| 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 | 42.3 | Very low | 37.2 | Very low | 235 Ų | 235 | 142.5 Ų | 142.5 | 100% | 1.158 | 80% | 0.799 | S | S | * | * | 0 | 120 | 0 | -71.7 | 179.2 | 171.3 | 0 | 0 | 107.6 | |||||
| 2 | P | 39.7 | Very low | 36.9 | Very low | 127 Ų | 127 | 140.4 Ų | 140.4 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | trans | -78.8 | 132.7 | -178.6 | 31.2 | -30.3 | 0 | 0 | 0 | 110.2 | ||||
| 3 | V | 37.6 | Very low | 36.4 | Very low | 135 Ų | 135 | 138.5 Ų | 138.5 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -88 | 107.9 | 175.3 | 178.5 | 0 | 0 | 0 | 0 | 107.9 | V5 | V3-V5 PolarHBondContact O-N 3.5Š| ||
| 4 | S | 35.8 | Very low | 36.3 | Very low | 107 Ų | 107 | 137.9 Ų | 137.9 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | trans | -70.1 | 116.2 | 176.3 | -53.7 | 0 | 0 | 0 | 0 | 110.1 | T6 | S4-T6 PolarHBondContact O-N 3.37Š| ||
| 5 | V | 40.4 | Very low | 35.9 | Very low | 134 Ų | 134 | 137.2 Ų | 137.2 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | trans | -84.9 | 108 | 174.8 | 178.5 | 0 | 0 | 0 | 0 | 108.8 | V3 R7 | V3-V5 PolarHBondContact O-N 3.5Å; V5-R7 PolarHBondContact O-N 3.24Å | ||
| 6 | T | 38.9 | Very low | 35.8 | Very low | 126 Ų | 126 | 135.8 Ų | 135.8 | 77% | 0.773 | 79% | 0.787 | S | S | * | * | trans | -78.8 | 102.8 | 175.1 | -43.6 | 0 | 0 | 0 | 0 | 109.3 | S4 T8 | S4-T6 PolarHBondContact O-N 3.37Å; T6-T8 PolarHBondContact O-N 3.37Å | ||
| 7 | R | 34.3 | Very low | 35.7 | Very low | 223 Ų | 223 | 134.2 Ų | 134.2 | 84% | 0.842 | 79% | 0.785 | S | S | * | * | trans | -79.7 | 104.8 | 174 | -171 | -176.9 | -124.7 | 172 | 0.7 | 109.2 | V5 T9 | V5-R7 PolarHBondContact O-N 3.24Å; R7-T9 PolarHBondContact O-N 3.26Å | ||
| 8 | T | 38.2 | Very low | 35.6 | Very low | 118 Ų | 118 | 132.2 Ų | 132.2 | 72% | 0.724 | 78% | 0.78 | S | S | * | * | trans | -79.7 | 101.3 | 173.1 | -37.4 | 0 | 0 | 0 | 0 | 109.1 | T6 I10 | T6-T8 PolarHBondContact O-N 3.37Å; T8-I10 PolarHBondContact O-N 3.26Å | ||
| 9 | T | 34 | Very low | 35.6 | Very low | 111 Ų | 111 | 130.6 Ų | 130.6 | 68% | 0.681 | 78% | 0.777 | S | S | * | * | trans | -75.1 | 104.9 | 171.2 | -51.4 | 0 | 0 | 0 | 0 | 108.5 | R7 T11 | R7-T9 PolarHBondContact O-N 3.26Å; T9-T11 PolarHBondContact O-N 3.22Å | ||
| 10 | I | 37.2 | Very low | 35.9 | Very low | 139 Ų | 139 | 129.9 Ų | 129.9 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | trans | -82.7 | 102.7 | 170.4 | -60.4 | 174 | 0 | 0 | 0 | 107.1 | T8 T12 | T8-I10 PolarHBondContact O-N 3.26Å; I10-T12 PolarHBondContact O-N 3.35Å | ||
| 11 | T | 30.9 | Very low | 36.8 | Very low | 113 Ų | 113 | 127.6 Ų | 127.6 | 69% | 0.693 | 76% | 0.756 | S | S | * | * | trans | -77.3 | 98 | 171 | -48.3 | 0 | 0 | 0 | 0 | 108.2 | T9 T13 | T9-T11 PolarHBondContact O-N 3.22Å; T11-T13 PolarHBondContact O-N 3.09Å; T11-T13 VanDerWaalsContact O-N 3.09Å | ||
| 12 | T | 33.4 | Very low | 37 | Very low | 117 Ų | 117 | 122.1 Ų | 122.1 | 72% | 0.718 | 74% | 0.736 | S | S | * | * | trans | -75.2 | 94.1 | 172.5 | -30.5 | 0 | 0 | 0 | 0 | 108.6 | I10 T14 | I10-T12 PolarHBondContact O-N 3.35Å; T12-T14 PolarHBondContact O-N 3.1Å; T12-T14 VanDerWaalsContact O-N 3.1Å | ||
| 13 | T | 30.9 | Very low | 37.7 | Very low | 116 Ų | 116 | 117.5 Ų | 117.5 | 71% | 0.712 | 71% | 0.712 | S | S | * | * | trans | -70 | 99.9 | 166.3 | 29.3 | 0 | 0 | 0 | 0 | 108.7 | T11 T15 | T11-T13 PolarHBondContact O-N 3.09Å; T11-T13 VanDerWaalsContact O-N 3.09Å; T13-T15 VanDerWaalsContact C-N 3.31Å; T13-T15 PolarHBondContact O-N 3.23Å | ||
| 14 | T | 34.3 | Very low | 39.1 | Very low | 130 Ų | 130 | 113.5 Ų | 113.5 | 80% | 0.798 | 69% | 0.69 | S | S | * | * | trans | -67 | 89.7 | 163.3 | 39.7 | 0 | 0 | 0 | 0 | 109 | T12 S16 | T12-T14 PolarHBondContact O-N 3.1Å; T12-T14 VanDerWaalsContact O-N 3.1Å; T14-S16 PolarHBondContact O-N 2.98Å | ||
| 15 | T | 30.6 | Very low | 40.3 | Very low | 127 Ų | 127 | 112.9 Ų | 112.9 | 78% | 0.779 | 68% | 0.683 | S | S | * | * | trans | -74.7 | 101.2 | 161 | 27.7 | 0 | 0 | 0 | 0 | 107.9 | T13 S17 | T13-T15 VanDerWaalsContact C-N 3.31Å; T13-T15 PolarHBondContact O-N 3.23Å; T15-S17 VanDerWaalsContact C-N 3.27Å; T15-S17 PolarHBondContact O-N 2.87Å | ||
| 16 | S | 34.5 | Very low | 41.4 | Very low | 114 Ų | 114 | 115.4 Ų | 115.4 | 80% | 0.797 | 68% | 0.678 | S | S | * | * | trans | -58 | 91.4 | 161.3 | 51.7 | 0 | 0 | 0 | 0 | 108.8 | T14 S18 | T14-S16 PolarHBondContact O-N 2.98Å; S16-S18 VanDerWaalsContact C-N 3.29Å; S16-S18 PolarHBondContact O-N 3.03Å | ||
| 17 | S | 33.3 | Very low | 42.5 | Very low | 109 Ų | 109 | 110.6 Ų | 110.6 | 76% | 0.762 | 65% | 0.651 | S | S | * | * | trans | -70.8 | 90.7 | 169.1 | 56.9 | 0 | 0 | 0 | 0 | 108.1 | T15 S19 | T15-S17 VanDerWaalsContact C-N 3.27Å; T15-S17 PolarHBondContact O-N 2.87Å; S17-S19 PolarHBondContact O-N 3.22Å | ||
| 18 | S | 34.3 | Very low | 44.2 | Very low | 99 Ų | 99 | 102.8 Ų | 102.8 | 69% | 0.692 | 63% | 0.626 | S | S | * | * | trans | -52.1 | 109.1 | 155.2 | 51.5 | 0 | 0 | 0 | 0 | 107.1 | S16 T20 | S16-S18 VanDerWaalsContact C-N 3.29Å; S16-S18 PolarHBondContact O-N 3.03Å; S18-T20 PolarHBondContact O-N 3.03Å | ||
| 19 | S | 36.2 | Very low | 45.8 | Very low | 102 Ų | 102 | 102 Ų | 102 | 71% | 0.713 | 62% | 0.621 | S | S | * | * | trans | -68.5 | 79.6 | 173.7 | 56 | 0 | 0 | 0 | 0 | 108.5 | S17 I21 | S17-S19 PolarHBondContact O-N 3.22Å; S19-I21 VanDerWaalsContact C-N 3.25Å; S19-I21 PolarHBondContact O-N 3.26Å | ||
| 20 | T | 42.3 | Very low | 48.2 | Very low | 115 Ų | 115 | 102.3 Ų | 102.3 | 71% | 0.706 | 62% | 0.615 | S | S | * | * | trans | -63.4 | 100.1 | 156 | 23.9 | 0 | 0 | 0 | 0 | 105.6 | S18 V22 | S18-T20 PolarHBondContact O-N 3.03Å; T20-V22 PolarHBondContact O-N 3.25Å | ||
| 21 | I | 53.8 | Low | 50.5 | Low | 82 Ų | 82 | 100.1 Ų | 100.1 | 42% | 0.421 | 61% | 0.609 | S | S | . | * | trans | -64.8 | 89.1 | 171 | -64.1 | 172.9 | 0 | 0 | 0 | 105.7 | S19 G23 G84 L86 | S19-I21 VanDerWaalsContact C-N 3.25Å; S19-I21 PolarHBondContact O-N 3.26Å; I21-G23 VanDerWaalsContact C-N 3.32Å; I21-G23 PolarHBondContact O-N 3.4Å; I21-G84 WeakPolarHBondContact CG2-O 3.14Å; I21-L86 HydrophobicContact CD1-CD2 3.88Å | ||
| 22 | V | 47.6 | Very low | 53.2 | Low | 120 Ų | 120 | 96.8 Ų | 96.8 | 73% | 0.727 | 59% | 0.587 | S | S | * | * | trans | -75 | 94.8 | 175.9 | 180 | 0 | 0 | 0 | 0 | 106.5 | T20 S24 | T20-V22 PolarHBondContact O-N 3.25Å; V22-S24 PolarHBondContact O-N 3.33Å; V22-S24 VanDerWaalsContact O-N 3.14Å | ||
| 23 | G | 54.4 | Low | 55.7 | Low | 31 Ų | 31 | 91.3 Ų | 91.3 | 32% | 0.32 | 55% | 0.554 | S | S | . | * | trans | -57.4 | 112.8 | 162.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | I21 P25 L83 | I21-G23 VanDerWaalsContact C-N 3.32Å; I21-G23 PolarHBondContact O-N 3.4Å; G23-P25 WeakPolarHBondContact O-CD 3.44Å; G23-L83 WeakPolarHBondContact CA-O 3.1Å | ||
| 24 | S | 65.4 | Low | 58.5 | Low | 51 Ų | 51 | 90.5 Ų | 90.5 | 36% | 0.357 | 55% | 0.545 | S | S | . | . | trans | -85.6 | 119.1 | -178.9 | -163.9 | 0 | 0 | 0 | 0 | 109.2 | V22 R26 A27 | V22-S24 PolarHBondContact O-N 3.33Å; V22-S24 VanDerWaalsContact O-N 3.14Å; S24-R26 PolarHBondContact O-N 3.27Å; S24-R26 WeakPolarHBondContact OG-CB 3.48Å; S24-A27 WeakPolarHBondContact O-CB 3.47Å; S24-A27 PolarHBondContact O-N 2.97Å | ||
| 25 | P | 61.5 | Low | 61.3 | Low | 93 Ų | 93 | 85.1 Ų | 85.1 | 60% | 0.604 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -12.7 | 172.2 | 24.6 | -33.3 | 0 | 0 | 0 | 112.4 | G23 A27 L28 | G23-P25 WeakPolarHBondContact O-CD 3.44Å; P25-A27 PolarHBondContact O-N 3.05Å; P25-L28 PolarHBondContact O-N 3.3Å; P25-L28 VanDerWaalsContact O-N 3.11Å |
| 26 | R | 63.1 | Low | 64.3 | Low | 187 Ų | 187 | 79.5 Ų | 79.5 | 71% | 0.706 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -59.2 | -24.3 | 170.1 | -66.2 | -177.9 | 175.2 | 172.2 | -1.2 | 113.5 | S24 L28 T29 Q30 | S24-R26 PolarHBondContact O-N 3.27Å; S24-R26 WeakPolarHBondContact OG-CB 3.48Å; R26-L28 PolarHBondContact O-N 3.35Å; R26-T29 WeakPolarHBondContact CA-OG1 3.39Å; R26-T29 PolarHBondContact O-N 3.01Å; R26-T29 PolarHBondContact O-OG1 2.95Å; R26-Q30 WeakPolarHBondContact O-CG 3.46Å; R26-Q30 PolarHBondContact O-N 2.91Å |
| 27 | A | 63.6 | Low | 67.1 | Low | 25 Ų | 25 | 77.2 Ų | 77.2 | 21% | 0.207 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -62.2 | -31.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | S24 P25 G33 | S24-A27 WeakPolarHBondContact O-CB 3.47Å; S24-A27 PolarHBondContact O-N 2.97Å; P25-A27 PolarHBondContact O-N 3.05Å; A27-G33 WeakPolarHBondContact O-CA 3.22Å |
| 28 | L | 68 | Low | 70 | Confident | 59 Ų | 59 | 75.9 Ų | 75.9 | 31% | 0.309 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -83.6 | -28.9 | 176.9 | -72.2 | 170.7 | 0 | 0 | 0 | 113.4 | P25 R26 L34 L79 L83 | P25-L28 PolarHBondContact O-N 3.3Å; P25-L28 VanDerWaalsContact O-N 3.11Å; R26-L28 PolarHBondContact O-N 3.35Å; L28-L34 PolarHBondContact O-N 3.01Å; L28-L79 HydrophobicContact CD2-CD2 4.05Å; L28-L83 HydrophobicContact CD1-CD1 4.09Å; L28-L83 HydrophobicContact CD1-CD2 3.69Å; L28-L83 HydrophobicContact CD1-CG 4.38Å; L28-L83 HydrophobicContact CD2-CD1 4.42Å; L28-L83 HydrophobicContact CD2-CD2 4.49Å; L28-L83 HydrophobicContact CG-CD1 4.36Å; L28-L83 HydrophobicContact CG-CD2 3.69Å; L28-L83 HydrophobicContact CG-CG 4.28Å |
| 29 | T | 71.8 | Confident | 72.9 | Confident | 103 Ų | 103 | 71.2 Ų | 71.2 | 63% | 0.632 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -85.9 | -10.7 | -177.6 | 62.5 | 0 | 0 | 0 | 0 | 113.2 | R26 | R26-T29 WeakPolarHBondContact CA-OG1 3.39Å; R26-T29 PolarHBondContact O-N 3.01Å; R26-T29 PolarHBondContact O-OG1 2.95Å |
| 30 | Q | 84.8 | Confident | 75.8 | Confident | 117 Ų | 117 | 67.4 Ų | 67.4 | 55% | 0.547 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -67.8 | 151.1 | 169.9 | -80.5 | -174.5 | -7.3 | 0 | 0 | 111.4 | R26 L32 G33 L34 | R26-Q30 WeakPolarHBondContact O-CG 3.46Å; R26-Q30 PolarHBondContact O-N 2.91Å; Q30-L32 PolarHBondContact O-N 3.4Å; Q30-L32 VanDerWaalsContact O-N 3.17Å; Q30-G33 PolarHBondContact O-N 3.27Å; Q30-L34 PolarHBondContact O-N 3.03Å |
| 31 | P | 86.3 | Confident | 78.4 | Confident | 92 Ų | 92 | 66.1 Ų | 66.1 | 60% | 0.597 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -57.1 | -35.1 | -177.6 | 21.7 | -33.2 | 0 | 0 | 0 | 112.8 | L35 W153 | P31-L35 WeakPolarHBondContact O-CB 3.45Å; P31-L35 PolarHBondContact O-N 3.33Å; P31-W153 HydrophobicContact CB-CZ3 4.33Å |
| 32 | L | 86.9 | Confident | 80.3 | Confident | 44 Ų | 44 | 62.2 Ų | 62.2 | 23% | 0.23 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -68.9 | -39.8 | 175.5 | -171.3 | 64.2 | 0 | 0 | 0 | 112.4 | Q30 L35 R36 E150 T154 | Q30-L32 PolarHBondContact O-N 3.4Å; Q30-L32 VanDerWaalsContact O-N 3.17Å; L32-L35 WeakPolarHBondContact O-CB 3.35Å; L32-L35 PolarHBondContact O-N 3.24Å; L32-R36 WeakPolarHBondContact O-CG 3.42Å; L32-R36 PolarHBondContact O-N 3.3Å; L32-E150 HydrophobicContact CD1-CB 4.41Å; L32-E150 HydrophobicContact CD1-CG 3.92Å; L32-T154 HydrophobicContact CD1-CG2 4.11Å; L32-T154 HydrophobicContact CD2-CG2 4.18Å |
| 33 | G | 86.4 | Confident | 82.6 | Confident | 2 Ų | 2 | 56.5 Ų | 56.5 | 2% | 0.021 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.8 | -41.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A27 Q30 L35 R36 L37 | A27-G33 WeakPolarHBondContact O-CA 3.22Å; Q30-G33 PolarHBondContact O-N 3.27Å; G33-L35 VanDerWaalsContact C-N 3.32Å; G33-L35 PolarHBondContact O-N 2.97Å; G33-R36 PolarHBondContact O-N 3.39Å; G33-L37 PolarHBondContact O-N 3.02Å |
| 34 | L | 90.1 | Very high | 84.5 | Confident | 98 Ų | 98 | 56.9 Ų | 56.9 | 51% | 0.513 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.3 | -40.1 | 173.3 | -69.7 | 174 | 0 | 0 | 0 | 111.9 | L28 Q30 L37 L38 | L28-L34 PolarHBondContact O-N 3.01Å; Q30-L34 PolarHBondContact O-N 3.03Å; L34-L37 PolarHBondContact O-N 2.99Å; L34-L38 PolarHBondContact O-N 3.3Å |
| 35 | L | 92.8 | Very high | 85.9 | Confident | 17 Ų | 17 | 56.4 Ų | 56.4 | 9% | 0.089 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.2 | -42.2 | 176.6 | -171.9 | 65.8 | 0 | 0 | 0 | 111.7 | P31 L32 G33 L37 L38 Q39 A146 T149 E150 W153 | P31-L35 WeakPolarHBondContact O-CB 3.45Å; P31-L35 PolarHBondContact O-N 3.33Å; L32-L35 WeakPolarHBondContact O-CB 3.35Å; L32-L35 PolarHBondContact O-N 3.24Å; G33-L35 VanDerWaalsContact C-N 3.32Å; G33-L35 PolarHBondContact O-N 2.97Å; L35-L37 VanDerWaalsContact C-N 3.35Å; L35-L38 WeakPolarHBondContact O-CB 3.34Å; L35-L38 PolarHBondContact O-N 3.4Å; L35-Q39 WeakPolarHBondContact O-CG 3.3Å; L35-Q39 PolarHBondContact O-N 3.39Å; L35-A146 HydrophobicContact CD1-CB 3.89Å; L35-A146 WeakPolarHBondContact CD2-O 3.34Å; L35-T149 HydrophobicContact CD1-CG2 4.46Å; L35-T149 HydrophobicContact CD2-CG2 3.96Å; L35-E150 HydrophobicContact CD2-CB 3.76Å; L35-W153 HydrophobicContact CB-CZ3 4.1Å; L35-W153 HydrophobicContact CD2-CD2 4.48Å; L35-W153 HydrophobicContact CD2-CE3 3.67Å; L35-W153 HydrophobicContact CD2-CH2 4.34Å; L35-W153 HydrophobicContact CD2-CZ3 3.6Å; L35-W153 HydrophobicContact CG-CZ3 4.34Å |
| 36 | R | 93.2 | Very high | 87.4 | Confident | 9 Ų | 9 | 52 Ų | 52 | 3% | 0.034 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66.7 | -34.6 | 174.9 | -72.7 | 178.2 | 177.5 | 175.1 | 4.1 | 113.1 | L32 G33 L38 Q39 L40 I78 L79 E82 E150 | L32-R36 WeakPolarHBondContact O-CG 3.42Å; L32-R36 PolarHBondContact O-N 3.3Å; G33-R36 PolarHBondContact O-N 3.39Å; R36-L38 VanDerWaalsContact C-N 3.34Å; R36-Q39 WeakPolarHBondContact O-CB 3.26Å; R36-Q39 PolarHBondContact O-N 3.48Å; R36-L40 WeakPolarHBondContact O-CB 3.44Å; R36-L40 PolarHBondContact O-N 3.39Å; R36-I78 VanDerWaalsContact NH1-CG2 3.28Å; R36-L79 HydrophobicContact CB-CD2 3.82Å; R36-L79 HydrophobicContact CB-CG 4.3Å; R36-E82 IonicContact CZ-OE1 2.68Å; R36-E82 IonicContact CZ-OE2 2.65Å; R36-E82 IonicContact NH1-OE1 3.85Å; R36-E82 PolarHBondContact NH1-OE1 2.88Å; R36-E82 IonicContact NH1-OE2 3.89Å; R36-E82 PolarHBondContact NH1-OE2 3.39Å; R36-E150 WeakPolarHBondContact CG-OE2 3.28Å; R36-E150 IonicContact CZ-OE1 3.9Å; R36-E150 IonicContact NE-OE1 3.68Å; R36-E150 PolarHBondContact NE-OE1 3.41Å; R36-E150 IonicContact NE-OE2 2.65Å; R36-E150 PolarHBondContact NE-OE2 2.89Å; R36-E150 IonicContact NH2-OE1 3.36Å; R36-E150 PolarHBondContact NH2-OE1 3.29Å |
| 37 | L | 93.1 | Very high | 88.8 | Confident | 67 Ų | 67 | 44.9 Ų | 44.9 | 35% | 0.351 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.4 | -40.8 | 171.5 | -173.8 | 65.8 | 0 | 0 | 0 | 111.3 | G33 L34 L35 L40 I41 | G33-L37 PolarHBondContact O-N 3.02Å; L34-L37 PolarHBondContact O-N 2.99Å; L35-L37 VanDerWaalsContact C-N 3.35Å; L37-L40 HydrophobicContact CD1-CD2 4.48Å; L37-L40 PolarHBondContact O-N 3.23Å; L37-I41 HydrophobicContact CD1-CD1 4.22Å; L37-I41 HydrophobicContact CD1-CG1 4.44Å; L37-I41 HydrophobicContact CD2-CD1 4.46Å; L37-I41 HydrophobicContact CG-CD1 3.89Å; L37-I41 HydrophobicContact CG-CG1 4.48Å; L37-I41 WeakPolarHBondContact O-CG1 3.19Å; L37-I41 PolarHBondContact O-N 3.49Å |
| 38 | L | 94.7 | Very high | 90.2 | Very high | 80 Ų | 80 | 46.1 Ų | 46.1 | 42% | 0.419 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 174.1 | 178.7 | 64.3 | 0 | 0 | 0 | 111.3 | L34 L35 R36 L40 I41 S42 V142 A146 | L34-L38 PolarHBondContact O-N 3.3Å; L35-L38 WeakPolarHBondContact O-CB 3.34Å; L35-L38 PolarHBondContact O-N 3.4Å; R36-L38 VanDerWaalsContact C-N 3.34Å; L38-L40 VanDerWaalsContact C-N 3.34Å; L38-L40 PolarHBondContact O-N 3.44Å; L38-I41 PolarHBondContact O-N 3.28Å; L38-S42 WeakPolarHBondContact O-CB 3.4Å; L38-S42 PolarHBondContact O-N 3.21Å; L38-V142 HydrophobicContact CD1-CG1 4.22Å; L38-V142 HydrophobicContact CD2-CG1 4.4Å; L38-V142 HydrophobicContact CG-CG1 4.36Å; L38-A146 HydrophobicContact CD2-CB 4.17Å; L38-A146 HydrophobicContact CG-CB 4.41Å |
| 39 | Q | 96.1 | Very high | 91.2 | Very high | 2 Ų | 2 | 45.6 Ų | 45.6 | 1% | 0.009 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.5 | -46 | 174.6 | -66.7 | 160.5 | 5.3 | 0 | 0 | 111.6 | L35 R36 S42 T43 T75 A146 Y147 E150 | L35-Q39 WeakPolarHBondContact O-CG 3.3Å; L35-Q39 PolarHBondContact O-N 3.39Å; R36-Q39 WeakPolarHBondContact O-CB 3.26Å; R36-Q39 PolarHBondContact O-N 3.48Å; Q39-S42 PolarHBondContact O-N 2.94Å; Q39-T43 WeakPolarHBondContact O-CB 3.39Å; Q39-T43 WeakPolarHBondContact O-CG2 3.44Å; Q39-T43 PolarHBondContact O-N 3.06Å; Q39-T43 PolarHBondContact O-OG1 3.1Å; Q39-T75 HydrophobicContact CB-CG2 4.32Å; Q39-A146 HydrophobicContact CG-CB 3.58Å; Q39-A146 PolarHBondContact NE2-O 2.89Å; Q39-Y147 HydrophobicContact CB-CD1 4.37Å; Q39-Y147 HydrophobicContact CB-CE1 3.82Å; Q39-Y147 HydrophobicContact CB-CE2 4.18Å; Q39-Y147 HydrophobicContact CG-CD1 3.76Å; Q39-Y147 HydrophobicContact CG-CD2 4.33Å; Q39-Y147 HydrophobicContact CG-CE1 3.72Å; Q39-Y147 HydrophobicContact CG-CE2 4.28Å; Q39-Y147 HydrophobicContact CG-CG 4.05Å; Q39-E150 PolarHBondContact NE2-OE2 3.49Å; Q39-E150 PolarHBondContact OE1-OE2 3.3Å |
| 40 | L | 95.8 | Very high | 91.9 | Very high | 22 Ų | 22 | 40.7 Ų | 40.7 | 12% | 0.115 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.5 | -51.3 | 179.8 | -172 | 78 | 0 | 0 | 0 | 111.9 | R36 L37 L38 S42 T43 C44 F72 T75 L76 L79 | R36-L40 WeakPolarHBondContact O-CB 3.44Å; R36-L40 PolarHBondContact O-N 3.39Å; L37-L40 HydrophobicContact CD1-CD2 4.48Å; L37-L40 PolarHBondContact O-N 3.23Å; L38-L40 VanDerWaalsContact C-N 3.34Å; L38-L40 PolarHBondContact O-N 3.44Å; L40-S42 VanDerWaalsContact C-N 3.32Å; L40-S42 PolarHBondContact O-N 2.99Å; L40-T43 PolarHBondContact O-OG1 3.46Å; L40-T43 VanDerWaalsContact O-OG1 3.06Å; L40-C44 WeakPolarHBondContact O-CB 3.21Å; L40-C44 PolarHBondContact O-N 3.25Å; L40-F72 HydrophobicContact CD1-CD2 3.43Å; L40-F72 VanDerWaalsContact CD1-CD2 3.43Å; L40-F72 HydrophobicContact CD1-CE2 3.49Å; L40-F72 VanDerWaalsContact CD1-CE2 3.49Å; L40-F72 HydrophobicContact CD1-CG 4.18Å; L40-F72 HydrophobicContact CD1-CZ 4.27Å; L40-F72 WeakPolarHBondContact CD1-O 3.32Å; L40-F72 HydrophobicContact CD2-CE2 4.44Å; L40-F72 HydrophobicContact CG-CD2 3.9Å; L40-F72 HydrophobicContact CG-CE2 3.72Å; L40-T75 HydrophobicContact CB-CG2 4.09Å; L40-T75 HydrophobicContact CD1-CG2 4.2Å; L40-L76 HydrophobicContact CD1-CB 3.82Å; L40-L76 HydrophobicContact CD1-CD1 4.39Å; L40-L76 HydrophobicContact CD2-CD1 4.24Å; L40-L79 HydrophobicContact CB-CD1 4.35Å; L40-L79 HydrophobicContact CD2-CD1 3.96Å |
| 41 | I | 96.2 | Very high | 92.1 | Very high | 87 Ų | 87 | 37 Ų | 37 | 45% | 0.446 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -63.2 | -43.3 | 179.6 | -67.4 | 169.1 | 0 | 0 | 0 | 110 | L37 L38 C44 V45 | L37-I41 HydrophobicContact CD1-CD1 4.22Å; L37-I41 HydrophobicContact CD1-CG1 4.44Å; L37-I41 HydrophobicContact CD2-CD1 4.46Å; L37-I41 HydrophobicContact CG-CD1 3.89Å; L37-I41 HydrophobicContact CG-CG1 4.48Å; L37-I41 WeakPolarHBondContact O-CG1 3.19Å; L37-I41 PolarHBondContact O-N 3.49Å; L38-I41 PolarHBondContact O-N 3.28Å; I41-C44 WeakPolarHBondContact O-CB 3.23Å; I41-C44 PolarHBondContact O-N 3.3Å; I41-V45 HydrophobicContact CG2-CG2 4.33Å; I41-V45 WeakPolarHBondContact O-CG2 3.46Å; I41-V45 PolarHBondContact O-N 3.45Å |
| 42 | S | 95.1 | Very high | 92.2 | Very high | 1 Ų | 1 | 36 Ų | 36 | 1% | 0.007 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.6 | -46.1 | -176.8 | -177.8 | 0 | 0 | 0 | 0 | 112.5 | L38 Q39 L40 C44 V45 A46 F139 A143 | L38-S42 WeakPolarHBondContact O-CB 3.4Å; L38-S42 PolarHBondContact O-N 3.21Å; Q39-S42 PolarHBondContact O-N 2.94Å; L40-S42 VanDerWaalsContact C-N 3.32Å; L40-S42 PolarHBondContact O-N 2.99Å; S42-C44 VanDerWaalsContact C-N 3.34Å; S42-C44 PolarHBondContact O-N 3.02Å; S42-V45 PolarHBondContact O-N 2.96Å; S42-A46 PolarHBondContact O-N 2.8Å; S42-F139 PolarHBondContact OG-O 3.45Å; S42-A143 WeakPolarHBondContact OG-CB 3.45Å; S42-A143 PolarHBondContact OG-N 2.9Å |
| 43 | T | 95.3 | Very high | 92 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -65.2 | -37.2 | 173.7 | 50.4 | 0 | 0 | 0 | 0 | 112.1 | Q39 L40 A46 F47 C71 A143 Y147 | Q39-T43 WeakPolarHBondContact O-CB 3.39Å; Q39-T43 WeakPolarHBondContact O-CG2 3.44Å; Q39-T43 PolarHBondContact O-N 3.06Å; Q39-T43 PolarHBondContact O-OG1 3.1Å; L40-T43 PolarHBondContact O-OG1 3.46Å; L40-T43 VanDerWaalsContact O-OG1 3.06Å; T43-A46 PolarHBondContact O-N 3.03Å; T43-F47 WeakPolarHBondContact O-CD1 3.45Å; T43-F47 PolarHBondContact O-N 3.19Å; T43-F47 VanDerWaalsContact O-N 3.11Å; T43-C71 HydrophobicContact CG2-CB 3.84Å; T43-A143 HydrophobicContact CG2-CB 3.84Å; T43-Y147 HydrophobicContact CG2-CE2 4.17Å |
| 44 | C | 95.3 | Very high | 91.8 | Very high | 39 Ų | 39 | 40.3 Ų | 40.3 | 26% | 0.264 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -59.2 | -50.1 | 174.3 | -174.3 | 0 | 0 | 0 | 0 | 112.9 | L40 I41 S42 A46 F47 S48 F72 | L40-C44 WeakPolarHBondContact O-CB 3.21Å; L40-C44 PolarHBondContact O-N 3.25Å; I41-C44 WeakPolarHBondContact O-CB 3.23Å; I41-C44 PolarHBondContact O-N 3.3Å; S42-C44 VanDerWaalsContact C-N 3.34Å; S42-C44 PolarHBondContact O-N 3.02Å; C44-A46 VanDerWaalsContact C-N 3.32Å; C44-A46 PolarHBondContact O-N 3.24Å; C44-F47 HydrophobicContact CB-CE1 4.18Å; C44-F47 HydrophobicContact CB-CZ 4.44Å; C44-S48 WeakPolarHBondContact O-CB 3.34Å; C44-S48 PolarHBondContact O-N 2.75Å; C44-S48 PolarHBondContact O-OG 2.87Å; C44-F72 HydrophobicContact CB-CD2 3.84Å; C44-F72 HydrophobicContact CB-CE2 3.82Å |
| 45 | V | 94.6 | Very high | 91 | Very high | 40 Ų | 40 | 35.7 Ų | 35.7 | 24% | 0.242 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.2 | -43.5 | 177 | 173.6 | 0 | 0 | 0 | 0 | 110.3 | I41 S42 S48 M49 V135 F139 | I41-V45 HydrophobicContact CG2-CG2 4.33Å; I41-V45 WeakPolarHBondContact O-CG2 3.46Å; I41-V45 PolarHBondContact O-N 3.45Å; S42-V45 PolarHBondContact O-N 2.96Å; V45-S48 PolarHBondContact O-N 3.41Å; V45-M49 HydrophobicContact CG1-CG 4.07Å; V45-M49 WeakPolarHBondContact O-CB 3.32Å; V45-M49 WeakPolarHBondContact O-CG 3.5Å; V45-M49 PolarHBondContact O-N 3.2Å; V45-V135 HydrophobicContact CG1-CG1 4.42Å; V45-F139 HydrophobicContact CB-CD1 4.1Å; V45-F139 HydrophobicContact CB-CD2 4.33Å; V45-F139 HydrophobicContact CB-CE1 4.38Å; V45-F139 HydrophobicContact CB-CG 4.06Å; V45-F139 HydrophobicContact CG1-CB 4.4Å; V45-F139 HydrophobicContact CG1-CD1 4.14Å; V45-F139 HydrophobicContact CG1-CD2 3.51Å; V45-F139 HydrophobicContact CG1-CE1 4.29Å; V45-F139 HydrophobicContact CG1-CE2 3.69Å; V45-F139 HydrophobicContact CG1-CG 3.75Å; V45-F139 HydrophobicContact CG1-CZ 4.08Å; V45-F139 HydrophobicContact CG2-CE1 4.4Å |
| 46 | A | 92.6 | Very high | 90 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.4 | -55.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S42 T43 C44 V50 W68 F139 | S42-A46 PolarHBondContact O-N 2.8Å; T43-A46 PolarHBondContact O-N 3.03Å; C44-A46 VanDerWaalsContact C-N 3.32Å; C44-A46 PolarHBondContact O-N 3.24Å; A46-V50 PolarHBondContact O-N 2.8Å; A46-W68 HydrophobicContact CB-CD2 3.86Å; A46-W68 HydrophobicContact CB-CE3 4.42Å; A46-W68 HydrophobicContact CB-CG 3.91Å; A46-F139 HydrophobicContact CB-CB 4.36Å |
| 47 | F | 92.3 | Very high | 88.9 | Confident | 39 Ų | 39 | 43.3 Ų | 43.3 | 17% | 0.171 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -69.9 | -34.9 | -179.8 | 75.9 | -110.8 | 0 | 0 | 0 | 112.5 | T43 C44 M49 V50 A51 M65 W68 F72 | T43-F47 WeakPolarHBondContact O-CD1 3.45Å; T43-F47 PolarHBondContact O-N 3.19Å; T43-F47 VanDerWaalsContact O-N 3.11Å; C44-F47 HydrophobicContact CB-CE1 4.18Å; C44-F47 HydrophobicContact CB-CZ 4.44Å; F47-M49 PolarHBondContact O-N 3.34Å; F47-V50 PolarHBondContact O-N 2.99Å; F47-A51 WeakPolarHBondContact O-CB 3.17Å; F47-A51 PolarHBondContact O-N 2.96Å; F47-M65 HydrophobicContact CB-CE 4.03Å; F47-M65 HydrophobicContact CB-SD 4.09Å; F47-W68 HydrophobicContact CB-CB 3.83Å; F47-W68 HydrophobicContact CB-CE3 4.23Å; F47-W68 HydrophobicContact CD1-CB 4.44Å; F47-F72 HydrophobicContact CD1-CB 4.38Å; F47-F72 HydrophobicContact CE1-CB 3.87Å; F47-F72 AromaticContact CE1-CD1 3.99Å; F47-F72 HydrophobicContact CE1-CD1 3.99Å; F47-F72 HydrophobicContact CE1-CD2 4.04Å; F47-F72 AromaticContact CE1-CG 3.69Å; F47-F72 HydrophobicContact CE1-CG 3.69Å; F47-F72 HydrophobicContact CZ-CD1 4.39Å; F47-F72 HydrophobicContact CZ-CG 4.44Å |
| 48 | S | 92.3 | Very high | 87.9 | Confident | 51 Ų | 51 | 41.5 Ų | 41.5 | 36% | 0.357 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -65.4 | -40.7 | -179.2 | -62.6 | 0 | 0 | 0 | 0 | 111.5 | C44 V45 S52 | C44-S48 WeakPolarHBondContact O-CB 3.34Å; C44-S48 PolarHBondContact O-N 2.75Å; C44-S48 PolarHBondContact O-OG 2.87Å; V45-S48 PolarHBondContact O-N 3.41Å; S48-S52 WeakPolarHBondContact O-CB 3.44Å; S48-S52 PolarHBondContact O-N 3.36Å |
| 49 | M | 89.7 | Confident | 87 | Confident | 47 Ų | 47 | 42 Ų | 42 | 23% | 0.232 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.1 | -47.8 | 176.9 | -72.3 | -60.6 | -118.2 | 0 | 0 | 111 | V45 F47 S52 V53 Y132 V135 A136 | V45-M49 HydrophobicContact CG1-CG 4.07Å; V45-M49 WeakPolarHBondContact O-CB 3.32Å; V45-M49 WeakPolarHBondContact O-CG 3.5Å; V45-M49 PolarHBondContact O-N 3.2Å; F47-M49 PolarHBondContact O-N 3.34Å; M49-S52 PolarHBondContact O-N 3.45Å; M49-S52 PolarHBondContact O-OG 3.03Å; M49-V53 WeakPolarHBondContact O-CG2 3.48Å; M49-Y132 HydrophobicContact CB-CD1 4.31Å; M49-Y132 HydrophobicContact CE-CD1 4.16Å; M49-Y132 HydrophobicContact CE-CE1 4.29Å; M49-Y132 HydrophobicContact CE-CG 4.37Å; M49-Y132 HydrophobicContact SD-CD1 3.6Å; M49-Y132 VanDerWaalsContact SD-CD1 3.6Å; M49-Y132 HydrophobicContact SD-CE1 3.74Å; M49-Y132 HydrophobicContact SD-CG 4.33Å; M49-V135 HydrophobicContact CE-CB 4Å; M49-V135 HydrophobicContact CE-CG1 3.64Å; M49-V135 HydrophobicContact CE-CG2 4.3Å; M49-V135 HydrophobicContact CG-CG1 4.2Å; M49-A136 HydrophobicContact CB-CB 4.31Å |
| 50 | V | 86.6 | Confident | 86 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -67.8 | -38.4 | -179.8 | 176.3 | 0 | 0 | 0 | 0 | 112.5 | A46 F47 S52 N54 A55 W56 M65 W68 Y116 A136 | A46-V50 PolarHBondContact O-N 2.8Å; F47-V50 PolarHBondContact O-N 2.99Å; V50-S52 VanDerWaalsContact C-N 3.35Å; V50-S52 PolarHBondContact O-N 3.45Å; V50-N54 PolarHBondContact O-N 2.93Å; V50-A55 HydrophobicContact CG1-CB 4.12Å; V50-A55 VanDerWaalsContact CG1-O 3.26Å; V50-A55 WeakPolarHBondContact CG1-O 3.29Å; V50-A55 PolarHBondContact O-N 3.4Å; V50-W56 HydrophobicContact CG1-CB 3.83Å; V50-M65 HydrophobicContact CB-SD 3.76Å; V50-M65 HydrophobicContact CG1-CG 4.14Å; V50-M65 HydrophobicContact CG1-SD 3.64Å; V50-W68 HydrophobicContact CB-CZ3 3.84Å; V50-W68 HydrophobicContact CG1-CZ3 4.17Å; V50-W68 HydrophobicContact CG2-CE3 4.45Å; V50-W68 HydrophobicContact CG2-CH2 3.7Å; V50-W68 HydrophobicContact CG2-CZ3 3.4Å; V50-W68 VanDerWaalsContact CG2-CZ3 3.4Å; V50-Y116 HydrophobicContact CG1-CE2 4.46Å; V50-Y116 HydrophobicContact CG2-CE1 4.11Å; V50-Y116 WeakPolarHBondContact CG2-OH 3.41Å; V50-A136 HydrophobicContact CG2-CB 3.36Å |
| 51 | A | 88.2 | Confident | 85.3 | Confident | 41 Ų | 41 | 43.3 Ų | 43.3 | 34% | 0.339 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62.8 | -40.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | F47 V53 N54 M65 | F47-A51 WeakPolarHBondContact O-CB 3.17Å; F47-A51 PolarHBondContact O-N 2.96Å; A51-V53 VanDerWaalsContact C-N 3.25Å; A51-V53 PolarHBondContact O-N 2.94Å; A51-N54 PolarHBondContact O-N 3.18Å; A51-N54 VanDerWaalsContact O-N 3.13Å; A51-M65 HydrophobicContact CB-CE 4.02Å |
| 52 | S | 88.3 | Confident | 84.8 | Confident | 71 Ų | 71 | 42.9 Ų | 42.9 | 50% | 0.497 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.2 | -29.6 | -175.9 | 74.2 | 0 | 0 | 0 | 0 | 114 | S48 M49 V50 Y132 | S48-S52 WeakPolarHBondContact O-CB 3.44Å; S48-S52 PolarHBondContact O-N 3.36Å; M49-S52 PolarHBondContact O-N 3.45Å; M49-S52 PolarHBondContact O-OG 3.03Å; V50-S52 VanDerWaalsContact C-N 3.35Å; V50-S52 PolarHBondContact O-N 3.45Å; S52-Y132 WeakPolarHBondContact OG-CD1 3.33Å; S52-Y132 VanDerWaalsContact OG-CE1 3.27Å; S52-Y132 WeakPolarHBondContact OG-CE1 3.24Å |
| 53 | V | 84 | Confident | 84.4 | Confident | 26 Ų | 26 | 46.4 Ų | 46.4 | 16% | 0.158 | 27% | 0.266 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.4 | 6.3 | 179.1 | -68.9 | 0 | 0 | 0 | 0 | 112.8 | M49 A51 A55 Y132 | M49-V53 WeakPolarHBondContact O-CG2 3.48Å; A51-V53 VanDerWaalsContact C-N 3.25Å; A51-V53 PolarHBondContact O-N 2.94Å; V53-A55 HydrophobicContact CB-CB 4.36Å; V53-A55 HydrophobicContact CG2-CB 3.38Å; V53-A55 PolarHBondContact O-N 3Å; V53-Y132 HydrophobicContact CG1-CD1 3.79Å; V53-Y132 HydrophobicContact CG1-CE1 4.29Å; V53-Y132 HydrophobicContact CG1-CG 3.94Å |
| 54 | N | 81.1 | Confident | 84.1 | Confident | 109 Ų | 109 | 46.4 Ų | 46.4 | 58% | 0.583 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.4 | 35.7 | -173 | -67.7 | -58.2 | 0 | 0 | 0 | 113.2 | V50 A51 W56 | V50-N54 PolarHBondContact O-N 2.93Å; A51-N54 PolarHBondContact O-N 3.18Å; A51-N54 VanDerWaalsContact O-N 3.13Å; N54-W56 PolarHBondContact O-N 3.09Å |
| 55 | A | 74.5 | Confident | 83.8 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.008 | 26% | 0.26 | C | S | . | . | trans | -85.3 | 39.7 | -174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V50 V53 Y116 Y120 M124 | V50-A55 HydrophobicContact CG1-CB 4.12Å; V50-A55 VanDerWaalsContact CG1-O 3.26Å; V50-A55 WeakPolarHBondContact CG1-O 3.29Å; V50-A55 PolarHBondContact O-N 3.4Å; V53-A55 HydrophobicContact CB-CB 4.36Å; V53-A55 HydrophobicContact CG2-CB 3.38Å; V53-A55 PolarHBondContact O-N 3Å; A55-Y116 WeakPolarHBondContact O-CE2 3.31Å; A55-Y116 PolarHBondContact O-OH 3.41Å; A55-Y120 HydrophobicContact CB-CE1 3.77Å; A55-Y120 WeakPolarHBondContact O-CE1 3.43Å; A55-M124 HydrophobicContact CB-CE 4.09Å | ||
| 56 | W | 70.6 | Confident | 83.7 | Confident | 106 Ų | 106 | 49.3 Ų | 49.3 | 40% | 0.402 | 27% | 0.272 | S | S | . | . | trans | -125.7 | 19.1 | -176.5 | 58.2 | -84.1 | 0 | 0 | 0 | 113 | V50 N54 G58 G61 N62 M65 | V50-W56 HydrophobicContact CG1-CB 3.83Å; N54-W56 PolarHBondContact O-N 3.09Å; W56-G58 PolarHBondContact O-N 2.63Å; W56-G61 CarbonylContact O-C 3.48Å; W56-N62 VanDerWaalsContact CZ3-OD1 3.27Å; W56-N62 WeakPolarHBondContact CZ3-OD1 3.2Å; W56-N62 PolarHBondContact O-N 3.13Å; W56-N62 PolarHBondContact O-OD1 3.29Å; W56-M65 HydrophobicContact CB-CG 3.4Å; W56-M65 HydrophobicContact CB-SD 4.45Å; W56-M65 HydrophobicContact CD2-CG 4.47Å; W56-M65 HydrophobicContact CG-CG 3.86Å | ||
| 57 | T | 69.9 | Low | 83.7 | Confident | 80 Ų | 80 | 49.3 Ų | 49.3 | 49% | 0.491 | 27% | 0.272 | S | S | . | . | trans | -67.6 | 129.7 | -176.4 | 55.4 | 0 | 0 | 0 | 0 | 112.2 | Y120 | T57-Y120 PolarHBondContact N-OH 3.47Å; T57-Y120 WeakPolarHBondContact O-CE2 3.43Å; T57-Y120 PolarHBondContact OG1-OH 3.12Å | ||
| 58 | G | 72.6 | Confident | 83.8 | Confident | 29 Ų | 29 | 47.5 Ų | 47.5 | 30% | 0.299 | 26% | 0.264 | S | S | . | . | S | Bend | trans | 95.8 | 171.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | W56 M60 G61 N62 | W56-G58 PolarHBondContact O-N 2.63Å; G58-M60 VanDerWaalsContact C-N 3.29Å; G58-M60 PolarHBondContact O-N 3.15Å; G58-G61 PolarHBondContact O-N 2.84Å; G58-N62 VanDerWaalsContact O-CG 3.28Å; G58-N62 PolarHBondContact O-N 2.95Å |
| 59 | P | 75.1 | Confident | 83.9 | Confident | 92 Ų | 92 | 47.5 Ų | 47.5 | 60% | 0.597 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -58.9 | -36.4 | -171.1 | -25.6 | 34.7 | 0 | 0 | 0 | 114.1 | W63 | P59-W63 PolarHBondContact O-N 2.82Å |
| 60 | M | 77.1 | Confident | 84.1 | Confident | 50 Ų | 50 | 49 Ų | 49 | 25% | 0.246 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -75.9 | -35.9 | -178.1 | -57.5 | -56.3 | 154.6 | 0 | 0 | 112.5 | G58 W63 A64 I115 T119 | G58-M60 VanDerWaalsContact C-N 3.29Å; G58-M60 PolarHBondContact O-N 3.15Å; M60-W63 PolarHBondContact O-N 3.44Å; M60-A64 PolarHBondContact O-N 3.41Å; M60-I115 HydrophobicContact CB-CG2 3.84Å; M60-I115 HydrophobicContact CG-CG2 4.07Å; M60-I115 HydrophobicContact SD-CG2 3.72Å; M60-T119 WeakPolarHBondContact CB-OG1 3.42Å; M60-T119 HydrophobicContact CG-CG2 4.23Å |
| 61 | G | 79.9 | Confident | 84.5 | Confident | 1 Ų | 1 | 49 Ų | 49 | 1% | 0.01 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.8 | -41.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | W56 G58 W63 A64 M65 | W56-G61 CarbonylContact O-C 3.48Å; G58-G61 PolarHBondContact O-N 2.84Å; G61-W63 VanDerWaalsContact C-N 3.32Å; G61-W63 PolarHBondContact O-N 3.38Å; G61-A64 PolarHBondContact O-N 2.9Å; G61-M65 PolarHBondContact O-N 3.37Å |
| 62 | N | 85.1 | Confident | 84.9 | Confident | 78 Ų | 78 | 49.6 Ų | 49.6 | 42% | 0.417 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -57.5 | -43.7 | 173 | -70 | -11.5 | 0 | 0 | 0 | 111.8 | W56 G58 M65 F66 | W56-N62 VanDerWaalsContact CZ3-OD1 3.27Å; W56-N62 WeakPolarHBondContact CZ3-OD1 3.2Å; W56-N62 PolarHBondContact O-N 3.13Å; W56-N62 PolarHBondContact O-OD1 3.29Å; G58-N62 VanDerWaalsContact O-CG 3.28Å; G58-N62 PolarHBondContact O-N 2.95Å; N62-M65 PolarHBondContact O-N 2.95Å; N62-F66 VanDerWaalsContact O-CB 3.29Å; N62-F66 WeakPolarHBondContact O-CB 3.32Å; N62-F66 PolarHBondContact O-N 2.83Å |
| 63 | W | 86.7 | Confident | 85.3 | Confident | 74 Ų | 74 | 48.5 Ų | 48.5 | 28% | 0.28 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.6 | -45.3 | 176.9 | 176.1 | -103.2 | 0 | 0 | 0 | 112.6 | P59 M60 G61 F66 T67 F108 S111 | P59-W63 PolarHBondContact O-N 2.82Å; M60-W63 PolarHBondContact O-N 3.44Å; G61-W63 VanDerWaalsContact C-N 3.32Å; G61-W63 PolarHBondContact O-N 3.38Å; W63-F66 PolarHBondContact O-N 2.97Å; W63-T67 VanDerWaalsContact O-CB 3.32Å; W63-T67 WeakPolarHBondContact O-CB 3.23Å; W63-T67 PolarHBondContact O-N 2.95Å; W63-T67 PolarHBondContact O-OG1 2.91Å; W63-F108 AromaticContact CH2-CD1 3.95Å; W63-F108 HydrophobicContact CH2-CD1 3.95Å; W63-F108 AromaticContact CH2-CE1 3.68Å; W63-F108 HydrophobicContact CH2-CE1 3.68Å; W63-F108 AromaticContact CZ2-CD1 3.71Å; W63-F108 HydrophobicContact CZ2-CD1 3.71Å; W63-F108 AromaticContact CZ2-CE1 3.91Å; W63-F108 HydrophobicContact CZ2-CE1 3.91Å; W63-S111 PolarHBondContact NE1-OG 3.14Å; W63-S111 VanDerWaalsContact NE1-OG 3.12Å |
| 64 | A | 88.8 | Confident | 85.8 | Confident | 1 Ų | 1 | 48.4 Ų | 48.4 | 1% | 0.008 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.7 | -46.2 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | M60 G61 T67 W68 Y116 | M60-A64 PolarHBondContact O-N 3.41Å; G61-A64 PolarHBondContact O-N 2.9Å; A64-T67 WeakPolarHBondContact O-CB 3.4Å; A64-T67 PolarHBondContact O-N 3.09Å; A64-W68 HydrophobicContact CB-CE3 4.38Å; A64-W68 HydrophobicContact CB-CH2 3.67Å; A64-W68 HydrophobicContact CB-CZ2 3.95Å; A64-W68 HydrophobicContact CB-CZ3 3.89Å; A64-W68 VanDerWaalsContact O-CE3 3.3Å; A64-W68 PolarHBondContact O-N 3.12Å; A64-Y116 HydrophobicContact CB-CD2 3.94Å; A64-Y116 HydrophobicContact CB-CG 4.31Å |
| 65 | M | 90.5 | Very high | 86.4 | Confident | 27 Ų | 27 | 43.3 Ų | 43.3 | 13% | 0.133 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.4 | -46.9 | 175.9 | -77.3 | -59.8 | -71.4 | 0 | 0 | 112.4 | F47 V50 A51 W56 G61 N62 T67 W68 C69 | F47-M65 HydrophobicContact CB-CE 4.03Å; F47-M65 HydrophobicContact CB-SD 4.09Å; V50-M65 HydrophobicContact CB-SD 3.76Å; V50-M65 HydrophobicContact CG1-CG 4.14Å; V50-M65 HydrophobicContact CG1-SD 3.64Å; A51-M65 HydrophobicContact CB-CE 4.02Å; W56-M65 HydrophobicContact CB-CG 3.4Å; W56-M65 HydrophobicContact CB-SD 4.45Å; W56-M65 HydrophobicContact CD2-CG 4.47Å; W56-M65 HydrophobicContact CG-CG 3.86Å; G61-M65 PolarHBondContact O-N 3.37Å; N62-M65 PolarHBondContact O-N 2.95Å; M65-T67 VanDerWaalsContact C-N 3.31Å; M65-T67 PolarHBondContact O-N 3.25Å; M65-W68 PolarHBondContact O-N 2.73Å; M65-W68 HydrophobicContact SD-CE3 3.89Å; M65-W68 HydrophobicContact SD-CZ3 3.99Å; M65-C69 WeakPolarHBondContact O-CB 2.98Å; M65-C69 PolarHBondContact O-N 3.5Å; M65-C69 PolarHBondContact O-SG 3.34Å |
| 66 | F | 91.6 | Very high | 87.4 | Confident | 112 Ų | 112 | 46.4 Ų | 46.4 | 49% | 0.491 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -56.5 | -48 | 175.5 | 171.4 | -100 | 0 | 0 | 0 | 111 | N62 W63 W68 C69 F70 | N62-F66 VanDerWaalsContact O-CB 3.29Å; N62-F66 WeakPolarHBondContact O-CB 3.32Å; N62-F66 PolarHBondContact O-N 2.83Å; W63-F66 PolarHBondContact O-N 2.97Å; F66-W68 PolarHBondContact O-N 3.12Å; F66-C69 PolarHBondContact O-N 3.39Å; F66-F70 HydrophobicContact CZ-CB 4.35Å; F66-F70 HydrophobicContact CZ-CD2 4.46Å; F66-F70 HydrophobicContact CZ-CG 4.38Å; F66-F70 WeakPolarHBondContact O-CB 3.39Å; F66-F70 PolarHBondContact O-N 2.87Å |
| 67 | T | 92.5 | Very high | 88.4 | Confident | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -55.5 | -54.2 | 178.7 | -71 | 0 | 0 | 0 | 0 | 111.9 | W63 A64 M65 F70 C71 F108 S112 | W63-T67 VanDerWaalsContact O-CB 3.32Å; W63-T67 WeakPolarHBondContact O-CB 3.23Å; W63-T67 PolarHBondContact O-N 2.95Å; W63-T67 PolarHBondContact O-OG1 2.91Å; A64-T67 WeakPolarHBondContact O-CB 3.4Å; A64-T67 PolarHBondContact O-N 3.09Å; M65-T67 VanDerWaalsContact C-N 3.31Å; M65-T67 PolarHBondContact O-N 3.25Å; T67-F70 PolarHBondContact O-N 3.42Å; T67-C71 VanDerWaalsContact O-CB 3.32Å; T67-C71 WeakPolarHBondContact O-CB 3.11Å; T67-C71 PolarHBondContact O-N 3.3Å; T67-C71 PolarHBondContact O-SG 2.87Å; T67-F108 HydrophobicContact CG2-CB 3.56Å; T67-S112 VanDerWaalsContact CB-OG 3.29Å; T67-S112 WeakPolarHBondContact CB-OG 3.28Å; T67-S112 VanDerWaalsContact CG2-OG 3.32Å; T67-S112 WeakPolarHBondContact CG2-OG 3.48Å; T67-S112 PolarHBondContact OG1-OG 3.07Å |
| 68 | W | 95 | Very high | 89.4 | Confident | 1 Ų | 1 | 40.9 Ų | 40.9 | 0% | 0.004 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.4 | -42.5 | -176 | -60.6 | -39.6 | 0 | 0 | 0 | 112 | A46 F47 V50 A64 M65 F66 F72 Y116 A136 S140 | A46-W68 HydrophobicContact CB-CD2 3.86Å; A46-W68 HydrophobicContact CB-CE3 4.42Å; A46-W68 HydrophobicContact CB-CG 3.91Å; F47-W68 HydrophobicContact CB-CB 3.83Å; F47-W68 HydrophobicContact CB-CE3 4.23Å; F47-W68 HydrophobicContact CD1-CB 4.44Å; V50-W68 HydrophobicContact CB-CZ3 3.84Å; V50-W68 HydrophobicContact CG1-CZ3 4.17Å; V50-W68 HydrophobicContact CG2-CE3 4.45Å; V50-W68 HydrophobicContact CG2-CH2 3.7Å; V50-W68 HydrophobicContact CG2-CZ3 3.4Å; V50-W68 VanDerWaalsContact CG2-CZ3 3.4Å; A64-W68 HydrophobicContact CB-CE3 4.38Å; A64-W68 HydrophobicContact CB-CH2 3.67Å; A64-W68 HydrophobicContact CB-CZ2 3.95Å; A64-W68 HydrophobicContact CB-CZ3 3.89Å; A64-W68 VanDerWaalsContact O-CE3 3.3Å; A64-W68 PolarHBondContact O-N 3.12Å; M65-W68 PolarHBondContact O-N 2.73Å; M65-W68 HydrophobicContact SD-CE3 3.89Å; M65-W68 HydrophobicContact SD-CZ3 3.99Å; F66-W68 PolarHBondContact O-N 3.12Å; W68-F72 VanDerWaalsContact O-CB 3.31Å; W68-F72 WeakPolarHBondContact O-CB 3.26Å; W68-F72 PolarHBondContact O-N 2.92Å; W68-Y116 HydrophobicContact CH2-CD1 4.04Å; W68-Y116 HydrophobicContact CH2-CD2 4.33Å; W68-Y116 HydrophobicContact CH2-CE1 4.13Å; W68-Y116 HydrophobicContact CH2-CE2 4.45Å; W68-Y116 HydrophobicContact CH2-CG 4.13Å; W68-A136 HydrophobicContact CH2-CB 4.21Å; W68-S140 VanDerWaalsContact NE1-CB 3.31Å; W68-S140 PolarHBondContact NE1-OG 3.35Å |
| 69 | C | 94.6 | Very high | 90.3 | Very high | 51 Ų | 51 | 40 Ų | 40 | 35% | 0.345 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -64.9 | -44 | 177.2 | -69.8 | 0 | 0 | 0 | 0 | 112.1 | M65 F66 F72 A73 | M65-C69 WeakPolarHBondContact O-CB 2.98Å; M65-C69 PolarHBondContact O-N 3.5Å; M65-C69 PolarHBondContact O-SG 3.34Å; F66-C69 PolarHBondContact O-N 3.39Å; C69-F72 PolarHBondContact O-N 3.12Å; C69-A73 WeakPolarHBondContact O-CB 3.34Å; C69-A73 PolarHBondContact O-N 3.13Å |
| 70 | F | 94.2 | Very high | 91 | Very high | 79 Ų | 79 | 40.1 Ų | 40.1 | 35% | 0.346 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -63.1 | -46.6 | 177.4 | 178.5 | -104.8 | 0 | 0 | 0 | 111.2 | F66 T67 F72 A73 V74 F101 F108 | F66-F70 HydrophobicContact CZ-CB 4.35Å; F66-F70 HydrophobicContact CZ-CD2 4.46Å; F66-F70 HydrophobicContact CZ-CG 4.38Å; F66-F70 WeakPolarHBondContact O-CB 3.39Å; F66-F70 PolarHBondContact O-N 2.87Å; T67-F70 PolarHBondContact O-N 3.42Å; F70-F72 PolarHBondContact O-N 3.47Å; F70-A73 PolarHBondContact O-N 2.94Å; F70-V74 HydrophobicContact CD2-CG2 4.16Å; F70-V74 HydrophobicContact CE1-CG2 4.37Å; F70-V74 HydrophobicContact CE2-CG2 3.78Å; F70-V74 HydrophobicContact CZ-CG2 3.9Å; F70-V74 WeakPolarHBondContact O-CG2 3.32Å; F70-V74 PolarHBondContact O-N 2.74Å; F70-F101 HydrophobicContact CD1-CE2 4.45Å; F70-F101 HydrophobicContact CE1-CD2 4.47Å; F70-F101 AromaticContact CE1-CE2 3.95Å; F70-F101 HydrophobicContact CE1-CE2 3.95Å; F70-F108 HydrophobicContact CE1-CE2 4.34Å |
| 71 | C | 95.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.4 | -44.5 | 177.3 | -66.9 | 0 | 0 | 0 | 0 | 111.4 | T43 T67 T75 Y147 | T43-C71 HydrophobicContact CG2-CB 3.84Å; T67-C71 VanDerWaalsContact O-CB 3.32Å; T67-C71 WeakPolarHBondContact O-CB 3.11Å; T67-C71 PolarHBondContact O-N 3.3Å; T67-C71 PolarHBondContact O-SG 2.87Å; C71-T75 VanDerWaalsContact O-CB 3.25Å; C71-T75 WeakPolarHBondContact O-CB 3.35Å; C71-T75 PolarHBondContact O-N 3.41Å; C71-T75 PolarHBondContact O-OG1 3.18Å; C71-Y147 HydrophobicContact CB-CE2 4.22Å; C71-Y147 PolarHBondContact O-OH 2.71Å |
| 72 | F | 95.9 | Very high | 91.9 | Very high | 53 Ų | 53 | 40 Ų | 40 | 23% | 0.232 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.1 | -51.2 | 175.5 | 172.7 | -96.7 | 0 | 0 | 0 | 112.1 | L40 C44 F47 W68 C69 F70 V74 T75 L76 | L40-F72 HydrophobicContact CD1-CD2 3.43Å; L40-F72 VanDerWaalsContact CD1-CD2 3.43Å; L40-F72 HydrophobicContact CD1-CE2 3.49Å; L40-F72 VanDerWaalsContact CD1-CE2 3.49Å; L40-F72 HydrophobicContact CD1-CG 4.18Å; L40-F72 HydrophobicContact CD1-CZ 4.27Å; L40-F72 WeakPolarHBondContact CD1-O 3.32Å; L40-F72 HydrophobicContact CD2-CE2 4.44Å; L40-F72 HydrophobicContact CG-CD2 3.9Å; L40-F72 HydrophobicContact CG-CE2 3.72Å; C44-F72 HydrophobicContact CB-CD2 3.84Å; C44-F72 HydrophobicContact CB-CE2 3.82Å; F47-F72 HydrophobicContact CD1-CB 4.38Å; F47-F72 HydrophobicContact CE1-CB 3.87Å; F47-F72 AromaticContact CE1-CD1 3.99Å; F47-F72 HydrophobicContact CE1-CD1 3.99Å; F47-F72 HydrophobicContact CE1-CD2 4.04Å; F47-F72 AromaticContact CE1-CG 3.69Å; F47-F72 HydrophobicContact CE1-CG 3.69Å; F47-F72 HydrophobicContact CZ-CD1 4.39Å; F47-F72 HydrophobicContact CZ-CG 4.44Å; W68-F72 VanDerWaalsContact O-CB 3.31Å; W68-F72 WeakPolarHBondContact O-CB 3.26Å; W68-F72 PolarHBondContact O-N 2.92Å; C69-F72 PolarHBondContact O-N 3.12Å; F70-F72 PolarHBondContact O-N 3.47Å; F72-V74 PolarHBondContact O-N 3.07Å; F72-T75 PolarHBondContact O-N 3.39Å; F72-L76 HydrophobicContact CE1-CD2 4.26Å; F72-L76 HydrophobicContact CZ-CD2 4.41Å; F72-L76 WeakPolarHBondContact O-CB 3.34Å; F72-L76 PolarHBondContact O-N 2.79Å |
| 73 | A | 96 | Very high | 91.9 | Very high | 48 Ų | 48 | 39.2 Ų | 39.2 | 40% | 0.397 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62 | -45.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | C69 F70 L76 V77 | C69-A73 WeakPolarHBondContact O-CB 3.34Å; C69-A73 PolarHBondContact O-N 3.13Å; F70-A73 PolarHBondContact O-N 2.94Å; A73-L76 WeakPolarHBondContact O-CB 3.36Å; A73-L76 PolarHBondContact O-N 2.87Å; A73-V77 WeakPolarHBondContact O-CG2 3.31Å; A73-V77 PolarHBondContact O-N 3.08Å |
| 74 | V | 94.5 | Very high | 91.7 | Very high | 25 Ų | 25 | 36.7 Ų | 36.7 | 15% | 0.152 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -71.9 | -39.2 | -179 | 179 | 0 | 0 | 0 | 0 | 111.3 | F70 F72 L76 V77 I78 F97 F101 | F70-V74 HydrophobicContact CD2-CG2 4.16Å; F70-V74 HydrophobicContact CE1-CG2 4.37Å; F70-V74 HydrophobicContact CE2-CG2 3.78Å; F70-V74 HydrophobicContact CZ-CG2 3.9Å; F70-V74 WeakPolarHBondContact O-CG2 3.32Å; F70-V74 PolarHBondContact O-N 2.74Å; F72-V74 PolarHBondContact O-N 3.07Å; V74-L76 VanDerWaalsContact C-N 3.28Å; V74-L76 PolarHBondContact O-N 2.97Å; V74-V77 PolarHBondContact O-N 3.21Å; V74-V77 VanDerWaalsContact O-N 3.16Å; V74-I78 HydrophobicContact CG1-CD1 4.14Å; V74-I78 HydrophobicContact CG1-CG1 4.48Å; V74-I78 WeakPolarHBondContact O-CG1 3.3Å; V74-I78 PolarHBondContact O-N 3.46Å; V74-F97 HydrophobicContact CG1-CZ 4.15Å; V74-F101 HydrophobicContact CB-CD2 4.02Å; V74-F101 HydrophobicContact CB-CE1 4.08Å; V74-F101 HydrophobicContact CB-CE2 3.38Å; V74-F101 HydrophobicContact CB-CZ 3.41Å; V74-F101 VanDerWaalsContact CB-CZ 3.41Å; V74-F101 HydrophobicContact CG1-CD1 3.88Å; V74-F101 HydrophobicContact CG1-CD2 3.44Å; V74-F101 VanDerWaalsContact CG1-CD2 3.44Å; V74-F101 HydrophobicContact CG1-CE1 3.79Å; V74-F101 HydrophobicContact CG1-CE2 3.35Å; V74-F101 HydrophobicContact CG1-CG 3.7Å; V74-F101 HydrophobicContact CG1-CZ 3.53Å; V74-F101 HydrophobicContact CG2-CE2 3.94Å; V74-F101 HydrophobicContact CG2-CZ 4.4Å |
| 75 | T | 94.8 | Very high | 91.4 | Very high | 2 Ų | 2 | 38.7 Ų | 38.7 | 1% | 0.012 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.2 | -37.5 | 173.7 | -63.9 | 0 | 0 | 0 | 0 | 111.8 | Q39 L40 C71 F72 I78 L79 F101 Y147 | Q39-T75 HydrophobicContact CB-CG2 4.32Å; L40-T75 HydrophobicContact CB-CG2 4.09Å; L40-T75 HydrophobicContact CD1-CG2 4.2Å; C71-T75 VanDerWaalsContact O-CB 3.25Å; C71-T75 WeakPolarHBondContact O-CB 3.35Å; C71-T75 PolarHBondContact O-N 3.41Å; C71-T75 PolarHBondContact O-OG1 3.18Å; F72-T75 PolarHBondContact O-N 3.39Å; T75-I78 PolarHBondContact O-N 3.33Å; T75-L79 HydrophobicContact CG2-CD1 4.34Å; T75-L79 WeakPolarHBondContact O-CG 2.77Å; T75-L79 PolarHBondContact O-N 3.01Å; T75-F101 WeakPolarHBondContact OG1-CE1 3.42Å; T75-Y147 PolarHBondContact OG1-OH 2.87Å |
| 76 | L | 93.8 | Very high | 91.1 | Very high | 66 Ų | 66 | 40 Ų | 40 | 35% | 0.346 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -62.3 | -46.1 | 172.9 | -176.2 | 63.9 | 0 | 0 | 0 | 111.4 | L40 F72 A73 V74 I78 L79 I80 | L40-L76 HydrophobicContact CD1-CB 3.82Å; L40-L76 HydrophobicContact CD1-CD1 4.39Å; L40-L76 HydrophobicContact CD2-CD1 4.24Å; F72-L76 HydrophobicContact CE1-CD2 4.26Å; F72-L76 HydrophobicContact CZ-CD2 4.41Å; F72-L76 WeakPolarHBondContact O-CB 3.34Å; F72-L76 PolarHBondContact O-N 2.79Å; A73-L76 WeakPolarHBondContact O-CB 3.36Å; A73-L76 PolarHBondContact O-N 2.87Å; V74-L76 VanDerWaalsContact C-N 3.28Å; V74-L76 PolarHBondContact O-N 2.97Å; L76-I78 VanDerWaalsContact C-N 3.32Å; L76-I78 PolarHBondContact O-N 2.94Å; L76-L79 PolarHBondContact O-N 2.99Å; L76-I80 HydrophobicContact CD1-CD1 4.28Å; L76-I80 HydrophobicContact CG-CD1 3.91Å; L76-I80 VanDerWaalsContact O-CG1 3.27Å; L76-I80 WeakPolarHBondContact O-CG1 3.35Å; L76-I80 PolarHBondContact O-N 2.83Å |
| 77 | V | 92.4 | Very high | 90.7 | Very high | 67 Ų | 67 | 38.8 Ų | 38.8 | 41% | 0.406 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -59.7 | -43.7 | 175.7 | 170.2 | 0 | 0 | 0 | 0 | 110.9 | A73 V74 L79 I80 V81 | A73-V77 WeakPolarHBondContact O-CG2 3.31Å; A73-V77 PolarHBondContact O-N 3.08Å; V74-V77 PolarHBondContact O-N 3.21Å; V74-V77 VanDerWaalsContact O-N 3.16Å; V77-L79 PolarHBondContact O-N 2.98Å; V77-I80 PolarHBondContact O-N 3.36Å; V77-V81 HydrophobicContact CG1-CG2 4.36Å; V77-V81 WeakPolarHBondContact O-CG2 3.48Å; V77-V81 PolarHBondContact O-N 3.38Å |
| 78 | I | 91.3 | Very high | 89.9 | Confident | 3 Ų | 3 | 43.8 Ų | 43.8 | 2% | 0.015 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.4 | -50.5 | 176.9 | -70.3 | 168.5 | 0 | 0 | 0 | 110.2 | R36 V74 T75 L76 I80 V81 E82 W94 F97 F101 | R36-I78 VanDerWaalsContact NH1-CG2 3.28Å; V74-I78 HydrophobicContact CG1-CD1 4.14Å; V74-I78 HydrophobicContact CG1-CG1 4.48Å; V74-I78 WeakPolarHBondContact O-CG1 3.3Å; V74-I78 PolarHBondContact O-N 3.46Å; T75-I78 PolarHBondContact O-N 3.33Å; L76-I78 VanDerWaalsContact C-N 3.32Å; L76-I78 PolarHBondContact O-N 2.94Å; I78-I80 VanDerWaalsContact C-N 3.35Å; I78-I80 PolarHBondContact O-N 3.04Å; I78-V81 PolarHBondContact O-N 3.42Å; I78-E82 WeakPolarHBondContact O-CG 3.4Å; I78-E82 PolarHBondContact O-N 2.89Å; I78-W94 HydrophobicContact CG2-CH2 4.42Å; I78-W94 HydrophobicContact CG2-CZ2 4.27Å; I78-F97 HydrophobicContact CD1-CE1 4.19Å; I78-F97 HydrophobicContact CG1-CE1 3.97Å; I78-F101 HydrophobicContact CD1-CD1 3.39Å; I78-F101 HydrophobicContact CD1-CE1 3.89Å; I78-F101 HydrophobicContact CD1-CG 4.15Å |
| 79 | L | 90.8 | Very high | 89.2 | Confident | 10 Ų | 10 | 52.4 Ų | 52.4 | 5% | 0.052 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -60.5 | -41.7 | 178.3 | -74.4 | 171 | 0 | 0 | 0 | 112.4 | L28 R36 L40 T75 L76 V77 E82 L83 | L28-L79 HydrophobicContact CD2-CD2 4.05Å; R36-L79 HydrophobicContact CB-CD2 3.82Å; R36-L79 HydrophobicContact CB-CG 4.3Å; L40-L79 HydrophobicContact CB-CD1 4.35Å; L40-L79 HydrophobicContact CD2-CD1 3.96Å; T75-L79 HydrophobicContact CG2-CD1 4.34Å; T75-L79 WeakPolarHBondContact O-CG 2.77Å; T75-L79 PolarHBondContact O-N 3.01Å; L76-L79 PolarHBondContact O-N 2.99Å; V77-L79 PolarHBondContact O-N 2.98Å; L79-E82 PolarHBondContact O-N 3.43Å; L79-L83 WeakPolarHBondContact O-CB 3.33Å; L79-L83 VanDerWaalsContact O-CG 3.25Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 2.99Å |
| 80 | I | 89.8 | Confident | 88.7 | Confident | 95 Ų | 95 | 52.4 Ų | 52.4 | 49% | 0.487 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 177.1 | -70.8 | 167.3 | 0 | 0 | 0 | 111 | L76 V77 I78 G84 | L76-I80 HydrophobicContact CD1-CD1 4.28Å; L76-I80 HydrophobicContact CG-CD1 3.91Å; L76-I80 VanDerWaalsContact O-CG1 3.27Å; L76-I80 WeakPolarHBondContact O-CG1 3.35Å; L76-I80 PolarHBondContact O-N 2.83Å; V77-I80 PolarHBondContact O-N 3.36Å; I78-I80 VanDerWaalsContact C-N 3.35Å; I78-I80 PolarHBondContact O-N 3.04Å; I80-G84 PolarHBondContact O-N 3.45Å |
| 81 | V | 88.6 | Confident | 88 | Confident | 13 Ų | 13 | 54.1 Ų | 54.1 | 8% | 0.079 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67.1 | -38.4 | 179.8 | 171.1 | 0 | 0 | 0 | 0 | 111.4 | V77 I78 G84 G85 L86 F90 W94 | V77-V81 HydrophobicContact CG1-CG2 4.36Å; V77-V81 WeakPolarHBondContact O-CG2 3.48Å; V77-V81 PolarHBondContact O-N 3.38Å; I78-V81 PolarHBondContact O-N 3.42Å; V81-G84 CarbonylContact O-C 3.53Å; V81-G84 PolarHBondContact O-N 3.3Å; V81-G85 PolarHBondContact O-N 3.22Å; V81-L86 HydrophobicContact CG1-CB 4.09Å; V81-L86 PolarHBondContact O-N 3.48Å; V81-F90 HydrophobicContact CG2-CD2 4.25Å; V81-F90 HydrophobicContact CG2-CE2 4.46Å; V81-W94 HydrophobicContact CB-CH2 3.47Å; V81-W94 VanDerWaalsContact CB-CH2 3.47Å; V81-W94 HydrophobicContact CB-CZ2 4.15Å; V81-W94 HydrophobicContact CB-CZ3 3.94Å; V81-W94 HydrophobicContact CG1-CD2 4.45Å; V81-W94 HydrophobicContact CG1-CE3 3.99Å; V81-W94 HydrophobicContact CG1-CH2 3.26Å; V81-W94 HydrophobicContact CG1-CZ2 3.78Å; V81-W94 HydrophobicContact CG1-CZ3 3.38Å; V81-W94 HydrophobicContact CG2-CH2 4.22Å; V81-W94 HydrophobicContact CG2-CZ3 4.35Å |
| 82 | E | 87.8 | Confident | 87.6 | Confident | 35 Ų | 35 | 57.1 Ų | 57.1 | 16% | 0.164 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -70.4 | -45.3 | 176.3 | -68.3 | -167.2 | 145 | 0 | 0 | 112.8 | R36 I78 L79 G84 G85 W94 | R36-E82 IonicContact CZ-OE1 2.68Å; R36-E82 IonicContact CZ-OE2 2.65Å; R36-E82 IonicContact NH1-OE1 3.85Å; R36-E82 PolarHBondContact NH1-OE1 2.88Å; R36-E82 IonicContact NH1-OE2 3.89Å; R36-E82 PolarHBondContact NH1-OE2 3.39Å; I78-E82 WeakPolarHBondContact O-CG 3.4Å; I78-E82 PolarHBondContact O-N 2.89Å; L79-E82 PolarHBondContact O-N 3.43Å; E82-G84 PolarHBondContact O-N 3.48Å; E82-G85 PolarHBondContact O-N 3.34Å; E82-W94 HydrophobicContact CG-CZ2 3.66Å |
| 83 | L | 85.9 | Confident | 87.1 | Confident | 61 Ų | 61 | 55.1 Ų | 55.1 | 32% | 0.319 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.9 | -39.1 | 173.5 | -80.1 | 173.9 | 0 | 0 | 0 | 111.2 | G23 L28 L79 G85 | G23-L83 WeakPolarHBondContact CA-O 3.1Å; L28-L83 HydrophobicContact CD1-CD1 4.09Å; L28-L83 HydrophobicContact CD1-CD2 3.69Å; L28-L83 HydrophobicContact CD1-CG 4.38Å; L28-L83 HydrophobicContact CD2-CD1 4.42Å; L28-L83 HydrophobicContact CD2-CD2 4.49Å; L28-L83 HydrophobicContact CG-CD1 4.36Å; L28-L83 HydrophobicContact CG-CD2 3.69Å; L28-L83 HydrophobicContact CG-CG 4.28Å; L79-L83 WeakPolarHBondContact O-CB 3.33Å; L79-L83 VanDerWaalsContact O-CG 3.25Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 2.99Å; L83-G85 VanDerWaalsContact C-N 3.28Å; L83-G85 PolarHBondContact O-N 2.9Å |
| 84 | G | 82.6 | Confident | 86.6 | Confident | 21 Ų | 21 | 54.5 Ų | 54.5 | 22% | 0.216 | 31% | 0.307 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.9 | -1.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114 | I21 I80 V81 E82 L86 | I21-G84 WeakPolarHBondContact CG2-O 3.14Å; I80-G84 PolarHBondContact O-N 3.45Å; V81-G84 CarbonylContact O-C 3.53Å; V81-G84 PolarHBondContact O-N 3.3Å; E82-G84 PolarHBondContact O-N 3.48Å; G84-L86 WeakPolarHBondContact O-CG 3.26Å; G84-L86 PolarHBondContact O-N 3.49Å |
| 85 | G | 82.2 | Confident | 86.2 | Confident | 44 Ų | 44 | 61 Ų | 61 | 45% | 0.454 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.2 | 24.8 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | V81 E82 L83 Q87 | V81-G85 PolarHBondContact O-N 3.22Å; E82-G85 PolarHBondContact O-N 3.34Å; L83-G85 VanDerWaalsContact C-N 3.28Å; L83-G85 PolarHBondContact O-N 2.9Å; G85-Q87 PolarHBondContact O-N 3.33Å |
| 86 | L | 83.5 | Confident | 85.9 | Confident | 54 Ų | 54 | 61.2 Ų | 61.2 | 28% | 0.283 | 33% | 0.33 | S | S | . | . | trans | -87.7 | 13.3 | -172.4 | -63.5 | 176.9 | 0 | 0 | 0 | 113.2 | I21 V81 G84 A88 R89 F90 | I21-L86 HydrophobicContact CD1-CD2 3.88Å; V81-L86 HydrophobicContact CG1-CB 4.09Å; V81-L86 PolarHBondContact O-N 3.48Å; G84-L86 WeakPolarHBondContact O-CG 3.26Å; G84-L86 PolarHBondContact O-N 3.49Å; L86-A88 PolarHBondContact O-N 2.97Å; L86-R89 PolarHBondContact O-N 3.21Å; L86-F90 PolarHBondContact O-N 3.35Å | ||
| 87 | Q | 83.1 | Confident | 85.8 | Confident | 86 Ų | 86 | 59.8 Ų | 59.8 | 40% | 0.402 | 32% | 0.321 | S | S | . | . | G | 310 helix | trans | -53.9 | -40.4 | -173.6 | -59.2 | 179.3 | -33.4 | 0 | 0 | 112.5 | G85 R89 F90 W94 | G85-Q87 PolarHBondContact O-N 3.33Å; Q87-R89 VanDerWaalsContact C-N 3.31Å; Q87-R89 PolarHBondContact O-N 3.1Å; Q87-F90 PolarHBondContact O-N 2.66Å; Q87-W94 HydrophobicContact CB-CB 4.37Å; Q87-W94 HydrophobicContact CB-CD2 4.11Å; Q87-W94 HydrophobicContact CB-CG 3.81Å; Q87-W94 HydrophobicContact CG-CD2 4.06Å; Q87-W94 HydrophobicContact CG-CG 4.03Å; Q87-W94 HydrophobicContact CG-CZ2 4.47Å; Q87-W94 VanDerWaalsContact NE2-NE1 3.13Å |
| 88 | A | 76.9 | Confident | 85.8 | Confident | 105 Ų | 105 | 57 Ų | 57 | 87% | 0.868 | 30% | 0.304 | S | S | * | . | G | 310 helix | trans | -74 | -16.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | L86 | L86-A88 PolarHBondContact O-N 2.97Š|
| 89 | R | 79.9 | Confident | 85.8 | Confident | 183 Ų | 183 | 57.1 Ų | 57.1 | 69% | 0.691 | 31% | 0.305 | S | S | * | . | G | 310 helix | trans | -98.2 | -3.7 | 179 | -65.3 | -160.3 | -75.5 | -176 | -3.8 | 112.9 | L86 Q87 | L86-R89 PolarHBondContact O-N 3.21Å; Q87-R89 VanDerWaalsContact C-N 3.31Å; Q87-R89 PolarHBondContact O-N 3.1Å |
| 90 | F | 82.8 | Confident | 85.9 | Confident | 51 Ų | 51 | 56.9 Ų | 56.9 | 22% | 0.224 | 30% | 0.304 | C | S | . | . | S | Bend | trans | -72.8 | 135.4 | 178.6 | -158.4 | -104.9 | 0 | 0 | 0 | 109.6 | V81 L86 Q87 L92 W94 F97 | V81-F90 HydrophobicContact CG2-CD2 4.25Å; V81-F90 HydrophobicContact CG2-CE2 4.46Å; L86-F90 PolarHBondContact O-N 3.35Å; Q87-F90 PolarHBondContact O-N 2.66Å; F90-L92 HydrophobicContact CD1-CB 3.86Å; F90-L92 HydrophobicContact CE1-CB 3.84Å; F90-L92 HydrophobicContact CE1-CD1 4.12Å; F90-L92 HydrophobicContact CE1-CG 4.12Å; F90-L92 PolarHBondContact O-N 2.89Å; F90-W94 HydrophobicContact CB-CE3 3.88Å; F90-W94 HydrophobicContact CB-CZ3 4.25Å; F90-W94 AromaticContact CD1-CE3 3.86Å; F90-W94 HydrophobicContact CD1-CE3 3.86Å; F90-W94 AromaticContact CD1-CZ3 3.95Å; F90-W94 HydrophobicContact CD1-CZ3 3.95Å; F90-W94 HydrophobicContact CD2-CE3 4.48Å; F90-W94 HydrophobicContact CD2-CZ3 4.02Å; F90-W94 HydrophobicContact CE1-CZ3 4.3Å; F90-W94 HydrophobicContact CE2-CZ3 4.38Å; F90-W94 AromaticContact CG-CE3 3.81Å; F90-W94 HydrophobicContact CG-CE3 3.81Å; F90-W94 AromaticContact CG-CZ3 3.8Å; F90-W94 HydrophobicContact CG-CZ3 3.8Å; F90-F97 HydrophobicContact CE1-CD1 4.04Å; F90-F97 HydrophobicContact CE1-CD2 4.46Å; F90-F97 HydrophobicContact CE1-CE1 4.13Å; F90-F97 HydrophobicContact CE1-CG 4.21Å; F90-F97 HydrophobicContact CE1-CZ 4.37Å; F90-F97 HydrophobicContact CZ-CE1 4.19Å; F90-F97 HydrophobicContact CZ-CZ 4.33Å |
| 91 | P | 80.9 | Confident | 86.2 | Confident | 115 Ų | 115 | 53.1 Ų | 53.1 | 75% | 0.747 | 28% | 0.284 | S | S | * | . | S | Bend | trans | -68.9 | -16.5 | -174.5 | 27.3 | -35.9 | 0 | 0 | 0 | 113.7 | ||
| 92 | L | 85.4 | Confident | 86.5 | Confident | 63 Ų | 63 | 52.5 Ų | 52.5 | 33% | 0.33 | 28% | 0.28 | S | S | . | . | S | Bend | trans | -106.8 | 154.8 | 177.3 | -57.4 | 177.1 | 0 | 0 | 0 | 110.8 | F90 W94 F97 L221 | F90-L92 HydrophobicContact CD1-CB 3.86Å; F90-L92 HydrophobicContact CE1-CB 3.84Å; F90-L92 HydrophobicContact CE1-CD1 4.12Å; F90-L92 HydrophobicContact CE1-CG 4.12Å; F90-L92 PolarHBondContact O-N 2.89Å; L92-W94 PolarHBondContact O-N 3.4Å; L92-F97 HydrophobicContact CB-CB 4.41Å; L92-F97 HydrophobicContact CD1-CD2 3.6Å; L92-F97 HydrophobicContact CD1-CE2 3.92Å; L92-F97 HydrophobicContact CD1-CG 4.42Å; L92-L221 HydrophobicContact CD2-CB 4.38Å |
| 93 | S | 85.3 | Confident | 86.9 | Confident | 11 Ų | 11 | 51.6 Ų | 51.6 | 8% | 0.077 | 28% | 0.278 | C | S | . | . | trans | -55.6 | 105.9 | 174 | -171.5 | 0 | 0 | 0 | 0 | 110.9 | R95 N96 F97 L221 D223 | S93-R95 PolarHBondContact O-N 2.65Å; S93-R95 VanDerWaalsContact O-N 3.07Å; S93-N96 PolarHBondContact O-N 3.41Å; S93-N96 VanDerWaalsContact O-N 3.08Å; S93-N96 PolarHBondContact OG-ND2 3.45Å; S93-F97 WeakPolarHBondContact O-CB 3.49Å; S93-F97 PolarHBondContact O-N 2.84Å; S93-L221 VanDerWaalsContact CB-O 3.31Å; S93-L221 WeakPolarHBondContact CB-O 3.44Å; S93-L221 PolarHBondContact N-O 2.93Å; S93-D223 VanDerWaalsContact CB-CG 3.5Å; S93-D223 WeakPolarHBondContact CB-OD1 3.26Å; S93-D223 WeakPolarHBondContact CB-OD2 3.32Å; S93-D223 PolarHBondContact OG-OD1 2.71Å; S93-D223 PolarHBondContact OG-OD2 3.12Å | ||
| 94 | W | 87.5 | Confident | 87.3 | Confident | 35 Ų | 35 | 51.1 Ų | 51.1 | 13% | 0.133 | 27% | 0.272 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -18.4 | -179.8 | -162.7 | -98.8 | 0 | 0 | 0 | 113 | I78 V81 E82 Q87 F90 L92 F97 P98 | I78-W94 HydrophobicContact CG2-CH2 4.42Å; I78-W94 HydrophobicContact CG2-CZ2 4.27Å; V81-W94 HydrophobicContact CB-CH2 3.47Å; V81-W94 VanDerWaalsContact CB-CH2 3.47Å; V81-W94 HydrophobicContact CB-CZ2 4.15Å; V81-W94 HydrophobicContact CB-CZ3 3.94Å; V81-W94 HydrophobicContact CG1-CD2 4.45Å; V81-W94 HydrophobicContact CG1-CE3 3.99Å; V81-W94 HydrophobicContact CG1-CH2 3.26Å; V81-W94 HydrophobicContact CG1-CZ2 3.78Å; V81-W94 HydrophobicContact CG1-CZ3 3.38Å; V81-W94 HydrophobicContact CG2-CH2 4.22Å; V81-W94 HydrophobicContact CG2-CZ3 4.35Å; E82-W94 HydrophobicContact CG-CZ2 3.66Å; Q87-W94 HydrophobicContact CB-CB 4.37Å; Q87-W94 HydrophobicContact CB-CD2 4.11Å; Q87-W94 HydrophobicContact CB-CG 3.81Å; Q87-W94 HydrophobicContact CG-CD2 4.06Å; Q87-W94 HydrophobicContact CG-CG 4.03Å; Q87-W94 HydrophobicContact CG-CZ2 4.47Å; Q87-W94 VanDerWaalsContact NE2-NE1 3.13Å; F90-W94 HydrophobicContact CB-CE3 3.88Å; F90-W94 HydrophobicContact CB-CZ3 4.25Å; F90-W94 AromaticContact CD1-CE3 3.86Å; F90-W94 HydrophobicContact CD1-CE3 3.86Å; F90-W94 AromaticContact CD1-CZ3 3.95Å; F90-W94 HydrophobicContact CD1-CZ3 3.95Å; F90-W94 HydrophobicContact CD2-CE3 4.48Å; F90-W94 HydrophobicContact CD2-CZ3 4.02Å; F90-W94 HydrophobicContact CE1-CZ3 4.3Å; F90-W94 HydrophobicContact CE2-CZ3 4.38Å; F90-W94 AromaticContact CG-CE3 3.81Å; F90-W94 HydrophobicContact CG-CE3 3.81Å; F90-W94 AromaticContact CG-CZ3 3.8Å; F90-W94 HydrophobicContact CG-CZ3 3.8Å; L92-W94 PolarHBondContact O-N 3.4Å; W94-F97 HydrophobicContact CZ3-CD1 4.38Å; W94-P98 HydrophobicContact CD2-CG 4.41Å; W94-P98 HydrophobicContact CZ2-CG 4.29Å; W94-P98 WeakPolarHBondContact O-CD 3.48Å; W94-P98 WeakPolarHBondContact O-CG 3.1Å |
| 95 | R | 84.8 | Confident | 88 | Confident | 162 Ų | 162 | 50.1 Ų | 50.1 | 61% | 0.611 | 26% | 0.262 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | -34 | 177.2 | -55.5 | -176.8 | 88.6 | 176.9 | 3.2 | 112.2 | S93 I161 | S93-R95 PolarHBondContact O-N 2.65Å; S93-R95 VanDerWaalsContact O-N 3.07Å; R95-I161 PolarHBondContact NH2-O 3.46Å |
| 96 | N | 89.3 | Confident | 88.7 | Confident | 6 Ų | 6 | 48.6 Ų | 48.6 | 3% | 0.032 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | -34.2 | -178.3 | -71.1 | -47.4 | 0 | 0 | 0 | 112.3 | S93 I99 T100 G163 Y164 M165 N220 L221 | S93-N96 PolarHBondContact O-N 3.41Å; S93-N96 VanDerWaalsContact O-N 3.08Å; S93-N96 PolarHBondContact OG-ND2 3.45Å; N96-I99 WeakPolarHBondContact O-CG2 3.44Å; N96-T100 VanDerWaalsContact O-CB 3.31Å; N96-T100 WeakPolarHBondContact O-CB 3.44Å; N96-T100 PolarHBondContact O-N 3.45Å; N96-T100 VanDerWaalsContact O-N 3.07Å; N96-T100 PolarHBondContact O-OG1 3.25Å; N96-G163 WeakPolarHBondContact OD1-CA 3.35Å; N96-Y164 PolarHBondContact OD1-N 3.5Å; N96-Y164 VanDerWaalsContact OD1-N 3.13Å; N96-M165 HydrophobicContact CB-CB 4.03Å; N96-M165 HydrophobicContact CB-CG 3.9Å; N96-M165 PolarHBondContact OD1-N 2.83Å; N96-M165 VanDerWaalsContact OD1-N 3.12Å; N96-N220 PolarHBondContact ND2-O 3.42Å; N96-L221 HydrophobicContact CB-CD2 4.05Å |
| 97 | F | 91.2 | Very high | 89.2 | Confident | 35 Ų | 35 | 47.1 Ų | 47.1 | 15% | 0.154 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.6 | -53.8 | -171.2 | 174.2 | -98.7 | 0 | 0 | 0 | 114.1 | V74 I78 F90 L92 S93 W94 I99 T100 F101 L221 | V74-F97 HydrophobicContact CG1-CZ 4.15Å; I78-F97 HydrophobicContact CD1-CE1 4.19Å; I78-F97 HydrophobicContact CG1-CE1 3.97Å; F90-F97 HydrophobicContact CE1-CD1 4.04Å; F90-F97 HydrophobicContact CE1-CD2 4.46Å; F90-F97 HydrophobicContact CE1-CE1 4.13Å; F90-F97 HydrophobicContact CE1-CG 4.21Å; F90-F97 HydrophobicContact CE1-CZ 4.37Å; F90-F97 HydrophobicContact CZ-CE1 4.19Å; F90-F97 HydrophobicContact CZ-CZ 4.33Å; L92-F97 HydrophobicContact CB-CB 4.41Å; L92-F97 HydrophobicContact CD1-CD2 3.6Å; L92-F97 HydrophobicContact CD1-CE2 3.92Å; L92-F97 HydrophobicContact CD1-CG 4.42Å; S93-F97 WeakPolarHBondContact O-CB 3.49Å; S93-F97 PolarHBondContact O-N 2.84Å; W94-F97 HydrophobicContact CZ3-CD1 4.38Å; F97-I99 PolarHBondContact O-N 3.38Å; F97-T100 PolarHBondContact O-N 3.01Å; F97-F101 WeakPolarHBondContact O-CB 3.37Å; F97-F101 PolarHBondContact O-N 2.97Å; F97-L221 HydrophobicContact CB-CD2 4.14Å |
| 98 | P | 91.8 | Very high | 89.8 | Confident | 8 Ų | 8 | 44.5 Ų | 44.5 | 5% | 0.052 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.1 | -41.3 | -175.8 | -22.9 | 34.9 | 0 | 0 | 0 | 113.2 | W94 F101 A102 | W94-P98 HydrophobicContact CD2-CG 4.41Å; W94-P98 HydrophobicContact CZ2-CG 4.29Å; W94-P98 WeakPolarHBondContact O-CD 3.48Å; W94-P98 WeakPolarHBondContact O-CG 3.1Å; P98-F101 PolarHBondContact O-N 3.3Å; P98-A102 VanDerWaalsContact O-CB 3.28Å; P98-A102 WeakPolarHBondContact O-CB 3.39Å; P98-A102 PolarHBondContact O-N 3.25Å |
| 99 | I | 92 | Very high | 90.6 | Very high | 7 Ų | 7 | 39.5 Ų | 39.5 | 4% | 0.036 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -68 | -40.1 | 177.7 | -176.1 | 160.6 | 0 | 0 | 0 | 112.3 | N96 F97 F101 A102 C103 T154 M165 A166 L171 | N96-I99 WeakPolarHBondContact O-CG2 3.44Å; F97-I99 PolarHBondContact O-N 3.38Å; I99-F101 VanDerWaalsContact C-N 3.35Å; I99-A102 PolarHBondContact O-N 3.17Å; I99-C103 WeakPolarHBondContact O-CB 3.48Å; I99-C103 PolarHBondContact O-N 2.86Å; I99-T154 WeakPolarHBondContact CD1-OG1 3.35Å; I99-M165 HydrophobicContact CG2-CB 3.91Å; I99-A166 VanDerWaalsContact CD1-CA 3.44Å; I99-A166 HydrophobicContact CD1-CB 3.63Å; I99-L171 HydrophobicContact CG1-CD2 4.35Å |
| 100 | T | 93.4 | Very high | 91.3 | Very high | 5 Ų | 5 | 34.7 Ų | 34.7 | 3% | 0.031 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61.7 | -47.2 | 175.8 | -55.8 | 0 | 0 | 0 | 0 | 110.1 | N96 F97 C103 Y104 M165 V174 I217 L221 | N96-T100 VanDerWaalsContact O-CB 3.31Å; N96-T100 WeakPolarHBondContact O-CB 3.44Å; N96-T100 PolarHBondContact O-N 3.45Å; N96-T100 VanDerWaalsContact O-N 3.07Å; N96-T100 PolarHBondContact O-OG1 3.25Å; F97-T100 PolarHBondContact O-N 3.01Å; T100-C103 PolarHBondContact O-N 3.48Å; T100-Y104 HydrophobicContact CG2-CD2 4.02Å; T100-Y104 HydrophobicContact CG2-CE2 3.89Å; T100-Y104 WeakPolarHBondContact O-CD2 3.07Å; T100-Y104 PolarHBondContact O-N 3.42Å; T100-M165 HydrophobicContact CG2-SD 4.5Å; T100-M165 VanDerWaalsContact OG1-CB 3.25Å; T100-M165 WeakPolarHBondContact OG1-CB 3.25Å; T100-M165 WeakPolarHBondContact OG1-CG 3.41Å; T100-V174 HydrophobicContact CG2-CG2 3.86Å; T100-I217 HydrophobicContact CG2-CG2 4.09Å; T100-L221 HydrophobicContact CG2-CD2 4.43Å |
| 101 | F | 94.6 | Very high | 91.7 | Very high | 15 Ų | 15 | 32.7 Ų | 32.7 | 7% | 0.066 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -63.3 | -46.5 | 177.2 | 170.1 | -101.3 | 0 | 0 | 0 | 111.8 | F70 V74 T75 I78 F97 P98 I99 C103 Y104 A105 Y147 | F70-F101 HydrophobicContact CD1-CE2 4.45Å; F70-F101 HydrophobicContact CE1-CD2 4.47Å; F70-F101 AromaticContact CE1-CE2 3.95Å; F70-F101 HydrophobicContact CE1-CE2 3.95Å; V74-F101 HydrophobicContact CB-CD2 4.02Å; V74-F101 HydrophobicContact CB-CE1 4.08Å; V74-F101 HydrophobicContact CB-CE2 3.38Å; V74-F101 HydrophobicContact CB-CZ 3.41Å; V74-F101 VanDerWaalsContact CB-CZ 3.41Å; V74-F101 HydrophobicContact CG1-CD1 3.88Å; V74-F101 HydrophobicContact CG1-CD2 3.44Å; V74-F101 VanDerWaalsContact CG1-CD2 3.44Å; V74-F101 HydrophobicContact CG1-CE1 3.79Å; V74-F101 HydrophobicContact CG1-CE2 3.35Å; V74-F101 HydrophobicContact CG1-CG 3.7Å; V74-F101 HydrophobicContact CG1-CZ 3.53Å; V74-F101 HydrophobicContact CG2-CE2 3.94Å; V74-F101 HydrophobicContact CG2-CZ 4.4Å; T75-F101 WeakPolarHBondContact OG1-CE1 3.42Å; I78-F101 HydrophobicContact CD1-CD1 3.39Å; I78-F101 HydrophobicContact CD1-CE1 3.89Å; I78-F101 HydrophobicContact CD1-CG 4.15Å; F97-F101 WeakPolarHBondContact O-CB 3.37Å; F97-F101 PolarHBondContact O-N 2.97Å; P98-F101 PolarHBondContact O-N 3.3Å; I99-F101 VanDerWaalsContact C-N 3.35Å; F101-C103 PolarHBondContact O-N 3.04Å; F101-Y104 PolarHBondContact O-N 2.76Å; F101-Y104 VanDerWaalsContact O-N 3.14Å; F101-A105 HydrophobicContact CE1-CB 4.16Å; F101-A105 HydrophobicContact CE2-CB 4.26Å; F101-A105 HydrophobicContact CZ-CB 3.94Å; F101-A105 VanDerWaalsContact O-CB 3.3Å; F101-A105 WeakPolarHBondContact O-CB 3.4Å; F101-A105 PolarHBondContact O-N 3.48Å; F101-Y147 HydrophobicContact CE1-CE1 4.08Å |
| 102 | A | 95.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -58.8 | -37.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | P98 I99 A105 A106 Y147 E150 V151 | P98-A102 VanDerWaalsContact O-CB 3.28Å; P98-A102 WeakPolarHBondContact O-CB 3.39Å; P98-A102 PolarHBondContact O-N 3.25Å; I99-A102 PolarHBondContact O-N 3.17Å; A102-A105 PolarHBondContact O-N 3.28Å; A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.07Å; A102-Y147 HydrophobicContact CB-CD1 4.31Å; A102-E150 HydrophobicContact CB-CB 4.4Å; A102-E150 HydrophobicContact CB-CG 3.89Å; A102-V151 HydrophobicContact CB-CG2 3.81Å |
| 103 | C | 95.7 | Very high | 92.3 | Very high | 16 Ų | 16 | 24.7 Ų | 24.7 | 11% | 0.108 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -64.5 | -47.7 | 174.5 | -172.3 | 0 | 0 | 0 | 0 | 112.1 | I99 T100 F101 A105 A106 L107 V151 L171 V174 | I99-C103 WeakPolarHBondContact O-CB 3.48Å; I99-C103 PolarHBondContact O-N 2.86Å; T100-C103 PolarHBondContact O-N 3.48Å; F101-C103 PolarHBondContact O-N 3.04Å; C103-A105 PolarHBondContact O-N 3.46Å; C103-A106 PolarHBondContact O-N 3.41Å; C103-L107 WeakPolarHBondContact O-CG 3.46Å; C103-L107 PolarHBondContact O-N 3.38Å; C103-L107 VanDerWaalsContact O-N 3.17Å; C103-V151 HydrophobicContact CB-CG2 3.93Å; C103-L171 HydrophobicContact CB-CD2 3.94Å; C103-V174 HydrophobicContact CB-CB 4.46Å; C103-V174 HydrophobicContact CB-CG1 3.9Å; C103-V174 VanDerWaalsContact SG-CG1 3.51Å |
| 104 | Y | 96.1 | Very high | 92.4 | Very high | 52 Ų | 52 | 28.8 Ų | 28.8 | 20% | 0.204 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.9 | -44.6 | 173.5 | -84.6 | -65 | 0 | 0 | 0 | 112.5 | T100 F101 A106 L107 F108 V174 T177 F178 I217 | T100-Y104 HydrophobicContact CG2-CD2 4.02Å; T100-Y104 HydrophobicContact CG2-CE2 3.89Å; T100-Y104 WeakPolarHBondContact O-CD2 3.07Å; T100-Y104 PolarHBondContact O-N 3.42Å; F101-Y104 PolarHBondContact O-N 2.76Å; F101-Y104 VanDerWaalsContact O-N 3.14Å; Y104-A106 VanDerWaalsContact C-N 3.34Å; Y104-A106 PolarHBondContact O-N 3.34Å; Y104-L107 PolarHBondContact O-N 3.35Å; Y104-L107 VanDerWaalsContact O-N 3.16Å; Y104-F108 HydrophobicContact CD1-CE2 4.22Å; Y104-F108 HydrophobicContact CD1-CZ 4.43Å; Y104-F108 HydrophobicContact CG-CE2 4.41Å; Y104-F108 WeakPolarHBondContact O-CB 3.45Å; Y104-F108 WeakPolarHBondContact O-CD2 3.28Å; Y104-F108 WeakPolarHBondContact O-CG 3.41Å; Y104-F108 PolarHBondContact O-N 2.93Å; Y104-V174 HydrophobicContact CD1-CG1 3.73Å; Y104-V174 HydrophobicContact CD2-CG1 3.69Å; Y104-V174 HydrophobicContact CE1-CG1 3.77Å; Y104-V174 HydrophobicContact CE2-CB 4.4Å; Y104-V174 HydrophobicContact CE2-CG1 3.74Å; Y104-V174 HydrophobicContact CE2-CG2 4.09Å; Y104-V174 HydrophobicContact CG-CG1 3.7Å; Y104-T177 PolarHBondContact OH-OG1 3.49Å; Y104-F178 HydrophobicContact CE1-CB 4.44Å; Y104-I217 VanDerWaalsContact OH-CD1 3.27Å; Y104-I217 WeakPolarHBondContact OH-CD1 3.19Å |
| 105 | A | 95.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.8 | -39.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | F101 A102 C103 L107 F108 C109 Y147 | F101-A105 HydrophobicContact CE1-CB 4.16Å; F101-A105 HydrophobicContact CE2-CB 4.26Å; F101-A105 HydrophobicContact CZ-CB 3.94Å; F101-A105 VanDerWaalsContact O-CB 3.3Å; F101-A105 WeakPolarHBondContact O-CB 3.4Å; F101-A105 PolarHBondContact O-N 3.48Å; A102-A105 PolarHBondContact O-N 3.28Å; C103-A105 PolarHBondContact O-N 3.46Å; A105-L107 PolarHBondContact O-N 3.28Å; A105-F108 PolarHBondContact O-N 2.92Å; A105-C109 VanDerWaalsContact O-CB 3.28Å; A105-C109 WeakPolarHBondContact O-CB 3.37Å; A105-C109 PolarHBondContact O-N 2.98Å; A105-C109 PolarHBondContact O-SG 3.29Å; A105-C109 VanDerWaalsContact O-SG 3.38Å; A105-Y147 HydrophobicContact CB-CD1 3.7Å; A105-Y147 HydrophobicContact CB-CD2 3.67Å; A105-Y147 HydrophobicContact CB-CE1 3.7Å; A105-Y147 HydrophobicContact CB-CE2 3.69Å; A105-Y147 HydrophobicContact CB-CG 3.71Å |
| 106 | A | 96.9 | Very high | 91.8 | Very high | 11 Ų | 11 | 21.5 Ų | 21.5 | 9% | 0.091 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -58.5 | -47.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | A102 C103 Y104 L110 C144 A148 | A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.07Å; C103-A106 PolarHBondContact O-N 3.41Å; Y104-A106 VanDerWaalsContact C-N 3.34Å; Y104-A106 PolarHBondContact O-N 3.34Å; A106-L110 VanDerWaalsContact O-CB 3.26Å; A106-L110 WeakPolarHBondContact O-CB 3.49Å; A106-L110 PolarHBondContact O-N 3.27Å; A106-C144 PolarHBondContact O-SG 3.33Å; A106-C144 VanDerWaalsContact O-SG 3.38Å; A106-A148 HydrophobicContact CB-CB 4.38Å |
| 107 | L | 95.4 | Very high | 91.4 | Very high | 24 Ų | 24 | 22.9 Ų | 22.9 | 13% | 0.126 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -67.3 | -42.1 | 180 | -68.1 | 173.7 | 0 | 0 | 0 | 112.6 | C103 Y104 A105 L110 S111 V174 F175 F178 | C103-L107 WeakPolarHBondContact O-CG 3.46Å; C103-L107 PolarHBondContact O-N 3.38Å; C103-L107 VanDerWaalsContact O-N 3.17Å; Y104-L107 PolarHBondContact O-N 3.35Å; Y104-L107 VanDerWaalsContact O-N 3.16Å; A105-L107 PolarHBondContact O-N 3.28Å; L107-L110 PolarHBondContact O-N 3.3Å; L107-S111 PolarHBondContact O-N 2.97Å; L107-V174 HydrophobicContact CD1-CG1 4.28Å; L107-F175 HydrophobicContact CD1-CD2 4.15Å; L107-F175 HydrophobicContact CD2-CD2 3.94Å; L107-F175 HydrophobicContact CD2-CE2 4.29Å; L107-F178 HydrophobicContact CB-CD1 3.81Å; L107-F178 HydrophobicContact CB-CD2 3.83Å; L107-F178 HydrophobicContact CB-CE1 3.75Å; L107-F178 HydrophobicContact CB-CE2 3.78Å; L107-F178 HydrophobicContact CB-CG 3.84Å; L107-F178 HydrophobicContact CB-CZ 3.73Å; L107-F178 HydrophobicContact CD1-CB 3.76Å; L107-F178 HydrophobicContact CD1-CD1 3.88Å; L107-F178 HydrophobicContact CD1-CD2 4.41Å; L107-F178 HydrophobicContact CD1-CG 3.75Å; L107-F178 HydrophobicContact CD2-CD1 4.24Å; L107-F178 HydrophobicContact CD2-CE1 4.35Å; L107-F178 HydrophobicContact CG-CD1 4.2Å; L107-F178 HydrophobicContact CG-CE1 4.45Å; L107-F178 HydrophobicContact CG-CG 4.34Å; L107-F178 VanDerWaalsContact O-CZ 3.26Å; L107-F178 WeakPolarHBondContact O-CZ 3.42Å |
| 108 | F | 94.1 | Very high | 90.5 | Very high | 31 Ų | 31 | 24.7 Ų | 24.7 | 14% | 0.136 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -61.8 | -51.2 | 174.7 | -72.7 | -53.4 | 0 | 0 | 0 | 110.8 | W63 T67 F70 Y104 A105 L110 S111 S112 F178 | W63-F108 AromaticContact CH2-CD1 3.95Å; W63-F108 HydrophobicContact CH2-CD1 3.95Å; W63-F108 AromaticContact CH2-CE1 3.68Å; W63-F108 HydrophobicContact CH2-CE1 3.68Å; W63-F108 AromaticContact CZ2-CD1 3.71Å; W63-F108 HydrophobicContact CZ2-CD1 3.71Å; W63-F108 AromaticContact CZ2-CE1 3.91Å; W63-F108 HydrophobicContact CZ2-CE1 3.91Å; T67-F108 HydrophobicContact CG2-CB 3.56Å; F70-F108 HydrophobicContact CE1-CE2 4.34Å; Y104-F108 HydrophobicContact CD1-CE2 4.22Å; Y104-F108 HydrophobicContact CD1-CZ 4.43Å; Y104-F108 HydrophobicContact CG-CE2 4.41Å; Y104-F108 WeakPolarHBondContact O-CB 3.45Å; Y104-F108 WeakPolarHBondContact O-CD2 3.28Å; Y104-F108 WeakPolarHBondContact O-CG 3.41Å; Y104-F108 PolarHBondContact O-N 2.93Å; A105-F108 PolarHBondContact O-N 2.92Å; F108-L110 VanDerWaalsContact C-N 3.32Å; F108-L110 PolarHBondContact O-N 3.41Å; F108-S111 PolarHBondContact O-N 2.97Å; F108-S111 VanDerWaalsContact O-N 3.14Å; F108-S111 PolarHBondContact O-OG 3.14Å; F108-S112 PolarHBondContact O-N 2.91Å; F108-S112 PolarHBondContact O-OG 2.84Å; F108-F178 HydrophobicContact CD1-CD2 4.25Å; F108-F178 AromaticContact CD1-CE2 3.6Å; F108-F178 HydrophobicContact CD1-CE2 3.6Å; F108-F178 HydrophobicContact CE1-CD2 4.08Å; F108-F178 AromaticContact CE1-CE2 3.82Å; F108-F178 HydrophobicContact CE1-CE2 3.82Å; F108-F178 HydrophobicContact CG-CE2 4.27Å |
| 109 | C | 94.4 | Very high | 89.4 | Confident | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -60 | -40.3 | 177.1 | -74.2 | 0 | 0 | 0 | 0 | 112 | A105 S112 S113 S140 C144 | A105-C109 VanDerWaalsContact O-CB 3.28Å; A105-C109 WeakPolarHBondContact O-CB 3.37Å; A105-C109 PolarHBondContact O-N 2.98Å; A105-C109 PolarHBondContact O-SG 3.29Å; A105-C109 VanDerWaalsContact O-SG 3.38Å; C109-S112 PolarHBondContact O-N 2.63Å; C109-S113 VanDerWaalsContact O-CB 3.3Å; C109-S113 WeakPolarHBondContact O-CB 3.22Å; C109-S113 PolarHBondContact O-N 3.4Å; C109-S113 PolarHBondContact O-OG 2.61Å; C109-S113 VanDerWaalsContact O-OG 3.07Å; C109-S140 PolarHBondContact O-OG 3.05Å; C109-C144 HydrophobicContact CB-CB 3.77Å |
| 110 | L | 94.6 | Very high | 88.2 | Confident | 81 Ų | 81 | 25.6 Ų | 25.6 | 42% | 0.424 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -59.1 | -47.2 | 173.7 | -176.6 | 62.7 | 0 | 0 | 0 | 111.3 | A106 L107 F108 S113 I114 | A106-L110 VanDerWaalsContact O-CB 3.26Å; A106-L110 WeakPolarHBondContact O-CB 3.49Å; A106-L110 PolarHBondContact O-N 3.27Å; L107-L110 PolarHBondContact O-N 3.3Å; F108-L110 VanDerWaalsContact C-N 3.32Å; F108-L110 PolarHBondContact O-N 3.41Å; L110-S113 PolarHBondContact O-N 2.97Å; L110-I114 HydrophobicContact CD1-CD1 4.13Å; L110-I114 HydrophobicContact CG-CD1 4.12Å; L110-I114 WeakPolarHBondContact O-CG1 3.14Å; L110-I114 PolarHBondContact O-N 3.37Å; L110-I114 VanDerWaalsContact O-N 3.12Å |
| 111 | S | 91.6 | Very high | 86.9 | Confident | 9 Ų | 9 | 26.3 Ų | 26.3 | 6% | 0.063 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62.6 | -44.6 | 179 | 73.2 | 0 | 0 | 0 | 0 | 112.1 | W63 L107 F108 S113 I114 I115 | W63-S111 PolarHBondContact NE1-OG 3.14Å; W63-S111 VanDerWaalsContact NE1-OG 3.12Å; L107-S111 PolarHBondContact O-N 2.97Å; F108-S111 PolarHBondContact O-N 2.97Å; F108-S111 VanDerWaalsContact O-N 3.14Å; F108-S111 PolarHBondContact O-OG 3.14Å; S111-S113 VanDerWaalsContact C-N 3.33Å; S111-S113 PolarHBondContact O-N 2.9Å; S111-I114 PolarHBondContact O-N 3.05Å; S111-I114 VanDerWaalsContact O-N 3.16Å; S111-I115 VanDerWaalsContact O-CB 3.31Å; S111-I115 WeakPolarHBondContact O-CB 3.48Å; S111-I115 VanDerWaalsContact O-CG1 3.24Å; S111-I115 WeakPolarHBondContact O-CG1 3.25Å; S111-I115 PolarHBondContact O-N 3.46Å |
| 112 | S | 88.9 | Confident | 85.5 | Confident | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.007 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64 | -39.6 | 177.3 | -67 | 0 | 0 | 0 | 0 | 111.5 | T67 F108 C109 I114 Y116 | T67-S112 VanDerWaalsContact CB-OG 3.29Å; T67-S112 WeakPolarHBondContact CB-OG 3.28Å; T67-S112 VanDerWaalsContact CG2-OG 3.32Å; T67-S112 WeakPolarHBondContact CG2-OG 3.48Å; T67-S112 PolarHBondContact OG1-OG 3.07Å; F108-S112 PolarHBondContact O-N 2.91Å; F108-S112 PolarHBondContact O-OG 2.84Å; C109-S112 PolarHBondContact O-N 2.63Å; S112-I114 PolarHBondContact O-N 3.05Å; S112-Y116 WeakPolarHBondContact O-CB 3.17Å; S112-Y116 PolarHBondContact O-N 3.28Å |
| 113 | S | 89.4 | Confident | 84.1 | Confident | 10 Ų | 10 | 37.4 Ų | 37.4 | 7% | 0.07 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.4 | -21.4 | 175.3 | -73.3 | 0 | 0 | 0 | 0 | 114.3 | C109 L110 S111 P117 S140 C141 | C109-S113 VanDerWaalsContact O-CB 3.3Å; C109-S113 WeakPolarHBondContact O-CB 3.22Å; C109-S113 PolarHBondContact O-N 3.4Å; C109-S113 PolarHBondContact O-OG 2.61Å; C109-S113 VanDerWaalsContact O-OG 3.07Å; L110-S113 PolarHBondContact O-N 2.97Å; S111-S113 VanDerWaalsContact C-N 3.33Å; S111-S113 PolarHBondContact O-N 2.9Å; S113-P117 VanDerWaalsContact O-CD 3.24Å; S113-P117 WeakPolarHBondContact O-CD 3.4Å; S113-P117 WeakPolarHBondContact O-CG 2.94Å; S113-S140 WeakPolarHBondContact OG-CB 3.27Å; S113-S140 PolarHBondContact OG-OG 3.43Å; S113-C141 VanDerWaalsContact CB-SG 3.51Å; S113-C141 PolarHBondContact OG-N 3.25Å; S113-C141 VanDerWaalsContact OG-N 3.1Å; S113-C141 PolarHBondContact OG-SG 2.94Å |
| 114 | I | 86.8 | Confident | 82.8 | Confident | 97 Ų | 97 | 38.2 Ų | 38.2 | 50% | 0.497 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -94.2 | -50.6 | 175.6 | -64.5 | 167.2 | 0 | 0 | 0 | 110.2 | L110 S111 S112 P117 T118 | L110-I114 HydrophobicContact CD1-CD1 4.13Å; L110-I114 HydrophobicContact CG-CD1 4.12Å; L110-I114 WeakPolarHBondContact O-CG1 3.14Å; L110-I114 PolarHBondContact O-N 3.37Å; L110-I114 VanDerWaalsContact O-N 3.12Å; S111-I114 PolarHBondContact O-N 3.05Å; S111-I114 VanDerWaalsContact O-N 3.16Å; S112-I114 PolarHBondContact O-N 3.05Å; I114-P117 WeakPolarHBondContact O-CD 3.33Å; I114-P117 WeakPolarHBondContact O-CG 3.38Å; I114-T118 WeakPolarHBondContact O-CB 2.79Å; I114-T118 WeakPolarHBondContact O-CG2 3.34Å; I114-T118 PolarHBondContact O-N 3.49Å; I114-T118 PolarHBondContact O-OG1 3.26Å |
| 115 | I | 82.4 | Confident | 81.5 | Confident | 44 Ų | 44 | 39.9 Ų | 39.9 | 23% | 0.226 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -67.6 | -46.2 | -172.9 | -66.6 | 168.2 | 0 | 0 | 0 | 111.1 | M60 S111 T118 T119 | M60-I115 HydrophobicContact CB-CG2 3.84Å; M60-I115 HydrophobicContact CG-CG2 4.07Å; M60-I115 HydrophobicContact SD-CG2 3.72Å; S111-I115 VanDerWaalsContact O-CB 3.31Å; S111-I115 WeakPolarHBondContact O-CB 3.48Å; S111-I115 VanDerWaalsContact O-CG1 3.24Å; S111-I115 WeakPolarHBondContact O-CG1 3.25Å; S111-I115 PolarHBondContact O-N 3.46Å; I115-T118 PolarHBondContact O-N 3.14Å; I115-T118 PolarHBondContact O-OG1 3.3Å; I115-T119 HydrophobicContact CG2-CG2 4.3Å; I115-T119 WeakPolarHBondContact O-CB 3.29Å; I115-T119 WeakPolarHBondContact O-CG2 3.49Å; I115-T119 PolarHBondContact O-N 2.77Å; I115-T119 PolarHBondContact O-OG1 2.94Å |
| 116 | Y | 78.9 | Confident | 80.3 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.5 | -48.9 | -174.5 | -172.3 | -109.8 | 0 | 0 | 0 | 113.1 | V50 A55 A64 W68 S112 Y120 V121 A133 | V50-Y116 HydrophobicContact CG1-CE2 4.46Å; V50-Y116 HydrophobicContact CG2-CE1 4.11Å; V50-Y116 WeakPolarHBondContact CG2-OH 3.41Å; A55-Y116 WeakPolarHBondContact O-CE2 3.31Å; A55-Y116 PolarHBondContact O-OH 3.41Å; A64-Y116 HydrophobicContact CB-CD2 3.94Å; A64-Y116 HydrophobicContact CB-CG 4.31Å; W68-Y116 HydrophobicContact CH2-CD1 4.04Å; W68-Y116 HydrophobicContact CH2-CD2 4.33Å; W68-Y116 HydrophobicContact CH2-CE1 4.13Å; W68-Y116 HydrophobicContact CH2-CE2 4.45Å; W68-Y116 HydrophobicContact CH2-CG 4.13Å; S112-Y116 WeakPolarHBondContact O-CB 3.17Å; S112-Y116 PolarHBondContact O-N 3.28Å; Y116-Y120 HydrophobicContact CD2-CD1 4.48Å; Y116-Y120 HydrophobicContact CD2-CG 4.47Å; Y116-Y120 AromaticContact CE2-CD1 3.65Å; Y116-Y120 HydrophobicContact CE2-CD1 3.65Å; Y116-Y120 HydrophobicContact CE2-CE1 4.34Å; Y116-Y120 HydrophobicContact CE2-CG 4.04Å; Y116-Y120 AromaticContact CZ-CD1 3.83Å; Y116-Y120 WeakPolarHBondContact O-CA 3.22Å; Y116-Y120 WeakPolarHBondContact O-CB 3.37Å; Y116-Y120 PolarHBondContact O-N 3.45Å; Y116-V121 HydrophobicContact CD1-CG2 4.36Å; Y116-V121 HydrophobicContact CE1-CG2 4.3Å; Y116-V121 PolarHBondContact O-N 3.39Å; Y116-A133 HydrophobicContact CE1-CB 3.71Å |
| 117 | P | 79.2 | Confident | 79.5 | Confident | 34 Ų | 34 | 48.4 Ų | 48.4 | 22% | 0.221 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -68.9 | -36.9 | 176.7 | 26.2 | -34.9 | 0 | 0 | 0 | 113.4 | S113 I114 T119 V121 Q122 T137 | S113-P117 VanDerWaalsContact O-CD 3.24Å; S113-P117 WeakPolarHBondContact O-CD 3.4Å; S113-P117 WeakPolarHBondContact O-CG 2.94Å; I114-P117 WeakPolarHBondContact O-CD 3.33Å; I114-P117 WeakPolarHBondContact O-CG 3.38Å; P117-T119 VanDerWaalsContact C-N 3.32Å; P117-T119 PolarHBondContact O-N 3.14Å; P117-V121 HydrophobicContact CB-CB 4.25Å; P117-V121 HydrophobicContact CB-CG2 4.19Å; P117-V121 PolarHBondContact O-N 2.99Å; P117-Q122 PolarHBondContact O-N 2.91Å; P117-T137 HydrophobicContact CB-CG2 4.21Å; P117-T137 HydrophobicContact CG-CG2 3.78Å |
| 118 | T | 73.4 | Confident | 78.8 | Confident | 73 Ų | 73 | 55.3 Ų | 55.3 | 45% | 0.448 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -76 | -15.2 | -178.8 | 58.2 | 0 | 0 | 0 | 0 | 113.7 | I114 I115 Q122 | I114-T118 WeakPolarHBondContact O-CB 2.79Å; I114-T118 WeakPolarHBondContact O-CG2 3.34Å; I114-T118 PolarHBondContact O-N 3.49Å; I114-T118 PolarHBondContact O-OG1 3.26Å; I115-T118 PolarHBondContact O-N 3.14Å; I115-T118 PolarHBondContact O-OG1 3.3Å; T118-Q122 PolarHBondContact O-NE2 2.82Å |
| 119 | T | 67.9 | Low | 78 | Confident | 19 Ų | 19 | 55.9 Ų | 55.9 | 12% | 0.117 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -117.9 | -17.1 | -180 | 61.6 | 0 | 0 | 0 | 0 | 113.5 | M60 I115 P117 F123 H282 | M60-T119 WeakPolarHBondContact CB-OG1 3.42Å; M60-T119 HydrophobicContact CG-CG2 4.23Å; I115-T119 HydrophobicContact CG2-CG2 4.3Å; I115-T119 WeakPolarHBondContact O-CB 3.29Å; I115-T119 WeakPolarHBondContact O-CG2 3.49Å; I115-T119 PolarHBondContact O-N 2.77Å; I115-T119 PolarHBondContact O-OG1 2.94Å; P117-T119 VanDerWaalsContact C-N 3.32Å; P117-T119 PolarHBondContact O-N 3.14Å; T119-F123 WeakPolarHBondContact O-CD2 3.21Å; T119-H282 PolarHBondContact O-ND1 2.89Å |
| 120 | Y | 66.4 | Low | 77.4 | Confident | 16 Ų | 16 | 58.6 Ų | 58.6 | 6% | 0.063 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -122.9 | -57.9 | -172.2 | -148.2 | -111.5 | 0 | 0 | 0 | 111.7 | A55 T57 Y116 Q122 F123 M124 H282 | A55-Y120 HydrophobicContact CB-CE1 3.77Å; A55-Y120 WeakPolarHBondContact O-CE1 3.43Å; T57-Y120 PolarHBondContact N-OH 3.47Å; T57-Y120 WeakPolarHBondContact O-CE2 3.43Å; T57-Y120 PolarHBondContact OG1-OH 3.12Å; Y116-Y120 HydrophobicContact CD2-CD1 4.48Å; Y116-Y120 HydrophobicContact CD2-CG 4.47Å; Y116-Y120 AromaticContact CE2-CD1 3.65Å; Y116-Y120 HydrophobicContact CE2-CD1 3.65Å; Y116-Y120 HydrophobicContact CE2-CE1 4.34Å; Y116-Y120 HydrophobicContact CE2-CG 4.04Å; Y116-Y120 AromaticContact CZ-CD1 3.83Å; Y116-Y120 WeakPolarHBondContact O-CA 3.22Å; Y116-Y120 WeakPolarHBondContact O-CB 3.37Å; Y116-Y120 PolarHBondContact O-N 3.45Å; Y120-Q122 PolarHBondContact O-N 3.17Å; Y120-F123 PolarHBondContact O-N 3.43Å; Y120-M124 HydrophobicContact CD1-CE 3.13Å; Y120-M124 HydrophobicContact CD1-SD 4.4Å; Y120-M124 HydrophobicContact CE1-CE 2.92Å; Y120-M124 HydrophobicContact CG-CE 4.21Å; Y120-M124 WeakPolarHBondContact O-CG 3.4Å; Y120-M124 PolarHBondContact O-N 2.97Å; Y120-H282 AromaticContact CD2-CE1 3.32Å; Y120-H282 WeakPolarHBondContact CD2-CE1 3.32Å; Y120-H282 AromaticContact CD2-ND1 3.42Å; Y120-H282 WeakPolarHBondContact CD2-ND1 3.5Å; Y120-H282 AromaticContact CE2-CE1 3.49Å; Y120-H282 VanDerWaalsContact CE2-CE1 3.49Å; Y120-H282 WeakPolarHBondContact CE2-CE1 3.15Å; Y120-H282 AromaticContact CE2-ND1 3.91Å; Y120-H282 AromaticContact CE2-NE2 3.78Å |
| 121 | V | 66.8 | Low | 77 | Confident | 20 Ų | 20 | 58.7 Ų | 58.7 | 12% | 0.121 | 31% | 0.309 | C | S | . | . | G | 310 helix | trans | -63.3 | -39.9 | -174.2 | -180 | 0 | 0 | 0 | 0 | 112.6 | Y116 P117 F123 M124 R130 A133 I134 | Y116-V121 HydrophobicContact CD1-CG2 4.36Å; Y116-V121 HydrophobicContact CE1-CG2 4.3Å; Y116-V121 PolarHBondContact O-N 3.39Å; P117-V121 HydrophobicContact CB-CB 4.25Å; P117-V121 HydrophobicContact CB-CG2 4.19Å; P117-V121 PolarHBondContact O-N 2.99Å; V121-F123 PolarHBondContact O-N 3.28Å; V121-M124 PolarHBondContact O-N 2.91Å; V121-R130 HydrophobicContact CG1-CG 3.94Å; V121-A133 HydrophobicContact CG2-CB 3.7Å; V121-I134 HydrophobicContact CG1-CG1 4.09Å |
| 122 | Q | 66.2 | Low | 76.7 | Confident | 127 Ų | 127 | 62.1 Ų | 62.1 | 59% | 0.593 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -65.4 | -21.5 | -177.9 | 66.4 | 166.6 | -10.9 | 0 | 0 | 114.3 | P117 T118 Y120 | P117-Q122 PolarHBondContact O-N 2.91Å; T118-Q122 PolarHBondContact O-NE2 2.82Å; Y120-Q122 PolarHBondContact O-N 3.17Å |
| 123 | F | 65.4 | Low | 76.5 | Confident | 121 Ų | 121 | 62.1 Ų | 62.1 | 53% | 0.531 | 32% | 0.321 | S | S | . | . | G | 310 helix | trans | -101.7 | 0.1 | -179.2 | -59.1 | -68.1 | 0 | 0 | 0 | 113.1 | T119 Y120 V121 | T119-F123 WeakPolarHBondContact O-CD2 3.21Å; Y120-F123 PolarHBondContact O-N 3.43Å; V121-F123 PolarHBondContact O-N 3.28Å |
| 124 | M | 68.4 | Low | 76.3 | Confident | 33 Ų | 33 | 65.1 Ų | 65.1 | 16% | 0.163 | 34% | 0.336 | C | S | . | . | S | Bend | trans | -80.5 | 135.6 | 176.8 | -75.3 | -178 | 168.2 | 0 | 0 | 112.2 | A55 Y120 V121 R130 A133 | A55-M124 HydrophobicContact CB-CE 4.09Å; Y120-M124 HydrophobicContact CD1-CE 3.13Å; Y120-M124 HydrophobicContact CD1-SD 4.4Å; Y120-M124 HydrophobicContact CE1-CE 2.92Å; Y120-M124 HydrophobicContact CG-CE 4.21Å; Y120-M124 WeakPolarHBondContact O-CG 3.4Å; Y120-M124 PolarHBondContact O-N 2.97Å; V121-M124 PolarHBondContact O-N 2.91Å; M124-R130 HydrophobicContact CB-CB 4.12Å; M124-R130 HydrophobicContact CB-CG 4.11Å; M124-R130 HydrophobicContact SD-CB 4.16Å; M124-R130 HydrophobicContact SD-CG 4.42Å; M124-A133 HydrophobicContact CE-CB 4.44Å; M124-A133 HydrophobicContact SD-CB 4.12Å |
| 125 | A | 69.2 | Low | 76.5 | Confident | 87 Ų | 87 | 62.6 Ų | 62.6 | 72% | 0.719 | 33% | 0.325 | S | S | * | . | P | Polyproline II helix | trans | -59.3 | 149.7 | 165.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | G127 | A125-G127 PolarHBondContact O-N 3.02Š|
| 126 | H | 70.9 | Confident | 76.8 | Confident | 157 Ų | 157 | 60.5 Ų | 60.5 | 73% | 0.727 | 31% | 0.314 | S | S | * | . | S | Bend | trans | -58.9 | 125.8 | 176.9 | -72 | 64.2 | 0 | 0 | 0 | 109.8 | R130 | H126-R130 PolarHBondContact CD2-NH1 3.12Å; H126-R130 PolarHBondContact CD2-NH2 3.21Å; H126-R130 PolarHBondContact CE1-NH1 3.3Å; H126-R130 PolarHBondContact ND1-NH1 3.19Å; H126-R130 VanDerWaalsContact ND1-NH1 3.15Å; H126-R130 PolarHBondContact NE2-NH1 3.14Å; H126-R130 PolarHBondContact NE2-NH2 3.47Å |
| 127 | G | 79.3 | Confident | 77.4 | Confident | 32 Ų | 32 | 61.4 Ų | 61.4 | 33% | 0.33 | 32% | 0.32 | S | S | . | . | S | Bend | trans | 158.6 | -174.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | A125 S129 R130 D131 | A125-G127 PolarHBondContact O-N 3.02Å; G127-S129 VanDerWaalsContact C-N 3.28Å; G127-S129 PolarHBondContact O-N 3.41Å; G127-S129 VanDerWaalsContact O-N 3.14Å; G127-R130 WeakPolarHBondContact O-CB 3.38Å; G127-R130 PolarHBondContact O-N 2.94Å; G127-D131 PolarHBondContact O-N 3.3Å |
| 128 | R | 79.8 | Confident | 78.1 | Confident | 169 Ų | 169 | 63.1 Ų | 63.1 | 64% | 0.638 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -51.2 | -38.4 | -174.2 | 179.8 | 170.9 | 44.9 | 84.1 | 3.6 | 114.7 | R130 D131 Y132 | R128-R130 VanDerWaalsContact C-N 3.35Å; R128-R130 PolarHBondContact O-N 3.13Å; R128-D131 PolarHBondContact O-N 3.05Å; R128-Y132 HydrophobicContact CG-CD2 4.01Å; R128-Y132 HydrophobicContact CG-CE2 3.73Å; R128-Y132 WeakPolarHBondContact O-CD2 3.41Å; R128-Y132 PolarHBondContact O-N 2.88Å; R128-Y132 VanDerWaalsContact O-N 3.13Å |
| 129 | S | 78.9 | Confident | 79 | Confident | 44 Ų | 44 | 63 Ų | 63 | 31% | 0.308 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.1 | -40.2 | 178.4 | -171.8 | 0 | 0 | 0 | 0 | 112.3 | G127 Y132 A133 | G127-S129 VanDerWaalsContact C-N 3.28Å; G127-S129 PolarHBondContact O-N 3.41Å; G127-S129 VanDerWaalsContact O-N 3.14Å; S129-Y132 PolarHBondContact O-N 3.34Å; S129-A133 WeakPolarHBondContact O-CB 3.43Å; S129-A133 PolarHBondContact O-N 2.94Å |
| 130 | R | 81.3 | Confident | 80.3 | Confident | 57 Ų | 57 | 62.1 Ų | 62.1 | 22% | 0.215 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -69.6 | -41 | 178.7 | -164.4 | -178.5 | 69.2 | 171.8 | 4.3 | 111.8 | V121 M124 H126 G127 R128 Y132 A133 I134 | V121-R130 HydrophobicContact CG1-CG 3.94Å; M124-R130 HydrophobicContact CB-CB 4.12Å; M124-R130 HydrophobicContact CB-CG 4.11Å; M124-R130 HydrophobicContact SD-CB 4.16Å; M124-R130 HydrophobicContact SD-CG 4.42Å; H126-R130 PolarHBondContact CD2-NH1 3.12Å; H126-R130 PolarHBondContact CD2-NH2 3.21Å; H126-R130 PolarHBondContact CE1-NH1 3.3Å; H126-R130 PolarHBondContact ND1-NH1 3.19Å; H126-R130 VanDerWaalsContact ND1-NH1 3.15Å; H126-R130 PolarHBondContact NE2-NH1 3.14Å; H126-R130 PolarHBondContact NE2-NH2 3.47Å; G127-R130 WeakPolarHBondContact O-CB 3.38Å; G127-R130 PolarHBondContact O-N 2.94Å; R128-R130 VanDerWaalsContact C-N 3.35Å; R128-R130 PolarHBondContact O-N 3.13Å; R130-Y132 VanDerWaalsContact C-N 3.31Å; R130-Y132 PolarHBondContact O-N 3.05Å; R130-A133 PolarHBondContact O-N 2.91Å; R130-I134 HydrophobicContact CG-CD1 4.21Å; R130-I134 VanDerWaalsContact O-CG1 3.25Å; R130-I134 WeakPolarHBondContact O-CG1 3.5Å; R130-I134 PolarHBondContact O-N 3.2Å |
| 131 | D | 85.7 | Confident | 81.7 | Confident | 83 Ų | 83 | 63.9 Ų | 63.9 | 44% | 0.444 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.1 | -42.2 | 177.7 | -60 | -22.5 | 0 | 0 | 0 | 110.9 | G127 R128 I134 V135 | G127-D131 PolarHBondContact O-N 3.3Å; R128-D131 PolarHBondContact O-N 3.05Å; D131-I134 PolarHBondContact O-N 2.86Å; D131-V135 WeakPolarHBondContact O-CG2 3.35Å; D131-V135 PolarHBondContact O-N 3.44Å |
| 132 | Y | 84.9 | Confident | 83.1 | Confident | 81 Ų | 81 | 65.8 Ų | 65.8 | 32% | 0.318 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | 176.3 | -81.5 | -126.7 | 0 | 0 | 0 | 111.9 | M49 S52 V53 R128 S129 R130 V135 A136 | M49-Y132 HydrophobicContact CB-CD1 4.31Å; M49-Y132 HydrophobicContact CE-CD1 4.16Å; M49-Y132 HydrophobicContact CE-CE1 4.29Å; M49-Y132 HydrophobicContact CE-CG 4.37Å; M49-Y132 HydrophobicContact SD-CD1 3.6Å; M49-Y132 VanDerWaalsContact SD-CD1 3.6Å; M49-Y132 HydrophobicContact SD-CE1 3.74Å; M49-Y132 HydrophobicContact SD-CG 4.33Å; S52-Y132 WeakPolarHBondContact OG-CD1 3.33Å; S52-Y132 VanDerWaalsContact OG-CE1 3.27Å; S52-Y132 WeakPolarHBondContact OG-CE1 3.24Å; V53-Y132 HydrophobicContact CG1-CD1 3.79Å; V53-Y132 HydrophobicContact CG1-CE1 4.29Å; V53-Y132 HydrophobicContact CG1-CG 3.94Å; R128-Y132 HydrophobicContact CG-CD2 4.01Å; R128-Y132 HydrophobicContact CG-CE2 3.73Å; R128-Y132 WeakPolarHBondContact O-CD2 3.41Å; R128-Y132 PolarHBondContact O-N 2.88Å; R128-Y132 VanDerWaalsContact O-N 3.13Å; S129-Y132 PolarHBondContact O-N 3.34Å; R130-Y132 VanDerWaalsContact C-N 3.31Å; R130-Y132 PolarHBondContact O-N 3.05Å; Y132-V135 PolarHBondContact O-N 3.27Å; Y132-A136 WeakPolarHBondContact O-CB 3.21Å; Y132-A136 PolarHBondContact O-N 2.8Å |
| 133 | A | 84.4 | Confident | 84.5 | Confident | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -67.6 | -35.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y116 V121 M124 S129 R130 A136 T137 | Y116-A133 HydrophobicContact CE1-CB 3.71Å; V121-A133 HydrophobicContact CG2-CB 3.7Å; M124-A133 HydrophobicContact CE-CB 4.44Å; M124-A133 HydrophobicContact SD-CB 4.12Å; S129-A133 WeakPolarHBondContact O-CB 3.43Å; S129-A133 PolarHBondContact O-N 2.94Å; R130-A133 PolarHBondContact O-N 2.91Å; A133-A136 PolarHBondContact O-N 3.43Å; A133-T137 WeakPolarHBondContact O-CB 3.46Å; A133-T137 PolarHBondContact O-N 3.36Å; A133-T137 PolarHBondContact O-OG1 3.19Å |
| 134 | I | 86.1 | Confident | 86 | Confident | 74 Ų | 74 | 54.7 Ų | 54.7 | 38% | 0.379 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.9 | -48.8 | 172.1 | -69.1 | 163.3 | 0 | 0 | 0 | 109.8 | V121 R130 D131 A136 T137 T138 | V121-I134 HydrophobicContact CG1-CG1 4.09Å; R130-I134 HydrophobicContact CG-CD1 4.21Å; R130-I134 VanDerWaalsContact O-CG1 3.25Å; R130-I134 WeakPolarHBondContact O-CG1 3.5Å; R130-I134 PolarHBondContact O-N 3.2Å; D131-I134 PolarHBondContact O-N 2.86Å; I134-A136 VanDerWaalsContact C-N 3.32Å; I134-A136 PolarHBondContact O-N 3.13Å; I134-T137 WeakPolarHBondContact O-CB 3.48Å; I134-T137 PolarHBondContact O-N 3.3Å; I134-T137 VanDerWaalsContact O-N 3.14Å; I134-T138 HydrophobicContact CG2-CG2 4.46Å; I134-T138 WeakPolarHBondContact O-CG2 3.23Å; I134-T138 PolarHBondContact O-N 2.97Å; I134-T138 PolarHBondContact O-OG1 3.16Å |
| 135 | V | 90.3 | Very high | 87.3 | Confident | 44 Ų | 44 | 58.8 Ų | 58.8 | 27% | 0.267 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.7 | -43.7 | 177.1 | 175.9 | 0 | 0 | 0 | 0 | 111 | V45 M49 D131 Y132 T137 T138 F139 | V45-V135 HydrophobicContact CG1-CG1 4.42Å; M49-V135 HydrophobicContact CE-CB 4Å; M49-V135 HydrophobicContact CE-CG1 3.64Å; M49-V135 HydrophobicContact CE-CG2 4.3Å; M49-V135 HydrophobicContact CG-CG1 4.2Å; D131-V135 WeakPolarHBondContact O-CG2 3.35Å; D131-V135 PolarHBondContact O-N 3.44Å; Y132-V135 PolarHBondContact O-N 3.27Å; V135-T137 VanDerWaalsContact C-N 3.29Å; V135-T137 PolarHBondContact O-N 3.05Å; V135-T138 WeakPolarHBondContact CA-OG1 3.45Å; V135-T138 PolarHBondContact O-N 2.9Å; V135-T138 PolarHBondContact O-OG1 3.43Å; V135-F139 HydrophobicContact CG1-CD2 3.65Å; V135-F139 HydrophobicContact CG1-CE2 3.77Å; V135-F139 WeakPolarHBondContact O-CD2 3.5Å; V135-F139 PolarHBondContact O-N 2.92Å |
| 136 | A | 89.9 | Confident | 88.6 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.7 | -40.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | M49 V50 W68 Y132 A133 I134 S140 | M49-A136 HydrophobicContact CB-CB 4.31Å; V50-A136 HydrophobicContact CG2-CB 3.36Å; W68-A136 HydrophobicContact CH2-CB 4.21Å; Y132-A136 WeakPolarHBondContact O-CB 3.21Å; Y132-A136 PolarHBondContact O-N 2.8Å; A133-A136 PolarHBondContact O-N 3.43Å; I134-A136 VanDerWaalsContact C-N 3.32Å; I134-A136 PolarHBondContact O-N 3.13Å; A136-S140 VanDerWaalsContact O-CB 3.3Å; A136-S140 WeakPolarHBondContact O-CB 3.42Å; A136-S140 PolarHBondContact O-N 3.18Å |
| 137 | T | 90.6 | Very high | 89.8 | Confident | 18 Ų | 18 | 47.3 Ų | 47.3 | 11% | 0.11 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66.1 | -43.7 | 177.3 | -53.9 | 0 | 0 | 0 | 0 | 111.5 | P117 A133 I134 V135 S140 C141 | P117-T137 HydrophobicContact CB-CG2 4.21Å; P117-T137 HydrophobicContact CG-CG2 3.78Å; A133-T137 WeakPolarHBondContact O-CB 3.46Å; A133-T137 PolarHBondContact O-N 3.36Å; A133-T137 PolarHBondContact O-OG1 3.19Å; I134-T137 WeakPolarHBondContact O-CB 3.48Å; I134-T137 PolarHBondContact O-N 3.3Å; I134-T137 VanDerWaalsContact O-N 3.14Å; V135-T137 VanDerWaalsContact C-N 3.29Å; V135-T137 PolarHBondContact O-N 3.05Å; T137-S140 WeakPolarHBondContact O-CB 3.26Å; T137-S140 PolarHBondContact O-N 3.03Å; T137-C141 PolarHBondContact O-N 3.26Å; T137-C141 PolarHBondContact O-SG 2.97Å |
| 138 | T | 93.5 | Very high | 90.5 | Very high | 71 Ų | 71 | 48 Ų | 48 | 44% | 0.436 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 179.2 | 56.6 | 0 | 0 | 0 | 0 | 111.4 | I134 V135 C141 V142 | I134-T138 HydrophobicContact CG2-CG2 4.46Å; I134-T138 WeakPolarHBondContact O-CG2 3.23Å; I134-T138 PolarHBondContact O-N 2.97Å; I134-T138 PolarHBondContact O-OG1 3.16Å; V135-T138 WeakPolarHBondContact CA-OG1 3.45Å; V135-T138 PolarHBondContact O-N 2.9Å; V135-T138 PolarHBondContact O-OG1 3.43Å; T138-C141 WeakPolarHBondContact O-CB 3.4Å; T138-C141 PolarHBondContact O-N 3.28Å; T138-V142 WeakPolarHBondContact O-CG2 3.34Å; T138-V142 PolarHBondContact O-N 2.71Å |
| 139 | F | 93.8 | Very high | 91.2 | Very high | 71 Ų | 71 | 42.3 Ų | 42.3 | 31% | 0.311 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -65 | -40.2 | 173.8 | -83.3 | -83.8 | 0 | 0 | 0 | 111.4 | S42 V45 A46 V135 C141 V142 A143 | S42-F139 PolarHBondContact OG-O 3.45Å; V45-F139 HydrophobicContact CB-CD1 4.1Å; V45-F139 HydrophobicContact CB-CD2 4.33Å; V45-F139 HydrophobicContact CB-CE1 4.38Å; V45-F139 HydrophobicContact CB-CG 4.06Å; V45-F139 HydrophobicContact CG1-CB 4.4Å; V45-F139 HydrophobicContact CG1-CD1 4.14Å; V45-F139 HydrophobicContact CG1-CD2 3.51Å; V45-F139 HydrophobicContact CG1-CE1 4.29Å; V45-F139 HydrophobicContact CG1-CE2 3.69Å; V45-F139 HydrophobicContact CG1-CG 3.75Å; V45-F139 HydrophobicContact CG1-CZ 4.08Å; V45-F139 HydrophobicContact CG2-CE1 4.4Å; A46-F139 HydrophobicContact CB-CB 4.36Å; V135-F139 HydrophobicContact CG1-CD2 3.65Å; V135-F139 HydrophobicContact CG1-CE2 3.77Å; V135-F139 WeakPolarHBondContact O-CD2 3.5Å; V135-F139 PolarHBondContact O-N 2.92Å; F139-C141 VanDerWaalsContact C-N 3.25Å; F139-C141 PolarHBondContact O-N 3.08Å; F139-V142 WeakPolarHBondContact O-CB 3.11Å; F139-V142 PolarHBondContact O-N 3.49Å; F139-A143 PolarHBondContact O-N 2.95Å |
| 140 | S | 94.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -55.8 | -39.4 | 172 | -172.7 | 0 | 0 | 0 | 0 | 112.6 | W68 C109 S113 A136 T137 A143 C144 | W68-S140 VanDerWaalsContact NE1-CB 3.31Å; W68-S140 PolarHBondContact NE1-OG 3.35Å; C109-S140 PolarHBondContact O-OG 3.05Å; S113-S140 WeakPolarHBondContact OG-CB 3.27Å; S113-S140 PolarHBondContact OG-OG 3.43Å; A136-S140 VanDerWaalsContact O-CB 3.3Å; A136-S140 WeakPolarHBondContact O-CB 3.42Å; A136-S140 PolarHBondContact O-N 3.18Å; T137-S140 WeakPolarHBondContact O-CB 3.26Å; T137-S140 PolarHBondContact O-N 3.03Å; S140-A143 PolarHBondContact O-N 3.41Å; S140-C144 WeakPolarHBondContact O-CB 3.39Å; S140-C144 PolarHBondContact O-N 3.36Å |
| 141 | C | 95 | Very high | 92.5 | Very high | 53 Ų | 53 | 38.4 Ų | 38.4 | 36% | 0.358 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -65.9 | -42.3 | 173.9 | -67 | 0 | 0 | 0 | 0 | 112.3 | S113 T137 T138 F139 C144 L145 | S113-C141 VanDerWaalsContact CB-SG 3.51Å; S113-C141 PolarHBondContact OG-N 3.25Å; S113-C141 VanDerWaalsContact OG-N 3.1Å; S113-C141 PolarHBondContact OG-SG 2.94Å; T137-C141 PolarHBondContact O-N 3.26Å; T137-C141 PolarHBondContact O-SG 2.97Å; T138-C141 WeakPolarHBondContact O-CB 3.4Å; T138-C141 PolarHBondContact O-N 3.28Å; F139-C141 VanDerWaalsContact C-N 3.25Å; F139-C141 PolarHBondContact O-N 3.08Å; C141-C144 WeakPolarHBondContact O-CB 3.27Å; C141-C144 PolarHBondContact O-N 3.23Å; C141-L145 WeakPolarHBondContact O-CG 3.44Å; C141-L145 PolarHBondContact O-N 3.29Å |
| 142 | V | 96.6 | Very high | 92.7 | Very high | 60 Ų | 60 | 37.6 Ų | 37.6 | 36% | 0.364 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -61.2 | -45 | 175.4 | 172.7 | 0 | 0 | 0 | 0 | 110.7 | L38 T138 F139 C144 L145 A146 | L38-V142 HydrophobicContact CD1-CG1 4.22Å; L38-V142 HydrophobicContact CD2-CG1 4.4Å; L38-V142 HydrophobicContact CG-CG1 4.36Å; T138-V142 WeakPolarHBondContact O-CG2 3.34Å; T138-V142 PolarHBondContact O-N 2.71Å; F139-V142 WeakPolarHBondContact O-CB 3.11Å; F139-V142 PolarHBondContact O-N 3.49Å; V142-C144 PolarHBondContact O-N 2.89Å; V142-L145 PolarHBondContact O-N 2.82Å; V142-A146 WeakPolarHBondContact O-CB 3.42Å; V142-A146 PolarHBondContact O-N 3.45Å |
| 143 | A | 95.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.2 | -45.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | S42 T43 F139 S140 L145 A146 Y147 | S42-A143 WeakPolarHBondContact OG-CB 3.45Å; S42-A143 PolarHBondContact OG-N 2.9Å; T43-A143 HydrophobicContact CG2-CB 3.84Å; F139-A143 PolarHBondContact O-N 2.95Å; S140-A143 PolarHBondContact O-N 3.41Å; A143-L145 PolarHBondContact O-N 2.76Å; A143-A146 PolarHBondContact O-N 2.64Å; A143-Y147 HydrophobicContact CB-CD2 4.48Å; A143-Y147 HydrophobicContact CB-CE2 4.32Å; A143-Y147 WeakPolarHBondContact O-CD2 3.38Å; A143-Y147 PolarHBondContact O-N 3.47Å |
| 144 | C | 96.1 | Very high | 93 | Very high | 15 Ų | 15 | 43 Ų | 43 | 10% | 0.101 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -55.2 | -50.2 | 175.5 | 177 | 0 | 0 | 0 | 0 | 111.8 | A106 C109 S140 C141 V142 A146 Y147 A148 | A106-C144 PolarHBondContact O-SG 3.33Å; A106-C144 VanDerWaalsContact O-SG 3.38Å; C109-C144 HydrophobicContact CB-CB 3.77Å; S140-C144 WeakPolarHBondContact O-CB 3.39Å; S140-C144 PolarHBondContact O-N 3.36Å; C141-C144 WeakPolarHBondContact O-CB 3.27Å; C141-C144 PolarHBondContact O-N 3.23Å; V142-C144 PolarHBondContact O-N 2.89Å; C144-A146 VanDerWaalsContact C-N 3.32Å; C144-A146 PolarHBondContact O-N 3.04Å; C144-Y147 PolarHBondContact O-N 3.14Å; C144-A148 WeakPolarHBondContact O-CB 3.43Å; C144-A148 PolarHBondContact O-N 2.68Å |
| 145 | L | 96.6 | Very high | 92.9 | Very high | 118 Ų | 118 | 45 Ų | 45 | 62% | 0.618 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -64.5 | -37.8 | 179.1 | -68.6 | 175.8 | 0 | 0 | 0 | 111.8 | C141 V142 A143 A148 T149 | C141-L145 WeakPolarHBondContact O-CG 3.44Å; C141-L145 PolarHBondContact O-N 3.29Å; V142-L145 PolarHBondContact O-N 2.82Å; A143-L145 PolarHBondContact O-N 2.76Å; L145-A148 PolarHBondContact O-N 2.96Å; L145-T149 VanDerWaalsContact O-CB 3.31Å; L145-T149 WeakPolarHBondContact O-CB 3.34Å; L145-T149 PolarHBondContact O-N 3.24Å; L145-T149 PolarHBondContact O-OG1 3.36Å |
| 146 | A | 96.1 | Very high | 92.4 | Very high | 3 Ų | 3 | 44.1 Ų | 44.1 | 3% | 0.025 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -67.2 | -42.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L35 L38 Q39 V142 A143 C144 T149 E150 | L35-A146 HydrophobicContact CD1-CB 3.89Å; L35-A146 WeakPolarHBondContact CD2-O 3.34Å; L38-A146 HydrophobicContact CD2-CB 4.17Å; L38-A146 HydrophobicContact CG-CB 4.41Å; Q39-A146 HydrophobicContact CG-CB 3.58Å; Q39-A146 PolarHBondContact NE2-O 2.89Å; V142-A146 WeakPolarHBondContact O-CB 3.42Å; V142-A146 PolarHBondContact O-N 3.45Å; A143-A146 PolarHBondContact O-N 2.64Å; C144-A146 VanDerWaalsContact C-N 3.32Å; C144-A146 PolarHBondContact O-N 3.04Å; A146-T149 PolarHBondContact O-N 3.32Å; A146-E150 PolarHBondContact O-N 3.4Å |
| 147 | Y | 96.5 | Very high | 91.6 | Very high | 1 Ų | 1 | 53.2 Ų | 53.2 | 0% | 0.004 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66 | -41.4 | 172.9 | -74.4 | -59.7 | 0 | 0 | 0 | 112.1 | Q39 T43 C71 T75 F101 A102 A105 A143 C144 T149 E150 V151 | Q39-Y147 HydrophobicContact CB-CD1 4.37Å; Q39-Y147 HydrophobicContact CB-CE1 3.82Å; Q39-Y147 HydrophobicContact CB-CE2 4.18Å; Q39-Y147 HydrophobicContact CG-CD1 3.76Å; Q39-Y147 HydrophobicContact CG-CD2 4.33Å; Q39-Y147 HydrophobicContact CG-CE1 3.72Å; Q39-Y147 HydrophobicContact CG-CE2 4.28Å; Q39-Y147 HydrophobicContact CG-CG 4.05Å; T43-Y147 HydrophobicContact CG2-CE2 4.17Å; C71-Y147 HydrophobicContact CB-CE2 4.22Å; C71-Y147 PolarHBondContact O-OH 2.71Å; T75-Y147 PolarHBondContact OG1-OH 2.87Å; F101-Y147 HydrophobicContact CE1-CE1 4.08Å; A102-Y147 HydrophobicContact CB-CD1 4.31Å; A105-Y147 HydrophobicContact CB-CD1 3.7Å; A105-Y147 HydrophobicContact CB-CD2 3.67Å; A105-Y147 HydrophobicContact CB-CE1 3.7Å; A105-Y147 HydrophobicContact CB-CE2 3.69Å; A105-Y147 HydrophobicContact CB-CG 3.71Å; A143-Y147 HydrophobicContact CB-CD2 4.48Å; A143-Y147 HydrophobicContact CB-CE2 4.32Å; A143-Y147 WeakPolarHBondContact O-CD2 3.38Å; A143-Y147 PolarHBondContact O-N 3.47Å; C144-Y147 PolarHBondContact O-N 3.14Å; Y147-T149 VanDerWaalsContact C-N 3.3Å; Y147-T149 PolarHBondContact O-N 3.19Å; Y147-E150 WeakPolarHBondContact O-CB 3.4Å; Y147-E150 PolarHBondContact O-N 2.86Å; Y147-V151 WeakPolarHBondContact O-CG2 3.3Å; Y147-V151 PolarHBondContact O-N 2.96Å |
| 148 | A | 94.9 | Very high | 90 | Very high | 46 Ų | 46 | 59 Ų | 59 | 38% | 0.38 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.5 | -38 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A106 C144 L145 E150 V151 A152 | A106-A148 HydrophobicContact CB-CB 4.38Å; C144-A148 WeakPolarHBondContact O-CB 3.43Å; C144-A148 PolarHBondContact O-N 2.68Å; L145-A148 PolarHBondContact O-N 2.96Å; A148-E150 VanDerWaalsContact C-N 3.34Å; A148-V151 PolarHBondContact O-N 3.45Å; A148-A152 WeakPolarHBondContact O-CB 3.41Å; A148-A152 PolarHBondContact O-N 2.87Å |
| 149 | T | 94 | Very high | 88.2 | Confident | 49 Ų | 49 | 59.9 Ų | 59.9 | 30% | 0.301 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -65.6 | -39.3 | 175 | -58.1 | 0 | 0 | 0 | 0 | 111 | L35 L145 A146 Y147 A152 W153 | L35-T149 HydrophobicContact CD1-CG2 4.46Å; L35-T149 HydrophobicContact CD2-CG2 3.96Å; L145-T149 VanDerWaalsContact O-CB 3.31Å; L145-T149 WeakPolarHBondContact O-CB 3.34Å; L145-T149 PolarHBondContact O-N 3.24Å; L145-T149 PolarHBondContact O-OG1 3.36Å; A146-T149 PolarHBondContact O-N 3.32Å; Y147-T149 VanDerWaalsContact C-N 3.3Å; Y147-T149 PolarHBondContact O-N 3.19Å; T149-A152 PolarHBondContact O-N 3.11Å; T149-W153 HydrophobicContact CG2-CD2 3.86Å; T149-W153 VanDerWaalsContact CG2-CE2 3.48Å; T149-W153 HydrophobicContact CG2-CE3 4.31Å; T149-W153 HydrophobicContact CG2-CG 4.37Å; T149-W153 HydrophobicContact CG2-CH2 4.11Å; T149-W153 HydrophobicContact CG2-CZ2 3.63Å; T149-W153 HydrophobicContact CG2-CZ3 4.43Å; T149-W153 WeakPolarHBondContact O-CB 3.39Å; T149-W153 PolarHBondContact O-N 3.31Å |
| 150 | E | 94 | Very high | 86.8 | Confident | 2 Ų | 2 | 61.9 Ų | 61.9 | 1% | 0.009 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -60.6 | -48.6 | 174.6 | 168 | 163.4 | 178.9 | 0 | 0 | 110.8 | L32 L35 R36 Q39 A102 A146 Y147 A148 A152 W153 T154 | L32-E150 HydrophobicContact CD1-CB 4.41Å; L32-E150 HydrophobicContact CD1-CG 3.92Å; L35-E150 HydrophobicContact CD2-CB 3.76Å; R36-E150 WeakPolarHBondContact CG-OE2 3.28Å; R36-E150 IonicContact CZ-OE1 3.9Å; R36-E150 IonicContact NE-OE1 3.68Å; R36-E150 PolarHBondContact NE-OE1 3.41Å; R36-E150 IonicContact NE-OE2 2.65Å; R36-E150 PolarHBondContact NE-OE2 2.89Å; R36-E150 IonicContact NH2-OE1 3.36Å; R36-E150 PolarHBondContact NH2-OE1 3.29Å; Q39-E150 PolarHBondContact NE2-OE2 3.49Å; Q39-E150 PolarHBondContact OE1-OE2 3.3Å; A102-E150 HydrophobicContact CB-CB 4.4Å; A102-E150 HydrophobicContact CB-CG 3.89Å; A146-E150 PolarHBondContact O-N 3.4Å; Y147-E150 WeakPolarHBondContact O-CB 3.4Å; Y147-E150 PolarHBondContact O-N 2.86Å; A148-E150 VanDerWaalsContact C-N 3.34Å; E150-A152 VanDerWaalsContact C-N 3.28Å; E150-A152 PolarHBondContact O-N 3.16Å; E150-W153 PolarHBondContact O-N 3.39Å; E150-T154 HydrophobicContact CG-CG2 4.37Å; E150-T154 WeakPolarHBondContact O-CB 3.37Å; E150-T154 WeakPolarHBondContact O-CG2 3.35Å; E150-T154 PolarHBondContact O-N 3.01Å; E150-T154 PolarHBondContact O-OG1 2.95Å |
| 151 | V | 92.9 | Very high | 85.2 | Confident | 17 Ų | 17 | 68.8 Ų | 68.8 | 10% | 0.103 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -58.3 | -42.4 | 175.8 | 175.1 | 0 | 0 | 0 | 0 | 110.9 | A102 C103 Y147 A148 T154 R155 L171 | A102-V151 HydrophobicContact CB-CG2 3.81Å; C103-V151 HydrophobicContact CB-CG2 3.93Å; Y147-V151 WeakPolarHBondContact O-CG2 3.3Å; Y147-V151 PolarHBondContact O-N 2.96Å; A148-V151 PolarHBondContact O-N 3.45Å; V151-T154 PolarHBondContact O-N 3.34Å; V151-R155 WeakPolarHBondContact O-CB 3.43Å; V151-R155 PolarHBondContact O-N 3.31Å; V151-L171 HydrophobicContact CG1-CD1 3.69Å; V151-L171 HydrophobicContact CG1-CD2 3.69Å; V151-L171 HydrophobicContact CG1-CG 4.37Å |
| 152 | A | 90.4 | Very high | 84 | Confident | 67 Ų | 67 | 68.6 Ų | 68.6 | 55% | 0.554 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -65.3 | -39.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A148 T149 E150 | A148-A152 WeakPolarHBondContact O-CB 3.41Å; A148-A152 PolarHBondContact O-N 2.87Å; T149-A152 PolarHBondContact O-N 3.11Å; E150-A152 VanDerWaalsContact C-N 3.28Å; E150-A152 PolarHBondContact O-N 3.16Å |
| 153 | W | 89.7 | Confident | 83.2 | Confident | 154 Ų | 154 | 66.2 Ų | 66.2 | 58% | 0.583 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -74.5 | -32 | 178.2 | -72.5 | -7.1 | 0 | 0 | 0 | 113.4 | P31 L35 T149 E150 | P31-W153 HydrophobicContact CB-CZ3 4.33Å; L35-W153 HydrophobicContact CB-CZ3 4.1Å; L35-W153 HydrophobicContact CD2-CD2 4.48Å; L35-W153 HydrophobicContact CD2-CE3 3.67Å; L35-W153 HydrophobicContact CD2-CH2 4.34Å; L35-W153 HydrophobicContact CD2-CZ3 3.6Å; L35-W153 HydrophobicContact CG-CZ3 4.34Å; T149-W153 HydrophobicContact CG2-CD2 3.86Å; T149-W153 VanDerWaalsContact CG2-CE2 3.48Å; T149-W153 HydrophobicContact CG2-CE3 4.31Å; T149-W153 HydrophobicContact CG2-CG 4.37Å; T149-W153 HydrophobicContact CG2-CH2 4.11Å; T149-W153 HydrophobicContact CG2-CZ2 3.63Å; T149-W153 HydrophobicContact CG2-CZ3 4.43Å; T149-W153 WeakPolarHBondContact O-CB 3.39Å; T149-W153 PolarHBondContact O-N 3.31Å; E150-W153 PolarHBondContact O-N 3.39Å |
| 154 | T | 86 | Confident | 82.7 | Confident | 40 Ų | 40 | 67.7 Ų | 67.7 | 25% | 0.245 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -93.3 | -0.7 | -177.9 | 54.8 | 0 | 0 | 0 | 0 | 113.4 | L32 I99 E150 V151 | L32-T154 HydrophobicContact CD1-CG2 4.11Å; L32-T154 HydrophobicContact CD2-CG2 4.18Å; I99-T154 WeakPolarHBondContact CD1-OG1 3.35Å; E150-T154 HydrophobicContact CG-CG2 4.37Å; E150-T154 WeakPolarHBondContact O-CB 3.37Å; E150-T154 WeakPolarHBondContact O-CG2 3.35Å; E150-T154 PolarHBondContact O-N 3.01Å; E150-T154 PolarHBondContact O-OG1 2.95Å; V151-T154 PolarHBondContact O-N 3.34Å |
| 155 | R | 84.1 | Confident | 82.4 | Confident | 116 Ų | 116 | 67 Ų | 67 | 44% | 0.438 | 37% | 0.372 | S | S | . | . | S | Bend | trans | -62.7 | 140.5 | 177.1 | -165 | 178.6 | -179 | -179.3 | 1.7 | 111.5 | V151 R157 A166 | V151-R155 WeakPolarHBondContact O-CB 3.43Å; V151-R155 PolarHBondContact O-N 3.31Å; R155-R157 PolarHBondContact O-N 3.46Å; R155-A166 VanDerWaalsContact CG-O 3.28Å; R155-A166 WeakPolarHBondContact CG-O 3.38Å |
| 156 | A | 79.1 | Confident | 82 | Confident | 25 Ų | 25 | 61.6 Ų | 61.6 | 21% | 0.207 | 35% | 0.345 | C | S | . | . | P | Polyproline II helix | trans | -59.6 | 128.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | T162 A166 T167 | A156-T162 WeakPolarHBondContact CB-OG1 3.42Å; A156-A166 HydrophobicContact CB-CB 4.02Å; A156-A166 WeakPolarHBondContact CB-O 3.23Å; A156-A166 PolarHBondContact N-O 2.93Å; A156-T167 HydrophobicContact CB-CG2 4.29Å |
| 157 | R | 72.6 | Confident | 81.7 | Confident | 191 Ų | 191 | 63.3 Ų | 63.3 | 72% | 0.721 | 35% | 0.354 | S | S | * | . | P | Polyproline II helix | trans | -85.3 | 149.7 | 164.1 | -63.9 | -173.7 | -178.6 | -140.2 | 1.1 | 110.4 | R155 G159 E160 | R155-R157 PolarHBondContact O-N 3.46Å; R157-G159 PolarHBondContact O-N 3.08Å; R157-G159 VanDerWaalsContact O-N 3.12Å; R157-E160 PolarHBondContact O-N 3.44Å; R157-E160 VanDerWaalsContact O-N 3.09Å |
| 158 | P | 57.3 | Low | 81.4 | Confident | 141 Ų | 141 | 65.1 Ų | 65.1 | 92% | 0.916 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55 | 119.5 | 175.6 | -23.1 | 32.9 | 0 | 0 | 0 | 110.9 | ||
| 159 | G | 55.5 | Low | 81.1 | Confident | 88 Ų | 88 | 63.1 Ų | 63.1 | 91% | 0.907 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 96.6 | -3.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 116 | R157 | R157-G159 PolarHBondContact O-N 3.08Å; R157-G159 VanDerWaalsContact O-N 3.12Å |
| 160 | E | 66.1 | Low | 81 | Confident | 114 Ų | 114 | 60.8 Ų | 60.8 | 53% | 0.533 | 34% | 0.335 | S | S | . | . | trans | -91.9 | 130.7 | 178.5 | -155.6 | 172.7 | -175.4 | 0 | 0 | 111.3 | R157 T162 | R157-E160 PolarHBondContact O-N 3.44Å; R157-E160 VanDerWaalsContact O-N 3.09Å; E160-T162 HydrophobicContact CB-CG2 4.21Å; E160-T162 HydrophobicContact CG-CG2 3.97Å; E160-T162 PolarHBondContact O-N 3.11Å; E160-T162 PolarHBondContact O-OG1 3.16Å | ||
| 161 | I | 60.5 | Low | 81 | Confident | 145 Ų | 145 | 62 Ų | 62 | 74% | 0.744 | 34% | 0.341 | S | S | * | . | trans | -74.8 | 80.3 | 177.8 | -51.6 | 173 | 0 | 0 | 0 | 108.5 | R95 | R95-I161 PolarHBondContact NH2-O 3.46Š| ||
| 162 | T | 70.6 | Confident | 81.1 | Confident | 48 Ų | 48 | 62.6 Ų | 62.6 | 29% | 0.294 | 34% | 0.343 | S | S | . | . | trans | -110.8 | 166.2 | 176.9 | 50.9 | 0 | 0 | 0 | 0 | 110.5 | A156 E160 | A156-T162 WeakPolarHBondContact CB-OG1 3.42Å; E160-T162 HydrophobicContact CB-CG2 4.21Å; E160-T162 HydrophobicContact CG-CG2 3.97Å; E160-T162 PolarHBondContact O-N 3.11Å; E160-T162 PolarHBondContact O-OG1 3.16Å | ||
| 163 | G | 79.7 | Confident | 81.3 | Confident | 11 Ų | 11 | 59.5 Ų | 59.5 | 11% | 0.113 | 32% | 0.318 | C | S | . | . | trans | -65.7 | 149.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | N96 M165 A166 | N96-G163 WeakPolarHBondContact OD1-CA 3.35Å; G163-M165 PolarHBondContact O-N 3.38Å; G163-M165 VanDerWaalsContact O-N 3.12Å; G163-A166 WeakPolarHBondContact O-CB 3.43Å; G163-A166 PolarHBondContact O-N 3.1Å | ||
| 164 | Y | 84.4 | Confident | 81.6 | Confident | 31 Ų | 31 | 52.2 Ų | 52.2 | 12% | 0.122 | 29% | 0.29 | C | S | . | . | G | 310 helix | trans | -52.9 | -35 | 178.6 | 171.4 | -97.1 | 0 | 0 | 0 | 112.6 | N96 A166 T167 P169 T216 N220 F232 L236 | N96-Y164 PolarHBondContact OD1-N 3.5Å; N96-Y164 VanDerWaalsContact OD1-N 3.13Å; Y164-A166 PolarHBondContact O-N 3.46Å; Y164-A166 VanDerWaalsContact O-N 3.15Å; Y164-T167 VanDerWaalsContact O-CB 3.32Å; Y164-T167 WeakPolarHBondContact O-CB 3.46Å; Y164-T167 WeakPolarHBondContact O-CG2 3.04Å; Y164-T167 PolarHBondContact O-N 3.4Å; Y164-T167 PolarHBondContact O-OG1 3.45Å; Y164-P169 HydrophobicContact CE2-CB 4.21Å; Y164-P169 WeakPolarHBondContact OH-CB 3.25Å; Y164-T216 HydrophobicContact CE1-CG2 4.39Å; Y164-N220 WeakPolarHBondContact CB-OD1 3.37Å; Y164-N220 HydrophobicContact CD1-CB 4.2Å; Y164-N220 VanDerWaalsContact CD1-ND2 3.29Å; Y164-N220 WeakPolarHBondContact CD1-ND2 3.27Å; Y164-N220 VanDerWaalsContact CD1-OD1 3.24Å; Y164-N220 WeakPolarHBondContact CD1-OD1 3.41Å; Y164-N220 VanDerWaalsContact CG-OD1 3.31Å; Y164-F232 HydrophobicContact CD1-CZ 4.47Å; Y164-F232 AromaticContact CD2-CE1 3.76Å; Y164-F232 HydrophobicContact CD2-CE1 3.76Å; Y164-F232 HydrophobicContact CD2-CZ 4.24Å; Y164-F232 HydrophobicContact CE2-CE1 4.01Å; Y164-F232 HydrophobicContact CE2-CZ 4.34Å; Y164-F232 HydrophobicContact CG-CE1 4.15Å; Y164-F232 HydrophobicContact CG-CZ 4.3Å; Y164-L236 HydrophobicContact CD2-CD1 4.32Å; Y164-L236 HydrophobicContact CE2-CD1 3.39Å; Y164-L236 WeakPolarHBondContact OH-CD1 3.35Å |
| 165 | M | 89.1 | Confident | 82.1 | Confident | 1 Ų | 1 | 53.4 Ų | 53.4 | 1% | 0.005 | 29% | 0.292 | C | S | . | . | G | 310 helix | trans | -68.1 | -12.1 | 179.9 | -69.9 | -66.2 | 167.3 | 0 | 0 | 114.1 | N96 I99 T100 G163 T167 L171 I217 N220 | N96-M165 HydrophobicContact CB-CB 4.03Å; N96-M165 HydrophobicContact CB-CG 3.9Å; N96-M165 PolarHBondContact OD1-N 2.83Å; N96-M165 VanDerWaalsContact OD1-N 3.12Å; I99-M165 HydrophobicContact CG2-CB 3.91Å; T100-M165 HydrophobicContact CG2-SD 4.5Å; T100-M165 VanDerWaalsContact OG1-CB 3.25Å; T100-M165 WeakPolarHBondContact OG1-CB 3.25Å; T100-M165 WeakPolarHBondContact OG1-CG 3.41Å; G163-M165 PolarHBondContact O-N 3.38Å; G163-M165 VanDerWaalsContact O-N 3.12Å; M165-T167 VanDerWaalsContact C-N 3.32Å; M165-L171 WeakPolarHBondContact O-CD2 3.21Å; M165-I217 VanDerWaalsContact CE-CA 3.45Å; M165-I217 HydrophobicContact CE-CB 3.94Å; M165-I217 HydrophobicContact CE-CG1 3.8Å; M165-I217 HydrophobicContact CE-CG2 4.02Å; M165-N220 HydrophobicContact CE-CB 3.56Å; M165-N220 HydrophobicContact CG-CB 4.3Å |
| 166 | A | 88.1 | Confident | 82.7 | Confident | 4 Ų | 4 | 47.9 Ų | 47.9 | 3% | 0.033 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -84.9 | -5.1 | 171 | 0 | 0 | 0 | 0 | 0 | 114 | I99 R155 A156 G163 Y164 | I99-A166 VanDerWaalsContact CD1-CA 3.44Å; I99-A166 HydrophobicContact CD1-CB 3.63Å; R155-A166 VanDerWaalsContact CG-O 3.28Å; R155-A166 WeakPolarHBondContact CG-O 3.38Å; A156-A166 HydrophobicContact CB-CB 4.02Å; A156-A166 WeakPolarHBondContact CB-O 3.23Å; A156-A166 PolarHBondContact N-O 2.93Å; G163-A166 WeakPolarHBondContact O-CB 3.43Å; G163-A166 PolarHBondContact O-N 3.1Å; Y164-A166 PolarHBondContact O-N 3.46Å; Y164-A166 VanDerWaalsContact O-N 3.15Å |
| 167 | T | 89.8 | Confident | 83.5 | Confident | 38 Ų | 38 | 46.8 Ų | 46.8 | 23% | 0.233 | 26% | 0.262 | C | S | . | . | S | Bend | trans | -88.7 | 164.9 | 178.7 | 71.9 | 0 | 0 | 0 | 0 | 112 | A156 Y164 M165 G170 L171 | A156-T167 HydrophobicContact CB-CG2 4.29Å; Y164-T167 VanDerWaalsContact O-CB 3.32Å; Y164-T167 WeakPolarHBondContact O-CB 3.46Å; Y164-T167 WeakPolarHBondContact O-CG2 3.04Å; Y164-T167 PolarHBondContact O-N 3.4Å; Y164-T167 PolarHBondContact O-OG1 3.45Å; M165-T167 VanDerWaalsContact C-N 3.32Å; T167-G170 PolarHBondContact O-N 3.03Å; T167-G170 PolarHBondContact OG1-N 2.63Å; T167-L171 WeakPolarHBondContact O-CG 3.49Å; T167-L171 PolarHBondContact O-N 3.02Å; T167-L171 VanDerWaalsContact O-N 3.07Å |
| 168 | V | 90.1 | Very high | 84.6 | Confident | 39 Ų | 39 | 38.3 Ų | 38.3 | 24% | 0.236 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.7 | -48 | 177.7 | -159.1 | 0 | 0 | 0 | 0 | 112 | G170 L171 L172 Y310 | V168-G170 VanDerWaalsContact C-N 3.31Å; V168-G170 PolarHBondContact O-N 2.85Å; V168-L171 PolarHBondContact O-N 3.35Å; V168-L172 HydrophobicContact CG1-CD1 4.24Å; V168-L172 WeakPolarHBondContact O-CG 3.43Å; V168-L172 PolarHBondContact O-N 3.07Å; V168-Y310 HydrophobicContact CB-CD2 4.46Å; V168-Y310 HydrophobicContact CB-CG 4.47Å; V168-Y310 HydrophobicContact CG1-CD2 4.03Å; V168-Y310 HydrophobicContact CG1-CE2 3.84Å; V168-Y310 HydrophobicContact CG1-CG 4.49Å |
| 169 | P | 89.9 | Confident | 86.5 | Confident | 5 Ų | 5 | 31.8 Ų | 31.8 | 3% | 0.032 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -56.3 | -41.4 | 173.7 | -28.8 | 38.6 | 0 | 0 | 0 | 113.5 | Y164 L172 K173 D307 L314 | Y164-P169 HydrophobicContact CE2-CB 4.21Å; Y164-P169 WeakPolarHBondContact OH-CB 3.25Å; P169-L172 PolarHBondContact O-N 3.02Å; P169-K173 WeakPolarHBondContact O-CG 3.2Å; P169-K173 PolarHBondContact O-N 3.3Å; P169-D307 WeakPolarHBondContact CA-OD1 3.19Å; P169-D307 WeakPolarHBondContact CB-OD1 3.27Å; P169-L314 HydrophobicContact CG-CD1 4.07Å |
| 170 | G | 91.3 | Very high | 88.4 | Confident | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.6 | -47.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113 | T167 V168 L172 K173 V174 | T167-G170 PolarHBondContact O-N 3.03Å; T167-G170 PolarHBondContact OG1-N 2.63Å; V168-G170 VanDerWaalsContact C-N 3.31Å; V168-G170 PolarHBondContact O-N 2.85Å; G170-L172 VanDerWaalsContact C-N 3.34Å; G170-K173 WeakPolarHBondContact O-CB 3.37Å; G170-K173 PolarHBondContact O-N 3.02Å; G170-V174 PolarHBondContact O-N 3.42Å |
| 171 | L | 93.6 | Very high | 89.7 | Confident | 28 Ų | 28 | 24.6 Ų | 24.6 | 15% | 0.147 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -67.5 | -34.5 | 176.8 | -63.3 | 176.7 | 0 | 0 | 0 | 112.3 | I99 C103 V151 M165 T167 V168 K173 V174 F175 | I99-L171 HydrophobicContact CG1-CD2 4.35Å; C103-L171 HydrophobicContact CB-CD2 3.94Å; V151-L171 HydrophobicContact CG1-CD1 3.69Å; V151-L171 HydrophobicContact CG1-CD2 3.69Å; V151-L171 HydrophobicContact CG1-CG 4.37Å; M165-L171 WeakPolarHBondContact O-CD2 3.21Å; T167-L171 WeakPolarHBondContact O-CG 3.49Å; T167-L171 PolarHBondContact O-N 3.02Å; T167-L171 VanDerWaalsContact O-N 3.07Å; V168-L171 PolarHBondContact O-N 3.35Å; L171-K173 VanDerWaalsContact C-N 3.35Å; L171-V174 PolarHBondContact O-N 3.13Å; L171-F175 PolarHBondContact O-N 3.06Å |
| 172 | L | 94.6 | Very high | 91.1 | Very high | 28 Ų | 28 | 19.4 Ų | 19.4 | 15% | 0.147 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -63.1 | -39.9 | 173.4 | -74.3 | 170.1 | 0 | 0 | 0 | 111.5 | V168 P169 G170 V174 F175 E176 D307 Y310 | V168-L172 HydrophobicContact CG1-CD1 4.24Å; V168-L172 WeakPolarHBondContact O-CG 3.43Å; V168-L172 PolarHBondContact O-N 3.07Å; P169-L172 PolarHBondContact O-N 3.02Å; G170-L172 VanDerWaalsContact C-N 3.34Å; L172-V174 VanDerWaalsContact C-N 3.31Å; L172-V174 PolarHBondContact O-N 3.14Å; L172-F175 WeakPolarHBondContact O-CB 3.31Å; L172-F175 PolarHBondContact O-N 3.46Å; L172-F175 VanDerWaalsContact O-N 3.13Å; L172-E176 WeakPolarHBondContact O-CB 3.34Å; L172-E176 VanDerWaalsContact O-CG 3.23Å; L172-E176 WeakPolarHBondContact O-CG 3.35Å; L172-E176 PolarHBondContact O-N 3.08Å; L172-D307 HydrophobicContact CB-CB 4.25Å; L172-D307 HydrophobicContact CD1-CB 4.05Å; L172-Y310 HydrophobicContact CD1-CD2 3.91Å; L172-Y310 HydrophobicContact CD1-CE2 4.41Å |
| 173 | K | 95.1 | Very high | 92.2 | Very high | 3 Ų | 3 | 17.1 Ų | 17.1 | 1% | 0.013 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.7 | -41.2 | 174.3 | -69.9 | -76.4 | 159.6 | -128.7 | 0 | 112.4 | P169 G170 L171 E176 T177 A213 T216 I217 D307 | P169-K173 WeakPolarHBondContact O-CG 3.2Å; P169-K173 PolarHBondContact O-N 3.3Å; G170-K173 WeakPolarHBondContact O-CB 3.37Å; G170-K173 PolarHBondContact O-N 3.02Å; L171-K173 VanDerWaalsContact C-N 3.35Å; K173-E176 WeakPolarHBondContact CD-OE2 3.43Å; K173-E176 IonicContact NZ-OE1 2.87Å; K173-E176 IonicContact NZ-OE2 3.18Å; K173-E176 PolarHBondContact NZ-OE2 3.18Å; K173-E176 PolarHBondContact O-N 3.21Å; K173-T177 PolarHBondContact O-N 3.33Å; K173-T177 VanDerWaalsContact O-N 3.14Å; K173-T177 PolarHBondContact O-OG1 2.94Å; K173-A213 HydrophobicContact CD-CB 4.03Å; K173-T216 HydrophobicContact CD-CG2 4.1Å; K173-T216 HydrophobicContact CG-CG2 4.21Å; K173-I217 HydrophobicContact CB-CD1 4.28Å; K173-I217 HydrophobicContact CB-CG1 4.07Å; K173-D307 WeakPolarHBondContact CE-OD2 3.21Å; K173-D307 IonicContact NZ-OD2 2.71Å; K173-D307 PolarHBondContact NZ-OD2 3.4Å |
| 174 | V | 96.4 | Very high | 92.8 | Very high | 1 Ų | 1 | 19.5 Ų | 19.5 | 1% | 0.006 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -64.9 | -41.3 | 176.1 | 175 | 0 | 0 | 0 | 0 | 111.2 | T100 C103 Y104 L107 G170 L171 L172 T177 F178 I217 | T100-V174 HydrophobicContact CG2-CG2 3.86Å; C103-V174 HydrophobicContact CB-CB 4.46Å; C103-V174 HydrophobicContact CB-CG1 3.9Å; C103-V174 VanDerWaalsContact SG-CG1 3.51Å; Y104-V174 HydrophobicContact CD1-CG1 3.73Å; Y104-V174 HydrophobicContact CD2-CG1 3.69Å; Y104-V174 HydrophobicContact CE1-CG1 3.77Å; Y104-V174 HydrophobicContact CE2-CB 4.4Å; Y104-V174 HydrophobicContact CE2-CG1 3.74Å; Y104-V174 HydrophobicContact CE2-CG2 4.09Å; Y104-V174 HydrophobicContact CG-CG1 3.7Å; L107-V174 HydrophobicContact CD1-CG1 4.28Å; G170-V174 PolarHBondContact O-N 3.42Å; L171-V174 PolarHBondContact O-N 3.13Å; L172-V174 VanDerWaalsContact C-N 3.31Å; L172-V174 PolarHBondContact O-N 3.14Å; V174-T177 PolarHBondContact O-OG1 3.16Å; V174-F178 VanDerWaalsContact O-CB 3.27Å; V174-F178 WeakPolarHBondContact O-CB 3.28Å; V174-F178 PolarHBondContact O-N 3.43Å; V174-F178 VanDerWaalsContact O-N 3.08Å; V174-I217 HydrophobicContact CG2-CD1 4.23Å |
| 175 | F | 96.6 | Very high | 93 | Very high | 65 Ų | 65 | 21.1 Ų | 21.1 | 29% | 0.285 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -66 | -42.3 | 176 | -176.5 | -105.2 | 0 | 0 | 0 | 112 | L107 L171 L172 T177 F178 V179 I299 A303 | L107-F175 HydrophobicContact CD1-CD2 4.15Å; L107-F175 HydrophobicContact CD2-CD2 3.94Å; L107-F175 HydrophobicContact CD2-CE2 4.29Å; L171-F175 PolarHBondContact O-N 3.06Å; L172-F175 WeakPolarHBondContact O-CB 3.31Å; L172-F175 PolarHBondContact O-N 3.46Å; L172-F175 VanDerWaalsContact O-N 3.13Å; F175-T177 PolarHBondContact O-N 3.1Å; F175-F178 PolarHBondContact O-N 3.5Å; F175-V179 HydrophobicContact CD1-CG2 4.17Å; F175-V179 HydrophobicContact CD2-CG2 4.31Å; F175-V179 HydrophobicContact CE1-CG2 3.77Å; F175-V179 HydrophobicContact CE2-CG2 3.92Å; F175-V179 HydrophobicContact CG-CG2 4.43Å; F175-V179 HydrophobicContact CZ-CG2 3.64Å; F175-V179 WeakPolarHBondContact O-CG2 3.5Å; F175-V179 PolarHBondContact O-N 2.93Å; F175-I299 HydrophobicContact CE1-CG2 3.81Å; F175-I299 HydrophobicContact CZ-CG2 3.76Å; F175-A303 HydrophobicContact CD1-CB 3.76Å; F175-A303 HydrophobicContact CE1-CB 4.06Å |
| 176 | E | 96.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.2 | -47.3 | 179.3 | -75.9 | 165 | -175.2 | 0 | 0 | 112.5 | L172 K173 A180 N300 A303 Y304 D307 | L172-E176 WeakPolarHBondContact O-CB 3.34Å; L172-E176 VanDerWaalsContact O-CG 3.23Å; L172-E176 WeakPolarHBondContact O-CG 3.35Å; L172-E176 PolarHBondContact O-N 3.08Å; K173-E176 WeakPolarHBondContact CD-OE2 3.43Å; K173-E176 IonicContact NZ-OE1 2.87Å; K173-E176 IonicContact NZ-OE2 3.18Å; K173-E176 PolarHBondContact NZ-OE2 3.18Å; K173-E176 PolarHBondContact O-N 3.21Å; E176-A180 WeakPolarHBondContact O-CB 3.24Å; E176-A180 PolarHBondContact O-N 2.9Å; E176-N300 VanDerWaalsContact CA-OD1 3.26Å; E176-N300 WeakPolarHBondContact CA-OD1 3.32Å; E176-N300 PolarHBondContact O-ND2 3.41Å; E176-N300 PolarHBondContact O-OD1 3.07Å; E176-A303 HydrophobicContact CG-CB 3.89Å; E176-Y304 HydrophobicContact CB-CE1 4.18Å; E176-Y304 HydrophobicContact CB-CE2 4.39Å; E176-Y304 HydrophobicContact CG-CD1 4.02Å; E176-Y304 HydrophobicContact CG-CD2 4.4Å; E176-Y304 HydrophobicContact CG-CE1 3.82Å; E176-Y304 HydrophobicContact CG-CE2 4.16Å; E176-Y304 HydrophobicContact CG-CG 4.3Å; E176-Y304 WeakPolarHBondContact OE1-CA 3.42Å; E176-Y304 VanDerWaalsContact OE1-CD1 3.26Å; E176-Y304 WeakPolarHBondContact OE1-CD1 3.43Å; E176-Y304 WeakPolarHBondContact OE2-CE1 3.47Å; E176-D307 WeakPolarHBondContact OE1-CB 3.37Å |
| 177 | T | 96.5 | Very high | 92.8 | Very high | 1 Ų | 1 | 23.6 Ų | 23.6 | 1% | 0.006 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -68.2 | -39 | 177.2 | 52.1 | 0 | 0 | 0 | 0 | 111.5 | Y104 K173 V174 F175 A180 C181 F210 A213 I217 | Y104-T177 PolarHBondContact OH-OG1 3.49Å; K173-T177 PolarHBondContact O-N 3.33Å; K173-T177 VanDerWaalsContact O-N 3.14Å; K173-T177 PolarHBondContact O-OG1 2.94Å; V174-T177 PolarHBondContact O-OG1 3.16Å; F175-T177 PolarHBondContact O-N 3.1Å; T177-A180 PolarHBondContact O-N 3.44Å; T177-C181 PolarHBondContact O-N 3.19Å; T177-C181 PolarHBondContact O-SG 3.17Å; T177-F210 HydrophobicContact CG2-CD2 4.15Å; T177-F210 HydrophobicContact CG2-CE2 4.25Å; T177-A213 HydrophobicContact CG2-CB 3.52Å; T177-I217 HydrophobicContact CG2-CD1 3.88Å |
| 178 | F | 95.6 | Very high | 92.5 | Very high | 13 Ų | 13 | 25.6 Ų | 25.6 | 6% | 0.057 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.3 | -47.9 | 176.7 | 178.5 | -100.7 | 0 | 0 | 0 | 112.1 | Y104 L107 F108 V174 F175 A180 C181 I182 | Y104-F178 HydrophobicContact CE1-CB 4.44Å; L107-F178 HydrophobicContact CB-CD1 3.81Å; L107-F178 HydrophobicContact CB-CD2 3.83Å; L107-F178 HydrophobicContact CB-CE1 3.75Å; L107-F178 HydrophobicContact CB-CE2 3.78Å; L107-F178 HydrophobicContact CB-CG 3.84Å; L107-F178 HydrophobicContact CB-CZ 3.73Å; L107-F178 HydrophobicContact CD1-CB 3.76Å; L107-F178 HydrophobicContact CD1-CD1 3.88Å; L107-F178 HydrophobicContact CD1-CD2 4.41Å; L107-F178 HydrophobicContact CD1-CG 3.75Å; L107-F178 HydrophobicContact CD2-CD1 4.24Å; L107-F178 HydrophobicContact CD2-CE1 4.35Å; L107-F178 HydrophobicContact CG-CD1 4.2Å; L107-F178 HydrophobicContact CG-CE1 4.45Å; L107-F178 HydrophobicContact CG-CG 4.34Å; L107-F178 VanDerWaalsContact O-CZ 3.26Å; L107-F178 WeakPolarHBondContact O-CZ 3.42Å; F108-F178 HydrophobicContact CD1-CD2 4.25Å; F108-F178 AromaticContact CD1-CE2 3.6Å; F108-F178 HydrophobicContact CD1-CE2 3.6Å; F108-F178 HydrophobicContact CE1-CD2 4.08Å; F108-F178 AromaticContact CE1-CE2 3.82Å; F108-F178 HydrophobicContact CE1-CE2 3.82Å; F108-F178 HydrophobicContact CG-CE2 4.27Å; V174-F178 VanDerWaalsContact O-CB 3.27Å; V174-F178 WeakPolarHBondContact O-CB 3.28Å; V174-F178 PolarHBondContact O-N 3.43Å; V174-F178 VanDerWaalsContact O-N 3.08Å; F175-F178 PolarHBondContact O-N 3.5Å; F178-A180 VanDerWaalsContact C-N 3.31Å; F178-A180 PolarHBondContact O-N 3.23Å; F178-C181 WeakPolarHBondContact O-CB 3.38Å; F178-C181 PolarHBondContact O-N 3.03Å; F178-I182 HydrophobicContact CD1-CD1 4.08Å; F178-I182 HydrophobicContact CE1-CD1 3.39Å; F178-I182 HydrophobicContact CE1-CG1 4.26Å; F178-I182 HydrophobicContact CZ-CD1 3.67Å; F178-I182 HydrophobicContact CZ-CG1 4.31Å; F178-I182 PolarHBondContact O-N 3.42Å; F178-I182 VanDerWaalsContact O-N 3.1Å |
| 179 | V | 95.9 | Very high | 91.9 | Very high | 5 Ų | 5 | 27.6 Ų | 27.6 | 3% | 0.03 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.7 | -41.4 | 176.4 | 173.1 | 0 | 0 | 0 | 0 | 110.6 | F175 C181 I182 I183 L296 I299 N300 | F175-V179 HydrophobicContact CD1-CG2 4.17Å; F175-V179 HydrophobicContact CD2-CG2 4.31Å; F175-V179 HydrophobicContact CE1-CG2 3.77Å; F175-V179 HydrophobicContact CE2-CG2 3.92Å; F175-V179 HydrophobicContact CG-CG2 4.43Å; F175-V179 HydrophobicContact CZ-CG2 3.64Å; F175-V179 WeakPolarHBondContact O-CG2 3.5Å; F175-V179 PolarHBondContact O-N 2.93Å; V179-C181 VanDerWaalsContact C-N 3.35Å; V179-C181 PolarHBondContact O-N 2.88Å; V179-I182 PolarHBondContact O-N 2.85Å; V179-I183 HydrophobicContact CG1-CD1 4.22Å; V179-I183 WeakPolarHBondContact O-CG1 3.44Å; V179-I183 PolarHBondContact O-N 3.04Å; V179-L296 HydrophobicContact CG1-CB 4.15Å; V179-L296 HydrophobicContact CG1-CD2 4.14Å; V179-I299 HydrophobicContact CG2-CG2 4.43Å; V179-N300 HydrophobicContact CB-CB 4.42Å; V179-N300 HydrophobicContact CG1-CB 3.74Å |
| 180 | A | 95.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.9 | -40.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | E176 T177 F178 I182 I183 F184 F210 | E176-A180 WeakPolarHBondContact O-CB 3.24Å; E176-A180 PolarHBondContact O-N 2.9Å; T177-A180 PolarHBondContact O-N 3.44Å; F178-A180 VanDerWaalsContact C-N 3.31Å; F178-A180 PolarHBondContact O-N 3.23Å; A180-I182 VanDerWaalsContact C-N 3.33Å; A180-I182 PolarHBondContact O-N 2.92Å; A180-I183 WeakPolarHBondContact O-CB 3.45Å; A180-I183 PolarHBondContact O-N 3.38Å; A180-I183 VanDerWaalsContact O-N 3.16Å; A180-F184 HydrophobicContact CB-CE2 4.27Å; A180-F184 WeakPolarHBondContact O-CD2 3.26Å; A180-F184 WeakPolarHBondContact O-CG 3.39Å; A180-F184 PolarHBondContact O-N 3.02Å; A180-F210 HydrophobicContact CB-CB 4.15Å; A180-F210 HydrophobicContact CB-CD2 3.94Å; A180-F210 HydrophobicContact CB-CG 4.47Å |
| 181 | C | 93.3 | Very high | 90.4 | Very high | 51 Ų | 51 | 36.1 Ų | 36.1 | 35% | 0.345 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -59.4 | -41.7 | 173.2 | -70.9 | 0 | 0 | 0 | 0 | 112.6 | T177 F178 V179 I183 F184 A185 F210 | T177-C181 PolarHBondContact O-N 3.19Å; T177-C181 PolarHBondContact O-SG 3.17Å; F178-C181 WeakPolarHBondContact O-CB 3.38Å; F178-C181 PolarHBondContact O-N 3.03Å; V179-C181 VanDerWaalsContact C-N 3.35Å; V179-C181 PolarHBondContact O-N 2.88Å; C181-I183 VanDerWaalsContact C-N 3.35Å; C181-F184 PolarHBondContact O-N 2.98Å; C181-A185 PolarHBondContact O-N 3.46Å; C181-F210 VanDerWaalsContact SG-CE2 3.59Å |
| 182 | I | 91.4 | Very high | 89.4 | Confident | 35 Ų | 35 | 35.2 Ų | 35.2 | 18% | 0.179 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.9 | -41.1 | 175.1 | -63.3 | -178.4 | 0 | 0 | 0 | 110.6 | F178 V179 A180 F184 A185 F186 L296 | F178-I182 HydrophobicContact CD1-CD1 4.08Å; F178-I182 HydrophobicContact CE1-CD1 3.39Å; F178-I182 HydrophobicContact CE1-CG1 4.26Å; F178-I182 HydrophobicContact CZ-CD1 3.67Å; F178-I182 HydrophobicContact CZ-CG1 4.31Å; F178-I182 PolarHBondContact O-N 3.42Å; F178-I182 VanDerWaalsContact O-N 3.1Å; V179-I182 PolarHBondContact O-N 2.85Å; A180-I182 VanDerWaalsContact C-N 3.33Å; A180-I182 PolarHBondContact O-N 2.92Å; I182-F184 VanDerWaalsContact C-N 3.34Å; I182-F184 PolarHBondContact O-N 3.48Å; I182-A185 WeakPolarHBondContact O-CB 3.39Å; I182-A185 PolarHBondContact O-N 3.44Å; I182-F186 HydrophobicContact CG2-CD2 3.72Å; I182-F186 HydrophobicContact CG2-CE2 3.45Å; I182-F186 VanDerWaalsContact CG2-CE2 3.45Å; I182-F186 VanDerWaalsContact O-CD2 3.24Å; I182-F186 WeakPolarHBondContact O-CD2 3.38Å; I182-F186 PolarHBondContact O-N 3.14Å; I182-F186 VanDerWaalsContact O-N 3.08Å; I182-L296 HydrophobicContact CB-CD1 4.26Å; I182-L296 HydrophobicContact CG2-CD1 3.49Å; I182-L296 VanDerWaalsContact CG2-CD1 3.49Å; I182-L296 HydrophobicContact CG2-CD2 4.39Å |
| 183 | I | 93.1 | Very high | 88.6 | Confident | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -56.5 | -50.2 | 173.6 | -68.3 | 168.8 | 0 | 0 | 0 | 109.8 | V179 A180 C181 A185 F186 I187 Y206 V293 L296 | V179-I183 HydrophobicContact CG1-CD1 4.22Å; V179-I183 WeakPolarHBondContact O-CG1 3.44Å; V179-I183 PolarHBondContact O-N 3.04Å; A180-I183 WeakPolarHBondContact O-CB 3.45Å; A180-I183 PolarHBondContact O-N 3.38Å; A180-I183 VanDerWaalsContact O-N 3.16Å; C181-I183 VanDerWaalsContact C-N 3.35Å; I183-A185 VanDerWaalsContact C-N 3.3Å; I183-A185 PolarHBondContact O-N 2.97Å; I183-F186 WeakPolarHBondContact O-CA 3.47Å; I183-F186 PolarHBondContact O-N 3.3Å; I183-I187 HydrophobicContact CG2-CD1 4.43Å; I183-I187 HydrophobicContact CG2-CG2 4.49Å; I183-I187 WeakPolarHBondContact O-CG1 3.45Å; I183-I187 PolarHBondContact O-N 3.41Å; I183-Y206 HydrophobicContact CG2-CD2 3.47Å; I183-Y206 VanDerWaalsContact CG2-CD2 3.47Å; I183-Y206 HydrophobicContact CG2-CE2 3.71Å; I183-Y206 HydrophobicContact CG2-CG 4.08Å; I183-V293 HydrophobicContact CG2-CG1 4.02Å; I183-L296 HydrophobicContact CD1-CB 3.97Å; I183-L296 HydrophobicContact CG1-CB 3.58Å; I183-L296 HydrophobicContact CG1-CD1 4.06Å; I183-L296 HydrophobicContact CG1-CG 4.47Å |
| 184 | F | 92 | Very high | 87.8 | Confident | 62 Ų | 62 | 41 Ų | 41 | 27% | 0.272 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -56.9 | -40.4 | 177.1 | -67 | -49.5 | 0 | 0 | 0 | 113 | A180 C181 I182 F186 I187 S188 A207 F210 | A180-F184 HydrophobicContact CB-CE2 4.27Å; A180-F184 WeakPolarHBondContact O-CD2 3.26Å; A180-F184 WeakPolarHBondContact O-CG 3.39Å; A180-F184 PolarHBondContact O-N 3.02Å; C181-F184 PolarHBondContact O-N 2.98Å; I182-F184 VanDerWaalsContact C-N 3.34Å; I182-F184 PolarHBondContact O-N 3.48Å; F184-F186 VanDerWaalsContact C-N 3.3Å; F184-F186 PolarHBondContact O-N 2.79Å; F184-I187 HydrophobicContact CD1-CD1 3.91Å; F184-I187 HydrophobicContact CD1-CG1 4.3Å; F184-I187 HydrophobicContact CE1-CD1 4.37Å; F184-I187 CarbonylContact O-C 3.48Å; F184-I187 PolarHBondContact O-N 2.9Å; F184-S188 PolarHBondContact O-N 2.88Å; F184-A207 HydrophobicContact CZ-CB 4.3Å; F184-F210 HydrophobicContact CE2-CB 4.01Å; F184-F210 HydrophobicContact CE2-CD1 4.29Å; F184-F210 HydrophobicContact CE2-CD2 4.29Å; F184-F210 AromaticContact CE2-CG 3.93Å; F184-F210 HydrophobicContact CE2-CG 3.93Å; F184-F210 HydrophobicContact CZ-CB 4.31Å |
| 185 | A | 87.6 | Confident | 87 | Confident | 64 Ų | 64 | 47.5 Ų | 47.5 | 53% | 0.529 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.1 | -41.5 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | C181 I182 I183 S188 | C181-A185 PolarHBondContact O-N 3.46Å; I182-A185 WeakPolarHBondContact O-CB 3.39Å; I182-A185 PolarHBondContact O-N 3.44Å; I183-A185 VanDerWaalsContact C-N 3.3Å; I183-A185 PolarHBondContact O-N 2.97Å; A185-S188 WeakPolarHBondContact O-CB 3.44Å; A185-S188 PolarHBondContact O-OG 3.38Å |
| 186 | F | 86.5 | Confident | 86.4 | Confident | 50 Ų | 50 | 46.2 Ų | 46.2 | 22% | 0.219 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -73 | -30.4 | 177.7 | -75.8 | -61.3 | 0 | 0 | 0 | 114.1 | I182 I183 F184 L192 R289 A292 V293 L296 | I182-F186 HydrophobicContact CG2-CD2 3.72Å; I182-F186 HydrophobicContact CG2-CE2 3.45Å; I182-F186 VanDerWaalsContact CG2-CE2 3.45Å; I182-F186 VanDerWaalsContact O-CD2 3.24Å; I182-F186 WeakPolarHBondContact O-CD2 3.38Å; I182-F186 PolarHBondContact O-N 3.14Å; I182-F186 VanDerWaalsContact O-N 3.08Å; I183-F186 WeakPolarHBondContact O-CA 3.47Å; I183-F186 PolarHBondContact O-N 3.3Å; F184-F186 VanDerWaalsContact C-N 3.3Å; F184-F186 PolarHBondContact O-N 2.79Å; F186-L192 WeakPolarHBondContact O-CD1 3.32Å; F186-R289 HydrophobicContact CD1-CB 4.24Å; F186-R289 HydrophobicContact CD1-CG 3.98Å; F186-R289 VanDerWaalsContact O-CZ 3.27Å; F186-R289 PolarHBondContact O-NE 3.23Å; F186-R289 PolarHBondContact O-NH2 2.61Å; F186-A292 HydrophobicContact CD1-CB 4.31Å; F186-A292 HydrophobicContact CD2-CB 4.03Å; F186-A292 HydrophobicContact CE1-CB 4.18Å; F186-A292 HydrophobicContact CE2-CB 3.89Å; F186-A292 HydrophobicContact CG-CB 4.24Å; F186-A292 HydrophobicContact CZ-CB 3.98Å; F186-V293 HydrophobicContact CB-CG2 3.63Å; F186-L296 HydrophobicContact CD2-CD1 3.7Å; F186-L296 HydrophobicContact CE2-CD1 3.83Å |
| 187 | I | 87.9 | Confident | 86 | Confident | 8 Ų | 8 | 51.1 Ų | 51.1 | 4% | 0.041 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -95.5 | 8.4 | 177.6 | 66.5 | 168.3 | 0 | 0 | 0 | 114.2 | I183 F184 E189 Y193 V203 Y206 W254 V293 | I183-I187 HydrophobicContact CG2-CD1 4.43Å; I183-I187 HydrophobicContact CG2-CG2 4.49Å; I183-I187 WeakPolarHBondContact O-CG1 3.45Å; I183-I187 PolarHBondContact O-N 3.41Å; F184-I187 HydrophobicContact CD1-CD1 3.91Å; F184-I187 HydrophobicContact CD1-CG1 4.3Å; F184-I187 HydrophobicContact CE1-CD1 4.37Å; F184-I187 CarbonylContact O-C 3.48Å; F184-I187 PolarHBondContact O-N 2.9Å; I187-E189 PolarHBondContact O-N 3.46Å; I187-Y193 WeakPolarHBondContact O-CE1 3.47Å; I187-V203 HydrophobicContact CD1-CB 4.26Å; I187-V203 HydrophobicContact CD1-CG1 3.81Å; I187-V203 HydrophobicContact CD1-CG2 3.67Å; I187-Y206 HydrophobicContact CD1-CD2 4.36Å; I187-W254 HydrophobicContact CG2-CH2 3.59Å; I187-W254 HydrophobicContact CG2-CZ2 4.27Å; I187-W254 HydrophobicContact CG2-CZ3 4.3Å; I187-V293 HydrophobicContact CG2-CG1 4.26Å; I187-V293 HydrophobicContact CG2-CG2 3.59Å |
| 188 | S | 82.5 | Confident | 85.7 | Confident | 79 Ų | 79 | 51.7 Ų | 51.7 | 55% | 0.552 | 28% | 0.278 | S | S | * | . | trans | -53.5 | -26.1 | -179.7 | 53.3 | 0 | 0 | 0 | 0 | 114.5 | F184 A185 P190 R289 | F184-S188 PolarHBondContact O-N 2.88Å; A185-S188 WeakPolarHBondContact O-CB 3.44Å; A185-S188 PolarHBondContact O-OG 3.38Å; S188-P190 WeakPolarHBondContact O-CD 3.49Å; S188-R289 PolarHBondContact OG-NH2 2.97Å | ||
| 189 | E | 78.9 | Confident | 85.5 | Confident | 82 Ų | 82 | 51.3 Ų | 51.3 | 38% | 0.383 | 28% | 0.276 | S | S | . | . | S | Bend | trans | -88.3 | 114.1 | 176 | -75.4 | -176.9 | -133.3 | 0 | 0 | 111.2 | I187 F191 L192 F286 R289 | I187-E189 PolarHBondContact O-N 3.46Å; E189-F191 PolarHBondContact O-N 2.76Å; E189-F191 VanDerWaalsContact O-N 3.14Å; E189-L192 HydrophobicContact CB-CD1 4.23Å; E189-L192 WeakPolarHBondContact O-CB 3.28Å; E189-L192 PolarHBondContact O-N 3.25Å; E189-L192 VanDerWaalsContact O-N 3.14Å; E189-F286 WeakPolarHBondContact OE2-CE1 3.12Å; E189-F286 VanDerWaalsContact OE2-CZ 3.29Å; E189-F286 WeakPolarHBondContact OE2-CZ 3.42Å; E189-R289 IonicContact OE1-CZ 2.76Å; E189-R289 IonicContact OE1-NH1 2.61Å; E189-R289 PolarHBondContact OE1-NH1 3.35Å; E189-R289 IonicContact OE1-NH2 3.6Å; E189-R289 IonicContact OE2-NH1 2.88Å |
| 190 | P | 74.2 | Confident | 85.4 | Confident | 56 Ų | 56 | 55.3 Ų | 55.3 | 36% | 0.364 | 30% | 0.295 | S | S | . | . | G | 310 helix | trans | -64.2 | -25.4 | -169.6 | -19.1 | 29.7 | 0 | 0 | 0 | 114.6 | S188 L192 Y193 Q194 | S188-P190 WeakPolarHBondContact O-CD 3.49Å; P190-L192 PolarHBondContact O-N 3.36Å; P190-Y193 PolarHBondContact O-N 3.19Å; P190-Y193 VanDerWaalsContact O-N 3.13Å; P190-Q194 HydrophobicContact CB-CG 3.86Å; P190-Q194 VanDerWaalsContact CB-NE2 3.33Å; P190-Q194 WeakPolarHBondContact O-CB 3.48Å; P190-Q194 WeakPolarHBondContact O-CG 3.43Å; P190-Q194 PolarHBondContact O-N 3.06Å |
| 191 | F | 73.6 | Confident | 85.3 | Confident | 127 Ų | 127 | 60.8 Ų | 60.8 | 56% | 0.557 | 32% | 0.315 | S | S | * | . | G | 310 helix | trans | -56.8 | -23.6 | 177 | -176 | -100.2 | 0 | 0 | 0 | 113.2 | E189 Y193 H195 | E189-F191 PolarHBondContact O-N 2.76Å; E189-F191 VanDerWaalsContact O-N 3.14Å; F191-Y193 VanDerWaalsContact C-N 3.28Å; F191-Y193 PolarHBondContact O-N 3.3Å; F191-H195 AromaticContact CD2-NE2 3.64Å; F191-H195 AromaticContact CE2-NE2 3.76Å |
| 192 | L | 73.6 | Confident | 85.4 | Confident | 9 Ų | 9 | 58.3 Ų | 58.3 | 5% | 0.047 | 30% | 0.299 | C | S | . | . | G | 310 helix | trans | -68.9 | -20.4 | 179.7 | -75.8 | 161.9 | 0 | 0 | 0 | 114.2 | F186 E189 P190 Q258 F286 R290 | F186-L192 WeakPolarHBondContact O-CD1 3.32Å; E189-L192 HydrophobicContact CB-CD1 4.23Å; E189-L192 WeakPolarHBondContact O-CB 3.28Å; E189-L192 PolarHBondContact O-N 3.25Å; E189-L192 VanDerWaalsContact O-N 3.14Å; P190-L192 PolarHBondContact O-N 3.36Å; L192-Q258 PolarHBondContact O-NE2 3.28Å; L192-F286 HydrophobicContact CD1-CD1 4.44Å; L192-F286 HydrophobicContact CD2-CB 4.43Å; L192-F286 HydrophobicContact CD2-CD1 3.96Å; L192-F286 HydrophobicContact CG-CD1 4.3Å; L192-R290 HydrophobicContact CD2-CG 3.9Å |
| 193 | Y | 77.5 | Confident | 85.6 | Confident | 49 Ų | 49 | 57.8 Ų | 57.8 | 19% | 0.192 | 30% | 0.297 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -140.4 | -25.8 | -173.1 | 64.7 | -93.6 | 0 | 0 | 0 | 115.9 | I187 P190 F191 H195 K196 E200 V203 | I187-Y193 WeakPolarHBondContact O-CE1 3.47Å; P190-Y193 PolarHBondContact O-N 3.19Å; P190-Y193 VanDerWaalsContact O-N 3.13Å; F191-Y193 VanDerWaalsContact C-N 3.28Å; F191-Y193 PolarHBondContact O-N 3.3Å; Y193-H195 PolarHBondContact O-N 3.48Å; Y193-K196 PolarHBondContact O-N 2.98Å; Y193-E200 HydrophobicContact CD2-CG 4.15Å; Y193-V203 HydrophobicContact CD1-CG2 4.04Å; Y193-V203 HydrophobicContact CD2-CG2 3.93Å; Y193-V203 HydrophobicContact CE1-CG2 4.43Å; Y193-V203 HydrophobicContact CE2-CG2 4.34Å; Y193-V203 HydrophobicContact CG-CG2 3.77Å |
| 194 | Q | 78.7 | Confident | 85.7 | Confident | 104 Ų | 104 | 59.7 Ų | 59.7 | 49% | 0.486 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -11.9 | -171.4 | -80.1 | -174.8 | -20.6 | 0 | 0 | 116.1 | P190 | P190-Q194 HydrophobicContact CB-CG 3.86Å; P190-Q194 VanDerWaalsContact CB-NE2 3.33Å; P190-Q194 WeakPolarHBondContact O-CB 3.48Å; P190-Q194 WeakPolarHBondContact O-CG 3.43Å; P190-Q194 PolarHBondContact O-N 3.06Å |
| 195 | H | 79 | Confident | 85.9 | Confident | 138 Ų | 138 | 56.7 Ų | 56.7 | 64% | 0.639 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97 | -5 | -177.8 | -62.1 | -50.4 | 0 | 0 | 0 | 113.9 | F191 Y193 | F191-H195 AromaticContact CD2-NE2 3.64Å; F191-H195 AromaticContact CE2-NE2 3.76Å; Y193-H195 PolarHBondContact O-N 3.48Å |
| 196 | K | 83.8 | Confident | 86.3 | Confident | 38 Ų | 38 | 53.7 Ų | 53.7 | 17% | 0.165 | 27% | 0.274 | C | S | . | . | trans | -134.4 | 119.6 | -178.5 | -51.2 | -167.9 | -166 | 175.7 | 0 | 110.1 | Y193 A198 L199 E200 Y257 Y263 N264 | Y193-K196 PolarHBondContact O-N 2.98Å; K196-A198 PolarHBondContact O-N 2.95Å; K196-A198 VanDerWaalsContact O-N 3.12Å; K196-L199 HydrophobicContact CB-CB 4.38Å; K196-L199 HydrophobicContact CB-CD1 3.98Å; K196-L199 HydrophobicContact CB-CG 4.04Å; K196-L199 HydrophobicContact CD-CD1 4.03Å; K196-L199 HydrophobicContact CG-CD1 4.17Å; K196-L199 PolarHBondContact O-N 3.37Å; K196-E200 PolarHBondContact O-N 3.17Å; K196-Y257 HydrophobicContact CB-CD1 4.46Å; K196-Y257 HydrophobicContact CD-CD1 3.81Å; K196-Y257 PolarHBondContact NZ-O 3.19Å; K196-Y263 PolarHBondContact NZ-O 3.19Å; K196-N264 PolarHBondContact NZ-O 3.09Å | ||
| 197 | P | 89.6 | Confident | 86.8 | Confident | 103 Ų | 103 | 52.9 Ų | 52.9 | 67% | 0.669 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -61.1 | -29.2 | -176.6 | 24.5 | -34.4 | 0 | 0 | 0 | 112.6 | L199 E200 W201 | P197-L199 VanDerWaalsContact C-N 3.32Å; P197-L199 PolarHBondContact O-N 2.73Å; P197-E200 PolarHBondContact O-N 3.37Å; P197-W201 PolarHBondContact O-N 2.94Å |
| 198 | A | 89.8 | Confident | 87.2 | Confident | 13 Ų | 13 | 56 Ų | 56 | 11% | 0.107 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.2 | -33.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | K196 C202 Y257 | K196-A198 PolarHBondContact O-N 2.95Å; K196-A198 VanDerWaalsContact O-N 3.12Å; A198-C202 PolarHBondContact O-N 3.36Å; A198-C202 PolarHBondContact O-SG 2.91Å; A198-Y257 HydrophobicContact CB-CD1 4.15Å; A198-Y257 HydrophobicContact CB-CD2 3.56Å; A198-Y257 HydrophobicContact CB-CE1 3.93Å; A198-Y257 HydrophobicContact CB-CE2 3.34Å; A198-Y257 HydrophobicContact CB-CG 3.96Å |
| 199 | L | 90.8 | Very high | 87.8 | Confident | 4 Ų | 4 | 52.2 Ų | 52.2 | 2% | 0.021 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -78.1 | -37 | 177.5 | -63.2 | 176.7 | 0 | 0 | 0 | 111 | K196 P197 W201 C202 V203 W254 Q258 | K196-L199 HydrophobicContact CB-CB 4.38Å; K196-L199 HydrophobicContact CB-CD1 3.98Å; K196-L199 HydrophobicContact CB-CG 4.04Å; K196-L199 HydrophobicContact CD-CD1 4.03Å; K196-L199 HydrophobicContact CG-CD1 4.17Å; K196-L199 PolarHBondContact O-N 3.37Å; P197-L199 VanDerWaalsContact C-N 3.32Å; P197-L199 PolarHBondContact O-N 2.73Å; L199-W201 VanDerWaalsContact C-N 3.28Å; L199-W201 PolarHBondContact O-N 3.31Å; L199-C202 WeakPolarHBondContact O-CB 3.25Å; L199-C202 PolarHBondContact O-N 3.47Å; L199-C202 VanDerWaalsContact O-N 3.14Å; L199-V203 WeakPolarHBondContact O-CG2 3.45Å; L199-V203 PolarHBondContact O-N 2.92Å; L199-W254 HydrophobicContact CD2-CD2 4.33Å; L199-W254 HydrophobicContact CD2-CE3 3.9Å; L199-W254 HydrophobicContact CD2-CZ3 4.27Å; L199-Q258 VanDerWaalsContact CD1-NE2 3.32Å; L199-Q258 HydrophobicContact CD2-CG 4.01Å |
| 200 | E | 93.1 | Very high | 88.7 | Confident | 90 Ų | 90 | 51.2 Ų | 51.2 | 42% | 0.421 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -58.4 | -41.8 | 170.2 | -65.1 | -178.3 | 163.8 | 0 | 0 | 111.6 | Y193 K196 P197 C202 V203 A204 | Y193-E200 HydrophobicContact CD2-CG 4.15Å; K196-E200 PolarHBondContact O-N 3.17Å; P197-E200 PolarHBondContact O-N 3.37Å; E200-C202 PolarHBondContact O-N 2.83Å; E200-V203 PolarHBondContact O-N 3.42Å; E200-A204 PolarHBondContact O-N 3.33Å |
| 201 | W | 95.3 | Very high | 89.7 | Confident | 114 Ų | 114 | 53.1 Ų | 53.1 | 43% | 0.432 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -58.6 | -44.8 | 172.3 | 175.8 | -101.5 | 0 | 0 | 0 | 112.3 | P197 L199 V203 A204 V205 L246 T249 | P197-W201 PolarHBondContact O-N 2.94Å; L199-W201 VanDerWaalsContact C-N 3.28Å; L199-W201 PolarHBondContact O-N 3.31Å; W201-V203 VanDerWaalsContact C-N 3.3Å; W201-V203 PolarHBondContact O-N 2.98Å; W201-A204 WeakPolarHBondContact O-CB 3.42Å; W201-A204 PolarHBondContact O-N 2.99Å; W201-A204 VanDerWaalsContact O-N 3.17Å; W201-V205 HydrophobicContact CD2-CG2 4.36Å; W201-V205 HydrophobicContact CZ2-CG2 4.08Å; W201-V205 WeakPolarHBondContact O-CG2 3.32Å; W201-V205 PolarHBondContact O-N 3.45Å; W201-L246 HydrophobicContact CH2-CD2 4.37Å; W201-L246 HydrophobicContact CZ2-CD2 3.96Å; W201-T249 PolarHBondContact NE1-OG1 3.05Å; W201-T249 VanDerWaalsContact NE1-OG1 3.1Å |
| 202 | C | 95 | Very high | 90.7 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59.1 | -41.5 | 175.6 | -65.3 | 0 | 0 | 0 | 0 | 112 | A198 L199 E200 V205 Y206 A250 W254 | A198-C202 PolarHBondContact O-N 3.36Å; A198-C202 PolarHBondContact O-SG 2.91Å; L199-C202 WeakPolarHBondContact O-CB 3.25Å; L199-C202 PolarHBondContact O-N 3.47Å; L199-C202 VanDerWaalsContact O-N 3.14Å; E200-C202 PolarHBondContact O-N 2.83Å; C202-V205 WeakPolarHBondContact O-CB 3.43Å; C202-V205 PolarHBondContact O-N 2.89Å; C202-Y206 HydrophobicContact CB-CE2 4.21Å; C202-Y206 WeakPolarHBondContact O-CD1 3.47Å; C202-Y206 WeakPolarHBondContact O-CD2 3.43Å; C202-Y206 WeakPolarHBondContact O-CE2 3.13Å; C202-Y206 PolarHBondContact O-N 3.02Å; C202-A250 HydrophobicContact CB-CB 4.37Å; C202-W254 HydrophobicContact CB-CE3 3.84Å; C202-W254 HydrophobicContact CB-CZ3 4.47Å |
| 203 | V | 94.3 | Very high | 91.7 | Very high | 24 Ų | 24 | 48.7 Ų | 48.7 | 15% | 0.145 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -64 | -42.2 | 176 | 179.6 | 0 | 0 | 0 | 0 | 111.2 | I187 Y193 L199 E200 W201 V205 Y206 A207 | I187-V203 HydrophobicContact CD1-CB 4.26Å; I187-V203 HydrophobicContact CD1-CG1 3.81Å; I187-V203 HydrophobicContact CD1-CG2 3.67Å; Y193-V203 HydrophobicContact CD1-CG2 4.04Å; Y193-V203 HydrophobicContact CD2-CG2 3.93Å; Y193-V203 HydrophobicContact CE1-CG2 4.43Å; Y193-V203 HydrophobicContact CE2-CG2 4.34Å; Y193-V203 HydrophobicContact CG-CG2 3.77Å; L199-V203 WeakPolarHBondContact O-CG2 3.45Å; L199-V203 PolarHBondContact O-N 2.92Å; E200-V203 PolarHBondContact O-N 3.42Å; W201-V203 VanDerWaalsContact C-N 3.3Å; W201-V203 PolarHBondContact O-N 2.98Å; V203-V205 VanDerWaalsContact C-N 3.34Å; V203-V205 PolarHBondContact O-N 2.92Å; V203-Y206 PolarHBondContact O-N 2.65Å; V203-A207 WeakPolarHBondContact O-CB 3.33Å; V203-A207 PolarHBondContact O-N 3.42Å |
| 204 | A | 95.3 | Very high | 92.5 | Very high | 39 Ų | 39 | 47.6 Ų | 47.6 | 32% | 0.322 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | E200 W201 Y206 A207 I208 | E200-A204 PolarHBondContact O-N 3.33Å; W201-A204 WeakPolarHBondContact O-CB 3.42Å; W201-A204 PolarHBondContact O-N 2.99Å; W201-A204 VanDerWaalsContact O-N 3.17Å; A204-Y206 PolarHBondContact O-N 3.5Å; A204-A207 PolarHBondContact O-N 3.04Å; A204-I208 WeakPolarHBondContact O-CB 3.4Å; A204-I208 VanDerWaalsContact O-CG1 3.23Å; A204-I208 WeakPolarHBondContact O-CG1 3.44Å; A204-I208 PolarHBondContact O-N 3.46Å |
| 205 | V | 96.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.9 | -49.3 | 173.5 | 163.5 | 0 | 0 | 0 | 0 | 111 | W201 C202 V203 A207 I208 C209 L246 Y247 A250 | W201-V205 HydrophobicContact CD2-CG2 4.36Å; W201-V205 HydrophobicContact CZ2-CG2 4.08Å; W201-V205 WeakPolarHBondContact O-CG2 3.32Å; W201-V205 PolarHBondContact O-N 3.45Å; C202-V205 WeakPolarHBondContact O-CB 3.43Å; C202-V205 PolarHBondContact O-N 2.89Å; V203-V205 VanDerWaalsContact C-N 3.34Å; V203-V205 PolarHBondContact O-N 2.92Å; V205-A207 VanDerWaalsContact C-N 3.32Å; V205-A207 PolarHBondContact O-N 3.3Å; V205-I208 PolarHBondContact O-N 2.87Å; V205-C209 WeakPolarHBondContact O-CB 3.39Å; V205-C209 PolarHBondContact O-N 2.81Å; V205-C209 PolarHBondContact O-SG 2.9Å; V205-L246 HydrophobicContact CB-CB 4.48Å; V205-L246 HydrophobicContact CG1-CB 3.78Å; V205-L246 HydrophobicContact CG2-CB 4.11Å; V205-L246 HydrophobicContact CG2-CD2 4.25Å; V205-Y247 HydrophobicContact CG1-CD2 4.15Å; V205-Y247 HydrophobicContact CG1-CE2 4.36Å; V205-Y247 HydrophobicContact CG1-CG 4.46Å; V205-A250 HydrophobicContact CB-CB 4.45Å; V205-A250 HydrophobicContact CG1-CB 4.01Å |
| 206 | Y | 96.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.8 | -42.5 | 179 | -54.4 | -30.8 | 0 | 0 | 0 | 111.6 | I183 I187 C202 V203 A204 F210 Y247 A250 W254 V293 T297 | I183-Y206 HydrophobicContact CG2-CD2 3.47Å; I183-Y206 VanDerWaalsContact CG2-CD2 3.47Å; I183-Y206 HydrophobicContact CG2-CE2 3.71Å; I183-Y206 HydrophobicContact CG2-CG 4.08Å; I187-Y206 HydrophobicContact CD1-CD2 4.36Å; C202-Y206 HydrophobicContact CB-CE2 4.21Å; C202-Y206 WeakPolarHBondContact O-CD1 3.47Å; C202-Y206 WeakPolarHBondContact O-CD2 3.43Å; C202-Y206 WeakPolarHBondContact O-CE2 3.13Å; C202-Y206 PolarHBondContact O-N 3.02Å; V203-Y206 PolarHBondContact O-N 2.65Å; A204-Y206 PolarHBondContact O-N 3.5Å; Y206-F210 WeakPolarHBondContact O-CB 3.3Å; Y206-F210 PolarHBondContact O-N 3.36Å; Y206-Y247 AromaticContact CD1-CE1 3.67Å; Y206-Y247 HydrophobicContact CD1-CE1 3.67Å; Y206-Y247 HydrophobicContact CD1-CE2 4.47Å; Y206-Y247 AromaticContact CD1-CZ 3.63Å; Y206-Y247 WeakPolarHBondContact CD1-OH 3.38Å; Y206-Y247 HydrophobicContact CE1-CD1 4.33Å; Y206-Y247 AromaticContact CE1-CE1 3.75Å; Y206-Y247 HydrophobicContact CE1-CE1 3.75Å; Y206-A250 HydrophobicContact CE1-CB 3.77Å; Y206-W254 HydrophobicContact CE2-CE3 4.33Å; Y206-W254 HydrophobicContact CE2-CZ3 4.44Å; Y206-V293 HydrophobicContact CE2-CG1 4.08Å; Y206-T297 HydrophobicContact CE1-CG2 3.88Å; Y206-T297 PolarHBondContact OH-OG1 3.17Å |
| 207 | A | 96.3 | Very high | 94.3 | Very high | 34 Ų | 34 | 37.6 Ų | 37.6 | 28% | 0.281 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -65.4 | -48.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | F184 V203 A204 V205 F210 I211 | F184-A207 HydrophobicContact CZ-CB 4.3Å; V203-A207 WeakPolarHBondContact O-CB 3.33Å; V203-A207 PolarHBondContact O-N 3.42Å; A204-A207 PolarHBondContact O-N 3.04Å; V205-A207 VanDerWaalsContact C-N 3.32Å; V205-A207 PolarHBondContact O-N 3.3Å; A207-F210 PolarHBondContact O-N 3.38Å; A207-I211 VanDerWaalsContact O-CG1 3.28Å; A207-I211 WeakPolarHBondContact O-CG1 3.34Å; A207-I211 PolarHBondContact O-N 3.17Å |
| 208 | I | 96.7 | Very high | 94.4 | Very high | 73 Ų | 73 | 38.2 Ų | 38.2 | 37% | 0.374 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -59.3 | -53.5 | 179.4 | -68.8 | 164.4 | 0 | 0 | 0 | 109.6 | A204 V205 F210 I211 L212 L246 | A204-I208 WeakPolarHBondContact O-CB 3.4Å; A204-I208 VanDerWaalsContact O-CG1 3.23Å; A204-I208 WeakPolarHBondContact O-CG1 3.44Å; A204-I208 PolarHBondContact O-N 3.46Å; V205-I208 PolarHBondContact O-N 2.87Å; I208-F210 VanDerWaalsContact C-N 3.32Å; I208-F210 PolarHBondContact O-N 2.85Å; I208-I211 PolarHBondContact O-N 3.28Å; I208-I211 VanDerWaalsContact O-N 3.13Å; I208-L212 HydrophobicContact CG2-CD1 4.11Å; I208-L212 HydrophobicContact CG2-CG 4.39Å; I208-L212 WeakPolarHBondContact O-CG 3.47Å; I208-L212 PolarHBondContact O-N 2.84Å; I208-L246 HydrophobicContact CG2-CD1 4.01Å |
| 209 | C | 96.3 | Very high | 94.4 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.4 | -37.7 | -178.4 | -64.3 | 0 | 0 | 0 | 0 | 112.6 | V205 L212 A213 Y247 Y304 | V205-C209 WeakPolarHBondContact O-CB 3.39Å; V205-C209 PolarHBondContact O-N 2.81Å; V205-C209 PolarHBondContact O-SG 2.9Å; C209-L212 PolarHBondContact O-N 3.32Å; C209-A213 WeakPolarHBondContact O-CB 3.45Å; C209-A213 PolarHBondContact O-N 3.42Å; C209-Y247 HydrophobicContact CB-CD2 4.15Å; C209-Y247 HydrophobicContact CB-CE2 3.51Å; C209-Y304 HydrophobicContact CB-CE2 4.38Å; C209-Y304 WeakPolarHBondContact CB-OH 3.15Å; C209-Y304 PolarHBondContact O-OH 3.24Å |
| 210 | F | 96.1 | Very high | 94.4 | Very high | 60 Ų | 60 | 39.3 Ų | 39.3 | 26% | 0.263 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -59 | -46.6 | 172.6 | 172.5 | -99.4 | 0 | 0 | 0 | 111.6 | T177 A180 C181 F184 Y206 A207 I208 L212 A213 A214 | T177-F210 HydrophobicContact CG2-CD2 4.15Å; T177-F210 HydrophobicContact CG2-CE2 4.25Å; A180-F210 HydrophobicContact CB-CB 4.15Å; A180-F210 HydrophobicContact CB-CD2 3.94Å; A180-F210 HydrophobicContact CB-CG 4.47Å; C181-F210 VanDerWaalsContact SG-CE2 3.59Å; F184-F210 HydrophobicContact CE2-CB 4.01Å; F184-F210 HydrophobicContact CE2-CD1 4.29Å; F184-F210 HydrophobicContact CE2-CD2 4.29Å; F184-F210 AromaticContact CE2-CG 3.93Å; F184-F210 HydrophobicContact CE2-CG 3.93Å; F184-F210 HydrophobicContact CZ-CB 4.31Å; Y206-F210 WeakPolarHBondContact O-CB 3.3Å; Y206-F210 PolarHBondContact O-N 3.36Å; A207-F210 PolarHBondContact O-N 3.38Å; I208-F210 VanDerWaalsContact C-N 3.32Å; I208-F210 PolarHBondContact O-N 2.85Å; F210-L212 PolarHBondContact O-N 2.97Å; F210-A213 PolarHBondContact O-N 3.12Å; F210-A214 VanDerWaalsContact O-CB 3.22Å; F210-A214 WeakPolarHBondContact O-CB 3.2Å; F210-A214 PolarHBondContact O-N 3Å |
| 211 | I | 96.4 | Very high | 94.2 | Very high | 97 Ų | 97 | 35.9 Ų | 35.9 | 50% | 0.497 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -62.3 | -44.6 | 177.8 | -67.3 | 165.9 | 0 | 0 | 0 | 110.4 | A207 I208 A213 A214 V215 | A207-I211 VanDerWaalsContact O-CG1 3.28Å; A207-I211 WeakPolarHBondContact O-CG1 3.34Å; A207-I211 PolarHBondContact O-N 3.17Å; I208-I211 PolarHBondContact O-N 3.28Å; I208-I211 VanDerWaalsContact O-N 3.13Å; I211-A213 PolarHBondContact O-N 3.47Å; I211-A214 PolarHBondContact O-N 3.45Å; I211-V215 HydrophobicContact CG2-CG2 4.17Å; I211-V215 WeakPolarHBondContact O-CB 3.42Å; I211-V215 VanDerWaalsContact O-CG2 3.26Å; I211-V215 WeakPolarHBondContact O-CG2 3.41Å; I211-V215 PolarHBondContact O-N 3.5Å |
| 212 | L | 94.6 | Very high | 93.7 | Very high | 42 Ų | 42 | 32 Ų | 32 | 22% | 0.22 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -60.2 | -44.5 | 178.6 | -64.5 | 179 | 0 | 0 | 0 | 112.1 | I208 C209 F210 T216 L239 V242 | I208-L212 HydrophobicContact CG2-CD1 4.11Å; I208-L212 HydrophobicContact CG2-CG 4.39Å; I208-L212 WeakPolarHBondContact O-CG 3.47Å; I208-L212 PolarHBondContact O-N 2.84Å; C209-L212 PolarHBondContact O-N 3.32Å; F210-L212 PolarHBondContact O-N 2.97Å; L212-T216 PolarHBondContact O-N 3.48Å; L212-T216 VanDerWaalsContact O-N 3.12Å; L212-T216 PolarHBondContact O-OG1 3.1Å; L212-L239 HydrophobicContact CB-CD2 4.42Å; L212-L239 HydrophobicContact CD1-CD2 4.21Å; L212-L239 HydrophobicContact CD2-CD2 3.82Å; L212-L239 HydrophobicContact CG-CD2 4.35Å; L212-V242 HydrophobicContact CD1-CG1 4.38Å |
| 213 | A | 94.7 | Very high | 93.2 | Very high | 1 Ų | 1 | 36.5 Ų | 36.5 | 1% | 0.008 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -68.3 | -41.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | K173 T177 C209 F210 I211 T216 I217 | K173-A213 HydrophobicContact CD-CB 4.03Å; T177-A213 HydrophobicContact CG2-CB 3.52Å; C209-A213 WeakPolarHBondContact O-CB 3.45Å; C209-A213 PolarHBondContact O-N 3.42Å; F210-A213 PolarHBondContact O-N 3.12Å; I211-A213 PolarHBondContact O-N 3.47Å; A213-T216 WeakPolarHBondContact O-CB 3.27Å; A213-T216 PolarHBondContact O-N 2.98Å; A213-I217 WeakPolarHBondContact O-CG1 3.41Å; A213-I217 PolarHBondContact O-N 3.31Å |
| 214 | A | 94.2 | Very high | 92.7 | Very high | 25 Ų | 25 | 38 Ų | 38 | 21% | 0.207 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.5 | -44.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F210 I211 T216 I217 L218 | F210-A214 VanDerWaalsContact O-CB 3.22Å; F210-A214 WeakPolarHBondContact O-CB 3.2Å; F210-A214 PolarHBondContact O-N 3Å; I211-A214 PolarHBondContact O-N 3.45Å; A214-T216 VanDerWaalsContact C-N 3.29Å; A214-T216 PolarHBondContact O-N 2.9Å; A214-I217 PolarHBondContact O-N 2.98Å; A214-I217 VanDerWaalsContact O-N 3.09Å; A214-L218 WeakPolarHBondContact O-CG 3.49Å; A214-L218 PolarHBondContact O-N 3.43Å |
| 215 | V | 93.1 | Very high | 92.1 | Very high | 63 Ų | 63 | 37.7 Ų | 37.7 | 38% | 0.382 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -59 | -43.8 | 174.2 | 167.3 | 0 | 0 | 0 | 0 | 110.3 | I211 I217 L218 L219 | I211-V215 HydrophobicContact CG2-CG2 4.17Å; I211-V215 WeakPolarHBondContact O-CB 3.42Å; I211-V215 VanDerWaalsContact O-CG2 3.26Å; I211-V215 WeakPolarHBondContact O-CG2 3.41Å; I211-V215 PolarHBondContact O-N 3.5Å; V215-I217 VanDerWaalsContact C-N 3.29Å; V215-I217 PolarHBondContact O-N 2.98Å; V215-L218 PolarHBondContact O-N 2.87Å; V215-L219 HydrophobicContact CG1-CD1 3.83Å; V215-L219 HydrophobicContact CG1-CG 4.24Å; V215-L219 WeakPolarHBondContact O-CB 3.37Å; V215-L219 VanDerWaalsContact O-CG 3.26Å; V215-L219 WeakPolarHBondContact O-CG 3.45Å; V215-L219 PolarHBondContact O-N 3.38Å |
| 216 | T | 92.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -57.5 | -45.2 | 174.3 | -59.2 | 0 | 0 | 0 | 0 | 110.9 | Y164 K173 L212 A213 A214 N220 L236 L239 | Y164-T216 HydrophobicContact CE1-CG2 4.39Å; K173-T216 HydrophobicContact CD-CG2 4.1Å; K173-T216 HydrophobicContact CG-CG2 4.21Å; L212-T216 PolarHBondContact O-N 3.48Å; L212-T216 VanDerWaalsContact O-N 3.12Å; L212-T216 PolarHBondContact O-OG1 3.1Å; A213-T216 WeakPolarHBondContact O-CB 3.27Å; A213-T216 PolarHBondContact O-N 2.98Å; A214-T216 VanDerWaalsContact C-N 3.29Å; A214-T216 PolarHBondContact O-N 2.9Å; T216-N220 PolarHBondContact O-N 3.46Å; T216-N220 PolarHBondContact O-ND2 2.81Å; T216-L236 HydrophobicContact CG2-CD2 3.35Å; T216-L239 WeakPolarHBondContact OG1-CD1 3.29Å |
| 217 | I | 93.1 | Very high | 90.5 | Very high | 7 Ų | 7 | 52.8 Ų | 52.8 | 4% | 0.036 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.6 | -48.6 | 178.5 | -65.8 | 168.4 | 0 | 0 | 0 | 111.4 | T100 Y104 M165 K173 V174 T177 A213 A214 V215 L219 N220 L221 | T100-I217 HydrophobicContact CG2-CG2 4.09Å; Y104-I217 VanDerWaalsContact OH-CD1 3.27Å; Y104-I217 WeakPolarHBondContact OH-CD1 3.19Å; M165-I217 VanDerWaalsContact CE-CA 3.45Å; M165-I217 HydrophobicContact CE-CB 3.94Å; M165-I217 HydrophobicContact CE-CG1 3.8Å; M165-I217 HydrophobicContact CE-CG2 4.02Å; K173-I217 HydrophobicContact CB-CD1 4.28Å; K173-I217 HydrophobicContact CB-CG1 4.07Å; V174-I217 HydrophobicContact CG2-CD1 4.23Å; T177-I217 HydrophobicContact CG2-CD1 3.88Å; A213-I217 WeakPolarHBondContact O-CG1 3.41Å; A213-I217 PolarHBondContact O-N 3.31Å; A214-I217 PolarHBondContact O-N 2.98Å; A214-I217 VanDerWaalsContact O-N 3.09Å; V215-I217 VanDerWaalsContact C-N 3.29Å; V215-I217 PolarHBondContact O-N 2.98Å; I217-L219 PolarHBondContact O-N 3.38Å; I217-N220 PolarHBondContact O-N 2.7Å; I217-L221 HydrophobicContact CG2-CD1 3.75Å; I217-L221 HydrophobicContact CG2-CG 4.16Å; I217-L221 WeakPolarHBondContact O-CG 3.36Å; I217-L221 PolarHBondContact O-N 2.65Å |
| 218 | L | 92.2 | Very high | 89.8 | Confident | 117 Ų | 117 | 53.1 Ų | 53.1 | 61% | 0.613 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -62.3 | -40.9 | -179.1 | -68.6 | 173.7 | 0 | 0 | 0 | 112.6 | A214 V215 N220 L221 G222 | A214-L218 WeakPolarHBondContact O-CG 3.49Å; A214-L218 PolarHBondContact O-N 3.43Å; V215-L218 PolarHBondContact O-N 2.87Å; L218-N220 VanDerWaalsContact C-N 3.29Å; L218-N220 PolarHBondContact O-N 3.17Å; L218-L221 PolarHBondContact O-N 3.3Å; L218-G222 PolarHBondContact O-N 2.79Å |
| 219 | L | 90.6 | Very high | 89 | Confident | 35 Ų | 35 | 55.8 Ų | 55.8 | 18% | 0.183 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.4 | -39.3 | 176.4 | -73.4 | 170.9 | 0 | 0 | 0 | 112.1 | V215 I217 D223 C224 L228 F235 | V215-L219 HydrophobicContact CG1-CD1 3.83Å; V215-L219 HydrophobicContact CG1-CG 4.24Å; V215-L219 WeakPolarHBondContact O-CB 3.37Å; V215-L219 VanDerWaalsContact O-CG 3.26Å; V215-L219 WeakPolarHBondContact O-CG 3.45Å; V215-L219 PolarHBondContact O-N 3.38Å; I217-L219 PolarHBondContact O-N 3.38Å; L219-D223 PolarHBondContact O-N 3.42Å; L219-C224 HydrophobicContact CD2-CB 3.8Å; L219-C224 PolarHBondContact O-N 3.14Å; L219-L228 HydrophobicContact CD1-CD1 4.21Å; L219-F235 HydrophobicContact CD1-CE1 4.3Å |
| 220 | N | 89.8 | Confident | 88.5 | Confident | 4 Ų | 4 | 60 Ų | 60 | 2% | 0.021 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -76.1 | -33 | 177 | -74.2 | -76.2 | 0 | 0 | 0 | 112.8 | N96 Y164 M165 T216 I217 L218 F232 | N96-N220 PolarHBondContact ND2-O 3.42Å; Y164-N220 WeakPolarHBondContact CB-OD1 3.37Å; Y164-N220 HydrophobicContact CD1-CB 4.2Å; Y164-N220 VanDerWaalsContact CD1-ND2 3.29Å; Y164-N220 WeakPolarHBondContact CD1-ND2 3.27Å; Y164-N220 VanDerWaalsContact CD1-OD1 3.24Å; Y164-N220 WeakPolarHBondContact CD1-OD1 3.41Å; Y164-N220 VanDerWaalsContact CG-OD1 3.31Å; M165-N220 HydrophobicContact CE-CB 3.56Å; M165-N220 HydrophobicContact CG-CB 4.3Å; T216-N220 PolarHBondContact O-N 3.46Å; T216-N220 PolarHBondContact O-ND2 2.81Å; I217-N220 PolarHBondContact O-N 2.7Å; L218-N220 VanDerWaalsContact C-N 3.29Å; L218-N220 PolarHBondContact O-N 3.17Å; N220-F232 WeakPolarHBondContact OD1-CZ 3.29Å |
| 221 | L | 89.2 | Confident | 88 | Confident | 19 Ų | 19 | 61.3 Ų | 61.3 | 10% | 0.099 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -71 | -32.1 | 175 | -70.1 | 177.6 | 0 | 0 | 0 | 112.2 | L92 S93 N96 F97 T100 I217 L218 | L92-L221 HydrophobicContact CD2-CB 4.38Å; S93-L221 VanDerWaalsContact CB-O 3.31Å; S93-L221 WeakPolarHBondContact CB-O 3.44Å; S93-L221 PolarHBondContact N-O 2.93Å; N96-L221 HydrophobicContact CB-CD2 4.05Å; F97-L221 HydrophobicContact CB-CD2 4.14Å; T100-L221 HydrophobicContact CG2-CD2 4.43Å; I217-L221 HydrophobicContact CG2-CD1 3.75Å; I217-L221 HydrophobicContact CG2-CG 4.16Å; I217-L221 WeakPolarHBondContact O-CG 3.36Å; I217-L221 PolarHBondContact O-N 2.65Å; L218-L221 PolarHBondContact O-N 3.3Å |
| 222 | G | 85.5 | Confident | 87.4 | Confident | 33 Ų | 33 | 58.7 Ų | 58.7 | 34% | 0.34 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | 1.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | L218 C224 | L218-G222 PolarHBondContact O-N 2.79Å; G222-C224 PolarHBondContact O-N 2.9Å; G222-C224 VanDerWaalsContact O-N 3.1Å; G222-C224 PolarHBondContact O-SG 2.93Å; G222-C224 VanDerWaalsContact O-SG 3.35Å |
| 223 | D | 84.5 | Confident | 86.9 | Confident | 93 Ų | 93 | 59.3 Ų | 59.3 | 50% | 0.497 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 51.6 | 27.6 | -171.2 | -66.2 | -32.9 | 0 | 0 | 0 | 113.6 | S93 L219 T225 | S93-D223 VanDerWaalsContact CB-CG 3.5Å; S93-D223 WeakPolarHBondContact CB-OD1 3.26Å; S93-D223 WeakPolarHBondContact CB-OD2 3.32Å; S93-D223 PolarHBondContact OG-OD1 2.71Å; S93-D223 PolarHBondContact OG-OD2 3.12Å; L219-D223 PolarHBondContact O-N 3.42Å; D223-T225 PolarHBondContact O-N 3.35Å |
| 224 | C | 82.4 | Confident | 86.5 | Confident | 57 Ų | 57 | 62.8 Ų | 62.8 | 39% | 0.385 | 37% | 0.365 | S | S | . | . | G | 310 helix | trans | -84.8 | 14.9 | -177.5 | -65 | 0 | 0 | 0 | 0 | 113.3 | L219 G222 N226 M227 | L219-C224 HydrophobicContact CD2-CB 3.8Å; L219-C224 PolarHBondContact O-N 3.14Å; G222-C224 PolarHBondContact O-N 2.9Å; G222-C224 VanDerWaalsContact O-N 3.1Å; G222-C224 PolarHBondContact O-SG 2.93Å; G222-C224 VanDerWaalsContact O-SG 3.35Å; C224-N226 VanDerWaalsContact C-N 3.27Å; C224-N226 PolarHBondContact O-N 3.39Å; C224-M227 WeakPolarHBondContact O-CB 3.31Å; C224-M227 PolarHBondContact O-N 3.4Å |
| 225 | T | 83.8 | Confident | 86.3 | Confident | 32 Ų | 32 | 63.8 Ų | 63.8 | 20% | 0.196 | 37% | 0.365 | C | S | . | . | G | 310 helix | trans | -67.7 | -26.4 | -174 | 55.9 | 0 | 0 | 0 | 0 | 113.1 | D223 M227 F232 | D223-T225 PolarHBondContact O-N 3.35Å; T225-M227 VanDerWaalsContact C-N 3.26Å; T225-M227 PolarHBondContact O-N 2.86Å; T225-F232 HydrophobicContact CG2-CD2 3.93Å; T225-F232 HydrophobicContact CG2-CE2 3.66Å; T225-F232 HydrophobicContact CG2-CG 4.5Å; T225-F232 HydrophobicContact CG2-CZ 4Å |
| 226 | N | 79.6 | Confident | 86.1 | Confident | 153 Ų | 153 | 61.1 Ų | 61.1 | 82% | 0.818 | 35% | 0.348 | S | S | * | . | G | 310 helix | trans | -76.9 | -8.9 | 178.4 | -64.4 | -33.6 | 0 | 0 | 0 | 113.9 | C224 L228 | C224-N226 VanDerWaalsContact C-N 3.27Å; C224-N226 PolarHBondContact O-N 3.39Å; N226-L228 VanDerWaalsContact C-N 3.28Å |
| 227 | M | 80.3 | Confident | 85.9 | Confident | 164 Ų | 164 | 62.1 Ų | 62.1 | 81% | 0.808 | 36% | 0.355 | S | S | * | . | G | 310 helix | trans | -82.6 | -8.4 | 178.6 | -60.1 | -65.9 | -78 | 0 | 0 | 112.5 | C224 T225 | C224-M227 WeakPolarHBondContact O-CB 3.31Å; C224-M227 PolarHBondContact O-N 3.4Å; T225-M227 VanDerWaalsContact C-N 3.26Å; T225-M227 PolarHBondContact O-N 2.86Å |
| 228 | L | 81.1 | Confident | 85.8 | Confident | 40 Ų | 40 | 63.4 Ų | 63.4 | 21% | 0.209 | 37% | 0.37 | C | S | . | . | trans | -77.8 | 135.8 | -179.5 | -76.2 | 153.4 | 0 | 0 | 0 | 110.6 | L219 N226 I230 F232 F235 | L219-L228 HydrophobicContact CD1-CD1 4.21Å; N226-L228 VanDerWaalsContact C-N 3.28Å; L228-I230 PolarHBondContact O-N 3.29Å; L228-F232 HydrophobicContact CD1-CD2 3.95Å; L228-F235 HydrophobicContact CD1-CD1 4.02Å; L228-F235 HydrophobicContact CD1-CE1 4.25Å; L228-F235 HydrophobicContact CD1-CG 4.46Å; L228-F235 HydrophobicContact CD2-CD1 4.31Å; L228-F235 HydrophobicContact CD2-CD2 4.16Å; L228-F235 HydrophobicContact CD2-CE1 4.18Å; L228-F235 HydrophobicContact CD2-CE2 4.03Å; L228-F235 HydrophobicContact CD2-CG 4.28Å; L228-F235 HydrophobicContact CD2-CZ 4.03Å | ||
| 229 | P | 80.6 | Confident | 85.8 | Confident | 130 Ų | 130 | 58.9 Ų | 58.9 | 84% | 0.844 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -72.1 | -9.1 | 178.1 | 28.6 | -33.8 | 0 | 0 | 0 | 113.6 | ||
| 230 | I | 85.2 | Confident | 85.9 | Confident | 87 Ų | 87 | 57.2 Ų | 57.2 | 45% | 0.446 | 34% | 0.337 | S | S | . | . | S | Bend | trans | -120.8 | 146.2 | -174.9 | -58.3 | 171.3 | 0 | 0 | 0 | 108.3 | L228 F232 T234 | L228-I230 PolarHBondContact O-N 3.29Å; I230-F232 PolarHBondContact O-N 2.87Å; I230-T234 HydrophobicContact CG2-CG2 4.26Å |
| 231 | P | 85.2 | Confident | 86.1 | Confident | 89 Ų | 89 | 61 Ų | 61 | 58% | 0.578 | 36% | 0.358 | S | S | * | . | trans | -50.9 | 128.4 | 172.6 | -27.3 | 34.9 | 0 | 0 | 0 | 112.2 | T234 F235 | P231-T234 WeakPolarHBondContact O-CB 3.12Å; P231-T234 PolarHBondContact O-N 2.95Å; P231-F235 PolarHBondContact O-N 3.48Å | ||
| 232 | F | 83.5 | Confident | 86.5 | Confident | 41 Ų | 41 | 63.5 Ų | 63.5 | 18% | 0.18 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -52.7 | -43.3 | -174.4 | 178.9 | -108.1 | 0 | 0 | 0 | 114.4 | Y164 N220 T225 L228 I230 T234 F235 L236 | Y164-F232 HydrophobicContact CD1-CZ 4.47Å; Y164-F232 AromaticContact CD2-CE1 3.76Å; Y164-F232 HydrophobicContact CD2-CE1 3.76Å; Y164-F232 HydrophobicContact CD2-CZ 4.24Å; Y164-F232 HydrophobicContact CE2-CE1 4.01Å; Y164-F232 HydrophobicContact CE2-CZ 4.34Å; Y164-F232 HydrophobicContact CG-CE1 4.15Å; Y164-F232 HydrophobicContact CG-CZ 4.3Å; N220-F232 WeakPolarHBondContact OD1-CZ 3.29Å; T225-F232 HydrophobicContact CG2-CD2 3.93Å; T225-F232 HydrophobicContact CG2-CE2 3.66Å; T225-F232 HydrophobicContact CG2-CG 4.5Å; T225-F232 HydrophobicContact CG2-CZ 4Å; L228-F232 HydrophobicContact CD1-CD2 3.95Å; I230-F232 PolarHBondContact O-N 2.87Å; F232-T234 PolarHBondContact O-N 3.2Å; F232-F235 WeakPolarHBondContact O-CB 3.1Å; F232-F235 PolarHBondContact O-N 2.88Å; F232-L236 HydrophobicContact CD1-CD1 3.91Å; F232-L236 HydrophobicContact CD1-CG 4.5Å; F232-L236 HydrophobicContact CD2-CG 4.48Å; F232-L236 HydrophobicContact CE1-CD1 3.42Å; F232-L236 VanDerWaalsContact CE1-CD1 3.42Å; F232-L236 HydrophobicContact CE1-CG 4.17Å; F232-L236 HydrophobicContact CE2-CD1 4.26Å; F232-L236 HydrophobicContact CE2-CD2 4.1Å; F232-L236 HydrophobicContact CE2-CG 4.13Å; F232-L236 HydrophobicContact CZ-CD1 3.61Å; F232-L236 HydrophobicContact CZ-CD2 3.98Å; F232-L236 HydrophobicContact CZ-CG 3.96Å; F232-L236 WeakPolarHBondContact O-CG 3.46Å; F232-L236 PolarHBondContact O-N 3.47Å |
| 233 | P | 85.3 | Confident | 86.9 | Confident | 56 Ų | 56 | 62 Ų | 62 | 36% | 0.364 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.2 | -37.1 | 176.7 | -23.8 | 35.8 | 0 | 0 | 0 | 114 | L236 S237 V315 | P233-L236 PolarHBondContact O-N 3.05Å; P233-S237 PolarHBondContact O-N 3.42Å; P233-V315 HydrophobicContact CB-CG2 3.88Å |
| 234 | T | 86.3 | Confident | 87.5 | Confident | 73 Ų | 73 | 58.6 Ų | 58.6 | 45% | 0.448 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -68.4 | -41.6 | 177.1 | -52.4 | 0 | 0 | 0 | 0 | 110.7 | I230 P231 F232 S237 G238 | I230-T234 HydrophobicContact CG2-CG2 4.26Å; P231-T234 WeakPolarHBondContact O-CB 3.12Å; P231-T234 PolarHBondContact O-N 2.95Å; F232-T234 PolarHBondContact O-N 3.2Å; T234-S237 PolarHBondContact O-N 3.24Å; T234-G238 PolarHBondContact O-N 3.29Å |
| 235 | F | 88.1 | Confident | 88.2 | Confident | 47 Ų | 47 | 61 Ų | 61 | 21% | 0.206 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -58.4 | -48.8 | 174 | 174.8 | -105.4 | 0 | 0 | 0 | 111.6 | L219 L228 P231 F232 S237 G238 L239 | L219-F235 HydrophobicContact CD1-CE1 4.3Å; L228-F235 HydrophobicContact CD1-CD1 4.02Å; L228-F235 HydrophobicContact CD1-CE1 4.25Å; L228-F235 HydrophobicContact CD1-CG 4.46Å; L228-F235 HydrophobicContact CD2-CD1 4.31Å; L228-F235 HydrophobicContact CD2-CD2 4.16Å; L228-F235 HydrophobicContact CD2-CE1 4.18Å; L228-F235 HydrophobicContact CD2-CE2 4.03Å; L228-F235 HydrophobicContact CD2-CG 4.28Å; L228-F235 HydrophobicContact CD2-CZ 4.03Å; P231-F235 PolarHBondContact O-N 3.48Å; F232-F235 WeakPolarHBondContact O-CB 3.1Å; F232-F235 PolarHBondContact O-N 2.88Å; F235-S237 PolarHBondContact O-N 2.91Å; F235-G238 PolarHBondContact O-N 2.93Å; F235-L239 HydrophobicContact CD1-CD1 4.15Å; F235-L239 HydrophobicContact CE1-CD1 3.5Å; F235-L239 VanDerWaalsContact CE1-CD1 3.5Å; F235-L239 HydrophobicContact CE1-CG 4.26Å; F235-L239 HydrophobicContact CE2-CD1 4.21Å; F235-L239 HydrophobicContact CE2-CD2 4.34Å; F235-L239 HydrophobicContact CE2-CG 4.25Å; F235-L239 HydrophobicContact CZ-CD1 3.54Å; F235-L239 HydrophobicContact CZ-CD2 4.36Å; F235-L239 HydrophobicContact CZ-CG 4.08Å; F235-L239 WeakPolarHBondContact O-CG 3.38Å; F235-L239 PolarHBondContact O-N 3.49Å |
| 236 | L | 89.1 | Confident | 88.8 | Confident | 6 Ų | 6 | 60.8 Ų | 60.8 | 3% | 0.031 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -59.1 | -46.9 | 176.7 | -69.5 | 175.7 | 0 | 0 | 0 | 112.6 | Y164 T216 F232 P233 G238 L239 A240 | Y164-L236 HydrophobicContact CD2-CD1 4.32Å; Y164-L236 HydrophobicContact CE2-CD1 3.39Å; Y164-L236 WeakPolarHBondContact OH-CD1 3.35Å; T216-L236 HydrophobicContact CG2-CD2 3.35Å; F232-L236 HydrophobicContact CD1-CD1 3.91Å; F232-L236 HydrophobicContact CD1-CG 4.5Å; F232-L236 HydrophobicContact CD2-CG 4.48Å; F232-L236 HydrophobicContact CE1-CD1 3.42Å; F232-L236 VanDerWaalsContact CE1-CD1 3.42Å; F232-L236 HydrophobicContact CE1-CG 4.17Å; F232-L236 HydrophobicContact CE2-CD1 4.26Å; F232-L236 HydrophobicContact CE2-CD2 4.1Å; F232-L236 HydrophobicContact CE2-CG 4.13Å; F232-L236 HydrophobicContact CZ-CD1 3.61Å; F232-L236 HydrophobicContact CZ-CD2 3.98Å; F232-L236 HydrophobicContact CZ-CG 3.96Å; F232-L236 WeakPolarHBondContact O-CG 3.46Å; F232-L236 PolarHBondContact O-N 3.47Å; P233-L236 PolarHBondContact O-N 3.05Å; L236-G238 VanDerWaalsContact C-N 3.29Å; L236-G238 PolarHBondContact O-N 3.42Å; L236-L239 PolarHBondContact O-N 3.39Å; L236-A240 WeakPolarHBondContact O-CB 3.32Å; L236-A240 PolarHBondContact O-N 3.46Å |
| 237 | S | 89.3 | Confident | 89.6 | Confident | 21 Ų | 21 | 53.5 Ų | 53.5 | 15% | 0.147 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.5 | -38.5 | 178.2 | -173.6 | 0 | 0 | 0 | 0 | 112 | P233 T234 F235 L241 | P233-S237 PolarHBondContact O-N 3.42Å; T234-S237 PolarHBondContact O-N 3.24Å; F235-S237 PolarHBondContact O-N 2.91Å; S237-L241 WeakPolarHBondContact O-CB 3.32Å; S237-L241 PolarHBondContact O-N 3.46Å |
| 238 | G | 91 | Very high | 90.4 | Very high | 34 Ų | 34 | 47.9 Ų | 47.9 | 35% | 0.351 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.9 | -46.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | T234 F235 L236 L241 V242 | T234-G238 PolarHBondContact O-N 3.29Å; F235-G238 PolarHBondContact O-N 2.93Å; L236-G238 VanDerWaalsContact C-N 3.29Å; L236-G238 PolarHBondContact O-N 3.42Å; G238-L241 PolarHBondContact O-N 3.01Å; G238-V242 WeakPolarHBondContact O-CG2 3.49Å; G238-V242 PolarHBondContact O-N 3.5Å |
| 239 | L | 91.6 | Very high | 91.1 | Very high | 22 Ų | 22 | 48.5 Ų | 48.5 | 12% | 0.115 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.9 | -45.3 | 176 | -68.5 | -172.8 | 0 | 0 | 0 | 112.1 | L212 T216 F235 L236 L241 V242 S243 | L212-L239 HydrophobicContact CB-CD2 4.42Å; L212-L239 HydrophobicContact CD1-CD2 4.21Å; L212-L239 HydrophobicContact CD2-CD2 3.82Å; L212-L239 HydrophobicContact CG-CD2 4.35Å; T216-L239 WeakPolarHBondContact OG1-CD1 3.29Å; F235-L239 HydrophobicContact CD1-CD1 4.15Å; F235-L239 HydrophobicContact CE1-CD1 3.5Å; F235-L239 VanDerWaalsContact CE1-CD1 3.5Å; F235-L239 HydrophobicContact CE1-CG 4.26Å; F235-L239 HydrophobicContact CE2-CD1 4.21Å; F235-L239 HydrophobicContact CE2-CD2 4.34Å; F235-L239 HydrophobicContact CE2-CG 4.25Å; F235-L239 HydrophobicContact CZ-CD1 3.54Å; F235-L239 HydrophobicContact CZ-CD2 4.36Å; F235-L239 HydrophobicContact CZ-CG 4.08Å; F235-L239 WeakPolarHBondContact O-CG 3.38Å; F235-L239 PolarHBondContact O-N 3.49Å; L236-L239 PolarHBondContact O-N 3.39Å; L239-L241 VanDerWaalsContact C-N 3.33Å; L239-L241 PolarHBondContact O-N 3.3Å; L239-V242 PolarHBondContact O-N 2.88Å; L239-S243 PolarHBondContact O-N 3.21Å; L239-S243 PolarHBondContact O-OG 2.92Å |
| 240 | A | 92.6 | Very high | 91.9 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.9 | -43 | 178 | 0 | 0 | 0 | 0 | 0 | 111.5 | L236 S243 V244 D307 L308 | L236-A240 WeakPolarHBondContact O-CB 3.32Å; L236-A240 PolarHBondContact O-N 3.46Å; A240-S243 PolarHBondContact O-N 2.96Å; A240-V244 WeakPolarHBondContact O-CG2 3.47Å; A240-V244 PolarHBondContact O-N 2.97Å; A240-D307 WeakPolarHBondContact CB-OD2 3.4Å; A240-L308 HydrophobicContact CB-CB 4.03Å; A240-L308 HydrophobicContact CB-CD1 4.05Å |
| 241 | L | 94.8 | Very high | 92.4 | Very high | 85 Ų | 85 | 40.6 Ų | 40.6 | 45% | 0.445 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62 | -47.3 | 177.6 | 179.4 | 64.1 | 0 | 0 | 0 | 111.7 | S237 G238 L239 S243 V244 L245 L308 | S237-L241 WeakPolarHBondContact O-CB 3.32Å; S237-L241 PolarHBondContact O-N 3.46Å; G238-L241 PolarHBondContact O-N 3.01Å; L239-L241 VanDerWaalsContact C-N 3.33Å; L239-L241 PolarHBondContact O-N 3.3Å; L241-S243 VanDerWaalsContact C-N 3.33Å; L241-S243 PolarHBondContact O-N 3.48Å; L241-V244 PolarHBondContact O-N 2.79Å; L241-L245 HydrophobicContact CG-CD1 4.38Å; L241-L245 WeakPolarHBondContact O-CG 3Å; L241-L245 PolarHBondContact O-N 2.97Å; L241-L308 HydrophobicContact CB-CD1 4Å; L241-L308 HydrophobicContact CD1-CD2 4.02Å |
| 242 | V | 96 | Very high | 92.9 | Very high | 70 Ų | 70 | 40.8 Ų | 40.8 | 42% | 0.424 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59 | -46.3 | 177 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | L212 G238 L239 V244 L245 L246 | L212-V242 HydrophobicContact CD1-CG1 4.38Å; G238-V242 WeakPolarHBondContact O-CG2 3.49Å; G238-V242 PolarHBondContact O-N 3.5Å; L239-V242 PolarHBondContact O-N 2.88Å; V242-V244 PolarHBondContact O-N 3.49Å; V242-L245 PolarHBondContact O-N 3.3Å; V242-L246 HydrophobicContact CG1-CD1 3.83Å; V242-L246 HydrophobicContact CG1-CG 4.35Å; V242-L246 WeakPolarHBondContact O-CG 3.34Å; V242-L246 PolarHBondContact O-N 2.92Å |
| 243 | S | 95.8 | Very high | 93.4 | Very high | 1 Ų | 1 | 41 Ų | 41 | 1% | 0.007 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62 | -41.2 | 178.2 | -65.4 | 0 | 0 | 0 | 0 | 113 | L239 A240 L241 L246 Y247 Y304 | L239-S243 PolarHBondContact O-N 3.21Å; L239-S243 PolarHBondContact O-OG 2.92Å; A240-S243 PolarHBondContact O-N 2.96Å; L241-S243 VanDerWaalsContact C-N 3.33Å; L241-S243 PolarHBondContact O-N 3.48Å; S243-L246 PolarHBondContact O-N 3.06Å; S243-Y247 WeakPolarHBondContact O-CB 3.39Å; S243-Y247 PolarHBondContact O-N 2.97Å; S243-Y304 VanDerWaalsContact CB-CE1 3.41Å |
| 244 | V | 97.2 | Very high | 93.8 | Very high | 22 Ų | 22 | 38.3 Ų | 38.3 | 13% | 0.133 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.2 | -47.6 | 175.8 | 168.9 | 0 | 0 | 0 | 0 | 110.9 | A240 L241 V242 L246 Y247 A248 L301 Y304 V305 L308 | A240-V244 WeakPolarHBondContact O-CG2 3.47Å; A240-V244 PolarHBondContact O-N 2.97Å; L241-V244 PolarHBondContact O-N 2.79Å; V242-V244 PolarHBondContact O-N 3.49Å; V244-L246 PolarHBondContact O-N 3.48Å; V244-Y247 PolarHBondContact O-N 2.89Å; V244-A248 VanDerWaalsContact O-CB 3.3Å; V244-A248 WeakPolarHBondContact O-CB 3.29Å; V244-A248 PolarHBondContact O-N 3.47Å; V244-L301 HydrophobicContact CG1-CD1 4.28Å; V244-Y304 WeakPolarHBondContact CG2-O 3.34Å; V244-V305 HydrophobicContact CG1-CG2 3.96Å; V244-V305 HydrophobicContact CG2-CG2 3.94Å; V244-L308 HydrophobicContact CG2-CB 4.31Å; V244-L308 HydrophobicContact CG2-CD2 4.12Å |
| 245 | L | 97.1 | Very high | 94.1 | Very high | 107 Ų | 107 | 36.7 Ų | 36.7 | 56% | 0.56 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -62.2 | -43.7 | 179.7 | -67.8 | 174.8 | 0 | 0 | 0 | 111.6 | L241 V242 A248 T249 | L241-L245 HydrophobicContact CG-CD1 4.38Å; L241-L245 WeakPolarHBondContact O-CG 3Å; L241-L245 PolarHBondContact O-N 2.97Å; V242-L245 PolarHBondContact O-N 3.3Å; L245-A248 PolarHBondContact O-N 3Å; L245-T249 PolarHBondContact O-N 3.2Å |
| 246 | L | 96.1 | Very high | 94.3 | Very high | 29 Ų | 29 | 37.3 Ų | 37.3 | 15% | 0.152 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.1 | -49 | 177.6 | -68.9 | 173.3 | 0 | 0 | 0 | 111.5 | W201 V205 I208 V242 S243 V244 A248 T249 A250 | W201-L246 HydrophobicContact CH2-CD2 4.37Å; W201-L246 HydrophobicContact CZ2-CD2 3.96Å; V205-L246 HydrophobicContact CB-CB 4.48Å; V205-L246 HydrophobicContact CG1-CB 3.78Å; V205-L246 HydrophobicContact CG2-CB 4.11Å; V205-L246 HydrophobicContact CG2-CD2 4.25Å; I208-L246 HydrophobicContact CG2-CD1 4.01Å; V242-L246 HydrophobicContact CG1-CD1 3.83Å; V242-L246 HydrophobicContact CG1-CG 4.35Å; V242-L246 WeakPolarHBondContact O-CG 3.34Å; V242-L246 PolarHBondContact O-N 2.92Å; S243-L246 PolarHBondContact O-N 3.06Å; V244-L246 PolarHBondContact O-N 3.48Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 2.97Å; L246-T249 PolarHBondContact O-N 3.29Å; L246-T249 PolarHBondContact O-OG1 3.29Å; L246-A250 PolarHBondContact O-N 3.25Å |
| 247 | Y | 96.5 | Very high | 94.4 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.2 | -29.6 | 178.1 | -94.4 | -93.1 | 0 | 0 | 0 | 113.3 | V205 Y206 C209 S243 V244 T249 A250 I251 T297 N300 L301 Y304 | V205-Y247 HydrophobicContact CG1-CD2 4.15Å; V205-Y247 HydrophobicContact CG1-CE2 4.36Å; V205-Y247 HydrophobicContact CG1-CG 4.46Å; Y206-Y247 AromaticContact CD1-CE1 3.67Å; Y206-Y247 HydrophobicContact CD1-CE1 3.67Å; Y206-Y247 HydrophobicContact CD1-CE2 4.47Å; Y206-Y247 AromaticContact CD1-CZ 3.63Å; Y206-Y247 WeakPolarHBondContact CD1-OH 3.38Å; Y206-Y247 HydrophobicContact CE1-CD1 4.33Å; Y206-Y247 AromaticContact CE1-CE1 3.75Å; Y206-Y247 HydrophobicContact CE1-CE1 3.75Å; C209-Y247 HydrophobicContact CB-CD2 4.15Å; C209-Y247 HydrophobicContact CB-CE2 3.51Å; S243-Y247 WeakPolarHBondContact O-CB 3.39Å; S243-Y247 PolarHBondContact O-N 2.97Å; V244-Y247 PolarHBondContact O-N 2.89Å; Y247-T249 PolarHBondContact O-N 3.31Å; Y247-A250 PolarHBondContact O-N 3.49Å; Y247-A250 VanDerWaalsContact O-N 3.17Å; Y247-I251 PolarHBondContact O-N 3.44Å; Y247-T297 HydrophobicContact CD1-CG2 3.91Å; Y247-T297 HydrophobicContact CE1-CG2 4.21Å; Y247-N300 HydrophobicContact CD1-CB 4.26Å; Y247-N300 HydrophobicContact CE1-CB 3.68Å; Y247-N300 PolarHBondContact OH-ND2 3.39Å; Y247-L301 HydrophobicContact CD1-CB 4.48Å; Y247-Y304 AromaticContact CD2-CD2 3.66Å; Y247-Y304 HydrophobicContact CD2-CD2 3.66Å; Y247-Y304 AromaticContact CD2-CE2 3.55Å; Y247-Y304 HydrophobicContact CD2-CE2 3.55Å; Y247-Y304 AromaticContact CE2-CD2 3.84Å; Y247-Y304 HydrophobicContact CE2-CD2 3.84Å; Y247-Y304 AromaticContact CE2-CE2 3.22Å; Y247-Y304 HydrophobicContact CE2-CE2 3.22Å; Y247-Y304 HydrophobicContact CG-CD2 4.14Å; Y247-Y304 HydrophobicContact CG-CE2 4.35Å; Y247-Y304 AromaticContact CZ-CE2 3.82Å |
| 248 | A | 96.7 | Very high | 94.4 | Very high | 45 Ų | 45 | 39 Ų | 39 | 37% | 0.372 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62.7 | -30.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V244 L245 L246 I251 | V244-A248 VanDerWaalsContact O-CB 3.3Å; V244-A248 WeakPolarHBondContact O-CB 3.29Å; V244-A248 PolarHBondContact O-N 3.47Å; L245-A248 PolarHBondContact O-N 3Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 2.97Å; A248-I251 WeakPolarHBondContact O-CG2 3.22Å |
| 249 | T | 96.3 | Very high | 94.4 | Very high | 54 Ų | 54 | 39.3 Ų | 39.3 | 33% | 0.331 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -72.9 | -43.1 | 170.8 | 71.3 | 0 | 0 | 0 | 0 | 111.6 | W201 L245 L246 Y247 I251 V252 L253 | W201-T249 PolarHBondContact NE1-OG1 3.05Å; W201-T249 VanDerWaalsContact NE1-OG1 3.1Å; L245-T249 PolarHBondContact O-N 3.2Å; L246-T249 PolarHBondContact O-N 3.29Å; L246-T249 PolarHBondContact O-OG1 3.29Å; Y247-T249 PolarHBondContact O-N 3.31Å; T249-I251 PolarHBondContact O-N 3.06Å; T249-V252 PolarHBondContact O-N 3.16Å; T249-L253 WeakPolarHBondContact O-CB 3.31Å; T249-L253 VanDerWaalsContact O-CG 3.32Å; T249-L253 WeakPolarHBondContact O-CG 3.22Å; T249-L253 PolarHBondContact O-N 2.82Å |
| 250 | A | 95.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.1 | -38.5 | -177 | 0 | 0 | 0 | 0 | 0 | 113 | C202 V205 Y206 L246 Y247 V252 L253 W254 T297 | C202-A250 HydrophobicContact CB-CB 4.37Å; V205-A250 HydrophobicContact CB-CB 4.45Å; V205-A250 HydrophobicContact CG1-CB 4.01Å; Y206-A250 HydrophobicContact CE1-CB 3.77Å; L246-A250 PolarHBondContact O-N 3.25Å; Y247-A250 PolarHBondContact O-N 3.49Å; Y247-A250 VanDerWaalsContact O-N 3.17Å; A250-V252 PolarHBondContact O-N 3.12Å; A250-L253 PolarHBondContact O-N 3.29Å; A250-W254 WeakPolarHBondContact O-CB 3.33Å; A250-W254 PolarHBondContact O-N 3.42Å; A250-T297 HydrophobicContact CB-CG2 4.05Å |
| 251 | I | 96.3 | Very high | 93.8 | Very high | 51 Ų | 51 | 47.5 Ų | 47.5 | 26% | 0.262 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65 | -24.9 | 179.6 | -165.4 | 58.2 | 0 | 0 | 0 | 112.8 | Y247 A248 T249 P255 T297 L301 | Y247-I251 PolarHBondContact O-N 3.44Å; A248-I251 WeakPolarHBondContact O-CG2 3.22Å; T249-I251 PolarHBondContact O-N 3.06Å; I251-P255 WeakPolarHBondContact O-CD 3.09Å; I251-P255 VanDerWaalsContact O-CG 3.25Å; I251-P255 WeakPolarHBondContact O-CG 3.31Å; I251-T297 HydrophobicContact CB-CG2 4.19Å; I251-T297 HydrophobicContact CD1-CG2 4.02Å; I251-L301 HydrophobicContact CB-CD2 4.19Å; I251-L301 HydrophobicContact CG1-CD2 4.47Å; I251-L301 HydrophobicContact CG2-CD2 3.82Å |
| 252 | V | 95.7 | Very high | 93.5 | Very high | 92 Ų | 92 | 54 Ų | 54 | 56% | 0.558 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -89.3 | -49.1 | 176.1 | 179.1 | 0 | 0 | 0 | 0 | 110.6 | T249 A250 P255 L256 | T249-V252 PolarHBondContact O-N 3.16Å; A250-V252 PolarHBondContact O-N 3.12Å; V252-P255 WeakPolarHBondContact O-CD 3.38Å; V252-L256 VanDerWaalsContact O-CB 3.23Å; V252-L256 WeakPolarHBondContact O-CB 3.42Å; V252-L256 PolarHBondContact O-N 3.31Å |
| 253 | L | 94.1 | Very high | 92.8 | Very high | 45 Ų | 45 | 55.3 Ų | 55.3 | 24% | 0.236 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -68.4 | -40.5 | -174.3 | -68.8 | 174 | 0 | 0 | 0 | 112.4 | T249 A250 L256 Y257 | T249-L253 WeakPolarHBondContact O-CB 3.31Å; T249-L253 VanDerWaalsContact O-CG 3.32Å; T249-L253 WeakPolarHBondContact O-CG 3.22Å; T249-L253 PolarHBondContact O-N 2.82Å; A250-L253 PolarHBondContact O-N 3.29Å; L253-L256 PolarHBondContact O-N 2.88Å; L253-Y257 HydrophobicContact CD2-CD2 4.43Å; L253-Y257 HydrophobicContact CD2-CE2 3.99Å; L253-Y257 WeakPolarHBondContact O-CD2 3.24Å; L253-Y257 PolarHBondContact O-N 3.4Å; L253-Y257 VanDerWaalsContact O-N 3.08Å |
| 254 | W | 94.1 | Very high | 92.1 | Very high | 1 Ų | 1 | 61.7 Ų | 61.7 | 0% | 0.004 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -61.7 | -54.6 | -176.7 | -178.2 | -83.6 | 0 | 0 | 0 | 112.4 | I187 L199 C202 Y206 A250 L256 Q258 R290 V293 | I187-W254 HydrophobicContact CG2-CH2 3.59Å; I187-W254 HydrophobicContact CG2-CZ2 4.27Å; I187-W254 HydrophobicContact CG2-CZ3 4.3Å; L199-W254 HydrophobicContact CD2-CD2 4.33Å; L199-W254 HydrophobicContact CD2-CE3 3.9Å; L199-W254 HydrophobicContact CD2-CZ3 4.27Å; C202-W254 HydrophobicContact CB-CE3 3.84Å; C202-W254 HydrophobicContact CB-CZ3 4.47Å; Y206-W254 HydrophobicContact CE2-CE3 4.33Å; Y206-W254 HydrophobicContact CE2-CZ3 4.44Å; A250-W254 WeakPolarHBondContact O-CB 3.33Å; A250-W254 PolarHBondContact O-N 3.42Å; W254-L256 PolarHBondContact O-N 2.99Å; W254-Q258 HydrophobicContact CD2-CG 4.3Å; W254-Q258 HydrophobicContact CG-CG 4.46Å; W254-Q258 HydrophobicContact CZ2-CG 4.33Å; W254-Q258 VanDerWaalsContact O-CB 3.28Å; W254-Q258 WeakPolarHBondContact O-CB 3.41Å; W254-Q258 WeakPolarHBondContact O-CG 3.37Å; W254-Q258 PolarHBondContact O-N 3.16Å; W254-Q258 VanDerWaalsContact O-N 3.11Å; W254-R290 PolarHBondContact NE1-O 3.46Å; W254-V293 HydrophobicContact CD2-CB 4.5Å; W254-V293 HydrophobicContact CD2-CG1 3.73Å; W254-V293 HydrophobicContact CE3-CG1 4.13Å; W254-V293 HydrophobicContact CG-CG1 4.37Å; W254-V293 HydrophobicContact CH2-CB 4.3Å; W254-V293 HydrophobicContact CH2-CG1 3.81Å; W254-V293 HydrophobicContact CH2-CG2 4.44Å; W254-V293 HydrophobicContact CZ2-CB 3.5Å; W254-V293 VanDerWaalsContact CZ2-CB 3.5Å; W254-V293 HydrophobicContact CZ2-CG1 3.36Å; W254-V293 HydrophobicContact CZ2-CG2 3.91Å; W254-V293 HydrophobicContact CZ3-CG1 4.16Å |
| 255 | P | 92.8 | Very high | 91.4 | Very high | 38 Ų | 38 | 61.1 Ų | 61.1 | 25% | 0.247 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65 | -38 | 178.7 | -21.8 | 35.9 | 0 | 0 | 0 | 112.9 | I251 V252 Y257 Q258 F259 A294 | I251-P255 WeakPolarHBondContact O-CD 3.09Å; I251-P255 VanDerWaalsContact O-CG 3.25Å; I251-P255 WeakPolarHBondContact O-CG 3.31Å; V252-P255 WeakPolarHBondContact O-CD 3.38Å; P255-Y257 PolarHBondContact O-N 2.91Å; P255-Q258 PolarHBondContact O-N 2.95Å; P255-F259 HydrophobicContact CB-CD2 3.91Å; P255-F259 HydrophobicContact CB-CE2 4.26Å; P255-F259 WeakPolarHBondContact O-CB 3.31Å; P255-F259 WeakPolarHBondContact O-CD2 3.08Å; P255-F259 PolarHBondContact O-N 3.1Å; P255-A294 HydrophobicContact CG-CB 4.28Å |
| 256 | L | 92.4 | Very high | 90.7 | Very high | 60 Ų | 60 | 60.4 Ų | 60.4 | 31% | 0.314 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -58 | -50.1 | -179.7 | -175.9 | 69.1 | 0 | 0 | 0 | 111.3 | V252 L253 W254 D260 Y263 | V252-L256 VanDerWaalsContact O-CB 3.23Å; V252-L256 WeakPolarHBondContact O-CB 3.42Å; V252-L256 PolarHBondContact O-N 3.31Å; L253-L256 PolarHBondContact O-N 2.88Å; W254-L256 PolarHBondContact O-N 2.99Å; L256-D260 HydrophobicContact CD1-CB 4.48Å; L256-D260 WeakPolarHBondContact O-CB 3.18Å; L256-D260 PolarHBondContact O-N 3.45Å; L256-Y263 HydrophobicContact CD1-CD2 4.2Å; L256-Y263 HydrophobicContact CD1-CE2 3.8Å; L256-Y263 HydrophobicContact CD2-CE2 4.15Å; L256-Y263 HydrophobicContact CG-CD2 4.05Å; L256-Y263 HydrophobicContact CG-CE2 3.84Å |
| 257 | Y | 90.4 | Very high | 90 | Very high | 60 Ų | 60 | 61.4 Ų | 61.4 | 24% | 0.235 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -80.8 | -18.3 | -177.3 | -79.9 | -92.3 | 0 | 0 | 0 | 114.1 | K196 A198 L253 P255 Y263 | K196-Y257 HydrophobicContact CB-CD1 4.46Å; K196-Y257 HydrophobicContact CD-CD1 3.81Å; K196-Y257 PolarHBondContact NZ-O 3.19Å; A198-Y257 HydrophobicContact CB-CD1 4.15Å; A198-Y257 HydrophobicContact CB-CD2 3.56Å; A198-Y257 HydrophobicContact CB-CE1 3.93Å; A198-Y257 HydrophobicContact CB-CE2 3.34Å; A198-Y257 HydrophobicContact CB-CG 3.96Å; L253-Y257 HydrophobicContact CD2-CD2 4.43Å; L253-Y257 HydrophobicContact CD2-CE2 3.99Å; L253-Y257 WeakPolarHBondContact O-CD2 3.24Å; L253-Y257 PolarHBondContact O-N 3.4Å; L253-Y257 VanDerWaalsContact O-N 3.08Å; P255-Y257 PolarHBondContact O-N 2.91Å; Y257-Y263 HydrophobicContact CD1-CD1 4.18Å; Y257-Y263 HydrophobicContact CD1-CG 4.28Å; Y257-Y263 AromaticContact CE1-CD1 3.75Å; Y257-Y263 HydrophobicContact CE1-CD1 3.75Å; Y257-Y263 HydrophobicContact CE1-CE1 4.34Å; Y257-Y263 HydrophobicContact CE1-CG 4.31Å |
| 258 | Q | 89.6 | Confident | 89.3 | Confident | 2 Ų | 2 | 70.4 Ų | 70.4 | 1% | 0.009 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -92.2 | -33.3 | 179.4 | -68.9 | -68.1 | 1.7 | 0 | 0 | 113.7 | L192 L199 W254 P255 G265 Y266 R290 | L192-Q258 PolarHBondContact O-NE2 3.28Å; L199-Q258 VanDerWaalsContact CD1-NE2 3.32Å; L199-Q258 HydrophobicContact CD2-CG 4.01Å; W254-Q258 HydrophobicContact CD2-CG 4.3Å; W254-Q258 HydrophobicContact CG-CG 4.46Å; W254-Q258 HydrophobicContact CZ2-CG 4.33Å; W254-Q258 VanDerWaalsContact O-CB 3.28Å; W254-Q258 WeakPolarHBondContact O-CB 3.41Å; W254-Q258 WeakPolarHBondContact O-CG 3.37Å; W254-Q258 PolarHBondContact O-N 3.16Å; W254-Q258 VanDerWaalsContact O-N 3.11Å; P255-Q258 PolarHBondContact O-N 2.95Å; Q258-G265 CarbonylContact O-C 3.58Å; Q258-G265 WeakPolarHBondContact O-CA 3.49Å; Q258-Y266 PolarHBondContact O-N 3.07Å; Q258-R290 HydrophobicContact CG-CG 4.46Å; Q258-R290 VanDerWaalsContact OE1-CD 3.25Å |
| 259 | F | 90.6 | Very high | 88.5 | Confident | 41 Ų | 41 | 73.6 Ų | 73.6 | 18% | 0.18 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -115.5 | -17 | -171.1 | -55.6 | -62.6 | 0 | 0 | 0 | 114.9 | P255 P267 W287 R290 L291 A294 | P255-F259 HydrophobicContact CB-CD2 3.91Å; P255-F259 HydrophobicContact CB-CE2 4.26Å; P255-F259 WeakPolarHBondContact O-CB 3.31Å; P255-F259 WeakPolarHBondContact O-CD2 3.08Å; P255-F259 PolarHBondContact O-N 3.1Å; F259-P267 WeakPolarHBondContact O-CA 3.27Å; F259-P267 VanDerWaalsContact O-CB 3.31Å; F259-P267 WeakPolarHBondContact O-CB 3.16Å; F259-W287 AromaticContact CD1-NE1 3.99Å; F259-W287 HydrophobicContact CE1-CZ2 4.32Å; F259-W287 AromaticContact CE1-NE1 3.91Å; F259-R290 HydrophobicContact CE1-CB 4.25Å; F259-R290 HydrophobicContact CZ-CB 4.11Å; F259-L291 HydrophobicContact CZ-CB 4.32Å; F259-L291 HydrophobicContact CZ-CD1 4.5Å; F259-A294 HydrophobicContact CE2-CB 4.15Å |
| 260 | D | 87.6 | Confident | 87.5 | Confident | 52 Ų | 52 | 75.5 Ų | 75.5 | 28% | 0.278 | 36% | 0.364 | S | S | . | . | trans | -84.7 | 126.3 | 178.3 | -170.7 | -16.5 | 0 | 0 | 0 | 111.5 | L256 R262 Y263 G265 | L256-D260 HydrophobicContact CD1-CB 4.48Å; L256-D260 WeakPolarHBondContact O-CB 3.18Å; L256-D260 PolarHBondContact O-N 3.45Å; D260-R262 PolarHBondContact O-N 2.84Å; D260-R262 WeakPolarHBondContact OD1-CB 3.3Å; D260-R262 WeakPolarHBondContact OD1-CG 3.39Å; D260-R262 PolarHBondContact OD1-N 3.21Å; D260-Y263 HydrophobicContact CB-CD2 3.99Å; D260-Y263 PolarHBondContact O-N 2.99Å; D260-G265 VanDerWaalsContact O-CA 3.3Å; D260-G265 WeakPolarHBondContact O-CA 3.3Å; D260-G265 PolarHBondContact O-N 3.22Å | ||
| 261 | Q | 84.7 | Confident | 86.3 | Confident | 143 Ų | 143 | 78.4 Ų | 78.4 | 67% | 0.668 | 38% | 0.384 | S | S | * | . | G | 310 helix | trans | -60.3 | -31.7 | 177.2 | -68.6 | -176.5 | -31.4 | 0 | 0 | 112.7 | Y263 N264 P267 | Q261-Y263 PolarHBondContact O-N 3.03Å; Q261-Y263 VanDerWaalsContact O-N 3.17Å; Q261-N264 PolarHBondContact O-N 2.95Å; Q261-P267 HydrophobicContact CG-CG 3.63Å |
| 262 | R | 87.5 | Confident | 85.2 | Confident | 222 Ų | 222 | 76.5 Ų | 76.5 | 84% | 0.838 | 37% | 0.374 | S | S | * | . | G | 310 helix | trans | -60.4 | -27.2 | 178.9 | -65.9 | 178.4 | 178.8 | -168 | 0.8 | 112.6 | D260 | D260-R262 PolarHBondContact O-N 2.84Å; D260-R262 WeakPolarHBondContact OD1-CB 3.3Å; D260-R262 WeakPolarHBondContact OD1-CG 3.39Å; D260-R262 PolarHBondContact OD1-N 3.21Å |
| 263 | Y | 82.1 | Confident | 84 | Confident | 96 Ų | 96 | 75.3 Ų | 75.3 | 38% | 0.376 | 37% | 0.374 | S | S | . | . | G | 310 helix | trans | -105.2 | 19.7 | 179 | -62.5 | -78.7 | 0 | 0 | 0 | 112.3 | K196 L256 Y257 D260 Q261 G265 | K196-Y263 PolarHBondContact NZ-O 3.19Å; L256-Y263 HydrophobicContact CD1-CD2 4.2Å; L256-Y263 HydrophobicContact CD1-CE2 3.8Å; L256-Y263 HydrophobicContact CD2-CE2 4.15Å; L256-Y263 HydrophobicContact CG-CD2 4.05Å; L256-Y263 HydrophobicContact CG-CE2 3.84Å; Y257-Y263 HydrophobicContact CD1-CD1 4.18Å; Y257-Y263 HydrophobicContact CD1-CG 4.28Å; Y257-Y263 AromaticContact CE1-CD1 3.75Å; Y257-Y263 HydrophobicContact CE1-CD1 3.75Å; Y257-Y263 HydrophobicContact CE1-CE1 4.34Å; Y257-Y263 HydrophobicContact CE1-CG 4.31Å; D260-Y263 HydrophobicContact CB-CD2 3.99Å; D260-Y263 PolarHBondContact O-N 2.99Å; Q261-Y263 PolarHBondContact O-N 3.03Å; Q261-Y263 VanDerWaalsContact O-N 3.17Å; Y263-G265 VanDerWaalsContact C-N 3.33Å; Y263-G265 PolarHBondContact O-N 3.24Å |
| 264 | N | 81.4 | Confident | 82.8 | Confident | 135 Ų | 135 | 75 Ų | 75 | 72% | 0.722 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 41.6 | -173 | -54.6 | -48.8 | 0 | 0 | 0 | 112.6 | K196 Q261 | K196-N264 PolarHBondContact NZ-O 3.09Å; Q261-N264 PolarHBondContact O-N 2.95Å |
| 265 | G | 81.6 | Confident | 81.7 | Confident | 10 Ų | 10 | 75.6 Ų | 75.6 | 10% | 0.103 | 38% | 0.38 | C | S | . | . | trans | -91 | 169.1 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q258 D260 Y263 P267 | Q258-G265 CarbonylContact O-C 3.58Å; Q258-G265 WeakPolarHBondContact O-CA 3.49Å; D260-G265 VanDerWaalsContact O-CA 3.3Å; D260-G265 WeakPolarHBondContact O-CA 3.3Å; D260-G265 PolarHBondContact O-N 3.22Å; Y263-G265 VanDerWaalsContact C-N 3.33Å; Y263-G265 PolarHBondContact O-N 3.24Å; G265-P267 WeakPolarHBondContact O-CD 3.39Å | ||
| 266 | Y | 83.1 | Confident | 80.3 | Confident | 92 Ų | 92 | 78.6 Ų | 78.6 | 36% | 0.361 | 40% | 0.398 | S | S | . | . | trans | -111.1 | 92.8 | -180 | -66.1 | -96.2 | 0 | 0 | 0 | 109.9 | Q258 R268 D272 W287 | Q258-Y266 PolarHBondContact O-N 3.07Å; Y266-R268 VanDerWaalsContact C-N 3.25Å; Y266-R268 PolarHBondContact O-N 3.24Å; Y266-D272 HydrophobicContact CD1-CB 4.37Å; Y266-W287 PolarHBondContact O-NE1 3.18Å | ||
| 267 | P | 80.4 | Confident | 78.5 | Confident | 51 Ų | 51 | 85.1 Ų | 85.1 | 33% | 0.331 | 42% | 0.419 | S | S | . | . | trans | -66.9 | -25.4 | -172.9 | 26.7 | -37.2 | 0 | 0 | 0 | 113.4 | F259 Q261 G265 | F259-P267 WeakPolarHBondContact O-CA 3.27Å; F259-P267 VanDerWaalsContact O-CB 3.31Å; F259-P267 WeakPolarHBondContact O-CB 3.16Å; Q261-P267 HydrophobicContact CG-CG 3.63Å; G265-P267 WeakPolarHBondContact O-CD 3.39Å | ||
| 268 | R | 81.5 | Confident | 76.6 | Confident | 188 Ų | 188 | 87 Ų | 87 | 71% | 0.709 | 44% | 0.437 | S | S | * | . | S | Bend | trans | -126 | 138.7 | -175.5 | -65.6 | 179.8 | -173.6 | 169.7 | 2 | 110.7 | Y266 A270 S271 | Y266-R268 VanDerWaalsContact C-N 3.25Å; Y266-R268 PolarHBondContact O-N 3.24Å; R268-A270 PolarHBondContact O-N 2.86Å; R268-S271 WeakPolarHBondContact O-CB 3.33Å; R268-S271 PolarHBondContact O-N 2.68Å; R268-S271 PolarHBondContact O-OG 3.44Å |
| 269 | R | 80.3 | Confident | 74.6 | Confident | 112 Ų | 112 | 95.5 Ų | 95.5 | 42% | 0.423 | 48% | 0.477 | S | S | . | . | G | 310 helix | trans | -51.3 | -42.6 | 173.3 | -169.7 | 178.3 | -172.3 | -99.3 | -1.1 | 112.9 | S271 D272 C275 W287 D288 | R269-S271 PolarHBondContact O-N 3.04Å; R269-D272 PolarHBondContact O-N 3.49Å; R269-D272 VanDerWaalsContact O-N 3.14Å; R269-C275 HydrophobicContact CG-CB 4.3Å; R269-W287 HydrophobicContact CB-CD2 3.68Å; R269-W287 HydrophobicContact CB-CE3 3.66Å; R269-W287 HydrophobicContact CB-CG 4.15Å; R269-W287 HydrophobicContact CB-CH2 4.39Å; R269-W287 HydrophobicContact CB-CZ2 4.42Å; R269-W287 HydrophobicContact CB-CZ3 4.02Å; R269-W287 HydrophobicContact CG-CB 4.39Å; R269-W287 HydrophobicContact CG-CD2 4.02Å; R269-W287 HydrophobicContact CG-CE3 3.74Å; R269-W287 HydrophobicContact CG-CG 4.3Å; R269-W287 HydrophobicContact CG-CZ3 4.35Å; R269-D288 WeakPolarHBondContact CD-OD1 3.21Å; R269-D288 IonicContact CZ-OD1 3.93Å; R269-D288 IonicContact CZ-OD2 3.51Å; R269-D288 IonicContact NE-OD1 3.86Å; R269-D288 PolarHBondContact NE-OD1 3.27Å; R269-D288 IonicContact NE-OD2 3.74Å; R269-D288 PolarHBondContact NE-OD2 3.25Å; R269-D288 IonicContact NH2-OD1 3.27Å; R269-D288 IonicContact NH2-OD2 2.85Å; R269-D288 PolarHBondContact NH2-OD2 3Å |
| 270 | A | 75.3 | Confident | 72.6 | Confident | 95 Ų | 95 | 98 Ų | 98 | 79% | 0.785 | 50% | 0.495 | S | S | * | . | G | 310 helix | trans | -66.8 | -16.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | R268 D272 | R268-A270 PolarHBondContact O-N 2.86Å; A270-D272 VanDerWaalsContact C-N 3.33Å |
| 271 | S | 71.3 | Confident | 71 | Confident | 61 Ų | 61 | 99.3 Ų | 99.3 | 43% | 0.427 | 51% | 0.507 | S | S | . | . | G | 310 helix | trans | -84.2 | -9.7 | 176.5 | 66.5 | 0 | 0 | 0 | 0 | 113.3 | R268 R269 | R268-S271 WeakPolarHBondContact O-CB 3.33Å; R268-S271 PolarHBondContact O-N 2.68Å; R268-S271 PolarHBondContact O-OG 3.44Å; R269-S271 PolarHBondContact O-N 3.04Å |
| 272 | D | 72.5 | Confident | 69.6 | Low | 10 Ų | 10 | 94.9 Ų | 94.9 | 5% | 0.053 | 49% | 0.486 | C | S | . | . | trans | -94.3 | 109.7 | 177.7 | -167.9 | -28 | 0 | 0 | 0 | 109.8 | Y266 R269 A270 S274 C275 W287 | Y266-D272 HydrophobicContact CD1-CB 4.37Å; R269-D272 PolarHBondContact O-N 3.49Å; R269-D272 VanDerWaalsContact O-N 3.14Å; A270-D272 VanDerWaalsContact C-N 3.33Å; D272-S274 PolarHBondContact O-N 2.97Å; D272-S274 VanDerWaalsContact O-N 3.14Å; D272-S274 VanDerWaalsContact OD1-CB 3.28Å; D272-S274 WeakPolarHBondContact OD1-CB 3.45Å; D272-S274 PolarHBondContact OD1-N 3.11Å; D272-S274 PolarHBondContact OD1-OG 2.98Å; D272-S274 PolarHBondContact OD2-OG 3.41Å; D272-C275 WeakPolarHBondContact O-CB 3.21Å; D272-C275 PolarHBondContact O-N 3.46Å; D272-W287 HydrophobicContact CB-CB 4.09Å; D272-W287 PolarHBondContact OD2-N 2.6Å | ||
| 273 | A | 69.9 | Low | 68.4 | Low | 67 Ų | 67 | 88 Ų | 88 | 55% | 0.554 | 47% | 0.472 | S | S | * | . | G | 310 helix | trans | -59.5 | -24.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | C275 T276 | A273-C275 PolarHBondContact O-N 3.38Å; A273-T276 PolarHBondContact O-N 3.45Å |
| 274 | S | 69.7 | Low | 67.9 | Low | 40 Ų | 40 | 85.8 Ų | 85.8 | 28% | 0.28 | 47% | 0.468 | S | S | . | . | G | 310 helix | trans | -67.3 | -23.1 | 175.1 | 71.5 | 0 | 0 | 0 | 0 | 113.2 | D272 F286 | D272-S274 PolarHBondContact O-N 2.97Å; D272-S274 VanDerWaalsContact O-N 3.14Å; D272-S274 VanDerWaalsContact OD1-CB 3.28Å; D272-S274 WeakPolarHBondContact OD1-CB 3.45Å; D272-S274 PolarHBondContact OD1-N 3.11Å; D272-S274 PolarHBondContact OD1-OG 2.98Å; D272-S274 PolarHBondContact OD2-OG 3.41Å; S274-F286 VanDerWaalsContact CB-CD2 3.42Å; S274-F286 WeakPolarHBondContact OG-CD2 3.48Å; S274-F286 PolarHBondContact OG-N 2.86Å |
| 275 | C | 71.4 | Confident | 67.9 | Low | 13 Ų | 13 | 80.1 Ų | 80.1 | 9% | 0.088 | 44% | 0.439 | C | S | . | . | G | 310 helix | trans | -90.4 | -5.2 | 178.4 | -57.8 | 0 | 0 | 0 | 0 | 112.5 | R269 D272 A273 C285 | R269-C275 HydrophobicContact CG-CB 4.3Å; D272-C275 WeakPolarHBondContact O-CB 3.21Å; D272-C275 PolarHBondContact O-N 3.46Å; A273-C275 PolarHBondContact O-N 3.38Å; C275-C285 HydrophobicContact CB-CB 3.79Å; C275-C285 WeakPolarHBondContact CB-SG 3.34Å; C275-C285 WeakPolarHBondContact SG-CB 3Å; C275-C285 CovalentContact SG-SG 2.05Å; C275-C285 PolarHBondContact SG-SG 2.98Å |
| 276 | T | 62.9 | Low | 68 | Low | 100 Ų | 100 | 82.1 Ų | 82.1 | 61% | 0.613 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | -29.9 | 178.8 | -37.8 | 0 | 0 | 0 | 0 | 112.4 | A273 T278 | A273-T276 PolarHBondContact O-N 3.45Å; T276-T278 VanDerWaalsContact C-N 3.32Å; T276-T278 PolarHBondContact O-N 3.45Å |
| 277 | Y | 54 | Low | 68.1 | Low | 197 Ų | 197 | 79.6 Ų | 79.6 | 77% | 0.773 | 44% | 0.435 | S | S | * | . | trans | -89.5 | 56.9 | 177 | -75.4 | -86.6 | 0 | 0 | 0 | 112.2 | H279 | Y277-H279 VanDerWaalsContact C-N 3.33Å; Y277-H279 PolarHBondContact O-N 3.32Å | ||
| 278 | T | 50.3 | Low | 68.4 | Low | 99 Ų | 99 | 79.2 Ų | 79.2 | 61% | 0.607 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | 76.4 | 174.4 | 33.9 | 0 | 0 | 0 | 0 | 111.5 | T276 | T276-T278 VanDerWaalsContact C-N 3.32Å; T276-T278 PolarHBondContact O-N 3.45Å |
| 279 | H | 47.5 | Very low | 68.6 | Low | 181 Ų | 181 | 71.4 Ų | 71.4 | 84% | 0.838 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -127.5 | 7.7 | 162.7 | -82.8 | -70.6 | 0 | 0 | 0 | 113.5 | Y277 P281 | Y277-H279 VanDerWaalsContact C-N 3.33Å; Y277-H279 PolarHBondContact O-N 3.32Å; H279-P281 WeakPolarHBondContact O-CD 3.28Å |
| 280 | T | 50.5 | Low | 69.1 | Low | 93 Ų | 93 | 66.8 Ų | 66.8 | 57% | 0.571 | 38% | 0.383 | S | S | * | . | S | Bend | trans | -93.5 | 102 | 165.7 | 48.6 | 0 | 0 | 0 | 0 | 108.8 | H282 S283 | T280-H282 PolarHBondContact O-N 3.32Å; T280-S283 PolarHBondContact OG1-OG 2.74Å |
| 281 | P | 52.4 | Low | 69.8 | Low | 81 Ų | 81 | 65.2 Ų | 65.2 | 53% | 0.526 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | 137.9 | 167 | 25.7 | -32.4 | 0 | 0 | 0 | 107.9 | H279 | H279-P281 WeakPolarHBondContact O-CD 3.28Š|
| 282 | H | 55.2 | Low | 70.8 | Confident | 50 Ų | 50 | 63.4 Ų | 63.4 | 23% | 0.231 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 86.8 | 14.3 | 172.5 | -35.3 | -59.3 | 0 | 0 | 0 | 119.1 | T119 Y120 T280 | T119-H282 PolarHBondContact O-ND1 2.89Å; Y120-H282 AromaticContact CD2-CE1 3.32Å; Y120-H282 WeakPolarHBondContact CD2-CE1 3.32Å; Y120-H282 AromaticContact CD2-ND1 3.42Å; Y120-H282 WeakPolarHBondContact CD2-ND1 3.5Å; Y120-H282 AromaticContact CE2-CE1 3.49Å; Y120-H282 VanDerWaalsContact CE2-CE1 3.49Å; Y120-H282 WeakPolarHBondContact CE2-CE1 3.15Å; Y120-H282 AromaticContact CE2-ND1 3.91Å; Y120-H282 AromaticContact CE2-NE2 3.78Å; T280-H282 PolarHBondContact O-N 3.32Å |
| 283 | S | 62.7 | Low | 71.8 | Confident | 77 Ų | 77 | 63 Ų | 63 | 54% | 0.538 | 35% | 0.347 | S | S | . | . | trans | -119 | 142.7 | 171.5 | 64.2 | 0 | 0 | 0 | 0 | 113.2 | T280 | T280-S283 PolarHBondContact OG1-OG 2.74Š| ||
| 284 | V | 72.6 | Confident | 73 | Confident | 50 Ų | 50 | 60.4 Ų | 60.4 | 30% | 0.303 | 33% | 0.326 | S | S | . | . | trans | -94.3 | 127.5 | 175.7 | -176.1 | 0 | 0 | 0 | 0 | 108.2 | D288 R289 | V284-D288 HydrophobicContact CG1-CB 3.55Å; V284-R289 HydrophobicContact CB-CG 4.18Å; V284-R289 HydrophobicContact CG1-CG 3.93Å | ||
| 285 | C | 80.9 | Confident | 74.2 | Confident | 15 Ų | 15 | 63 Ų | 63 | 10% | 0.101 | 34% | 0.336 | C | S | . | . | trans | -69.6 | 161.6 | -176.2 | 78.9 | 0 | 0 | 0 | 0 | 112.5 | C275 W287 D288 R289 | C275-C285 HydrophobicContact CB-CB 3.79Å; C275-C285 WeakPolarHBondContact CB-SG 3.34Å; C275-C285 WeakPolarHBondContact SG-CB 3Å; C275-C285 CovalentContact SG-SG 2.05Å; C275-C285 PolarHBondContact SG-SG 2.98Å; C285-W287 VanDerWaalsContact C-N 3.34Å; C285-W287 PolarHBondContact O-N 3.21Å; C285-D288 PolarHBondContact O-N 2.88Å; C285-D288 VanDerWaalsContact O-N 3.16Å; C285-D288 VanDerWaalsContact SG-CG 3.57Å; C285-D288 PolarHBondContact SG-OD2 3.26Å; C285-D288 VanDerWaalsContact SG-OD2 3.32Å; C285-R289 WeakPolarHBondContact O-CG 3.37Å; C285-R289 PolarHBondContact O-N 3.14Å | ||
| 286 | F | 83 | Confident | 75.4 | Confident | 52 Ų | 52 | 63.6 Ų | 63.6 | 23% | 0.228 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -61.7 | -39.7 | -171.2 | -70.9 | -55.5 | 0 | 0 | 0 | 113.4 | E189 L192 S274 D288 R289 R290 | E189-F286 WeakPolarHBondContact OE2-CE1 3.12Å; E189-F286 VanDerWaalsContact OE2-CZ 3.29Å; E189-F286 WeakPolarHBondContact OE2-CZ 3.42Å; L192-F286 HydrophobicContact CD1-CD1 4.44Å; L192-F286 HydrophobicContact CD2-CB 4.43Å; L192-F286 HydrophobicContact CD2-CD1 3.96Å; L192-F286 HydrophobicContact CG-CD1 4.3Å; S274-F286 VanDerWaalsContact CB-CD2 3.42Å; S274-F286 WeakPolarHBondContact OG-CD2 3.48Å; S274-F286 PolarHBondContact OG-N 2.86Å; F286-D288 PolarHBondContact O-N 3.48Å; F286-R289 PolarHBondContact O-N 3.14Å; F286-R290 VanDerWaalsContact O-CG 3.27Å; F286-R290 WeakPolarHBondContact O-CG 3.45Å; F286-R290 PolarHBondContact O-N 2.05Å |
| 287 | W | 85.6 | Confident | 77 | Confident | 39 Ų | 39 | 58.8 Ų | 58.8 | 15% | 0.148 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.3 | -45.8 | 176.6 | -166.7 | 92.3 | 0 | 0 | 0 | 112.1 | F259 Y266 R269 D272 C285 R289 R290 L291 | F259-W287 AromaticContact CD1-NE1 3.99Å; F259-W287 HydrophobicContact CE1-CZ2 4.32Å; F259-W287 AromaticContact CE1-NE1 3.91Å; Y266-W287 PolarHBondContact O-NE1 3.18Å; R269-W287 HydrophobicContact CB-CD2 3.68Å; R269-W287 HydrophobicContact CB-CE3 3.66Å; R269-W287 HydrophobicContact CB-CG 4.15Å; R269-W287 HydrophobicContact CB-CH2 4.39Å; R269-W287 HydrophobicContact CB-CZ2 4.42Å; R269-W287 HydrophobicContact CB-CZ3 4.02Å; R269-W287 HydrophobicContact CG-CB 4.39Å; R269-W287 HydrophobicContact CG-CD2 4.02Å; R269-W287 HydrophobicContact CG-CE3 3.74Å; R269-W287 HydrophobicContact CG-CG 4.3Å; R269-W287 HydrophobicContact CG-CZ3 4.35Å; D272-W287 HydrophobicContact CB-CB 4.09Å; D272-W287 PolarHBondContact OD2-N 2.6Å; C285-W287 VanDerWaalsContact C-N 3.34Å; C285-W287 PolarHBondContact O-N 3.21Å; W287-R289 VanDerWaalsContact C-N 3.3Å; W287-R289 PolarHBondContact O-N 2.96Å; W287-R290 PolarHBondContact O-N 3.21Å; W287-L291 HydrophobicContact CE3-CB 4.45Å; W287-L291 HydrophobicContact CE3-CD2 4.5Å; W287-L291 HydrophobicContact CH2-CD2 3.84Å; W287-L291 HydrophobicContact CZ3-CB 4.2Å; W287-L291 HydrophobicContact CZ3-CD2 3.56Å; W287-L291 HydrophobicContact CZ3-CG 4.43Å; W287-L291 PolarHBondContact O-N 2.85Å |
| 288 | D | 85.9 | Confident | 79 | Confident | 43 Ų | 43 | 50.4 Ų | 50.4 | 23% | 0.23 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.6 | -36.9 | 179 | -67 | -18 | 0 | 0 | 0 | 110.9 | R269 V284 C285 F286 L291 A292 | R269-D288 WeakPolarHBondContact CD-OD1 3.21Å; R269-D288 IonicContact CZ-OD1 3.93Å; R269-D288 IonicContact CZ-OD2 3.51Å; R269-D288 IonicContact NE-OD1 3.86Å; R269-D288 PolarHBondContact NE-OD1 3.27Å; R269-D288 IonicContact NE-OD2 3.74Å; R269-D288 PolarHBondContact NE-OD2 3.25Å; R269-D288 IonicContact NH2-OD1 3.27Å; R269-D288 IonicContact NH2-OD2 2.85Å; R269-D288 PolarHBondContact NH2-OD2 3Å; V284-D288 HydrophobicContact CG1-CB 3.55Å; C285-D288 PolarHBondContact O-N 2.88Å; C285-D288 VanDerWaalsContact O-N 3.16Å; C285-D288 VanDerWaalsContact SG-CG 3.57Å; C285-D288 PolarHBondContact SG-OD2 3.26Å; C285-D288 VanDerWaalsContact SG-OD2 3.32Å; F286-D288 PolarHBondContact O-N 3.48Å; D288-L291 PolarHBondContact O-N 2.65Å; D288-A292 WeakPolarHBondContact O-CB 3.42Å; D288-A292 PolarHBondContact O-N 3.45Å |
| 289 | R | 87.3 | Confident | 81.3 | Confident | 24 Ų | 24 | 48.9 Ų | 48.9 | 9% | 0.091 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 173.4 | -63.8 | 173.4 | 65.8 | 164 | 3.2 | 112.4 | F186 S188 E189 V284 C285 F286 W287 L291 A292 V293 | F186-R289 HydrophobicContact CD1-CB 4.24Å; F186-R289 HydrophobicContact CD1-CG 3.98Å; F186-R289 VanDerWaalsContact O-CZ 3.27Å; F186-R289 PolarHBondContact O-NE 3.23Å; F186-R289 PolarHBondContact O-NH2 2.61Å; S188-R289 PolarHBondContact OG-NH2 2.97Å; E189-R289 IonicContact OE1-CZ 2.76Å; E189-R289 IonicContact OE1-NH1 2.61Å; E189-R289 PolarHBondContact OE1-NH1 3.35Å; E189-R289 IonicContact OE1-NH2 3.6Å; E189-R289 IonicContact OE2-NH1 2.88Å; V284-R289 HydrophobicContact CB-CG 4.18Å; V284-R289 HydrophobicContact CG1-CG 3.93Å; C285-R289 WeakPolarHBondContact O-CG 3.37Å; C285-R289 PolarHBondContact O-N 3.14Å; F286-R289 PolarHBondContact O-N 3.14Å; W287-R289 VanDerWaalsContact C-N 3.3Å; W287-R289 PolarHBondContact O-N 2.96Å; R289-L291 VanDerWaalsContact C-N 3.31Å; R289-L291 PolarHBondContact O-N 2.94Å; R289-A292 PolarHBondContact O-N 3.17Å; R289-V293 WeakPolarHBondContact O-CG2 3.44Å; R289-V293 PolarHBondContact O-N 2.65Å |
| 290 | R | 90 | Very high | 83.6 | Confident | 16 Ų | 16 | 40.3 Ų | 40.3 | 6% | 0.06 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.1 | -40.9 | 177.7 | -66.5 | 163.6 | -163.8 | -146.6 | 19.3 | 111.4 | L192 W254 Q258 F259 F286 W287 V293 A294 | L192-R290 HydrophobicContact CD2-CG 3.9Å; W254-R290 PolarHBondContact NE1-O 3.46Å; Q258-R290 HydrophobicContact CG-CG 4.46Å; Q258-R290 VanDerWaalsContact OE1-CD 3.25Å; F259-R290 HydrophobicContact CE1-CB 4.25Å; F259-R290 HydrophobicContact CZ-CB 4.11Å; F286-R290 VanDerWaalsContact O-CG 3.27Å; F286-R290 WeakPolarHBondContact O-CG 3.45Å; F286-R290 PolarHBondContact O-N 2.05Å; W287-R290 PolarHBondContact O-N 3.21Å; R290-V293 PolarHBondContact O-N 3.32Å; R290-A294 PolarHBondContact O-N 3.32Å; R290-A294 VanDerWaalsContact O-N 3.1Å |
| 291 | L | 91.1 | Very high | 85.8 | Confident | 62 Ų | 62 | 37.3 Ų | 37.3 | 33% | 0.325 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -65.2 | -46.9 | 175.4 | 179.5 | 65.1 | 0 | 0 | 0 | 111.3 | F259 W287 D288 R289 V293 A294 I295 | F259-L291 HydrophobicContact CZ-CB 4.32Å; F259-L291 HydrophobicContact CZ-CD1 4.5Å; W287-L291 HydrophobicContact CE3-CB 4.45Å; W287-L291 HydrophobicContact CE3-CD2 4.5Å; W287-L291 HydrophobicContact CH2-CD2 3.84Å; W287-L291 HydrophobicContact CZ3-CB 4.2Å; W287-L291 HydrophobicContact CZ3-CD2 3.56Å; W287-L291 HydrophobicContact CZ3-CG 4.43Å; W287-L291 PolarHBondContact O-N 2.85Å; D288-L291 PolarHBondContact O-N 2.65Å; R289-L291 VanDerWaalsContact C-N 3.31Å; R289-L291 PolarHBondContact O-N 2.94Å; L291-V293 VanDerWaalsContact C-N 3.31Å; L291-V293 PolarHBondContact O-N 2.62Å; L291-A294 WeakPolarHBondContact O-CB 3.24Å; L291-A294 PolarHBondContact O-N 3.31Å; L291-A294 VanDerWaalsContact O-N 3.12Å; L291-I295 HydrophobicContact CD1-CD1 4.08Å; L291-I295 HydrophobicContact CD1-CG1 4.32Å; L291-I295 HydrophobicContact CD2-CD1 4.45Å; L291-I295 HydrophobicContact CG-CD1 3.88Å; L291-I295 HydrophobicContact CG-CG1 4.49Å; L291-I295 WeakPolarHBondContact O-CG1 3.03Å; L291-I295 PolarHBondContact O-N 2.92Å |
| 292 | A | 90.9 | Very high | 88 | Confident | 22 Ų | 22 | 39.1 Ų | 39.1 | 18% | 0.182 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -54.8 | -46.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | F186 D288 R289 A294 I295 L296 | F186-A292 HydrophobicContact CD1-CB 4.31Å; F186-A292 HydrophobicContact CD2-CB 4.03Å; F186-A292 HydrophobicContact CE1-CB 4.18Å; F186-A292 HydrophobicContact CE2-CB 3.89Å; F186-A292 HydrophobicContact CG-CB 4.24Å; F186-A292 HydrophobicContact CZ-CB 3.98Å; D288-A292 WeakPolarHBondContact O-CB 3.42Å; D288-A292 PolarHBondContact O-N 3.45Å; R289-A292 PolarHBondContact O-N 3.17Å; A292-A294 VanDerWaalsContact C-N 3.34Å; A292-A294 PolarHBondContact O-N 3.27Å; A292-I295 PolarHBondContact O-N 2.87Å; A292-L296 WeakPolarHBondContact O-CB 3.44Å; A292-L296 WeakPolarHBondContact O-CD1 3.38Å; A292-L296 WeakPolarHBondContact O-CG 3.47Å; A292-L296 PolarHBondContact O-N 2.94Å |
| 293 | V | 93.6 | Very high | 89.9 | Confident | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.006 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.9 | -41.6 | 177.1 | 176.9 | 0 | 0 | 0 | 0 | 111.6 | I183 F186 I187 Y206 W254 R289 R290 L291 I295 L296 T297 | I183-V293 HydrophobicContact CG2-CG1 4.02Å; F186-V293 HydrophobicContact CB-CG2 3.63Å; I187-V293 HydrophobicContact CG2-CG1 4.26Å; I187-V293 HydrophobicContact CG2-CG2 3.59Å; Y206-V293 HydrophobicContact CE2-CG1 4.08Å; W254-V293 HydrophobicContact CD2-CB 4.5Å; W254-V293 HydrophobicContact CD2-CG1 3.73Å; W254-V293 HydrophobicContact CE3-CG1 4.13Å; W254-V293 HydrophobicContact CG-CG1 4.37Å; W254-V293 HydrophobicContact CH2-CB 4.3Å; W254-V293 HydrophobicContact CH2-CG1 3.81Å; W254-V293 HydrophobicContact CH2-CG2 4.44Å; W254-V293 HydrophobicContact CZ2-CB 3.5Å; W254-V293 VanDerWaalsContact CZ2-CB 3.5Å; W254-V293 HydrophobicContact CZ2-CG1 3.36Å; W254-V293 HydrophobicContact CZ2-CG2 3.91Å; W254-V293 HydrophobicContact CZ3-CG1 4.16Å; R289-V293 WeakPolarHBondContact O-CG2 3.44Å; R289-V293 PolarHBondContact O-N 2.65Å; R290-V293 PolarHBondContact O-N 3.32Å; L291-V293 VanDerWaalsContact C-N 3.31Å; L291-V293 PolarHBondContact O-N 2.62Å; V293-I295 PolarHBondContact O-N 2.92Å; V293-L296 PolarHBondContact O-N 3.4Å; V293-T297 VanDerWaalsContact O-CB 3.31Å; V293-T297 WeakPolarHBondContact O-CB 3.49Å; V293-T297 PolarHBondContact O-N 3.38Å; V293-T297 PolarHBondContact O-OG1 3Å |
| 294 | A | 94.9 | Very high | 91.5 | Very high | 13 Ų | 13 | 33.3 Ų | 33.3 | 11% | 0.107 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.9 | -46 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | P255 F259 R290 L291 A292 T297 G298 | P255-A294 HydrophobicContact CG-CB 4.28Å; F259-A294 HydrophobicContact CE2-CB 4.15Å; R290-A294 PolarHBondContact O-N 3.32Å; R290-A294 VanDerWaalsContact O-N 3.1Å; L291-A294 WeakPolarHBondContact O-CB 3.24Å; L291-A294 PolarHBondContact O-N 3.31Å; L291-A294 VanDerWaalsContact O-N 3.12Å; A292-A294 VanDerWaalsContact C-N 3.34Å; A292-A294 PolarHBondContact O-N 3.27Å; A294-T297 PolarHBondContact O-N 3.29Å; A294-G298 PolarHBondContact O-N 3.14Å; A294-G298 VanDerWaalsContact O-N 3.16Å |
| 295 | I | 95.6 | Very high | 92.7 | Very high | 95 Ų | 95 | 33.8 Ų | 33.8 | 49% | 0.487 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -64 | -48.2 | 178.2 | -66 | 169.4 | 0 | 0 | 0 | 110.4 | L291 A292 V293 T297 G298 I299 | L291-I295 HydrophobicContact CD1-CD1 4.08Å; L291-I295 HydrophobicContact CD1-CG1 4.32Å; L291-I295 HydrophobicContact CD2-CD1 4.45Å; L291-I295 HydrophobicContact CG-CD1 3.88Å; L291-I295 HydrophobicContact CG-CG1 4.49Å; L291-I295 WeakPolarHBondContact O-CG1 3.03Å; L291-I295 PolarHBondContact O-N 2.92Å; A292-I295 PolarHBondContact O-N 2.87Å; V293-I295 PolarHBondContact O-N 2.92Å; I295-T297 VanDerWaalsContact C-N 3.28Å; I295-T297 PolarHBondContact O-N 3.38Å; I295-G298 PolarHBondContact O-N 3.36Å; I295-G298 VanDerWaalsContact O-N 3.1Å; I295-I299 HydrophobicContact CG2-CD1 3.83Å; I295-I299 HydrophobicContact CG2-CG1 4.44Å; I295-I299 WeakPolarHBondContact O-CG1 3.49Å; I295-I299 PolarHBondContact O-N 3.42Å |
| 296 | L | 95.8 | Very high | 93.3 | Very high | 25 Ų | 25 | 35.4 Ų | 35.4 | 13% | 0.131 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.9 | -34.4 | 179.6 | -69.1 | 167.6 | 0 | 0 | 0 | 112 | V179 I182 I183 F186 A292 V293 G298 I299 N300 | V179-L296 HydrophobicContact CG1-CB 4.15Å; V179-L296 HydrophobicContact CG1-CD2 4.14Å; I182-L296 HydrophobicContact CB-CD1 4.26Å; I182-L296 HydrophobicContact CG2-CD1 3.49Å; I182-L296 VanDerWaalsContact CG2-CD1 3.49Å; I182-L296 HydrophobicContact CG2-CD2 4.39Å; I183-L296 HydrophobicContact CD1-CB 3.97Å; I183-L296 HydrophobicContact CG1-CB 3.58Å; I183-L296 HydrophobicContact CG1-CD1 4.06Å; I183-L296 HydrophobicContact CG1-CG 4.47Å; F186-L296 HydrophobicContact CD2-CD1 3.7Å; F186-L296 HydrophobicContact CE2-CD1 3.83Å; A292-L296 WeakPolarHBondContact O-CB 3.44Å; A292-L296 WeakPolarHBondContact O-CD1 3.38Å; A292-L296 WeakPolarHBondContact O-CG 3.47Å; A292-L296 PolarHBondContact O-N 2.94Å; V293-L296 PolarHBondContact O-N 3.4Å; L296-G298 VanDerWaalsContact C-N 3.32Å; L296-G298 PolarHBondContact O-N 3.48Å; L296-I299 PolarHBondContact O-N 2.87Å; L296-N300 WeakPolarHBondContact O-CB 3.44Å; L296-N300 PolarHBondContact O-N 3Å |
| 297 | T | 96.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.8 | -42.6 | 173.3 | -57.3 | 0 | 0 | 0 | 0 | 110.9 | Y206 Y247 A250 I251 V293 A294 I295 N300 L301 | Y206-T297 HydrophobicContact CE1-CG2 3.88Å; Y206-T297 PolarHBondContact OH-OG1 3.17Å; Y247-T297 HydrophobicContact CD1-CG2 3.91Å; Y247-T297 HydrophobicContact CE1-CG2 4.21Å; A250-T297 HydrophobicContact CB-CG2 4.05Å; I251-T297 HydrophobicContact CB-CG2 4.19Å; I251-T297 HydrophobicContact CD1-CG2 4.02Å; V293-T297 VanDerWaalsContact O-CB 3.31Å; V293-T297 WeakPolarHBondContact O-CB 3.49Å; V293-T297 PolarHBondContact O-N 3.38Å; V293-T297 PolarHBondContact O-OG1 3Å; A294-T297 PolarHBondContact O-N 3.29Å; I295-T297 VanDerWaalsContact C-N 3.28Å; I295-T297 PolarHBondContact O-N 3.38Å; T297-N300 PolarHBondContact O-N 2.76Å; T297-L301 WeakPolarHBondContact O-CB 3.1Å; T297-L301 PolarHBondContact O-N 2.94Å |
| 298 | G | 97.1 | Very high | 94.2 | Very high | 21 Ų | 21 | 32.6 Ų | 32.6 | 22% | 0.216 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -65.5 | -45.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | A294 I295 L296 N300 L301 L302 | A294-G298 PolarHBondContact O-N 3.14Å; A294-G298 VanDerWaalsContact O-N 3.16Å; I295-G298 PolarHBondContact O-N 3.36Å; I295-G298 VanDerWaalsContact O-N 3.1Å; L296-G298 VanDerWaalsContact C-N 3.32Å; L296-G298 PolarHBondContact O-N 3.48Å; G298-N300 VanDerWaalsContact C-N 3.33Å; G298-N300 PolarHBondContact O-N 2.86Å; G298-L301 PolarHBondContact O-N 3.39Å; G298-L302 WeakPolarHBondContact O-CG 3.43Å; G298-L302 PolarHBondContact O-N 3.01Å |
| 299 | I | 97 | Very high | 94.5 | Very high | 67 Ų | 67 | 33.7 Ų | 33.7 | 34% | 0.344 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -59.6 | -44.7 | 175.8 | -68.1 | 169.5 | 0 | 0 | 0 | 110.6 | F175 V179 I295 L296 L302 A303 | F175-I299 HydrophobicContact CE1-CG2 3.81Å; F175-I299 HydrophobicContact CZ-CG2 3.76Å; V179-I299 HydrophobicContact CG2-CG2 4.43Å; I295-I299 HydrophobicContact CG2-CD1 3.83Å; I295-I299 HydrophobicContact CG2-CG1 4.44Å; I295-I299 WeakPolarHBondContact O-CG1 3.49Å; I295-I299 PolarHBondContact O-N 3.42Å; L296-I299 PolarHBondContact O-N 2.87Å; I299-L302 PolarHBondContact O-N 3.18Å; I299-A303 PolarHBondContact O-N 3.22Å |
| 300 | N | 97 | Very high | 94.5 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -68.6 | -38.6 | -179 | -145.9 | 7.9 | 0 | 0 | 0 | 111.7 | E176 V179 Y247 L296 T297 G298 L302 A303 Y304 | E176-N300 VanDerWaalsContact CA-OD1 3.26Å; E176-N300 WeakPolarHBondContact CA-OD1 3.32Å; E176-N300 PolarHBondContact O-ND2 3.41Å; E176-N300 PolarHBondContact O-OD1 3.07Å; V179-N300 HydrophobicContact CB-CB 4.42Å; V179-N300 HydrophobicContact CG1-CB 3.74Å; Y247-N300 HydrophobicContact CD1-CB 4.26Å; Y247-N300 HydrophobicContact CE1-CB 3.68Å; Y247-N300 PolarHBondContact OH-ND2 3.39Å; L296-N300 WeakPolarHBondContact O-CB 3.44Å; L296-N300 PolarHBondContact O-N 3Å; T297-N300 PolarHBondContact O-N 2.76Å; G298-N300 VanDerWaalsContact C-N 3.33Å; G298-N300 PolarHBondContact O-N 2.86Å; N300-L302 VanDerWaalsContact C-N 3.32Å; N300-L302 PolarHBondContact O-N 3.13Å; N300-A303 WeakPolarHBondContact O-CB 3.42Å; N300-A303 PolarHBondContact O-N 3.43Å; N300-A303 VanDerWaalsContact O-N 3.13Å; N300-Y304 WeakPolarHBondContact O-CD2 3.35Å; N300-Y304 PolarHBondContact O-N 2.74Å |
| 301 | L | 97.3 | Very high | 94.3 | Very high | 31 Ų | 31 | 37.2 Ų | 37.2 | 16% | 0.162 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58.6 | -43.7 | 172.7 | 176.9 | 58.9 | 0 | 0 | 0 | 111.5 | V244 Y247 I251 T297 G298 A303 Y304 V305 | V244-L301 HydrophobicContact CG1-CD1 4.28Å; Y247-L301 HydrophobicContact CD1-CB 4.48Å; I251-L301 HydrophobicContact CB-CD2 4.19Å; I251-L301 HydrophobicContact CG1-CD2 4.47Å; I251-L301 HydrophobicContact CG2-CD2 3.82Å; T297-L301 WeakPolarHBondContact O-CB 3.1Å; T297-L301 PolarHBondContact O-N 2.94Å; G298-L301 PolarHBondContact O-N 3.39Å; L301-A303 VanDerWaalsContact C-N 3.29Å; L301-A303 PolarHBondContact O-N 2.96Å; L301-Y304 PolarHBondContact O-N 3.42Å; L301-V305 HydrophobicContact CD1-CG2 4.1Å; L301-V305 HydrophobicContact CG-CG2 4.45Å; L301-V305 WeakPolarHBondContact O-CB 3.37Å; L301-V305 VanDerWaalsContact O-CG2 3.29Å; L301-V305 WeakPolarHBondContact O-CG2 2.94Å; L301-V305 PolarHBondContact O-N 3.49Å |
| 302 | L | 97.4 | Very high | 93.9 | Very high | 119 Ų | 119 | 36.1 Ų | 36.1 | 62% | 0.623 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -62 | -36.8 | 175.4 | -70 | 173.7 | 0 | 0 | 0 | 112.3 | G298 I299 N300 S306 | G298-L302 WeakPolarHBondContact O-CG 3.43Å; G298-L302 PolarHBondContact O-N 3.01Å; I299-L302 PolarHBondContact O-N 3.18Å; N300-L302 VanDerWaalsContact C-N 3.32Å; N300-L302 PolarHBondContact O-N 3.13Å; L302-S306 WeakPolarHBondContact O-CB 3.36Å; L302-S306 PolarHBondContact O-N 3Å; L302-S306 PolarHBondContact O-OG 3.03Å |
| 303 | A | 96.3 | Very high | 93.4 | Very high | 5 Ų | 5 | 42.7 Ų | 42.7 | 4% | 0.041 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.3 | -50 | 174 | 0 | 0 | 0 | 0 | 0 | 111.3 | F175 E176 I299 N300 L301 V305 S306 D307 | F175-A303 HydrophobicContact CD1-CB 3.76Å; F175-A303 HydrophobicContact CE1-CB 4.06Å; E176-A303 HydrophobicContact CG-CB 3.89Å; I299-A303 PolarHBondContact O-N 3.22Å; N300-A303 WeakPolarHBondContact O-CB 3.42Å; N300-A303 PolarHBondContact O-N 3.43Å; N300-A303 VanDerWaalsContact O-N 3.13Å; L301-A303 VanDerWaalsContact C-N 3.29Å; L301-A303 PolarHBondContact O-N 2.96Å; A303-V305 VanDerWaalsContact C-N 3.34Å; A303-V305 PolarHBondContact O-N 2.72Å; A303-S306 WeakPolarHBondContact O-CB 3.26Å; A303-S306 PolarHBondContact O-N 3.21Å; A303-S306 VanDerWaalsContact O-N 3.14Å; A303-D307 PolarHBondContact O-N 3.2Å |
| 304 | Y | 96.2 | Very high | 92.4 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.5 | -38.9 | 176.9 | -76.8 | -64.8 | 0 | 0 | 0 | 113 | E176 C209 S243 V244 Y247 N300 L301 D307 L308 | E176-Y304 HydrophobicContact CB-CE1 4.18Å; E176-Y304 HydrophobicContact CB-CE2 4.39Å; E176-Y304 HydrophobicContact CG-CD1 4.02Å; E176-Y304 HydrophobicContact CG-CD2 4.4Å; E176-Y304 HydrophobicContact CG-CE1 3.82Å; E176-Y304 HydrophobicContact CG-CE2 4.16Å; E176-Y304 HydrophobicContact CG-CG 4.3Å; E176-Y304 WeakPolarHBondContact OE1-CA 3.42Å; E176-Y304 VanDerWaalsContact OE1-CD1 3.26Å; E176-Y304 WeakPolarHBondContact OE1-CD1 3.43Å; E176-Y304 WeakPolarHBondContact OE2-CE1 3.47Å; C209-Y304 HydrophobicContact CB-CE2 4.38Å; C209-Y304 WeakPolarHBondContact CB-OH 3.15Å; C209-Y304 PolarHBondContact O-OH 3.24Å; S243-Y304 VanDerWaalsContact CB-CE1 3.41Å; V244-Y304 WeakPolarHBondContact CG2-O 3.34Å; Y247-Y304 AromaticContact CD2-CD2 3.66Å; Y247-Y304 HydrophobicContact CD2-CD2 3.66Å; Y247-Y304 AromaticContact CD2-CE2 3.55Å; Y247-Y304 HydrophobicContact CD2-CE2 3.55Å; Y247-Y304 AromaticContact CE2-CD2 3.84Å; Y247-Y304 HydrophobicContact CE2-CD2 3.84Å; Y247-Y304 AromaticContact CE2-CE2 3.22Å; Y247-Y304 HydrophobicContact CE2-CE2 3.22Å; Y247-Y304 HydrophobicContact CG-CD2 4.14Å; Y247-Y304 HydrophobicContact CG-CE2 4.35Å; Y247-Y304 AromaticContact CZ-CE2 3.82Å; N300-Y304 WeakPolarHBondContact O-CD2 3.35Å; N300-Y304 PolarHBondContact O-N 2.74Å; L301-Y304 PolarHBondContact O-N 3.42Å; Y304-D307 PolarHBondContact O-N 3.36Å; Y304-L308 WeakPolarHBondContact O-CB 3.39Å; Y304-L308 PolarHBondContact O-N 3.21Å |
| 305 | V | 96.3 | Very high | 91.2 | Very high | 60 Ų | 60 | 48.6 Ų | 48.6 | 36% | 0.364 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.5 | -43.9 | 174.9 | 169.3 | 0 | 0 | 0 | 0 | 110.5 | V244 L301 A303 D307 L308 V309 | V244-V305 HydrophobicContact CG1-CG2 3.96Å; V244-V305 HydrophobicContact CG2-CG2 3.94Å; L301-V305 HydrophobicContact CD1-CG2 4.1Å; L301-V305 HydrophobicContact CG-CG2 4.45Å; L301-V305 WeakPolarHBondContact O-CB 3.37Å; L301-V305 VanDerWaalsContact O-CG2 3.29Å; L301-V305 WeakPolarHBondContact O-CG2 2.94Å; L301-V305 PolarHBondContact O-N 3.49Å; A303-V305 VanDerWaalsContact C-N 3.34Å; A303-V305 PolarHBondContact O-N 2.72Å; V305-D307 VanDerWaalsContact C-N 3.34Å; V305-D307 PolarHBondContact O-N 3.34Å; V305-L308 PolarHBondContact O-N 3.24Å; V305-V309 WeakPolarHBondContact O-CG2 3.42Å; V305-V309 PolarHBondContact O-N 3.32Å |
| 306 | S | 94.8 | Very high | 89.6 | Confident | 49 Ų | 49 | 51.3 Ų | 51.3 | 34% | 0.343 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 176.4 | -59.2 | 0 | 0 | 0 | 0 | 111 | L302 A303 L308 V309 Y310 | L302-S306 WeakPolarHBondContact O-CB 3.36Å; L302-S306 PolarHBondContact O-N 3Å; L302-S306 PolarHBondContact O-OG 3.03Å; A303-S306 WeakPolarHBondContact O-CB 3.26Å; A303-S306 PolarHBondContact O-N 3.21Å; A303-S306 VanDerWaalsContact O-N 3.14Å; S306-L308 PolarHBondContact O-N 3.23Å; S306-V309 PolarHBondContact O-N 2.87Å; S306-Y310 WeakPolarHBondContact O-CD2 3.44Å; S306-Y310 PolarHBondContact O-N 3.45Å |
| 307 | D | 93.2 | Very high | 87.9 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.3 | -43.3 | 177.2 | -178.8 | 43.5 | 0 | 0 | 0 | 111.6 | P169 L172 K173 E176 A240 A303 Y304 V305 V309 Y310 S311 | P169-D307 WeakPolarHBondContact CA-OD1 3.19Å; P169-D307 WeakPolarHBondContact CB-OD1 3.27Å; L172-D307 HydrophobicContact CB-CB 4.25Å; L172-D307 HydrophobicContact CD1-CB 4.05Å; K173-D307 WeakPolarHBondContact CE-OD2 3.21Å; K173-D307 IonicContact NZ-OD2 2.71Å; K173-D307 PolarHBondContact NZ-OD2 3.4Å; E176-D307 WeakPolarHBondContact OE1-CB 3.37Å; A240-D307 WeakPolarHBondContact CB-OD2 3.4Å; A303-D307 PolarHBondContact O-N 3.2Å; Y304-D307 PolarHBondContact O-N 3.36Å; V305-D307 VanDerWaalsContact C-N 3.34Å; V305-D307 PolarHBondContact O-N 3.34Å; D307-V309 PolarHBondContact O-N 3.23Å; D307-Y310 PolarHBondContact O-N 2.99Å; D307-S311 WeakPolarHBondContact O-CB 3.13Å; D307-S311 PolarHBondContact O-N 3.13Å; D307-S311 PolarHBondContact O-OG 3Å; D307-S311 PolarHBondContact OD1-OG 3.15Å |
| 308 | L | 93.2 | Very high | 85.6 | Confident | 31 Ų | 31 | 64 Ų | 64 | 16% | 0.162 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.1 | -44.1 | 174.4 | -179.1 | 62.6 | 0 | 0 | 0 | 111.8 | A240 L241 V244 Y304 V305 S306 S311 T312 | A240-L308 HydrophobicContact CB-CB 4.03Å; A240-L308 HydrophobicContact CB-CD1 4.05Å; L241-L308 HydrophobicContact CB-CD1 4Å; L241-L308 HydrophobicContact CD1-CD2 4.02Å; V244-L308 HydrophobicContact CG2-CB 4.31Å; V244-L308 HydrophobicContact CG2-CD2 4.12Å; Y304-L308 WeakPolarHBondContact O-CB 3.39Å; Y304-L308 PolarHBondContact O-N 3.21Å; V305-L308 PolarHBondContact O-N 3.24Å; S306-L308 PolarHBondContact O-N 3.23Å; L308-S311 PolarHBondContact O-N 3.47Å; L308-T312 HydrophobicContact CD1-CG2 3.9Å; L308-T312 HydrophobicContact CG-CG2 4.34Å; L308-T312 WeakPolarHBondContact O-CB 3.49Å; L308-T312 VanDerWaalsContact O-CG2 3.23Å; L308-T312 WeakPolarHBondContact O-CG2 3.38Å; L308-T312 PolarHBondContact O-N 2.98Å; L308-T312 PolarHBondContact O-OG1 3.38Å |
| 309 | V | 92.1 | Very high | 82.8 | Confident | 67 Ų | 67 | 72.2 Ų | 72.2 | 41% | 0.406 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.4 | -43.3 | 178.1 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | V305 S306 D307 T312 R313 | V305-V309 WeakPolarHBondContact O-CG2 3.42Å; V305-V309 PolarHBondContact O-N 3.32Å; S306-V309 PolarHBondContact O-N 2.87Å; D307-V309 PolarHBondContact O-N 3.23Å; V309-T312 PolarHBondContact O-OG1 2.97Å; V309-R313 WeakPolarHBondContact O-CG 3.25Å; V309-R313 PolarHBondContact O-N 3.49Å |
| 310 | Y | 89.1 | Confident | 82.1 | Confident | 110 Ų | 110 | 72.5 Ų | 72.5 | 43% | 0.431 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -70.1 | -41.3 | 177.5 | -75.6 | -67.5 | 0 | 0 | 0 | 112.2 | V168 L172 S306 D307 R313 L314 | V168-Y310 HydrophobicContact CB-CD2 4.46Å; V168-Y310 HydrophobicContact CB-CG 4.47Å; V168-Y310 HydrophobicContact CG1-CD2 4.03Å; V168-Y310 HydrophobicContact CG1-CE2 3.84Å; V168-Y310 HydrophobicContact CG1-CG 4.49Å; L172-Y310 HydrophobicContact CD1-CD2 3.91Å; L172-Y310 HydrophobicContact CD1-CE2 4.41Å; S306-Y310 WeakPolarHBondContact O-CD2 3.44Å; S306-Y310 PolarHBondContact O-N 3.45Å; D307-Y310 PolarHBondContact O-N 2.99Å; Y310-R313 PolarHBondContact O-N 3.14Å; Y310-L314 WeakPolarHBondContact O-CG 3.4Å; Y310-L314 PolarHBondContact O-N 3.47Å |
| 311 | S | 85.1 | Confident | 81.3 | Confident | 3 Ų | 3 | 76.3 Ų | 76.3 | 2% | 0.021 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 179.3 | -69.3 | 0 | 0 | 0 | 0 | 112.3 | D307 L308 L314 V315 | D307-S311 WeakPolarHBondContact O-CB 3.13Å; D307-S311 PolarHBondContact O-N 3.13Å; D307-S311 PolarHBondContact O-OG 3Å; D307-S311 PolarHBondContact OD1-OG 3.15Å; L308-S311 PolarHBondContact O-N 3.47Å; S311-L314 WeakPolarHBondContact O-CB 3.49Å; S311-L314 PolarHBondContact O-N 2.93Å; S311-V315 PolarHBondContact O-N 3.2Å |
| 312 | T | 83.4 | Confident | 80.4 | Confident | 39 Ų | 39 | 78.8 Ų | 78.8 | 24% | 0.239 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -66 | -40.6 | 175.3 | 50.3 | 0 | 0 | 0 | 0 | 111.9 | L308 V309 L314 V315 F316 | L308-T312 HydrophobicContact CD1-CG2 3.9Å; L308-T312 HydrophobicContact CG-CG2 4.34Å; L308-T312 WeakPolarHBondContact O-CB 3.49Å; L308-T312 VanDerWaalsContact O-CG2 3.23Å; L308-T312 WeakPolarHBondContact O-CG2 3.38Å; L308-T312 PolarHBondContact O-N 2.98Å; L308-T312 PolarHBondContact O-OG1 3.38Å; V309-T312 PolarHBondContact O-OG1 2.97Å; T312-L314 PolarHBondContact O-N 3.16Å; T312-V315 PolarHBondContact O-N 3.28Å; T312-F316 HydrophobicContact CG2-CE2 4.48Å; T312-F316 WeakPolarHBondContact O-CD2 3.34Å; T312-F316 PolarHBondContact O-N 3.28Å |
| 313 | R | 80.4 | Confident | 79.4 | Confident | 160 Ų | 160 | 76.4 Ų | 76.4 | 60% | 0.604 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -58.2 | -37.5 | 173.2 | -77.4 | -173.3 | -175.2 | -96.7 | 2.6 | 112.3 | V309 Y310 V315 V317 | V309-R313 WeakPolarHBondContact O-CG 3.25Å; V309-R313 PolarHBondContact O-N 3.49Å; Y310-R313 PolarHBondContact O-N 3.14Å; R313-V315 VanDerWaalsContact C-N 3.27Å; R313-V315 PolarHBondContact O-N 3.46Å; R313-V317 HydrophobicContact CB-CG2 4.31Å; R313-V317 WeakPolarHBondContact O-CB 3.05Å; R313-V317 VanDerWaalsContact O-CG2 3.3Å; R313-V317 WeakPolarHBondContact O-CG2 3.43Å; R313-V317 PolarHBondContact O-N 2.88Å |
| 314 | L | 71.3 | Confident | 78.4 | Confident | 90 Ų | 90 | 80.9 Ų | 80.9 | 47% | 0.471 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -66.4 | -27.9 | 176.7 | -71.1 | 169.2 | 0 | 0 | 0 | 113.4 | P169 Y310 S311 T312 | P169-L314 HydrophobicContact CG-CD1 4.07Å; Y310-L314 WeakPolarHBondContact O-CG 3.4Å; Y310-L314 PolarHBondContact O-N 3.47Å; S311-L314 WeakPolarHBondContact O-CB 3.49Å; S311-L314 PolarHBondContact O-N 2.93Å; T312-L314 PolarHBondContact O-N 3.16Å |
| 315 | V | 70.9 | Confident | 77.2 | Confident | 48 Ų | 48 | 86.3 Ų | 86.3 | 29% | 0.291 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -84 | -43.3 | 177.8 | 176.9 | 0 | 0 | 0 | 0 | 111.4 | P233 S311 T312 R313 | P233-V315 HydrophobicContact CB-CG2 3.88Å; S311-V315 PolarHBondContact O-N 3.2Å; T312-V315 PolarHBondContact O-N 3.28Å; R313-V315 VanDerWaalsContact C-N 3.27Å; R313-V315 PolarHBondContact O-N 3.46Å |
| 316 | F | 61.8 | Low | 75.8 | Confident | 152 Ų | 152 | 88.1 Ų | 88.1 | 67% | 0.667 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -93.1 | -23.6 | -171 | -69.4 | -70.7 | 0 | 0 | 0 | 115.3 | T312 K318 | T312-F316 HydrophobicContact CG2-CE2 4.48Å; T312-F316 WeakPolarHBondContact O-CD2 3.34Å; T312-F316 PolarHBondContact O-N 3.28Å; F316-K318 VanDerWaalsContact C-N 3.28Å |
| 317 | V | 58.5 | Low | 74.3 | Confident | 108 Ų | 108 | 91.2 Ų | 91.2 | 66% | 0.655 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.1 | 1.8 | 179.9 | -174.8 | 0 | 0 | 0 | 0 | 111.9 | R313 V319 | R313-V317 HydrophobicContact CB-CG2 4.31Å; R313-V317 WeakPolarHBondContact O-CB 3.05Å; R313-V317 VanDerWaalsContact O-CG2 3.3Å; R313-V317 WeakPolarHBondContact O-CG2 3.43Å; R313-V317 PolarHBondContact O-N 2.88Å; V317-V319 VanDerWaalsContact C-N 3.34Å |
| 318 | K | 49.9 | Very low | 72.8 | Confident | 184 Ų | 184 | 98.8 Ų | 98.8 | 80% | 0.8 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.2 | 19.2 | 177.2 | -109.8 | -176.2 | 179.3 | -177.4 | 0 | 114.1 | F316 | F316-K318 VanDerWaalsContact C-N 3.28Š|
| 319 | V | 37.6 | Very low | 70.9 | Confident | 193 Ų | 193 | 104.9 Ų | 104.9 | 100% | 1.17 | 52% | 0.523 | S | S | * | . | trans | -103.5 | 0 | 173 | -174.3 | 0 | 0 | 0 | 0 | 109.8 | V317 | V317-V319 VanDerWaalsContact C-N 3.34Š|
Retrieved 319 of 319 residues in 128.3 ms
(Link to these results)