PolarHBondContact O-N 3.13Š|
| 265 | L | 76.8 | Confident | 85 | Confident | 122 Ų | 122 | 62.2 Ų | 62.2 | 64% | 0.639 | 32% | 0.317 | S | S | * | . | G | 310 helix | trans | -91.6 | -6.9 | -172.3 | -60.4 | 179.7 | 0 | 0 | 0 | 114.7 | R262 G263 | R262-L265 HydrophobicContact CB-CD1 4.29Å; R262-L265 PolarHBondContact O-N 3.4Å; G263-L265 VanDerWaalsContact C-N 3.29Å; G263-L265 PolarHBondContact O-N 3.23Å |
| 266 | F | 81.8 | Confident | 85.2 | Confident | 33 Ų | 33 | 63.6 Ų | 63.6 | 15% | 0.145 | 32% | 0.321 | C | S | . | . | trans | -131.4 | 119 | -171.9 | -60.7 | -95.1 | 0 | 0 | 0 | 111.3 | M258 R262 L270 R271 F274 | M258-F266 HydrophobicContact CB-CE2 4Å; M258-F266 HydrophobicContact CB-CZ 3.85Å; R262-F266 HydrophobicContact CB-CE2 4.49Å; R262-F266 WeakPolarHBondContact O-CD2 3.22Å; F266-L270 HydrophobicContact CD1-CD2 3.61Å; F266-L270 HydrophobicContact CD1-CG 4.01Å; F266-L270 HydrophobicContact CE1-CD2 4.21Å; F266-R271 HydrophobicContact CB-CG 3.81Å; F266-R271 PolarHBondContact O-NE 3.37Å; F266-F274 HydrophobicContact CD1-CD2 4.28Å; F266-F274 HydrophobicContact CD1-CE2 4.04Å; F266-F274 HydrophobicContact CE1-CD2 4.27Å; F266-F274 AromaticContact CE1-CE2 3.78Å; F266-F274 HydrophobicContact CE1-CE2 3.78Å | ||
| 267 | D | 86.2 | Confident | 85.4 | Confident | 98 Ų | 98 | 66.1 Ų | 66.1 | 52% | 0.524 | 33% | 0.334 | S | S | . | . | trans | -69.3 | 173.2 | 171.1 | 77.8 | 11.1 | 0 | 0 | 0 | 112 | K269 L270 R271 | D267-K269 PolarHBondContact OD1-N 3.02Å; D267-K269 VanDerWaalsContact OD1-N 3.12Å; D267-L270 WeakPolarHBondContact OD1-CB 3.36Å; D267-L270 PolarHBondContact OD1-N 2.84Å; D267-R271 VanDerWaalsContact O-CG 3.24Å; D267-R271 WeakPolarHBondContact O-CG 3.47Å; D267-R271 PolarHBondContact O-N 2.85Å; D267-R271 VanDerWaalsContact O-N 3.13Å | ||
| 268 | C | 86.6 | Confident | 85.7 | Confident | 44 Ų | 44 | 66.4 Ų | 66.4 | 30% | 0.297 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -65 | -41.4 | -178.1 | 178.9 | 0 | 0 | 0 | 0 | 112.9 | C15 L270 R271 L272 | C15-C268 WeakPolarHBondContact CA-SG 3.47Å; C15-C268 HydrophobicContact CB-CB 3.88Å; C15-C268 WeakPolarHBondContact CB-SG 3.49Å; C15-C268 WeakPolarHBondContact SG-CA 3.16Å; C15-C268 WeakPolarHBondContact SG-CB 3.31Å; C15-C268 CovalentContact SG-SG 2.05Å; C15-C268 PolarHBondContact SG-SG 3.47Å; C268-L270 VanDerWaalsContact C-N 3.33Å; C268-L270 PolarHBondContact O-N 3.44Å; C268-R271 PolarHBondContact O-N 3.29Å; C268-L272 WeakPolarHBondContact O-CG 3.46Å; C268-L272 PolarHBondContact O-N 3.06Å |
| 269 | K | 88.3 | Confident | 86.2 | Confident | 175 Ų | 175 | 64.1 Ų | 64.1 | 76% | 0.761 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -60.4 | -45.7 | -177.9 | -71.3 | -178.2 | 179.5 | 177.4 | 0 | 110.7 | D267 L272 F273 | D267-K269 PolarHBondContact OD1-N 3.02Å; D267-K269 VanDerWaalsContact OD1-N 3.12Å; K269-L272 PolarHBondContact O-N 3.21Å; K269-F273 WeakPolarHBondContact O-CB 3.5Å; K269-F273 PolarHBondContact O-N 3.45Å |
| 270 | L | 89.3 | Confident | 86.7 | Confident | 65 Ų | 65 | 66.3 Ų | 66.3 | 34% | 0.34 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -68.6 | -38 | -179.4 | -169.5 | 58.9 | 0 | 0 | 0 | 112 | F266 D267 C268 L272 F273 F274 | F266-L270 HydrophobicContact CD1-CD2 3.61Å; F266-L270 HydrophobicContact CD1-CG 4.01Å; F266-L270 HydrophobicContact CE1-CD2 4.21Å; D267-L270 WeakPolarHBondContact OD1-CB 3.36Å; D267-L270 PolarHBondContact OD1-N 2.84Å; C268-L270 VanDerWaalsContact C-N 3.33Å; C268-L270 PolarHBondContact O-N 3.44Å; L270-L272 VanDerWaalsContact C-N 3.34Å; L270-L272 PolarHBondContact O-N 3.02Å; L270-F273 HydrophobicContact CD1-CD1 4.32Å; L270-F273 PolarHBondContact O-N 3.26Å; L270-F274 HydrophobicContact CD1-CD2 4.05Å; L270-F274 HydrophobicContact CD1-CE2 3.47Å; L270-F274 VanDerWaalsContact CD1-CE2 3.47Å; L270-F274 HydrophobicContact CD1-CZ 3.94Å; L270-F274 HydrophobicContact CD2-CE2 4.05Å; L270-F274 HydrophobicContact CG-CD2 3.89Å; L270-F274 HydrophobicContact CG-CE2 3.5Å; L270-F274 HydrophobicContact CG-CZ 4.42Å; L270-F274 VanDerWaalsContact O-CD2 3.26Å; L270-F274 WeakPolarHBondContact O-CD2 3.27Å; L270-F274 PolarHBondContact O-N 2.97Å |
| 271 | R | 87.3 | Confident | 87.5 | Confident | 78 Ų | 78 | 65.1 Ų | 65.1 | 29% | 0.294 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.7 | -39.1 | 172.8 | -72.2 | 172.2 | -174.3 | -140.4 | 22.3 | 112.6 | G263 F266 D267 C268 F275 | G263-R271 VanDerWaalsContact C-NH2 3.31Å; G263-R271 PolarHBondContact O-NH2 3.39Å; F266-R271 HydrophobicContact CB-CG 3.81Å; F266-R271 PolarHBondContact O-NE 3.37Å; D267-R271 VanDerWaalsContact O-CG 3.24Å; D267-R271 WeakPolarHBondContact O-CG 3.47Å; D267-R271 PolarHBondContact O-N 2.85Å; D267-R271 VanDerWaalsContact O-N 3.13Å; C268-R271 PolarHBondContact O-N 3.29Å; R271-F275 VanDerWaalsContact O-CB 3.28Å; R271-F275 WeakPolarHBondContact O-CB 3.14Å; R271-F275 PolarHBondContact O-N 2.74Å |
| 272 | L | 89.9 | Confident | 88.2 | Confident | 54 Ų | 54 | 63.4 Ų | 63.4 | 28% | 0.283 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -69.8 | -41.3 | 176.6 | -69.5 | 174.2 | 0 | 0 | 0 | 111.4 | S16 R17 C268 K269 L270 F275 Q276 | S16-L272 WeakPolarHBondContact O-CD2 3.5Å; R17-L272 HydrophobicContact CG-CD2 3.94Å; C268-L272 WeakPolarHBondContact O-CG 3.46Å; C268-L272 PolarHBondContact O-N 3.06Å; K269-L272 PolarHBondContact O-N 3.21Å; L270-L272 VanDerWaalsContact C-N 3.34Å; L270-L272 PolarHBondContact O-N 3.02Å; L272-F275 WeakPolarHBondContact O-CB 3.32Å; L272-F275 PolarHBondContact O-N 2.76Å; L272-Q276 PolarHBondContact O-N 2.94Å |
| 273 | F | 91.4 | Very high | 89 | Confident | 111 Ų | 111 | 59.9 Ų | 59.9 | 49% | 0.487 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.2 | -52.4 | 174.6 | 176.6 | -105.3 | 0 | 0 | 0 | 112.1 | K269 L270 F275 Q276 L277 | K269-F273 WeakPolarHBondContact O-CB 3.5Å; K269-F273 PolarHBondContact O-N 3.45Å; L270-F273 HydrophobicContact CD1-CD1 4.32Å; L270-F273 PolarHBondContact O-N 3.26Å; F273-F275 VanDerWaalsContact C-N 3.28Å; F273-F275 PolarHBondContact O-N 2.76Å; F273-Q276 PolarHBondContact O-N 3.16Å; F273-L277 HydrophobicContact CD1-CD1 3.93Å; F273-L277 HydrophobicContact CE1-CD1 3.3Å; F273-L277 HydrophobicContact CE1-CG 4.23Å; F273-L277 HydrophobicContact CE2-CD1 4Å; F273-L277 HydrophobicContact CE2-CG 4.18Å; F273-L277 HydrophobicContact CZ-CD1 3.36Å; F273-L277 HydrophobicContact CZ-CG 4.04Å; F273-L277 PolarHBondContact O-N 3.39Å |
| 274 | F | 92.7 | Very high | 90.4 | Very high | 32 Ų | 32 | 60.7 Ų | 60.7 | 14% | 0.14 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.2 | -32.4 | 177.4 | -73.2 | -51.9 | 0 | 0 | 0 | 112.8 | P255 Y256 F266 L270 K278 | P255-F274 HydrophobicContact CB-CD1 3.95Å; P255-F274 HydrophobicContact CB-CE1 3.56Å; P255-F274 HydrophobicContact CB-CE2 4.19Å; P255-F274 HydrophobicContact CB-CG 4.45Å; P255-F274 HydrophobicContact CB-CZ 3.7Å; P255-F274 HydrophobicContact CG-CD1 4.02Å; P255-F274 HydrophobicContact CG-CE1 3.76Å; P255-F274 HydrophobicContact CG-CZ 4.38Å; Y256-F274 HydrophobicContact CD2-CB 4.23Å; Y256-F274 WeakPolarHBondContact CD2-O 3.39Å; F266-F274 HydrophobicContact CD1-CD2 4.28Å; F266-F274 HydrophobicContact CD1-CE2 4.04Å; F266-F274 HydrophobicContact CE1-CD2 4.27Å; F266-F274 AromaticContact CE1-CE2 3.78Å; F266-F274 HydrophobicContact CE1-CE2 3.78Å; L270-F274 HydrophobicContact CD1-CD2 4.05Å; L270-F274 HydrophobicContact CD1-CE2 3.47Å; L270-F274 VanDerWaalsContact CD1-CE2 3.47Å; L270-F274 HydrophobicContact CD1-CZ 3.94Å; L270-F274 HydrophobicContact CD2-CE2 4.05Å; L270-F274 HydrophobicContact CG-CD2 3.89Å; L270-F274 HydrophobicContact CG-CE2 3.5Å; L270-F274 HydrophobicContact CG-CZ 4.42Å; L270-F274 VanDerWaalsContact O-CD2 3.26Å; L270-F274 WeakPolarHBondContact O-CD2 3.27Å; L270-F274 PolarHBondContact O-N 2.97Å; F274-K278 WeakPolarHBondContact O-CB 3.46Å; F274-K278 PolarHBondContact O-N 3.25Å |
| 275 | F | 92.1 | Very high | 91.7 | Very high | 11 Ų | 11 | 53.8 Ų | 53.8 | 5% | 0.048 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.2 | -50.6 | 172.5 | 170.2 | -105.3 | 0 | 0 | 0 | 111.6 | R17 K22 Y256 R271 L272 F273 K278 E279 | R17-F275 HydrophobicContact CB-CD1 4.06Å; R17-F275 HydrophobicContact CB-CE1 3.77Å; R17-F275 HydrophobicContact CB-CZ 4.11Å; R17-F275 HydrophobicContact CG-CD1 3.95Å; R17-F275 HydrophobicContact CG-CD2 4.46Å; R17-F275 HydrophobicContact CG-CE1 4.14Å; R17-F275 HydrophobicContact CG-CG 4.12Å; R17-F275 HydrophobicContact CG-CZ 4.48Å; K22-F275 HydrophobicContact CB-CE1 4.42Å; K22-F275 HydrophobicContact CD-CE1 4.27Å; K22-F275 HydrophobicContact CD-CZ 3.94Å; K22-F275 HydrophobicContact CG-CE1 4.49Å; K22-F275 HydrophobicContact CG-CZ 4.18Å; Y256-F275 HydrophobicContact CE2-CB 4Å; Y256-F275 HydrophobicContact CE2-CD2 4.1Å; R271-F275 VanDerWaalsContact O-CB 3.28Å; R271-F275 WeakPolarHBondContact O-CB 3.14Å; R271-F275 PolarHBondContact O-N 2.74Å; L272-F275 WeakPolarHBondContact O-CB 3.32Å; L272-F275 PolarHBondContact O-N 2.76Å; F273-F275 VanDerWaalsContact C-N 3.28Å; F273-F275 PolarHBondContact O-N 2.76Å; F275-K278 PolarHBondContact O-N 3.46Å; F275-E279 HydrophobicContact CD2-CG 4.13Å; F275-E279 HydrophobicContact CE1-CG 4.3Å; F275-E279 HydrophobicContact CE2-CG 3.59Å; F275-E279 HydrophobicContact CZ-CG 3.69Å; F275-E279 PolarHBondContact O-N 2.86Å |
| 276 | Q | 94.1 | Very high | 92.6 | Very high | 65 Ų | 65 | 48 Ų | 48 | 30% | 0.304 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.4 | -48.7 | 179.8 | -171.2 | 116.5 | -4.5 | 0 | 0 | 111.2 | N19 F21 L272 F273 K278 E279 S280 | N19-Q276 PolarHBondContact ND2-OE1 3.06Å; F21-Q276 HydrophobicContact CD1-CG 3.87Å; F21-Q276 VanDerWaalsContact CD1-NE2 3.26Å; F21-Q276 HydrophobicContact CE1-CG 3.84Å; F21-Q276 HydrophobicContact CZ-CG 4.5Å; L272-Q276 PolarHBondContact O-N 2.94Å; F273-Q276 PolarHBondContact O-N 3.16Å; Q276-K278 VanDerWaalsContact C-N 3.3Å; Q276-K278 PolarHBondContact O-N 2.78Å; Q276-E279 PolarHBondContact O-N 3.37Å; Q276-S280 PolarHBondContact O-N 2.93Å; Q276-S280 PolarHBondContact O-OG 2.92Å; Q276-S280 VanDerWaalsContact O-OG 3.06Å |
| 277 | L | 95.5 | Very high | 93.2 | Very high | 61 Ų | 61 | 48.8 Ų | 48.8 | 32% | 0.319 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -58.2 | -42.9 | 175.9 | -75 | -176.7 | 0 | 0 | 0 | 111.9 | V252 F273 S280 T281 | V252-L277 HydrophobicContact CG1-CB 3.68Å; V252-L277 HydrophobicContact CG2-CB 4.39Å; F273-L277 HydrophobicContact CD1-CD1 3.93Å; F273-L277 HydrophobicContact CE1-CD1 3.3Å; F273-L277 HydrophobicContact CE1-CG 4.23Å; F273-L277 HydrophobicContact CE2-CD1 4Å; F273-L277 HydrophobicContact CE2-CG 4.18Å; F273-L277 HydrophobicContact CZ-CD1 3.36Å; F273-L277 HydrophobicContact CZ-CG 4.04Å; F273-L277 PolarHBondContact O-N 3.39Å; L277-S280 PolarHBondContact O-N 3.36Å; L277-T281 WeakPolarHBondContact O-CB 3.02Å; L277-T281 WeakPolarHBondContact O-CG2 3.25Å; L277-T281 PolarHBondContact O-N 2.77Å; L277-T281 PolarHBondContact O-OG1 3.26Å |
| 278 | K | 95.5 | Very high | 93.5 | Very high | 13 Ų | 13 | 44.3 Ų | 44.3 | 6% | 0.057 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.5 | -45.4 | 179.2 | -175.8 | -90.3 | -81.1 | -178.2 | 0 | 110.7 | F249 V252 Y256 F274 F275 Q276 T281 L282 | F249-K278 HydrophobicContact CE2-CD 4.29Å; F249-K278 HydrophobicContact CE2-CG 4.11Å; V252-K278 HydrophobicContact CG1-CB 4Å; Y256-K278 HydrophobicContact CD1-CB 4.38Å; Y256-K278 HydrophobicContact CD1-CD 4.38Å; Y256-K278 HydrophobicContact CD1-CG 3.93Å; Y256-K278 HydrophobicContact CD2-CB 3.94Å; Y256-K278 HydrophobicContact CD2-CG 4.37Å; Y256-K278 HydrophobicContact CE1-CD 4.34Å; Y256-K278 HydrophobicContact CE1-CG 4.38Å; Y256-K278 HydrophobicContact CE2-CB 4.46Å; Y256-K278 HydrophobicContact CG-CB 3.86Å; Y256-K278 HydrophobicContact CG-CG 3.91Å; F274-K278 WeakPolarHBondContact O-CB 3.46Å; F274-K278 PolarHBondContact O-N 3.25Å; F275-K278 PolarHBondContact O-N 3.46Å; Q276-K278 VanDerWaalsContact C-N 3.3Å; Q276-K278 PolarHBondContact O-N 2.78Å; K278-T281 PolarHBondContact O-OG1 2.93Å; K278-L282 HydrophobicContact CD-CD2 4.29Å; K278-L282 WeakPolarHBondContact O-CB 3.44Å; K278-L282 PolarHBondContact O-N 3.22Å |
| 279 | E | 96.4 | Very high | 93.7 | Very high | 8 Ų | 8 | 42.2 Ų | 42.2 | 4% | 0.037 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -66.3 | -41 | 179.4 | -71.5 | -57.6 | 133.8 | 0 | 0 | 112.1 | F21 L26 K78 F275 Q276 L282 F283 | F21-E279 HydrophobicContact CE1-CB 3.98Å; L26-E279 HydrophobicContact CD1-CB 3.66Å; L26-E279 HydrophobicContact CD1-CG 3.98Å; K78-E279 IonicContact NZ-OE2 3.94Å; K78-E279 PolarHBondContact NZ-OE2 2.96Å; F275-E279 HydrophobicContact CD2-CG 4.13Å; F275-E279 HydrophobicContact CE1-CG 4.3Å; F275-E279 HydrophobicContact CE2-CG 3.59Å; F275-E279 HydrophobicContact CZ-CG 3.69Å; F275-E279 PolarHBondContact O-N 2.86Å; Q276-E279 PolarHBondContact O-N 3.37Å; E279-L282 PolarHBondContact O-N 2.97Å; E279-F283 WeakPolarHBondContact O-CB 3.42Å; E279-F283 PolarHBondContact O-N 3.47Å |
| 280 | S | 96.7 | Very high | 93.8 | Very high | 48 Ų | 48 | 34.5 Ų | 34.5 | 34% | 0.336 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -60.6 | -48.7 | 175.8 | -61.4 | 0 | 0 | 0 | 0 | 112.1 | F21 Q276 L277 F283 L284 | F21-S280 WeakPolarHBondContact CZ-OG 3.4Å; Q276-S280 PolarHBondContact O-N 2.93Å; Q276-S280 PolarHBondContact O-OG 2.92Å; Q276-S280 VanDerWaalsContact O-OG 3.06Å; L277-S280 PolarHBondContact O-N 3.36Å; S280-F283 WeakPolarHBondContact O-CB 3.44Å; S280-F283 PolarHBondContact O-N 3.48Å; S280-L284 PolarHBondContact O-N 3.48Å |
| 281 | T | 97.5 | Very high | 93.8 | Very high | 17 Ų | 17 | 33.9 Ų | 33.9 | 10% | 0.104 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -72.6 | -29.9 | 180 | 54.1 | 0 | 0 | 0 | 0 | 112.5 | P248 V252 L277 K278 L284 S285 | P248-T281 HydrophobicContact CB-CG2 3.75Å; V252-T281 HydrophobicContact CG2-CG2 4.01Å; L277-T281 WeakPolarHBondContact O-CB 3.02Å; L277-T281 WeakPolarHBondContact O-CG2 3.25Å; L277-T281 PolarHBondContact O-N 2.77Å; L277-T281 PolarHBondContact O-OG1 3.26Å; K278-T281 PolarHBondContact O-OG1 2.93Å; T281-L284 WeakPolarHBondContact O-CB 3.34Å; T281-L284 PolarHBondContact O-N 3.29Å; T281-S285 PolarHBondContact O-N 3.36Å |
| 282 | L | 97.4 | Very high | 93.8 | Very high | 4 Ų | 4 | 30.1 Ų | 30.1 | 2% | 0.021 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -66 | -40.6 | 171.8 | -177.1 | 64.3 | 0 | 0 | 0 | 111.7 | F102 Y103 F249 K278 E279 S285 S286 | F102-L282 HydrophobicContact CD1-CD1 4.41Å; F102-L282 HydrophobicContact CE1-CD1 3.37Å; F102-L282 HydrophobicContact CE1-CG 4.16Å; F102-L282 HydrophobicContact CZ-CD1 3.69Å; F102-L282 HydrophobicContact CZ-CG 4.09Å; Y103-L282 HydrophobicContact CE1-CD1 3.67Å; Y103-L282 WeakPolarHBondContact OH-CD2 3.28Å; F249-L282 HydrophobicContact CD2-CB 3.93Å; F249-L282 HydrophobicContact CD2-CD1 3.98Å; F249-L282 HydrophobicContact CE2-CB 4.05Å; F249-L282 HydrophobicContact CE2-CD1 3.63Å; F249-L282 HydrophobicContact CE2-CG 4.39Å; F249-L282 HydrophobicContact CZ-CD1 4.06Å; K278-L282 HydrophobicContact CD-CD2 4.29Å; K278-L282 WeakPolarHBondContact O-CB 3.44Å; K278-L282 PolarHBondContact O-N 3.22Å; E279-L282 PolarHBondContact O-N 2.97Å; L282-S285 WeakPolarHBondContact O-CB 3.49Å; L282-S285 PolarHBondContact O-N 3.01Å; L282-S286 PolarHBondContact O-N 3.5Å; L282-S286 PolarHBondContact O-OG 2.67Å |
| 283 | F | 97.3 | Very high | 93.5 | Very high | 36 Ų | 36 | 28 Ų | 28 | 16% | 0.158 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.4 | -46 | 171.4 | 171.6 | -99.4 | 0 | 0 | 0 | 111.1 | L26 L29 Y30 L33 E279 S280 S285 S286 L287 | L26-F283 HydrophobicContact CD2-CB 4.37Å; L29-F283 HydrophobicContact CB-CD2 4Å; L29-F283 HydrophobicContact CB-CE2 3.44Å; L29-F283 VanDerWaalsContact CB-CE2 3.44Å; L29-F283 HydrophobicContact CB-CZ 3.77Å; L29-F283 HydrophobicContact CD1-CD1 4.26Å; L29-F283 HydrophobicContact CD1-CD2 4.47Å; L29-F283 HydrophobicContact CD1-CE1 4.03Å; L29-F283 HydrophobicContact CD1-CE2 4.26Å; L29-F283 HydrophobicContact CD1-CG 4.48Å; L29-F283 HydrophobicContact CD1-CZ 4.03Å; L29-F283 HydrophobicContact CD2-CZ 4.02Å; L29-F283 HydrophobicContact CG-CE2 4.3Å; L29-F283 HydrophobicContact CG-CZ 4.17Å; Y30-F283 HydrophobicContact CD2-CD2 4.19Å; Y30-F283 HydrophobicContact CE2-CB 4.19Å; Y30-F283 AromaticContact CE2-CD2 3.91Å; Y30-F283 HydrophobicContact CE2-CD2 3.91Å; Y30-F283 WeakPolarHBondContact OH-CA 3.4Å; Y30-F283 PolarHBondContact OH-N 3.36Å; L33-F283 HydrophobicContact CD1-CD2 3.73Å; L33-F283 HydrophobicContact CD1-CE2 3.3Å; L33-F283 HydrophobicContact CD1-CZ 4.21Å; L33-F283 HydrophobicContact CD2-CE2 4.46Å; L33-F283 HydrophobicContact CG-CE2 3.76Å; L33-F283 HydrophobicContact CG-CZ 4.39Å; E279-F283 WeakPolarHBondContact O-CB 3.42Å; E279-F283 PolarHBondContact O-N 3.47Å; S280-F283 WeakPolarHBondContact O-CB 3.44Å; S280-F283 PolarHBondContact O-N 3.48Å; F283-S285 VanDerWaalsContact C-N 3.29Å; F283-S285 PolarHBondContact O-N 2.83Å; F283-S286 WeakPolarHBondContact O-CA 3.17Å; F283-S286 VanDerWaalsContact O-CB 3.32Å; F283-S286 WeakPolarHBondContact O-CB 3.42Å; F283-S286 PolarHBondContact O-N 3.17Å; F283-L287 HydrophobicContact CE1-CD1 4.37Å; F283-L287 PolarHBondContact O-N 3.21Å |
| 284 | L | 96.7 | Very high | 92.8 | Very high | 52 Ų | 52 | 26.5 Ų | 26.5 | 27% | 0.272 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -58.3 | -39.8 | 175.6 | -174.6 | 58.6 | 0 | 0 | 0 | 112.5 | V244 C245 P248 S280 T281 S286 L287 | V244-L284 HydrophobicContact CG1-CD1 4.22Å; V244-L284 VanDerWaalsContact O-CD2 3.26Å; V244-L284 WeakPolarHBondContact O-CD2 3.44Å; V244-L284 WeakPolarHBondContact O-CG 3.5Å; C245-L284 PolarHBondContact SG-O 3.09Å; C245-L284 VanDerWaalsContact SG-O 3.34Å; P248-L284 HydrophobicContact CB-CD2 4.36Å; P248-L284 HydrophobicContact CG-CD2 4.03Å; S280-L284 PolarHBondContact O-N 3.48Å; T281-L284 WeakPolarHBondContact O-CB 3.34Å; T281-L284 PolarHBondContact O-N 3.29Å; L284-S286 VanDerWaalsContact C-N 3.35Å; L284-L287 HydrophobicContact CD1-CD1 3.82Å; L284-L287 WeakPolarHBondContact O-CB 3.38Å; L284-L287 PolarHBondContact O-N 3.49Å |
| 285 | S | 96.4 | Very high | 92 | Very high | 2 Ų | 2 | 25.5 Ų | 25.5 | 1% | 0.014 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -64.3 | -37.9 | 173.2 | -175.7 | 0 | 0 | 0 | 0 | 112.5 | M106 C245 F246 T281 L282 F283 L287 N288 | M106-S285 PolarHBondContact SD-OG 3.43Å; M106-S285 VanDerWaalsContact SD-OG 3.34Å; C245-S285 WeakPolarHBondContact O-CA 3.49Å; C245-S285 WeakPolarHBondContact O-CB 3.49Å; C245-S285 PolarHBondContact O-N 2.71Å; F246-S285 VanDerWaalsContact CD1-OG 3.23Å; F246-S285 WeakPolarHBondContact CD1-OG 3.47Å; F246-S285 WeakPolarHBondContact CE1-OG 3.41Å; T281-S285 PolarHBondContact O-N 3.36Å; L282-S285 WeakPolarHBondContact O-CB 3.49Å; L282-S285 PolarHBondContact O-N 3.01Å; F283-S285 VanDerWaalsContact C-N 3.29Å; F283-S285 PolarHBondContact O-N 2.83Å; S285-L287 VanDerWaalsContact C-N 3.25Å; S285-L287 PolarHBondContact O-N 3.29Å; S285-N288 VanDerWaalsContact O-CB 3.28Å; S285-N288 WeakPolarHBondContact O-CB 3.33Å; S285-N288 PolarHBondContact O-N 3.19Å; S285-N288 VanDerWaalsContact O-N 3.17Å |
| 286 | S | 95.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -66.5 | -24.1 | -179.7 | -53.1 | 0 | 0 | 0 | 0 | 113.5 | Y30 F102 L282 F283 L284 N288 A289 | Y30-S286 WeakPolarHBondContact CE1-OG 3.4Å; Y30-S286 PolarHBondContact OH-OG 3.07Å; F102-S286 WeakPolarHBondContact CE2-OG 3.38Å; F102-S286 WeakPolarHBondContact CZ-OG 3.46Å; L282-S286 PolarHBondContact O-N 3.5Å; L282-S286 PolarHBondContact O-OG 2.67Å; F283-S286 WeakPolarHBondContact O-CA 3.17Å; F283-S286 VanDerWaalsContact O-CB 3.32Å; F283-S286 WeakPolarHBondContact O-CB 3.42Å; F283-S286 PolarHBondContact O-N 3.17Å; L284-S286 VanDerWaalsContact C-N 3.35Å; S286-N288 PolarHBondContact O-N 3.09Å; S286-N288 VanDerWaalsContact O-N 3.16Å; S286-A289 PolarHBondContact O-N 2.98Å |
| 287 | L | 94.7 | Very high | 90.5 | Very high | 50 Ų | 50 | 25.4 Ų | 25.4 | 26% | 0.262 | 13% | 0.134 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -26.9 | 174 | -76.4 | 161.7 | 0 | 0 | 0 | 112.2 | L33 F283 L284 S285 A289 V290 L291 | L33-L287 HydrophobicContact CD2-CD2 3.58Å; L33-L287 HydrophobicContact CD2-CG 4.27Å; F283-L287 HydrophobicContact CE1-CD1 4.37Å; F283-L287 PolarHBondContact O-N 3.21Å; L284-L287 HydrophobicContact CD1-CD1 3.82Å; L284-L287 WeakPolarHBondContact O-CB 3.38Å; L284-L287 PolarHBondContact O-N 3.49Å; S285-L287 VanDerWaalsContact C-N 3.25Å; S285-L287 PolarHBondContact O-N 3.29Å; L287-A289 PolarHBondContact O-N 3.28Å; L287-V290 PolarHBondContact O-N 3.3Å; L287-L291 HydrophobicContact CB-CD1 4.19Å; L287-L291 WeakPolarHBondContact O-CG 3.21Å; L287-L291 PolarHBondContact O-N 2.75Å |
| 288 | N | 91.5 | Very high | 89.4 | Confident | 4 Ų | 4 | 26.7 Ų | 26.7 | 2% | 0.021 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -54.2 | -40.7 | 178.6 | -172.7 | 85.5 | 0 | 0 | 0 | 112.2 | C245 F246 S285 S286 V290 L291 D292 | C245-N288 HydrophobicContact CB-CB 4.34Å; F246-N288 HydrophobicContact CE1-CB 4.24Å; F246-N288 HydrophobicContact CE2-CB 4.02Å; F246-N288 VanDerWaalsContact CE2-OD1 3.3Å; F246-N288 WeakPolarHBondContact CE2-OD1 3.44Å; F246-N288 HydrophobicContact CZ-CB 3.56Å; S285-N288 VanDerWaalsContact O-CB 3.28Å; S285-N288 WeakPolarHBondContact O-CB 3.33Å; S285-N288 PolarHBondContact O-N 3.19Å; S285-N288 VanDerWaalsContact O-N 3.17Å; S286-N288 PolarHBondContact O-N 3.09Å; S286-N288 VanDerWaalsContact O-N 3.16Å; N288-V290 PolarHBondContact O-N 3.47Å; N288-L291 PolarHBondContact O-N 3.24Å; N288-L291 VanDerWaalsContact O-N 3.1Å; N288-D292 VanDerWaalsContact ND2-CG 3.25Å; N288-D292 PolarHBondContact ND2-OD1 2.88Å; N288-D292 PolarHBondContact ND2-OD2 2.91Å; N288-D292 WeakPolarHBondContact O-CB 3.44Å; N288-D292 PolarHBondContact O-N 3.11Å; N288-D292 PolarHBondContact OD1-OD1 3.22Å |
| 289 | A | 91.2 | Very high | 88.2 | Confident | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.8 | -18.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | N41 D68 M71 F75 S286 L287 | N41-A289 PolarHBondContact ND2-O 3.28Å; D68-A289 HydrophobicContact CB-CB 4.24Å; M71-A289 HydrophobicContact SD-CB 3.89Å; F75-A289 HydrophobicContact CZ-CB 4.49Å; S286-A289 PolarHBondContact O-N 2.98Å; L287-A289 PolarHBondContact O-N 3.28Å |
| 290 | V | 90.6 | Very high | 87 | Confident | 14 Ų | 14 | 27.4 Ų | 27.4 | 9% | 0.085 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -101.7 | -30.9 | 177.9 | -170.4 | 0 | 0 | 0 | 0 | 111.3 | L33 V36 L40 L287 N288 P293 | L33-V290 HydrophobicContact CD2-CG2 3.8Å; V36-V290 HydrophobicContact CB-CG1 4.1Å; V36-V290 HydrophobicContact CG1-CG1 3.44Å; V36-V290 VanDerWaalsContact CG1-CG1 3.44Å; L40-V290 HydrophobicContact CD1-CG1 3.66Å; L40-V290 WeakPolarHBondContact CD1-O 3.46Å; L287-V290 PolarHBondContact O-N 3.3Å; N288-V290 PolarHBondContact O-N 3.47Å; V290-P293 WeakPolarHBondContact O-CD 3.41Å |
| 291 | L | 88.6 | Confident | 86.1 | Confident | 51 Ų | 51 | 34.4 Ų | 34.4 | 27% | 0.267 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -76.7 | -26.1 | 179.2 | -63.9 | 174.7 | 0 | 0 | 0 | 112.6 | V241 L287 N288 L294 I295 | V241-L291 HydrophobicContact CG1-CB 3.97Å; V241-L291 HydrophobicContact CG1-CD1 3.52Å; V241-L291 HydrophobicContact CG1-CG 4.37Å; V241-L291 HydrophobicContact CG2-CD1 4.45Å; L287-L291 HydrophobicContact CB-CD1 4.19Å; L287-L291 WeakPolarHBondContact O-CG 3.21Å; L287-L291 PolarHBondContact O-N 2.75Å; N288-L291 PolarHBondContact O-N 3.24Å; N288-L291 VanDerWaalsContact O-N 3.1Å; L291-L294 HydrophobicContact CD2-CD1 4.2Å; L291-L294 WeakPolarHBondContact O-CB 3.35Å; L291-L294 PolarHBondContact O-N 3.4Å; L291-L294 VanDerWaalsContact O-N 3.08Å; L291-I295 WeakPolarHBondContact O-CG1 3.37Å; L291-I295 PolarHBondContact O-N 3.1Å |
| 292 | D | 87.6 | Confident | 84.8 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.5 | -46.2 | -179.1 | -79.6 | 5.5 | 0 | 0 | 0 | 113.6 | I64 D68 F113 N288 L294 I295 Y296 | I64-D292 WeakPolarHBondContact CG2-OD2 3.46Å; D68-D292 WeakPolarHBondContact OD2-CB 3.5Å; F113-D292 WeakPolarHBondContact CE2-OD2 3.21Å; F113-D292 WeakPolarHBondContact CZ-OD1 3.25Å; N288-D292 VanDerWaalsContact ND2-CG 3.25Å; N288-D292 PolarHBondContact ND2-OD1 2.88Å; N288-D292 PolarHBondContact ND2-OD2 2.91Å; N288-D292 WeakPolarHBondContact O-CB 3.44Å; N288-D292 PolarHBondContact O-N 3.11Å; N288-D292 PolarHBondContact OD1-OD1 3.22Å; D292-L294 VanDerWaalsContact C-N 3.28Å; D292-L294 PolarHBondContact O-N 2.97Å; D292-I295 CarbonylContact O-C 3.57Å; D292-I295 WeakPolarHBondContact O-CA 3.49Å; D292-I295 VanDerWaalsContact O-CB 3.29Å; D292-I295 WeakPolarHBondContact O-CB 3.19Å; D292-I295 PolarHBondContact O-N 3.2Å; D292-I295 VanDerWaalsContact O-N 3.1Å; D292-Y296 HydrophobicContact CB-CE1 4.18Å; D292-Y296 HydrophobicContact CB-CE2 4.22Å; D292-Y296 WeakPolarHBondContact CB-OH 3.46Å; D292-Y296 WeakPolarHBondContact O-CD1 3.35Å; D292-Y296 VanDerWaalsContact O-CD2 3.28Å; D292-Y296 WeakPolarHBondContact O-CD2 3.48Å; D292-Y296 WeakPolarHBondContact O-CE1 3.46Å; D292-Y296 WeakPolarHBondContact O-CE2 3.28Å; D292-Y296 PolarHBondContact O-N 3.47Å |
| 293 | P | 84.2 | Confident | 83.7 | Confident | 9 Ų | 9 | 36.7 Ų | 36.7 | 6% | 0.058 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -52.9 | -38.9 | 168.6 | -31.5 | 37.4 | 0 | 0 | 0 | 115.1 | L40 N41 V290 Y296 F297 | L40-P293 HydrophobicContact CB-CB 3.85Å; L40-P293 HydrophobicContact CB-CG 3.84Å; L40-P293 HydrophobicContact CD1-CB 4.47Å; N41-P293 WeakPolarHBondContact OD1-CG 3.11Å; V290-P293 WeakPolarHBondContact O-CD 3.41Å; P293-Y296 VanDerWaalsContact CA-CD2 3.45Å; P293-Y296 HydrophobicContact CB-CD2 4.49Å; P293-Y296 HydrophobicContact CG-CE2 4.44Å; P293-Y296 PolarHBondContact O-N 2.96Å; P293-F297 PolarHBondContact O-N 3.08Å; P293-F297 VanDerWaalsContact O-N 3.1Å |
| 294 | L | 76.5 | Confident | 83 | Confident | 79 Ų | 79 | 39.5 Ų | 39.5 | 41% | 0.414 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -69 | -42.8 | 176.3 | -58.1 | 178 | 0 | 0 | 0 | 110.5 | L291 D292 Y296 F297 F298 | L291-L294 HydrophobicContact CD2-CD1 4.2Å; L291-L294 WeakPolarHBondContact O-CB 3.35Å; L291-L294 PolarHBondContact O-N 3.4Å; L291-L294 VanDerWaalsContact O-N 3.08Å; D292-L294 VanDerWaalsContact C-N 3.28Å; D292-L294 PolarHBondContact O-N 2.97Å; L294-Y296 VanDerWaalsContact C-N 3.26Å; L294-Y296 PolarHBondContact O-N 2.68Å; L294-F297 WeakPolarHBondContact O-CB 3.49Å; L294-F297 PolarHBondContact O-N 3.01Å; L294-F297 VanDerWaalsContact O-N 3.14Å; L294-F298 HydrophobicContact CB-CE2 4.46Å; L294-F298 WeakPolarHBondContact O-CD2 3.26Å; L294-F298 PolarHBondContact O-N 3.37Å |
| 295 | I | 75.9 | Confident | 82.2 | Confident | 12 Ų | 12 | 40.6 Ų | 40.6 | 6% | 0.062 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -55.6 | -42.6 | 172.6 | -73.3 | 165.2 | 0 | 0 | 0 | 110.5 | F113 V238 V241 L291 D292 F297 F298 L299 | F113-I295 HydrophobicContact CZ-CD1 4.45Å; V238-I295 HydrophobicContact CB-CG2 4.48Å; V238-I295 HydrophobicContact CG1-CD1 4.15Å; V238-I295 HydrophobicContact CG1-CG1 4.42Å; V238-I295 HydrophobicContact CG1-CG2 3.97Å; V238-I295 HydrophobicContact CG2-CB 4.21Å; V238-I295 HydrophobicContact CG2-CD1 4.4Å; V238-I295 HydrophobicContact CG2-CG1 3.81Å; V238-I295 HydrophobicContact CG2-CG2 3.68Å; V241-I295 HydrophobicContact CB-CD1 4.41Å; V241-I295 HydrophobicContact CG1-CD1 4.07Å; L291-I295 WeakPolarHBondContact O-CG1 3.37Å; L291-I295 PolarHBondContact O-N 3.1Å; D292-I295 CarbonylContact O-C 3.57Å; D292-I295 WeakPolarHBondContact O-CA 3.49Å; D292-I295 VanDerWaalsContact O-CB 3.29Å; D292-I295 WeakPolarHBondContact O-CB 3.19Å; D292-I295 PolarHBondContact O-N 3.2Å; D292-I295 VanDerWaalsContact O-N 3.1Å; I295-F297 PolarHBondContact O-N 3.44Å; I295-F298 PolarHBondContact O-N 3.06Å; I295-L299 HydrophobicContact CG2-CD1 3.68Å; I295-L299 HydrophobicContact CG2-CG 4.2Å; I295-L299 WeakPolarHBondContact O-CB 3.48Å; I295-L299 WeakPolarHBondContact O-CG 3.33Å; I295-L299 PolarHBondContact O-N 3.25Å |
| 296 | Y | 77 | Confident | 81.4 | Confident | 1 Ų | 1 | 42 Ų | 42 | 0% | 0.004 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.3 | -41.7 | 177.6 | -50.3 | -28 | 0 | 0 | 0 | 112 | A44 F48 L61 I64 V65 D68 D292 P293 L294 F298 L299 C300 | A44-Y296 HydrophobicContact CB-CD2 4.48Å; F48-Y296 AromaticContact CE2-CD2 3.58Å; F48-Y296 HydrophobicContact CE2-CD2 3.58Å; F48-Y296 HydrophobicContact CE2-CE2 4.1Å; F48-Y296 AromaticContact CE2-CG 3.99Å; F48-Y296 HydrophobicContact CE2-CG 3.99Å; F48-Y296 HydrophobicContact CZ-CD2 4.15Å; F48-Y296 HydrophobicContact CZ-CG 4.08Å; L61-Y296 HydrophobicContact CD2-CD1 3.51Å; L61-Y296 HydrophobicContact CD2-CE1 3.36Å; I64-Y296 WeakPolarHBondContact CB-OH 3.16Å; I64-Y296 WeakPolarHBondContact CG2-OH 3.28Å; V65-Y296 HydrophobicContact CG2-CD2 4.3Å; V65-Y296 HydrophobicContact CG2-CE2 3.5Å; V65-Y296 VanDerWaalsContact CG2-CE2 3.5Å; D68-Y296 PolarHBondContact OD2-OH 2.93Å; D292-Y296 HydrophobicContact CB-CE1 4.18Å; D292-Y296 HydrophobicContact CB-CE2 4.22Å; D292-Y296 WeakPolarHBondContact CB-OH 3.46Å; D292-Y296 WeakPolarHBondContact O-CD1 3.35Å; D292-Y296 VanDerWaalsContact O-CD2 3.28Å; D292-Y296 WeakPolarHBondContact O-CD2 3.48Å; D292-Y296 WeakPolarHBondContact O-CE1 3.46Å; D292-Y296 WeakPolarHBondContact O-CE2 3.28Å; D292-Y296 PolarHBondContact O-N 3.47Å; P293-Y296 VanDerWaalsContact CA-CD2 3.45Å; P293-Y296 HydrophobicContact CB-CD2 4.49Å; P293-Y296 HydrophobicContact CG-CE2 4.44Å; P293-Y296 PolarHBondContact O-N 2.96Å; L294-Y296 VanDerWaalsContact C-N 3.26Å; L294-Y296 PolarHBondContact O-N 2.68Å; Y296-F298 VanDerWaalsContact C-N 3.34Å; Y296-F298 PolarHBondContact O-N 3.24Å; Y296-L299 PolarHBondContact O-N 2.93Å; Y296-C300 WeakPolarHBondContact O-CA 3.47Å; Y296-C300 WeakPolarHBondContact O-CB 3.44Å; Y296-C300 PolarHBondContact O-N 2.94Å |
| 297 | F | 78 | Confident | 80.7 | Confident | 72 Ų | 72 | 42.9 Ų | 42.9 | 32% | 0.316 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -59 | -45.4 | 175.9 | -176.4 | -96 | 0 | 0 | 0 | 111.3 | P293 L294 I295 F303 R304 L307 F308 | P293-F297 PolarHBondContact O-N 3.08Å; P293-F297 VanDerWaalsContact O-N 3.1Å; L294-F297 WeakPolarHBondContact O-CB 3.49Å; L294-F297 PolarHBondContact O-N 3.01Å; L294-F297 VanDerWaalsContact O-N 3.14Å; I295-F297 PolarHBondContact O-N 3.44Å; F297-F303 HydrophobicContact CB-CE1 4.43Å; F297-R304 HydrophobicContact CD2-CG 3.86Å; F297-R304 HydrophobicContact CE2-CG 4.01Å; F297-R304 HydrophobicContact CG-CG 4.32Å; F297-R304 WeakPolarHBondContact O-CD 3.42Å; F297-R304 VanDerWaalsContact O-CG 3.24Å; F297-R304 WeakPolarHBondContact O-CG 3.18Å; F297-R304 PolarHBondContact O-NE 2.88Å; F297-L307 HydrophobicContact CD2-CD2 4.26Å; F297-L307 HydrophobicContact CE2-CD2 4.38Å; F297-F308 HydrophobicContact CE2-CZ 4.31Å; F297-F308 HydrophobicContact CZ-CZ 4.46Å |
| 298 | F | 72.4 | Confident | 80.3 | Confident | 89 Ų | 89 | 42.9 Ų | 42.9 | 39% | 0.39 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -76.7 | -30.7 | -179.4 | -67.3 | -63.8 | 0 | 0 | 0 | 114.4 | N234 L294 I295 Y296 | N234-F298 HydrophobicContact CB-CB 4.46Å; N234-F298 PolarHBondContact ND2-O 2.9Å; L294-F298 HydrophobicContact CB-CE2 4.46Å; L294-F298 WeakPolarHBondContact O-CD2 3.26Å; L294-F298 PolarHBondContact O-N 3.37Å; I295-F298 PolarHBondContact O-N 3.06Å; Y296-F298 VanDerWaalsContact C-N 3.34Å; Y296-F298 PolarHBondContact O-N 3.24Å |
| 299 | L | 69.3 | Low | 79.9 | Confident | 32 Ų | 32 | 50.9 Ų | 50.9 | 17% | 0.168 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -100 | -24.2 | -174.1 | -69 | -170.8 | 0 | 0 | 0 | 115.4 | F57 N234 V235 V238 I295 Y296 | F57-L299 HydrophobicContact CZ-CB 4.39Å; N234-L299 HydrophobicContact CB-CD2 3.78Å; V235-L299 HydrophobicContact CG2-CD2 4.11Å; V238-L299 HydrophobicContact CB-CD1 4.26Å; V238-L299 HydrophobicContact CG1-CD1 4.2Å; V238-L299 HydrophobicContact CG2-CD1 3.5Å; V238-L299 VanDerWaalsContact CG2-CD1 3.5Å; V238-L299 HydrophobicContact CG2-CD2 4.16Å; V238-L299 HydrophobicContact CG2-CG 3.82Å; I295-L299 HydrophobicContact CG2-CD1 3.68Å; I295-L299 HydrophobicContact CG2-CG 4.2Å; I295-L299 WeakPolarHBondContact O-CB 3.48Å; I295-L299 WeakPolarHBondContact O-CG 3.33Å; I295-L299 PolarHBondContact O-N 3.25Å; Y296-L299 PolarHBondContact O-N 2.93Å |
| 300 | C | 72.1 | Confident | 79.4 | Confident | 4 Ų | 4 | 52.3 Ų | 52.3 | 3% | 0.027 | 25% | 0.25 | C | C | . | . | trans | -112.9 | 104.4 | -169 | -170.4 | 0 | 0 | 0 | 0 | 111.5 | F57 L61 Y296 S302 F303 R304 | F57-C300 HydrophobicContact CE1-CB 4.02Å; L61-C300 HydrophobicContact CD1-CB 4.37Å; Y296-C300 WeakPolarHBondContact O-CA 3.47Å; Y296-C300 WeakPolarHBondContact O-CB 3.44Å; Y296-C300 PolarHBondContact O-N 2.94Å; C300-S302 VanDerWaalsContact C-N 3.35Å; C300-S302 PolarHBondContact O-N 3.36Å; C300-F303 HydrophobicContact CB-CB 3.65Å; C300-F303 WeakPolarHBondContact O-CB 3.44Å; C300-F303 PolarHBondContact O-N 3.27Å; C300-F303 PolarHBondContact SG-N 3.02Å; C300-F303 VanDerWaalsContact SG-N 3.42Å; C300-R304 PolarHBondContact O-N 3.4Å | ||
| 301 | R | 76.6 | Confident | 79.1 | Confident | 194 Ų | 194 | 56 Ų | 56 | 73% | 0.732 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -60.6 | -43.6 | 175.3 | -172.9 | 177.6 | 179.1 | 179.6 | 0.5 | 111.6 | F303 R304 T305 | R301-F303 VanDerWaalsContact C-N 3.27Å; R301-F303 PolarHBondContact O-N 3.17Å; R301-R304 PolarHBondContact O-N 3.17Å; R301-T305 PolarHBondContact O-N 3.05Å; R301-T305 PolarHBondContact O-OG1 3.24Å; R301-T305 VanDerWaalsContact O-OG1 3.1Å |
| 302 | S | 69.9 | Low | 78.6 | Confident | 61 Ų | 61 | 64.6 Ų | 64.6 | 43% | 0.427 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -59.8 | -37.1 | 178.2 | -57.9 | 0 | 0 | 0 | 0 | 112.8 | C300 T306 | C300-S302 VanDerWaalsContact C-N 3.35Å; C300-S302 PolarHBondContact O-N 3.36Å; S302-T306 VanDerWaalsContact O-CB 3.32Å; S302-T306 WeakPolarHBondContact O-CB 3.36Å; S302-T306 PolarHBondContact O-N 3.38Å; S302-T306 VanDerWaalsContact O-N 3.09Å; S302-T306 PolarHBondContact O-OG1 2.93Å |
| 303 | F | 75.8 | Confident | 77.9 | Confident | 8 Ų | 8 | 68.7 Ų | 68.7 | 4% | 0.035 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.9 | -55.8 | 173.8 | -176.6 | -93.4 | 0 | 0 | 0 | 110.9 | A44 V47 F48 F297 C300 R301 T305 T306 L307 | A44-F303 HydrophobicContact CB-CE2 4.38Å; V47-F303 HydrophobicContact CB-CD2 4.09Å; V47-F303 HydrophobicContact CB-CE2 3.76Å; V47-F303 HydrophobicContact CB-CZ 4.45Å; V47-F303 HydrophobicContact CG1-CD2 3.52Å; V47-F303 HydrophobicContact CG1-CE2 3.72Å; V47-F303 HydrophobicContact CG1-CG 4.17Å; V47-F303 HydrophobicContact CG1-CZ 4.5Å; V47-F303 HydrophobicContact CG2-CE2 4.28Å; V47-F303 HydrophobicContact CG2-CZ 4.5Å; F48-F303 AromaticContact CD2-CD2 3.99Å; F48-F303 HydrophobicContact CD2-CD2 3.99Å; F48-F303 HydrophobicContact CD2-CE2 4.02Å; F48-F303 HydrophobicContact CE1-CD2 4.24Å; F48-F303 AromaticContact CE2-CD2 3.48Å; F48-F303 HydrophobicContact CE2-CD2 3.48Å; F48-F303 VanDerWaalsContact CE2-CD2 3.48Å; F48-F303 AromaticContact CE2-CE2 3.68Å; F48-F303 HydrophobicContact CE2-CE2 3.68Å; F48-F303 HydrophobicContact CZ-CB 4.47Å; F48-F303 AromaticContact CZ-CD2 3.61Å; F48-F303 HydrophobicContact CZ-CD2 3.61Å; F48-F303 HydrophobicContact CZ-CE2 4.28Å; F48-F303 HydrophobicContact CZ-CG 4.39Å; F297-F303 HydrophobicContact CB-CE1 4.43Å; C300-F303 HydrophobicContact CB-CB 3.65Å; C300-F303 WeakPolarHBondContact O-CB 3.44Å; C300-F303 PolarHBondContact O-N 3.27Å; C300-F303 PolarHBondContact SG-N 3.02Å; C300-F303 VanDerWaalsContact SG-N 3.42Å; R301-F303 VanDerWaalsContact C-N 3.27Å; R301-F303 PolarHBondContact O-N 3.17Å; F303-T305 PolarHBondContact O-N 2.96Å; F303-T306 PolarHBondContact O-N 3.08Å; F303-L307 HydrophobicContact CE1-CD2 4.06Å; F303-L307 WeakPolarHBondContact O-CB 3.44Å; F303-L307 PolarHBondContact O-N 2.76Å |
| 304 | R | 82.7 | Confident | 76.8 | Confident | 95 Ų | 95 | 73.7 Ų | 73.7 | 36% | 0.358 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -56.7 | -48.5 | 179 | -73.6 | -174.4 | -74.2 | 166.3 | 0.6 | 112.9 | F297 C300 R301 T306 L307 F308 | F297-R304 HydrophobicContact CD2-CG 3.86Å; F297-R304 HydrophobicContact CE2-CG 4.01Å; F297-R304 HydrophobicContact CG-CG 4.32Å; F297-R304 WeakPolarHBondContact O-CD 3.42Å; F297-R304 VanDerWaalsContact O-CG 3.24Å; F297-R304 WeakPolarHBondContact O-CG 3.18Å; F297-R304 PolarHBondContact O-NE 2.88Å; C300-R304 PolarHBondContact O-N 3.4Å; R301-R304 PolarHBondContact O-N 3.17Å; R304-T306 VanDerWaalsContact C-N 3.32Å; R304-T306 PolarHBondContact O-N 3.07Å; R304-L307 PolarHBondContact O-N 3.4Å; R304-F308 HydrophobicContact CB-CD2 4.47Å; R304-F308 HydrophobicContact CB-CE2 4.27Å; R304-F308 WeakPolarHBondContact O-CD2 2.96Å; R304-F308 PolarHBondContact O-N 2.05Å |
| 305 | T | 78.4 | Confident | 75.8 | Confident | 75 Ų | 75 | 72.7 Ų | 72.7 | 46% | 0.46 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.4 | -42.1 | -179.4 | -59.5 | 0 | 0 | 0 | 0 | 111.7 | R301 F303 K309 | R301-T305 PolarHBondContact O-N 3.05Å; R301-T305 PolarHBondContact O-OG1 3.24Å; R301-T305 VanDerWaalsContact O-OG1 3.1Å; F303-T305 PolarHBondContact O-N 2.96Å; T305-K309 VanDerWaalsContact O-CB 3.3Å; T305-K309 WeakPolarHBondContact O-CB 3.48Å; T305-K309 PolarHBondContact O-N 3.29Å; T305-K309 VanDerWaalsContact O-N 3.11Å |
| 306 | T | 79.4 | Confident | 74.7 | Confident | 32 Ų | 32 | 74.8 Ų | 74.8 | 20% | 0.196 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -70.4 | -41 | 178.5 | -52.9 | 0 | 0 | 0 | 0 | 111.2 | V47 R50 I51 S302 F303 R304 K309 T310 | V47-T306 HydrophobicContact CG1-CG2 4.01Å; R50-T306 HydrophobicContact CB-CG2 4.17Å; I51-T306 HydrophobicContact CG1-CG2 4.08Å; I51-T306 WeakPolarHBondContact CG1-OG1 3.08Å; S302-T306 VanDerWaalsContact O-CB 3.32Å; S302-T306 WeakPolarHBondContact O-CB 3.36Å; S302-T306 PolarHBondContact O-N 3.38Å; S302-T306 VanDerWaalsContact O-N 3.09Å; S302-T306 PolarHBondContact O-OG1 2.93Å; F303-T306 PolarHBondContact O-N 3.08Å; R304-T306 VanDerWaalsContact C-N 3.32Å; R304-T306 PolarHBondContact O-N 3.07Å; T306-K309 PolarHBondContact O-N 3.21Å; T306-T310 WeakPolarHBondContact O-CB 3.24Å; T306-T310 PolarHBondContact O-N 2.93Å; T306-T310 PolarHBondContact O-OG1 3.38Å |
| 307 | L | 82.4 | Confident | 73.1 | Confident | 19 Ų | 19 | 80 Ų | 80 | 10% | 0.099 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -58.6 | -53.9 | 176.9 | 179.2 | 64.4 | 0 | 0 | 0 | 111.3 | V43 V47 F297 F303 R304 K309 T310 L311 | V43-L307 HydrophobicContact CG1-CD1 3.86Å; V47-L307 HydrophobicContact CG2-CB 4.14Å; V47-L307 HydrophobicContact CG2-CD1 3.8Å; F297-L307 HydrophobicContact CD2-CD2 4.26Å; F297-L307 HydrophobicContact CE2-CD2 4.38Å; F303-L307 HydrophobicContact CE1-CD2 4.06Å; F303-L307 WeakPolarHBondContact O-CB 3.44Å; F303-L307 PolarHBondContact O-N 2.76Å; R304-L307 PolarHBondContact O-N 3.4Å; L307-K309 PolarHBondContact O-N 2.98Å; L307-T310 PolarHBondContact O-N 3.41Å; L307-T310 VanDerWaalsContact O-N 3.14Å; L307-L311 HydrophobicContact CD1-CD1 3.68Å; L307-L311 HydrophobicContact CD1-CG 4.12Å; L307-L311 HydrophobicContact CG-CD1 3.95Å; L307-L311 WeakPolarHBondContact O-CG 3.21Å; L307-L311 PolarHBondContact O-N 2.67Å |
| 308 | F | 86.1 | Confident | 71.4 | Confident | 50 Ų | 50 | 80 Ų | 80 | 22% | 0.219 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 179.4 | -69.9 | -55.6 | 0 | 0 | 0 | 112.3 | F297 R304 T310 L311 R312 L313 | F297-F308 HydrophobicContact CE2-CZ 4.31Å; F297-F308 HydrophobicContact CZ-CZ 4.46Å; R304-F308 HydrophobicContact CB-CD2 4.47Å; R304-F308 HydrophobicContact CB-CE2 4.27Å; R304-F308 WeakPolarHBondContact O-CD2 2.96Å; R304-F308 PolarHBondContact O-N 2.05Å; F308-T310 PolarHBondContact O-N 3.3Å; F308-L311 PolarHBondContact O-N 2.87Å; F308-R312 PolarHBondContact O-N 3.39Å; F308-R312 VanDerWaalsContact O-N 3.15Å; F308-L313 HydrophobicContact CD1-CB 4.02Å; F308-L313 HydrophobicContact CD1-CD1 4.16Å; F308-L313 HydrophobicContact CE1-CD1 4.49Å; F308-L313 PolarHBondContact O-N 2.94Å |
| 309 | K | 83.8 | Confident | 69.6 | Low | 172 Ų | 172 | 78.4 Ų | 78.4 | 75% | 0.748 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -56.3 | -41 | 175.7 | -177.8 | 177.1 | -179.2 | 177.8 | 0 | 111.6 | T305 T306 L307 R312 | T305-K309 VanDerWaalsContact O-CB 3.3Å; T305-K309 WeakPolarHBondContact O-CB 3.48Å; T305-K309 PolarHBondContact O-N 3.29Å; T305-K309 VanDerWaalsContact O-N 3.11Å; T306-K309 PolarHBondContact O-N 3.21Å; L307-K309 PolarHBondContact O-N 2.98Å; K309-R312 PolarHBondContact O-N 3.48Å |
| 310 | T | 80.2 | Confident | 68.1 | Low | 30 Ų | 30 | 86.8 Ų | 86.8 | 18% | 0.184 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -79.7 | -32.5 | -175.1 | -41.7 | 0 | 0 | 0 | 0 | 112.6 | W46 T306 L307 F308 R312 | W46-T310 HydrophobicContact CE3-CG2 4.43Å; W46-T310 VanDerWaalsContact CH2-CB 3.49Å; W46-T310 HydrophobicContact CH2-CG2 2.99Å; W46-T310 HydrophobicContact CZ2-CG2 3.15Å; W46-T310 HydrophobicContact CZ3-CG2 3.67Å; T306-T310 WeakPolarHBondContact O-CB 3.24Å; T306-T310 PolarHBondContact O-N 2.93Å; T306-T310 PolarHBondContact O-OG1 3.38Å; L307-T310 PolarHBondContact O-N 3.41Å; L307-T310 VanDerWaalsContact O-N 3.14Å; F308-T310 PolarHBondContact O-N 3.3Å; T310-R312 PolarHBondContact O-N 2.97Å |
| 311 | L | 83.6 | Confident | 66.3 | Low | 90 Ų | 90 | 91.7 Ų | 91.7 | 47% | 0.471 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.9 | -0 | 172.7 | -66.5 | 176.3 | 0 | 0 | 0 | 113.4 | W46 L307 F308 L313 | W46-L311 HydrophobicContact CZ3-CD2 4.39Å; L307-L311 HydrophobicContact CD1-CD1 3.68Å; L307-L311 HydrophobicContact CD1-CG 4.12Å; L307-L311 HydrophobicContact CG-CD1 3.95Å; L307-L311 WeakPolarHBondContact O-CG 3.21Å; L307-L311 PolarHBondContact O-N 2.67Å; F308-L311 PolarHBondContact O-N 2.87Å; L311-L313 HydrophobicContact CB-CB 4.47Å; L311-L313 HydrophobicContact CB-CD1 3.84Å; L311-L313 HydrophobicContact CB-CG 3.82Å; L311-L313 HydrophobicContact CD1-CD1 3.88Å; L311-L313 PolarHBondContact O-N 3.13Å |
| 312 | R | 78.5 | Confident | 64.2 | Low | 232 Ų | 232 | 87.8 Ų | 87.8 | 88% | 0.875 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.5 | 21.4 | -172.2 | -57.1 | -177.5 | -179.5 | 177.5 | -0 | 113.4 | F308 K309 T310 | F308-R312 PolarHBondContact O-N 3.39Å; F308-R312 VanDerWaalsContact O-N 3.15Å; K309-R312 PolarHBondContact O-N 3.48Å; T310-R312 PolarHBondContact O-N 2.97Å |
| 313 | L | 72.5 | Confident | 62.4 | Low | 87 Ų | 87 | 91.9 Ų | 91.9 | 46% | 0.455 | 48% | 0.484 | S | S | . | . | P | Polyproline II helix | trans | -74.2 | 141 | 170.5 | -66.1 | 172.5 | 0 | 0 | 0 | 106.5 | F308 L311 A315 | F308-L313 HydrophobicContact CD1-CB 4.02Å; F308-L313 HydrophobicContact CD1-CD1 4.16Å; F308-L313 HydrophobicContact CE1-CD1 4.49Å; F308-L313 PolarHBondContact O-N 2.94Å; L311-L313 HydrophobicContact CB-CB 4.47Å; L311-L313 HydrophobicContact CB-CD1 3.84Å; L311-L313 HydrophobicContact CB-CG 3.82Å; L311-L313 HydrophobicContact CD1-CD1 3.88Å; L311-L313 PolarHBondContact O-N 3.13Å; L313-A315 PolarHBondContact O-N 2.86Å |
| 314 | P | 61.1 | Low | 60.4 | Low | 113 Ų | 113 | 101.9 Ų | 101.9 | 73% | 0.734 | 52% | 0.522 | S | S | * | . | P | Polyproline II helix | trans | -49.4 | 123.2 | 168.5 | 20.1 | -29.3 | 0 | 0 | 0 | 106.1 | G316 | P314-G316 PolarHBondContact O-N 3.12Š|
| 315 | A | 56.5 | Low | 58.1 | Low | 59 Ų | 59 | 100.6 Ų | 100.6 | 49% | 0.488 | 54% | 0.538 | S | S | . | . | P | Polyproline II helix | trans | -48.9 | 116.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 104 | L313 T317 | L313-A315 PolarHBondContact O-N 2.86Å; A315-T317 PolarHBondContact O-N 2.78Å; A315-T317 PolarHBondContact O-OG1 2.69Å |
| 316 | G | 52.1 | Low | 56 | Low | 55 Ų | 55 | 101.8 Ų | 101.8 | 57% | 0.567 | 55% | 0.55 | S | S | * | . | trans | -60.2 | 86 | -178 | 0 | 0 | 0 | 0 | 0 | 107.1 | P314 C318 | P314-G316 PolarHBondContact O-N 3.12Å; G316-C318 PolarHBondContact O-N 2.98Å | ||
| 317 | T | 43.3 | Very low | 53.9 | Low | 110 Ų | 110 | 109 Ų | 109 | 68% | 0.675 | 58% | 0.581 | S | S | * | * | trans | -63.8 | 100.5 | 165.9 | -48 | 0 | 0 | 0 | 0 | 100.3 | A315 S319 | A315-T317 PolarHBondContact O-N 2.78Å; A315-T317 PolarHBondContact O-OG1 2.69Å; T317-S319 PolarHBondContact O-N 3.22Å | ||
| 318 | C | 41.7 | Very low | 51.7 | Low | 72 Ų | 72 | 113.3 Ų | 113.3 | 49% | 0.486 | 61% | 0.613 | S | S | . | * | trans | -65.6 | 74.9 | 159.6 | -148.8 | 0 | 0 | 0 | 0 | 104.2 | G316 W320 L321 | G316-C318 PolarHBondContact O-N 2.98Å; C318-W320 PolarHBondContact O-N 3.21Å; C318-L321 PolarHBondContact O-N 3.15Å; C318-L321 VanDerWaalsContact O-N 3.1Å | ||
| 319 | S | 34.8 | Very low | 49.5 | Very low | 57 Ų | 57 | 117.4 Ų | 117.4 | 40% | 0.399 | 64% | 0.641 | S | S | . | * | G | 310 helix | trans | -57.3 | -25.5 | 178 | 53.4 | 0 | 0 | 0 | 0 | 110 | T317 L321 T322 E323 | T317-S319 PolarHBondContact O-N 3.22Å; S319-L321 PolarHBondContact O-N 2.96Å; S319-T322 PolarHBondContact O-N 2.89Å; S319-E323 PolarHBondContact O-N 3.02Å |
| 320 | W | 37.7 | Very low | 47.2 | Very low | 207 Ų | 207 | 120.3 Ų | 120.3 | 78% | 0.784 | 65% | 0.648 | S | S | * | * | G | 310 helix | trans | -56.8 | -11.2 | 171.6 | -116.6 | 82.6 | 0 | 0 | 0 | 116.7 | C318 | C318-W320 PolarHBondContact O-N 3.21Š|
| 321 | L | 34.2 | Very low | 45.1 | Very low | 108 Ų | 108 | 126.6 Ų | 126.6 | 57% | 0.565 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -107.3 | -5 | 173.9 | -80.7 | 169.4 | 0 | 0 | 0 | 114.5 | C318 S319 | C318-L321 PolarHBondContact O-N 3.15Å; C318-L321 VanDerWaalsContact O-N 3.1Å; S319-L321 PolarHBondContact O-N 2.96Å |
| 322 | T | 32.5 | Very low | 43.1 | Very low | 111 Ų | 111 | 128 Ų | 128 | 68% | 0.681 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114 | -18.9 | -175 | -33.9 | 0 | 0 | 0 | 0 | 112.4 | S319 R324 | S319-T322 PolarHBondContact O-N 2.89Å; T322-R324 PolarHBondContact O-N 3.15Å |
| 323 | E | 32.7 | Very low | 41.4 | Very low | 147 Ų | 147 | 122.3 Ų | 122.3 | 69% | 0.687 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | 32.1 | -167.2 | -144 | 170.7 | -159.4 | 0 | 0 | 114.7 | S319 | S319-E323 PolarHBondContact O-N 3.02Š|
| 324 | R | 35.1 | Very low | 40 | Very low | 219 Ų | 219 | 125.3 Ų | 125.3 | 83% | 0.826 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.9 | 23.5 | 169.7 | -139 | -175.5 | -74.8 | -157.1 | -1 | 114.1 | T322 | T322-R324 PolarHBondContact O-N 3.15Š|
| 325 | G | 32.5 | Very low | 38.8 | Very low | 68 Ų | 68 | 124.8 Ų | 124.8 | 70% | 0.701 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -108.5 | 2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 326 | S | 34.7 | Very low | 38 | Very low | 100 Ų | 100 | 132.4 Ų | 132.4 | 70% | 0.699 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -122.7 | 8.6 | -172.9 | 58 | 0 | 0 | 0 | 0 | 115.6 | ||
| 327 | E | 36.5 | Very low | 37.3 | Very low | 182 Ų | 182 | 136.3 Ų | 136.3 | 85% | 0.85 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -112.2 | 11.8 | -179.6 | -91.6 | -174 | 153.2 | 0 | 0 | 115.4 | ||
| 328 | S | 35.5 | Very low | 37 | Very low | 111 Ų | 111 | 137.6 Ų | 137.6 | 78% | 0.776 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -119.9 | 19.5 | 176.4 | 78.2 | 0 | 0 | 0 | 0 | 115.3 | ||
| 329 | V | 39 | Very low | 36.7 | Very low | 135 Ų | 135 | 141.3 Ų | 141.3 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -123.7 | 50 | 175.2 | -167.2 | 0 | 0 | 0 | 0 | 110.4 | ||
| 330 | R | 35.6 | Very low | 36.8 | Very low | 234 Ų | 234 | 146.2 Ų | 146.2 | 88% | 0.883 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -144.8 | 15.9 | 171.3 | -127.8 | -175 | -91.4 | -163.7 | -2.8 | 117.5 | ||
| 331 | D | 37.3 | Very low | 36.8 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 87% | 0.866 | 82% | 0.817 | S | S | * | * | trans | -126.8 | 76.2 | 167.5 | -82.5 | -26.8 | 0 | 0 | 0 | 110.8 | ||||
| 332 | S | 41.9 | Very low | 36.9 | Very low | 119 Ų | 119 | 144.7 Ų | 144.7 | 83% | 0.832 | 83% | 0.834 | S | S | * | * | trans | -156.2 | 53.8 | 164.2 | -62.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 333 | S | 42.5 | Very low | 37.2 | Very low | 113 Ų | 113 | 147.1 Ų | 147.1 | 79% | 0.79 | 85% | 0.845 | S | S | * | * | trans | -158 | 62.7 | 177.6 | -53.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 334 | T | 42.8 | Very low | 37.6 | Very low | 150 Ų | 150 | 147.2 Ų | 147.2 | 92% | 0.92 | 86% | 0.857 | S | S | * | * | trans | -178.9 | 99.8 | 150.4 | 32.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 335 | A | 36.2 | Very low | 37.8 | Very low | 102 Ų | 102 | 141.2 Ų | 141.2 | 84% | 0.843 | 86% | 0.86 | S | S | * | * | trans | -164.2 | 88.8 | 151 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 336 | T | 39.1 | Very low | 38.3 | Very low | 218 Ų | 218 | 147.8 Ų | 147.8 | 100% | 1.337 | 87% | 0.874 | S | S | * | * | trans | -129.9 | 0 | 152.9 | 37.8 | 0 | 0 | 0 | 0 | 106.6 |
Retrieved 336 of 336 residues in 85.5 ms
(Link to these results)