| 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 | 32.8 | Very low | 26.9 | Very low | 233 Ų | 233 | 158.1 Ų | 158.1 | 100% | 1.148 | 85% | 0.849 | S | S | * | * | 0 | 97.2 | 0 | -77.9 | 172.4 | 174.3 | 0 | 0 | 107.5 | Y3 | M1-Y3 PolarHBondContact O-N 3.44Š| |||
| 2 | S | 24.5 | Very low | 26.9 | Very low | 117 Ų | 117 | 158.2 Ų | 158.2 | 82% | 0.818 | 85% | 0.848 | S | S | * | * | trans | -77.6 | 108.6 | 179.7 | 38.5 | 0 | 0 | 0 | 0 | 109.4 | E4 | S2-E4 PolarHBondContact O-N 2.99Š| ||
| 3 | Y | 26.3 | Very low | 26.9 | Very low | 224 Ų | 224 | 152.5 Ų | 152.5 | 88% | 0.878 | 84% | 0.837 | S | S | * | * | trans | -89.1 | 99 | 167 | -94.4 | -90.1 | 0 | 0 | 0 | 108.5 | M1 A5 | M1-Y3 PolarHBondContact O-N 3.44Å; Y3-A5 PolarHBondContact O-N 3.4Å | ||
| 4 | E | 24.8 | Very low | 27.2 | Very low | 183 Ų | 183 | 151.2 Ų | 151.2 | 86% | 0.855 | 84% | 0.839 | S | S | * | * | trans | -65.9 | 113.5 | 161.1 | -75.6 | 176.8 | 145.2 | 0 | 0 | 108.5 | S2 S6 | S2-E4 PolarHBondContact O-N 2.99Å; E4-S6 PolarHBondContact O-N 3.34Å | ||
| 5 | A | 28.4 | Very low | 27.2 | Very low | 97 Ų | 97 | 157.9 Ų | 157.9 | 80% | 0.802 | 85% | 0.847 | S | S | * | * | trans | -78.2 | 96.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | Y3 C7 | Y3-A5 PolarHBondContact O-N 3.4Å; A5-C7 PolarHBondContact O-N 3.34Å | ||
| 6 | S | 25.2 | Very low | 27.2 | Very low | 99 Ų | 99 | 151.4 Ų | 151.4 | 69% | 0.692 | 83% | 0.828 | S | S | * | * | trans | -71.6 | 102.6 | 166.6 | 55.6 | 0 | 0 | 0 | 0 | 109.4 | E4 Y8 | E4-S6 PolarHBondContact O-N 3.34Å; S6-Y8 VanDerWaalsContact C-N 3.33Å; S6-Y8 PolarHBondContact O-N 3.37Å | ||
| 7 | C | 26.6 | Very low | 27.1 | Very low | 136 Ų | 136 | 150.2 Ų | 150.2 | 92% | 0.919 | 83% | 0.833 | S | S | * | * | trans | -69.9 | 90.9 | 164.7 | -84.7 | 0 | 0 | 0 | 0 | 109.4 | A5 | A5-C7 PolarHBondContact O-N 3.34Š| ||
| 8 | Y | 25.4 | Very low | 27.1 | Very low | 204 Ų | 204 | 149.1 Ų | 149.1 | 80% | 0.8 | 82% | 0.824 | S | S | * | * | trans | -76.8 | 152.6 | 155 | -99 | -92 | 0 | 0 | 0 | 110.1 | S6 | S6-Y8 VanDerWaalsContact C-N 3.33Å; S6-Y8 PolarHBondContact O-N 3.37Å | ||
| 9 | Q | 28.5 | Very low | 27.2 | Very low | 174 Ų | 174 | 146.3 Ų | 146.3 | 81% | 0.813 | 81% | 0.807 | S | S | * | * | trans | 103.2 | 88.9 | 158.9 | -70.1 | 161 | -26.1 | 0 | 0 | 119.4 | ||||
| 10 | S | 27.5 | Very low | 27.5 | Very low | 99 Ų | 99 | 151.1 Ų | 151.1 | 69% | 0.692 | 81% | 0.812 | S | S | * | * | 98.7 | 96.4 | 116.8 | 68.1 | 0 | 0 | 0 | 0 | 118 | L12 | S10-L12 PolarHBondContact O-N 3.24Å; S10-L12 VanDerWaalsContact O-N 3.13Å | |||
| 11 | D | 25.6 | Very low | 27.9 | Very low | 173 Ų | 173 | 145 Ų | 145 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | trans | -52.8 | 99.5 | 153 | -74.7 | -49.3 | 0 | 0 | 0 | 111.5 | ||||
| 12 | L | 27.8 | Very low | 28.4 | Very low | 159 Ų | 159 | 138 Ų | 138 | 83% | 0.832 | 75% | 0.753 | S | S | * | * | trans | -142.6 | 67.7 | 163.6 | -95.8 | 150.4 | 0 | 0 | 0 | 108.6 | S10 | S10-L12 PolarHBondContact O-N 3.24Å; S10-L12 VanDerWaalsContact O-N 3.13Å | ||
| 13 | A | 26.8 | Very low | 29.6 | Very low | 85 Ų | 85 | 137.3 Ų | 137.3 | 70% | 0.702 | 74% | 0.735 | S | S | * | * | trans | -67.9 | 130.1 | 161.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | R15 | A13-R15 PolarHBondContact O-N 3.33Š| ||
| 14 | P | 31.2 | Very low | 30.6 | Very low | 134 Ų | 134 | 127.2 Ų | 127.2 | 87% | 0.87 | 70% | 0.697 | S | S | * | * | trans | -68 | 106.1 | 178.2 | 20.9 | -20.8 | 0 | 0 | 0 | 109.2 | ||||
| 15 | R | 26.3 | Very low | 31.6 | Very low | 252 Ų | 252 | 125 Ų | 125 | 95% | 0.951 | 69% | 0.691 | S | S | * | * | trans | -76.8 | 119.6 | 161.3 | -73.2 | -177 | 173.3 | -173.9 | -0.8 | 107.4 | A13 | A13-R15 PolarHBondContact O-N 3.33Š| ||
| 16 | G | 26.9 | Very low | 32.5 | Very low | 53 Ų | 53 | 123.4 Ų | 123.4 | 55% | 0.546 | 67% | 0.668 | S | S | . | * | S | Bend | trans | 133.7 | 91 | 164.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | I18 | G16-I18 PolarHBondContact O-N 3.17Š|
| 17 | S | 25.8 | Very low | 33.4 | Very low | 132 Ų | 132 | 123.9 Ų | 123.9 | 92% | 0.923 | 66% | 0.659 | S | S | * | * | trans | 46.1 | 31.2 | 131.2 | 51.4 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 18 | I | 28.1 | Very low | 34.1 | Very low | 130 Ų | 130 | 122 Ų | 122 | 67% | 0.667 | 65% | 0.645 | S | S | * | * | trans | -128.8 | 134.3 | 162.9 | -56.7 | 175.9 | 0 | 0 | 0 | 105.9 | G16 | G16-I18 PolarHBondContact O-N 3.17Š| ||
| 19 | L | 29.2 | Very low | 34.6 | Very low | 95 Ų | 95 | 115.8 Ų | 115.8 | 50% | 0.497 | 62% | 0.624 | S | S | . | * | trans | 95.9 | 62 | -176.8 | -45.9 | 170.3 | 0 | 0 | 0 | 117 | P21 N296 | L19-P21 VanDerWaalsContact O-CD 3.23Å; L19-P21 WeakPolarHBondContact O-CD 3.25Å; L19-N296 HydrophobicContact CD1-CB 3.66Å; L19-N296 HydrophobicContact CD2-CB 3.87Å; L19-N296 WeakPolarHBondContact CD2-ND2 3.13Å; L19-N296 HydrophobicContact CG-CB 4.35Å | ||
| 20 | R | 32.4 | Very low | 35.4 | Very low | 243 Ų | 243 | 113.3 Ų | 113.3 | 92% | 0.917 | 62% | 0.624 | S | S | * | * | trans | -95.9 | 87.3 | 134.3 | -80.6 | -166 | -163.3 | -176.3 | 9 | 107.8 | ||||
| 21 | P | 34.8 | Very low | 36.1 | Very low | 24 Ų | 24 | 116 Ų | 116 | 16% | 0.156 | 63% | 0.63 | C | S | . | * | trans | -59.8 | 148.2 | 159.8 | 27.7 | -30.9 | 0 | 0 | 0 | 107.8 | L19 F23 | L19-P21 VanDerWaalsContact O-CD 3.23Å; L19-P21 WeakPolarHBondContact O-CD 3.25Å; P21-F23 PolarHBondContact O-N 3.48Å | ||
| 22 | P | 43.3 | Very low | 37 | Very low | 85 Ų | 85 | 111.4 Ų | 111.4 | 55% | 0.552 | 62% | 0.615 | S | S | * | * | trans | -63.3 | 106.7 | 175 | 28.9 | -30.4 | 0 | 0 | 0 | 105.7 | ||||
| 23 | F | 50.7 | Low | 37.4 | Very low | 102 Ų | 102 | 111.7 Ų | 111.7 | 45% | 0.447 | 62% | 0.618 | S | S | . | * | trans | -52.7 | 132.5 | 153.8 | -81.8 | -89.1 | 0 | 0 | 0 | 105.1 | P21 L25 | P21-F23 PolarHBondContact O-N 3.48Å; F23-L25 PolarHBondContact O-N 3.38Å | ||
| 24 | P | 47 | Very low | 38 | Very low | 13 Ų | 13 | 113.9 Ų | 113.9 | 8% | 0.084 | 62% | 0.618 | C | S | . | * | trans | -43.4 | 122.5 | 170.4 | -14.3 | 8.2 | 0 | 0 | 0 | 108.7 | I26 N336 L368 I371 | P24-I26 PolarHBondContact O-N 3Å; P24-N336 HydrophobicContact CB-CB 4.41Å; P24-N336 VanDerWaalsContact CB-ND2 3.28Å; P24-N336 WeakPolarHBondContact CB-ND2 3.4Å; P24-N336 WeakPolarHBondContact CD-ND2 3.29Å; P24-N336 HydrophobicContact CG-CB 4.08Å; P24-N336 WeakPolarHBondContact CG-ND2 3.3Å; P24-N336 VanDerWaalsContact N-ND2 3.15Å; P24-N336 PolarHBondContact O-ND2 2.97Å; P24-L368 HydrophobicContact CB-CD2 4.37Å; P24-I371 HydrophobicContact CB-CG1 4.45Å; P24-I371 HydrophobicContact CG-CD1 3.7Å; P24-I371 HydrophobicContact CG-CG1 3.88Å | ||
| 25 | L | 46 | Very low | 38.6 | Very low | 137 Ų | 137 | 119.7 Ų | 119.7 | 72% | 0.717 | 62% | 0.622 | S | S | * | * | trans | -66 | 107.1 | -180 | -72.5 | 172.9 | 0 | 0 | 0 | 106.4 | F23 Q27 | F23-L25 PolarHBondContact O-N 3.38Å; L25-Q27 HydrophobicContact CB-CG 4.37Å; L25-Q27 PolarHBondContact O-N 3.07Å | ||
| 26 | I | 47.4 | Very low | 39.4 | Very low | 63 Ų | 63 | 111.1 Ų | 111.1 | 32% | 0.323 | 60% | 0.601 | S | S | . | * | trans | -63.4 | 102.8 | 169.4 | -64.9 | 171.2 | 0 | 0 | 0 | 105.9 | P24 N336 A339 I340 F366 L368 | P24-I26 PolarHBondContact O-N 3Å; I26-N336 HydrophobicContact CD1-CB 4.47Å; I26-N336 HydrophobicContact CG1-CB 4.38Å; I26-A339 HydrophobicContact CD1-CB 4.07Å; I26-I340 HydrophobicContact CD1-CG2 4.03Å; I26-I340 HydrophobicContact CG1-CG2 4.26Å; I26-I340 HydrophobicContact CG2-CG2 3.81Å; I26-F366 HydrophobicContact CG2-CB 4.01Å; I26-F366 HydrophobicContact CG2-CD1 3.26Å; I26-F366 HydrophobicContact CG2-CE1 3.87Å; I26-F366 HydrophobicContact CG2-CG 3.76Å; I26-L368 HydrophobicContact CG1-CD2 3.9Å | ||
| 27 | Q | 44.8 | Very low | 40 | Very low | 108 Ų | 108 | 112.8 Ų | 112.8 | 51% | 0.505 | 62% | 0.618 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -94 | 125.8 | 176.8 | -66.1 | -166.3 | -5.7 | 0 | 0 | 108.9 | L25 M29 F366 S367 | L25-Q27 HydrophobicContact CB-CG 4.37Å; L25-Q27 PolarHBondContact O-N 3.07Å; Q27-M29 PolarHBondContact O-N 3.18Å; Q27-F366 WeakPolarHBondContact O-CA 3.16Å; Q27-S367 PolarHBondContact N-O 2.89Å; Q27-S367 PolarHBondContact O-N 3.14Å |
| 28 | P | 41.4 | Very low | 40.6 | Very low | 97 Ų | 97 | 114.9 Ų | 114.9 | 63% | 0.63 | 61% | 0.611 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -61.5 | 133.7 | 166.3 | 26 | -29.9 | 0 | 0 | 0 | 108.4 | F366 | P28-F366 HydrophobicContact CB-CD1 4.46Å; P28-F366 HydrophobicContact CB-CE1 4.38Å |
| 29 | M | 35.1 | Very low | 41 | Very low | 73 Ų | 73 | 120.2 Ų | 120.2 | 36% | 0.36 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -60.7 | 143.6 | 173 | -79.2 | -169.8 | -125.8 | 0 | 0 | 109.7 | Q27 L31 S362 G365 F366 | Q27-M29 PolarHBondContact O-N 3.18Å; M29-L31 PolarHBondContact O-N 3.35Å; M29-S362 VanDerWaalsContact CE-CB 3.4Å; M29-G365 WeakPolarHBondContact CB-O 3.49Å; M29-G365 PolarHBondContact N-O 2.81Å; M29-F366 WeakPolarHBondContact CE-O 3.46Å |
| 30 | P | 45.2 | Very low | 41.4 | Very low | 123 Ų | 123 | 121.1 Ų | 121.1 | 80% | 0.799 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 133.9 | 170.7 | -19.1 | 29.4 | 0 | 0 | 0 | 109.4 | A32 | P30-A32 PolarHBondContact O-N 2.71Š|
| 31 | L | 42.8 | Very low | 41.6 | Very low | 156 Ų | 156 | 115.7 Ų | 115.7 | 82% | 0.817 | 62% | 0.621 | S | S | * | * | trans | -59.8 | 105.7 | 172.8 | -74.4 | 161.8 | 0 | 0 | 0 | 108 | M29 N33 | M29-L31 PolarHBondContact O-N 3.35Å; L31-N33 PolarHBondContact O-N 3.08Å | ||
| 32 | A | 43.6 | Very low | 41.7 | Very low | 76 Ų | 76 | 120.1 Ų | 120.1 | 63% | 0.628 | 64% | 0.638 | S | S | * | * | trans | -55.3 | 127.8 | 161.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | P30 N34 | P30-A32 PolarHBondContact O-N 2.71Å; A32-N34 PolarHBondContact O-N 3.5Å | ||
| 33 | N | 36.7 | Very low | 41.4 | Very low | 165 Ų | 165 | 120.9 Ų | 120.9 | 88% | 0.882 | 65% | 0.652 | S | S | * | * | trans | -59.1 | 71.8 | -175 | -104.7 | -18.6 | 0 | 0 | 0 | 112.1 | L31 R35 | L31-N33 PolarHBondContact O-N 3.08Å; N33-R35 PolarHBondContact O-N 3.37Å | ||
| 34 | N | 40.1 | Very low | 40.8 | Very low | 131 Ų | 131 | 126.8 Ų | 126.8 | 70% | 0.701 | 67% | 0.671 | S | S | * | * | trans | -87 | 98 | 172 | -81.4 | -17 | 0 | 0 | 0 | 107.5 | A32 S36 | A32-N34 PolarHBondContact O-N 3.5Å; N34-S36 PolarHBondContact O-N 2.93Å | ||
| 35 | R | 43.1 | Very low | 40.4 | Very low | 256 Ų | 256 | 129.8 Ų | 129.8 | 97% | 0.966 | 69% | 0.689 | S | S | * | * | trans | -59.3 | 5.4 | 172.4 | -71.9 | -177.7 | 177.4 | -178.7 | -0.5 | 114.4 | N33 | N33-R35 PolarHBondContact O-N 3.37Š| ||
| 36 | S | 43.2 | Very low | 40.3 | Very low | 71 Ų | 71 | 130.6 Ų | 130.6 | 50% | 0.497 | 69% | 0.694 | S | S | . | * | S | Bend | trans | -91.6 | 106.4 | 170.9 | 63.3 | 0 | 0 | 0 | 0 | 109.3 | N34 K38 | N34-S36 PolarHBondContact O-N 2.93Å; S36-K38 PolarHBondContact O-N 3.22Å |
| 37 | G | 39.3 | Very low | 40.4 | Very low | 88 Ų | 88 | 135.4 Ų | 135.4 | 91% | 0.907 | 71% | 0.713 | S | S | * | * | trans | -63.2 | 37.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | R39 | G37-R39 PolarHBondContact O-N 2.99Š| ||
| 38 | K | 39.5 | Very low | 40.7 | Very low | 177 Ų | 177 | 131.3 Ų | 131.3 | 77% | 0.77 | 69% | 0.693 | S | S | * | * | trans | -78.5 | 99.5 | 166.7 | -68.9 | -174.4 | -177.7 | 180 | 0 | 107.5 | S36 N40 | S36-K38 PolarHBondContact O-N 3.22Å; K38-N40 PolarHBondContact O-N 3.02Å | ||
| 39 | R | 35.9 | Very low | 41.3 | Very low | 241 Ų | 241 | 130.7 Ų | 130.7 | 91% | 0.909 | 68% | 0.684 | S | S | * | * | trans | -47.1 | 109.8 | 162.1 | -96.9 | 179.7 | 173.5 | 158.3 | -1.7 | 107.5 | G37 V41 | G37-R39 PolarHBondContact O-N 2.99Å; R39-V41 PolarHBondContact O-N 3.26Å; R39-V41 VanDerWaalsContact O-N 3.16Å | ||
| 40 | N | 37.4 | Very low | 42.2 | Very low | 115 Ų | 115 | 129.5 Ų | 129.5 | 62% | 0.615 | 68% | 0.677 | S | S | * | * | trans | -55.6 | 122.1 | 177.5 | -94 | -22.6 | 0 | 0 | 0 | 108.5 | K38 F42 | K38-N40 PolarHBondContact O-N 3.02Å; N40-F42 HydrophobicContact CB-CB 4.45Å; N40-F42 HydrophobicContact CB-CD2 3.94Å; N40-F42 PolarHBondContact O-N 3.32Å | ||
| 41 | V | 36.2 | Very low | 42.3 | Very low | 129 Ų | 129 | 133.3 Ų | 133.3 | 78% | 0.782 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -58.2 | -1.4 | 178.4 | 176.4 | 0 | 0 | 0 | 0 | 112.6 | R39 A43 R44 | R39-V41 PolarHBondContact O-N 3.26Å; R39-V41 VanDerWaalsContact O-N 3.16Å; V41-A43 VanDerWaalsContact C-N 3.29Å; V41-A43 PolarHBondContact O-N 3.42Å; V41-R44 PolarHBondContact O-N 3.35Å |
| 42 | F | 37.8 | Very low | 42.5 | Very low | 116 Ų | 116 | 128.4 Ų | 128.4 | 51% | 0.509 | 65% | 0.65 | S | S | . | * | G | 310 helix | trans | -72.8 | -5.5 | -176.5 | -73.4 | -84.8 | 0 | 0 | 0 | 115.9 | N40 R44 T45 | N40-F42 HydrophobicContact CB-CB 4.45Å; N40-F42 HydrophobicContact CB-CD2 3.94Å; N40-F42 PolarHBondContact O-N 3.32Å; F42-R44 PolarHBondContact O-N 2.93Å; F42-R44 VanDerWaalsContact O-N 3.14Å; F42-T45 HydrophobicContact CD1-CG2 4.23Å; F42-T45 PolarHBondContact O-N 2.97Å; F42-T45 PolarHBondContact O-OG1 3.17Å |
| 43 | A | 37 | Very low | 42.9 | Very low | 101 Ų | 101 | 125.5 Ų | 125.5 | 84% | 0.835 | 62% | 0.624 | S | S | * | * | G | 310 helix | trans | -67.9 | -5.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | V41 | V41-A43 VanDerWaalsContact C-N 3.29Å; V41-A43 PolarHBondContact O-N 3.42Å |
| 44 | R | 36.9 | Very low | 43.7 | Very low | 227 Ų | 227 | 120.9 Ų | 120.9 | 86% | 0.857 | 60% | 0.602 | S | S | * | * | G | 310 helix | trans | -108.9 | 16 | 176.6 | -74.3 | -172 | 176.7 | -177.8 | -0.5 | 114.3 | V41 F42 N46 | V41-R44 PolarHBondContact O-N 3.35Å; F42-R44 PolarHBondContact O-N 2.93Å; F42-R44 VanDerWaalsContact O-N 3.14Å; R44-N46 PolarHBondContact O-N 3.31Å |
| 45 | T | 39.6 | Very low | 44.4 | Very low | 75 Ų | 75 | 124 Ų | 124 | 46% | 0.46 | 60% | 0.604 | S | S | . | * | S | Bend | trans | -71.8 | 112.4 | 163.3 | 54.5 | 0 | 0 | 0 | 0 | 107.1 | F42 K47 | F42-T45 HydrophobicContact CD1-CG2 4.23Å; F42-T45 PolarHBondContact O-N 2.97Å; F42-T45 PolarHBondContact O-OG1 3.17Å; T45-K47 PolarHBondContact O-N 2.93Å |
| 46 | N | 43.5 | Very low | 45.1 | Very low | 154 Ų | 154 | 116 Ų | 116 | 82% | 0.824 | 59% | 0.588 | S | S | * | * | trans | -57.7 | 91 | 173.5 | -81.7 | -18.5 | 0 | 0 | 0 | 108.2 | R44 Y48 | R44-N46 PolarHBondContact O-N 3.31Å; N46-Y48 PolarHBondContact O-N 2.92Å; N46-Y48 VanDerWaalsContact O-N 3.09Å | ||
| 47 | K | 50.7 | Low | 45.9 | Very low | 164 Ų | 164 | 114.8 Ų | 114.8 | 71% | 0.713 | 58% | 0.575 | S | S | * | * | trans | -51.9 | 120.7 | 171.6 | -78.5 | -174.8 | 176.8 | -178.4 | 0 | 107.1 | T45 N49 | T45-K47 PolarHBondContact O-N 2.93Å; K47-N49 PolarHBondContact O-N 3.43Å; K47-N49 VanDerWaalsContact O-N 3.1Å | ||
| 48 | Y | 49.5 | Very low | 46.9 | Very low | 22 Ų | 22 | 110.6 Ų | 110.6 | 9% | 0.086 | 53% | 0.532 | C | S | . | . | trans | -64.3 | 115.5 | 177.7 | -171.9 | -96.9 | 0 | 0 | 0 | 109 | N46 F50 R61 F66 D67 M287 M291 | N46-Y48 PolarHBondContact O-N 2.92Å; N46-Y48 VanDerWaalsContact O-N 3.09Å; Y48-F50 AromaticContact CD1-CD1 3.92Å; Y48-F50 HydrophobicContact CD1-CD1 3.92Å; Y48-F50 HydrophobicContact CD1-CD2 4.04Å; Y48-F50 AromaticContact CD1-CE1 3.71Å; Y48-F50 HydrophobicContact CD1-CE1 3.71Å; Y48-F50 AromaticContact CD1-CE2 3.88Å; Y48-F50 HydrophobicContact CD1-CE2 3.88Å; Y48-F50 HydrophobicContact CD1-CG 4.03Å; Y48-F50 AromaticContact CD1-CZ 3.68Å; Y48-F50 HydrophobicContact CD1-CZ 3.68Å; Y48-F50 AromaticContact CE1-CD1 3.96Å; Y48-F50 HydrophobicContact CE1-CD1 3.96Å; Y48-F50 AromaticContact CE1-CE1 3.89Å; Y48-F50 HydrophobicContact CE1-CE1 3.89Å; Y48-F50 HydrophobicContact CE1-CG 4.37Å; Y48-F50 HydrophobicContact CE1-CZ 4.32Å; Y48-F50 VanDerWaalsContact O-CD2 3.32Å; Y48-F50 WeakPolarHBondContact O-CD2 3.49Å; Y48-F50 WeakPolarHBondContact O-CE2 3.03Å; Y48-F50 PolarHBondContact O-N 3.4Å; Y48-R61 PolarHBondContact OH-NH2 2.75Å; Y48-F66 HydrophobicContact CD2-CB 4.05Å; Y48-F66 AromaticContact CD2-CD1 3.44Å; Y48-F66 HydrophobicContact CD2-CD1 3.44Å; Y48-F66 VanDerWaalsContact CD2-CD1 3.44Å; Y48-F66 HydrophobicContact CD2-CE1 4.02Å; Y48-F66 AromaticContact CD2-CG 3.81Å; Y48-F66 HydrophobicContact CD2-CG 3.81Å; Y48-F66 HydrophobicContact CE2-CB 4.22Å; Y48-F66 AromaticContact CE2-CD1 3.29Å; Y48-F66 HydrophobicContact CE2-CD1 3.29Å; Y48-F66 AromaticContact CE2-CE1 3.92Å; Y48-F66 HydrophobicContact CE2-CE1 3.92Å; Y48-F66 HydrophobicContact CE2-CG 4.02Å; Y48-F66 HydrophobicContact CG-CD1 4.44Å; Y48-D67 PolarHBondContact OH-OD1 3.1Å; Y48-M287 HydrophobicContact CD1-CE 4.16Å; Y48-M287 HydrophobicContact CE1-CE 3.44Å; Y48-M287 VanDerWaalsContact CE1-CE 3.44Å; Y48-M287 WeakPolarHBondContact OH-CE 3.37Å; Y48-M287 WeakPolarHBondContact OH-CG 3.42Å; Y48-M291 HydrophobicContact CE1-CE 4.45Å | ||
| 49 | N | 54.3 | Low | 47.9 | Very low | 85 Ų | 85 | 109.3 Ų | 109.3 | 46% | 0.455 | 53% | 0.527 | S | S | . | . | trans | -85.3 | 99.6 | -179.2 | -163.2 | 6.2 | 0 | 0 | 0 | 109.7 | K47 R51 D52 R61 | K47-N49 PolarHBondContact O-N 3.43Å; K47-N49 VanDerWaalsContact O-N 3.1Å; N49-R51 PolarHBondContact O-N 3.48Å; N49-D52 PolarHBondContact ND2-OD2 3.31Å; N49-D52 VanDerWaalsContact ND2-OD2 3.12Å; N49-D52 PolarHBondContact O-N 2.96Å; N49-R61 PolarHBondContact O-NH1 2.75Å | ||
| 50 | F | 53.7 | Low | 49.1 | Very low | 47 Ų | 47 | 104.2 Ų | 104.2 | 21% | 0.206 | 52% | 0.518 | C | S | . | . | G | 310 helix | trans | -64.5 | -20.7 | -179.4 | -66.3 | -93.8 | 0 | 0 | 0 | 113.1 | Y48 D52 V53 M287 M291 L335 A339 | Y48-F50 AromaticContact CD1-CD1 3.92Å; Y48-F50 HydrophobicContact CD1-CD1 3.92Å; Y48-F50 HydrophobicContact CD1-CD2 4.04Å; Y48-F50 AromaticContact CD1-CE1 3.71Å; Y48-F50 HydrophobicContact CD1-CE1 3.71Å; Y48-F50 AromaticContact CD1-CE2 3.88Å; Y48-F50 HydrophobicContact CD1-CE2 3.88Å; Y48-F50 HydrophobicContact CD1-CG 4.03Å; Y48-F50 AromaticContact CD1-CZ 3.68Å; Y48-F50 HydrophobicContact CD1-CZ 3.68Å; Y48-F50 AromaticContact CE1-CD1 3.96Å; Y48-F50 HydrophobicContact CE1-CD1 3.96Å; Y48-F50 AromaticContact CE1-CE1 3.89Å; Y48-F50 HydrophobicContact CE1-CE1 3.89Å; Y48-F50 HydrophobicContact CE1-CG 4.37Å; Y48-F50 HydrophobicContact CE1-CZ 4.32Å; Y48-F50 VanDerWaalsContact O-CD2 3.32Å; Y48-F50 WeakPolarHBondContact O-CD2 3.49Å; Y48-F50 WeakPolarHBondContact O-CE2 3.03Å; Y48-F50 PolarHBondContact O-N 3.4Å; F50-D52 PolarHBondContact O-N 3.47Å; F50-D52 VanDerWaalsContact O-N 3.1Å; F50-V53 PolarHBondContact O-N 2.82Å; F50-M287 HydrophobicContact CE1-CE 3.87Å; F50-M291 HydrophobicContact CB-CE 3.83Å; F50-M291 HydrophobicContact CD1-CE 3.33Å; F50-M291 HydrophobicContact CE1-CE 4.28Å; F50-M291 HydrophobicContact CG-CE 4.03Å; F50-L335 HydrophobicContact CD1-CD2 4.4Å; F50-L335 HydrophobicContact CE1-CB 3.95Å; F50-L335 HydrophobicContact CE1-CD2 3.79Å; F50-L335 HydrophobicContact CE1-CG 4.4Å; F50-L335 HydrophobicContact CZ-CB 4.37Å; F50-L335 WeakPolarHBondContact CZ-O 3.22Å; F50-A339 HydrophobicContact CE2-CB 3.57Å; F50-A339 HydrophobicContact CZ-CB 3.75Å |
| 51 | R | 48.7 | Very low | 50.5 | Low | 204 Ų | 204 | 99.7 Ų | 99.7 | 77% | 0.77 | 49% | 0.492 | S | S | * | . | G | 310 helix | trans | -61.7 | -18.3 | -179.6 | -73.3 | -175.1 | 167.7 | 174.2 | -2.6 | 113.4 | N49 | N49-R51 PolarHBondContact O-N 3.48Š|
| 52 | D | 46 | Very low | 51.7 | Low | 52 Ų | 52 | 97.1 Ų | 97.1 | 28% | 0.278 | 47% | 0.472 | S | S | . | . | G | 310 helix | trans | -97.4 | 12.3 | -172.7 | -56.4 | -39.6 | 0 | 0 | 0 | 114.6 | N49 F50 N57 | N49-D52 PolarHBondContact ND2-OD2 3.31Å; N49-D52 VanDerWaalsContact ND2-OD2 3.12Å; N49-D52 PolarHBondContact O-N 2.96Å; F50-D52 PolarHBondContact O-N 3.47Å; F50-D52 VanDerWaalsContact O-N 3.1Å; D52-N57 HydrophobicContact CB-CB 4.26Å; D52-N57 VanDerWaalsContact O-CB 3.23Å; D52-N57 WeakPolarHBondContact O-CB 3.45Å; D52-N57 PolarHBondContact OD1-ND2 3.3Å |
| 53 | V | 52.5 | Low | 53 | Low | 15 Ų | 15 | 98.4 Ų | 98.4 | 9% | 0.091 | 48% | 0.483 | C | S | . | . | trans | -102.1 | 27.6 | 177.4 | -163.1 | 0 | 0 | 0 | 0 | 112 | F50 L58 R61 L284 R288 M291 | F50-V53 PolarHBondContact O-N 2.82Å; V53-L58 HydrophobicContact CG1-CD2 4.49Å; V53-R61 VanDerWaalsContact CG2-NH2 3.28Å; V53-L284 HydrophobicContact CG1-CD1 4.16Å; V53-R288 HydrophobicContact CG1-CG 3.75Å; V53-M291 HydrophobicContact CB-CE 3.59Å; V53-M291 HydrophobicContact CB-SD 3.42Å; V53-M291 WeakPolarHBondContact CB-SD 3.43Å; V53-M291 HydrophobicContact CG1-CE 4.21Å; V53-M291 HydrophobicContact CG1-SD 3.42Å; V53-M291 WeakPolarHBondContact CG1-SD 3.42Å; V53-M291 HydrophobicContact CG2-CE 3.38Å; V53-M291 HydrophobicContact CG2-SD 3.77Å | ||
| 54 | T | 53.6 | Low | 54.9 | Low | 68 Ų | 68 | 94.7 Ų | 94.7 | 42% | 0.417 | 45% | 0.452 | S | S | . | . | S | Bend | trans | -84.1 | 154.8 | 167.8 | 54.7 | 0 | 0 | 0 | 0 | 109.9 | S56 N57 L58 | T54-S56 PolarHBondContact O-N 3.19Å; T54-S56 PolarHBondContact OG1-OG 3.05Å; T54-N57 PolarHBondContact O-N 3.18Å; T54-L58 PolarHBondContact O-N 3.31Å |
| 55 | R | 53.8 | Low | 57 | Low | 197 Ų | 197 | 88.6 Ų | 88.6 | 74% | 0.743 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -30.9 | -179.7 | -170.8 | 177.7 | 179.2 | 175.3 | 0.1 | 112.9 | N57 P276 | R55-N57 VanDerWaalsContact C-N 3.34Å; R55-P276 HydrophobicContact CG-CG 4.48Å |
| 56 | S | 57.4 | Low | 59.3 | Low | 89 Ų | 89 | 86.8 Ų | 86.8 | 62% | 0.622 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | -32.1 | 177.4 | 55.7 | 0 | 0 | 0 | 0 | 113.5 | T54 | T54-S56 PolarHBondContact O-N 3.19Å; T54-S56 PolarHBondContact OG1-OG 3.05Å |
| 57 | N | 60.8 | Low | 61.3 | Low | 44 Ų | 44 | 79.5 Ų | 79.5 | 24% | 0.235 | 39% | 0.389 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105 | -0.4 | -170.6 | -61.2 | 14.4 | 0 | 0 | 0 | 112.1 | D52 T54 R55 K59 D60 R61 | D52-N57 HydrophobicContact CB-CB 4.26Å; D52-N57 VanDerWaalsContact O-CB 3.23Å; D52-N57 WeakPolarHBondContact O-CB 3.45Å; D52-N57 PolarHBondContact OD1-ND2 3.3Å; T54-N57 PolarHBondContact O-N 3.18Å; R55-N57 VanDerWaalsContact C-N 3.34Å; N57-K59 PolarHBondContact O-N 3.27Å; N57-D60 PolarHBondContact O-N 3.36Å; N57-R61 WeakPolarHBondContact O-CG 3.48Å; N57-R61 PolarHBondContact O-N 3.38Å |
| 58 | L | 59.9 | Low | 63.1 | Low | 1 Ų | 1 | 75.7 Ų | 75.7 | 1% | 0.005 | 38% | 0.376 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | -27.8 | -178.8 | -71.6 | 174.5 | 0 | 0 | 0 | 113.4 | V53 T54 P276 L284 | V53-L58 HydrophobicContact CG1-CD2 4.49Å; T54-L58 PolarHBondContact O-N 3.31Å; L58-P276 HydrophobicContact CD1-CG 4.33Å; L58-L284 HydrophobicContact CD2-CD1 4.37Å; L58-L284 HydrophobicContact CD2-CD2 4.07Å |
| 59 | K | 61.7 | Low | 65.1 | Low | 150 Ų | 150 | 77.6 Ų | 77.6 | 65% | 0.652 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -42.5 | 177.5 | -70.8 | -174.8 | 177.7 | -177.5 | 0 | 111.5 | N57 R61 Q62 L277 | N57-K59 PolarHBondContact O-N 3.27Å; K59-R61 PolarHBondContact O-N 3.18Å; K59-Q62 PolarHBondContact O-N 3.49Å; K59-L277 HydrophobicContact CG-CD2 4.29Å |
| 60 | D | 61.2 | Low | 67 | Low | 134 Ų | 134 | 73.6 Ų | 73.6 | 72% | 0.717 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | -14.6 | -177.3 | -52.8 | -34.5 | 0 | 0 | 0 | 112.8 | N57 | N57-D60 PolarHBondContact O-N 3.36Š|
| 61 | R | 65.5 | Low | 69 | Low | 19 Ų | 19 | 72.5 Ų | 72.5 | 7% | 0.072 | 36% | 0.362 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | -3.5 | -178.2 | -72.5 | -77.9 | -63.3 | -114.9 | -21.7 | 114 | Y48 N49 V53 N57 K59 D63 S64 D67 | Y48-R61 PolarHBondContact OH-NH2 2.75Å; N49-R61 PolarHBondContact O-NH1 2.75Å; V53-R61 VanDerWaalsContact CG2-NH2 3.28Å; N57-R61 WeakPolarHBondContact O-CG 3.48Å; N57-R61 PolarHBondContact O-N 3.38Å; K59-R61 PolarHBondContact O-N 3.18Å; R61-D63 PolarHBondContact O-N 3.36Å; R61-S64 VanDerWaalsContact O-CB 3.24Å; R61-S64 WeakPolarHBondContact O-CB 3.47Å; R61-S64 PolarHBondContact O-N 3.42Å; R61-S64 VanDerWaalsContact O-N 3.11Å; R61-D67 IonicContact CZ-OD2 3.39Å; R61-D67 IonicContact NE-OD2 2.8Å; R61-D67 PolarHBondContact NE-OD2 2.74Å; R61-D67 IonicContact NH2-OD1 2.98Å; R61-D67 PolarHBondContact NH2-OD1 3.35Å; R61-D67 IonicContact NH2-OD2 2.75Å; R61-D67 PolarHBondContact NH2-OD2 3.49Å |
| 62 | Q | 61.5 | Low | 71.2 | Confident | 76 Ų | 76 | 69.3 Ų | 69.3 | 36% | 0.355 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -34.9 | -178.9 | -75.5 | -177.5 | 39.3 | 0 | 0 | 112.6 | K59 L277 I281 | K59-Q62 PolarHBondContact O-N 3.49Å; Q62-L277 HydrophobicContact CG-CD1 3.76Å; Q62-I281 HydrophobicContact CB-CD1 4.25Å; Q62-I281 HydrophobicContact CG-CD1 4.36Å; Q62-I281 WeakPolarHBondContact O-CD1 3.38Å |
| 63 | D | 64.7 | Low | 73.6 | Confident | 142 Ų | 142 | 67.7 Ų | 67.7 | 76% | 0.759 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.3 | 17.5 | -177.8 | -58.8 | -39.6 | 0 | 0 | 0 | 113.1 | R61 C65 | R61-D63 PolarHBondContact O-N 3.36Å; D63-C65 PolarHBondContact O-N 3Å |
| 64 | S | 76.6 | Confident | 75.8 | Confident | 24 Ų | 24 | 67 Ų | 67 | 17% | 0.168 | 34% | 0.343 | C | S | . | . | trans | -61.8 | 108 | 176.4 | 172.2 | 0 | 0 | 0 | 0 | 110.1 | R61 F66 D67 L68 | R61-S64 VanDerWaalsContact O-CB 3.24Å; R61-S64 WeakPolarHBondContact O-CB 3.47Å; R61-S64 PolarHBondContact O-N 3.42Å; R61-S64 VanDerWaalsContact O-N 3.11Å; S64-F66 PolarHBondContact O-N 3.14Å; S64-F66 VanDerWaalsContact O-N 3.09Å; S64-D67 WeakPolarHBondContact CB-OD2 3.48Å; S64-D67 PolarHBondContact O-N 3.31Å; S64-D67 PolarHBondContact OG-N 3.02Å; S64-D67 PolarHBondContact OG-OD2 3.07Å; S64-L68 PolarHBondContact O-N 3.14Å | ||
| 65 | C | 82.5 | Confident | 77.8 | Confident | 98 Ų | 98 | 66.8 Ų | 66.8 | 66% | 0.662 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -52.8 | -34.4 | 179.5 | -177.2 | 0 | 0 | 0 | 0 | 112.5 | D63 M69 | D63-C65 PolarHBondContact O-N 3Å; C65-M69 WeakPolarHBondContact O-CB 3.21Å; C65-M69 PolarHBondContact O-N 3.38Å |
| 66 | F | 86.3 | Confident | 79.9 | Confident | 38 Ų | 38 | 62.8 Ų | 62.8 | 17% | 0.167 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -70.6 | -42.9 | 176.4 | -176.8 | -94.9 | 0 | 0 | 0 | 112.2 | Y48 S64 L68 M69 L70 M287 M338 H343 | Y48-F66 HydrophobicContact CD2-CB 4.05Å; Y48-F66 AromaticContact CD2-CD1 3.44Å; Y48-F66 HydrophobicContact CD2-CD1 3.44Å; Y48-F66 VanDerWaalsContact CD2-CD1 3.44Å; Y48-F66 HydrophobicContact CD2-CE1 4.02Å; Y48-F66 AromaticContact CD2-CG 3.81Å; Y48-F66 HydrophobicContact CD2-CG 3.81Å; Y48-F66 HydrophobicContact CE2-CB 4.22Å; Y48-F66 AromaticContact CE2-CD1 3.29Å; Y48-F66 HydrophobicContact CE2-CD1 3.29Å; Y48-F66 AromaticContact CE2-CE1 3.92Å; Y48-F66 HydrophobicContact CE2-CE1 3.92Å; Y48-F66 HydrophobicContact CE2-CG 4.02Å; Y48-F66 HydrophobicContact CG-CD1 4.44Å; S64-F66 PolarHBondContact O-N 3.14Å; S64-F66 VanDerWaalsContact O-N 3.09Å; F66-L68 VanDerWaalsContact C-N 3.28Å; F66-L68 PolarHBondContact O-N 2.83Å; F66-M69 HydrophobicContact CD2-CE 3.4Å; F66-M69 HydrophobicContact CE2-CE 3.54Å; F66-M69 HydrophobicContact CG-CE 4.36Å; F66-M69 PolarHBondContact O-N 3.3Å; F66-L70 HydrophobicContact CE1-CD2 3.99Å; F66-L70 WeakPolarHBondContact O-CB 3.33Å; F66-L70 PolarHBondContact O-N 3.48Å; F66-M287 HydrophobicContact CE1-SD 4.23Å; F66-M338 HydrophobicContact CZ-CB 4.33Å; F66-H343 HydrophobicContact CE2-CB 4.37Å; F66-H343 AromaticContact CE2-ND1 3.91Å; F66-H343 HydrophobicContact CZ-CB 4.09Å |
| 67 | D | 86.2 | Confident | 81.8 | Confident | 1 Ų | 1 | 60.1 Ų | 60.1 | 1% | 0.005 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66.9 | -32.3 | -179.7 | -62.9 | -34.5 | 0 | 0 | 0 | 110.9 | Y48 R61 S64 T71 I281 L284 | Y48-D67 PolarHBondContact OH-OD1 3.1Å; R61-D67 IonicContact CZ-OD2 3.39Å; R61-D67 IonicContact NE-OD2 2.8Å; R61-D67 PolarHBondContact NE-OD2 2.74Å; R61-D67 IonicContact NH2-OD1 2.98Å; R61-D67 PolarHBondContact NH2-OD1 3.35Å; R61-D67 IonicContact NH2-OD2 2.75Å; R61-D67 PolarHBondContact NH2-OD2 3.49Å; S64-D67 WeakPolarHBondContact CB-OD2 3.48Å; S64-D67 PolarHBondContact O-N 3.31Å; S64-D67 PolarHBondContact OG-N 3.02Å; S64-D67 PolarHBondContact OG-OD2 3.07Å; D67-T71 WeakPolarHBondContact O-CB 3.29Å; D67-T71 PolarHBondContact O-N 2.92Å; D67-T71 PolarHBondContact O-OG1 3.4Å; D67-I281 HydrophobicContact CB-CG2 4.19Å; D67-L284 HydrophobicContact CB-CB 4.35Å |
| 68 | L | 89.1 | Confident | 83.5 | Confident | 84 Ų | 84 | 58.6 Ų | 58.6 | 44% | 0.44 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -70.1 | -46.5 | 172.1 | -66.8 | 175.6 | 0 | 0 | 0 | 112.7 | S64 F66 L70 T71 Q72 | S64-L68 PolarHBondContact O-N 3.14Å; F66-L68 VanDerWaalsContact C-N 3.28Å; F66-L68 PolarHBondContact O-N 2.83Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 2.97Å; L68-T71 VanDerWaalsContact O-CB 3.3Å; L68-T71 WeakPolarHBondContact O-CB 3.1Å; L68-T71 PolarHBondContact O-N 3.44Å; L68-T71 VanDerWaalsContact O-N 3.15Å; L68-Q72 PolarHBondContact O-N 3.38Å; L68-Q72 VanDerWaalsContact O-N 3.09Å |
| 69 | M | 91.9 | Very high | 85.2 | Confident | 62 Ų | 62 | 66 Ų | 66 | 31% | 0.305 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 174.6 | 179.7 | -170.8 | 70.5 | 0 | 0 | 111 | C65 F66 T71 Q72 D73 H343 | C65-M69 WeakPolarHBondContact O-CB 3.21Å; C65-M69 PolarHBondContact O-N 3.38Å; F66-M69 HydrophobicContact CD2-CE 3.4Å; F66-M69 HydrophobicContact CE2-CE 3.54Å; F66-M69 HydrophobicContact CG-CE 4.36Å; F66-M69 PolarHBondContact O-N 3.3Å; M69-T71 VanDerWaalsContact C-N 3.25Å; M69-T71 PolarHBondContact O-N 3.26Å; M69-Q72 WeakPolarHBondContact O-CB 3.43Å; M69-Q72 PolarHBondContact O-N 2.95Å; M69-Q72 VanDerWaalsContact O-N 3.08Å; M69-D73 PolarHBondContact O-N 3.32Å; M69-H343 WeakPolarHBondContact CE-CE1 3.3Å; M69-H343 VanDerWaalsContact CE-NE2 3.26Å; M69-H343 WeakPolarHBondContact CE-NE2 3.35Å |
| 70 | L | 93.7 | Very high | 86.8 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62 | -35.5 | 176.6 | -175.8 | 63 | 0 | 0 | 0 | 111.7 | F66 L68 D73 L74 G283 F286 M287 H343 L347 | F66-L70 HydrophobicContact CE1-CD2 3.99Å; F66-L70 WeakPolarHBondContact O-CB 3.33Å; F66-L70 PolarHBondContact O-N 3.48Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 2.97Å; L70-D73 PolarHBondContact O-N 3.45Å; L70-L74 HydrophobicContact CG-CD1 4.08Å; L70-L74 VanDerWaalsContact O-CB 3.28Å; L70-L74 WeakPolarHBondContact O-CB 3.49Å; L70-L74 WeakPolarHBondContact O-CD1 3.46Å; L70-L74 WeakPolarHBondContact O-CG 3.24Å; L70-L74 PolarHBondContact O-N 3.01Å; L70-G283 WeakPolarHBondContact CD2-O 3.49Å; L70-F286 HydrophobicContact CD1-CD1 4.48Å; L70-F286 HydrophobicContact CD2-CD1 4.12Å; L70-M287 HydrophobicContact CD2-CG 3.44Å; L70-M287 VanDerWaalsContact CD2-CG 3.44Å; L70-M287 HydrophobicContact CD2-SD 3.75Å; L70-H343 HydrophobicContact CD1-CB 4.36Å; L70-L347 HydrophobicContact CD1-CD1 3.89Å |
| 71 | T | 94.9 | Very high | 88.5 | Confident | 24 Ų | 24 | 56.8 Ų | 56.8 | 15% | 0.147 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61 | -44.6 | 172.3 | -62.1 | 0 | 0 | 0 | 0 | 111.4 | D67 L68 M69 L74 L75 V282 G283 | D67-T71 WeakPolarHBondContact O-CB 3.29Å; D67-T71 PolarHBondContact O-N 2.92Å; D67-T71 PolarHBondContact O-OG1 3.4Å; L68-T71 VanDerWaalsContact O-CB 3.3Å; L68-T71 WeakPolarHBondContact O-CB 3.1Å; L68-T71 PolarHBondContact O-N 3.44Å; L68-T71 VanDerWaalsContact O-N 3.15Å; M69-T71 VanDerWaalsContact C-N 3.25Å; M69-T71 PolarHBondContact O-N 3.26Å; T71-L74 PolarHBondContact O-N 3.47Å; T71-L75 HydrophobicContact CG2-CD1 4.27Å; T71-L75 VanDerWaalsContact O-CG 3.28Å; T71-L75 WeakPolarHBondContact O-CG 3.42Å; T71-L75 PolarHBondContact O-N 2.98Å; T71-V282 HydrophobicContact CG2-CB 4.06Å; T71-V282 HydrophobicContact CG2-CG2 4.3Å; T71-G283 WeakPolarHBondContact OG1-CA 3.39Å; T71-G283 PolarHBondContact OG1-N 3.21Å |
| 72 | Q | 95.7 | Very high | 89.9 | Confident | 138 Ų | 138 | 58.8 Ų | 58.8 | 65% | 0.645 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -63.5 | -44.8 | 177.7 | -67 | 176.9 | -18.3 | 0 | 0 | 112 | L68 M69 L75 K76 | L68-Q72 PolarHBondContact O-N 3.38Å; L68-Q72 VanDerWaalsContact O-N 3.09Å; M69-Q72 WeakPolarHBondContact O-CB 3.43Å; M69-Q72 PolarHBondContact O-N 2.95Å; M69-Q72 VanDerWaalsContact O-N 3.08Å; Q72-L75 PolarHBondContact O-N 3.26Å; Q72-K76 PolarHBondContact O-N 2.92Å |
| 73 | D | 96.8 | Very high | 91.3 | Very high | 17 Ų | 17 | 55.9 Ų | 55.9 | 9% | 0.091 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67.4 | -37.3 | 178.6 | -79.8 | -19 | 0 | 0 | 0 | 112.2 | M69 L70 K76 R77 H343 K344 L347 L349 | M69-D73 PolarHBondContact O-N 3.32Å; L70-D73 PolarHBondContact O-N 3.45Å; D73-K76 PolarHBondContact O-N 2.99Å; D73-R77 PolarHBondContact O-N 3.39Å; D73-H343 IonicContact OD2-CD2 3.97Å; D73-H343 PolarHBondContact OD2-CD2 2.97Å; D73-H343 VanDerWaalsContact OD2-CD2 3.23Å; D73-H343 IonicContact OD2-NE2 3.03Å; D73-H343 PolarHBondContact OD2-NE2 2.98Å; D73-K344 VanDerWaalsContact OD2-CE 3.28Å; D73-K344 WeakPolarHBondContact OD2-CE 3.35Å; D73-L347 HydrophobicContact CB-CD1 3.63Å; D73-L349 HydrophobicContact CB-CD1 3.56Å |
| 74 | L | 97.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.5 | -42.6 | 172 | -80.7 | 165.3 | 0 | 0 | 0 | 112 | L70 T71 R77 N78 V245 V282 F286 L347 | L70-L74 HydrophobicContact CG-CD1 4.08Å; L70-L74 VanDerWaalsContact O-CB 3.28Å; L70-L74 WeakPolarHBondContact O-CB 3.49Å; L70-L74 WeakPolarHBondContact O-CD1 3.46Å; L70-L74 WeakPolarHBondContact O-CG 3.24Å; L70-L74 PolarHBondContact O-N 3.01Å; T71-L74 PolarHBondContact O-N 3.47Å; L74-R77 PolarHBondContact O-N 2.95Å; L74-N78 WeakPolarHBondContact O-CB 3.48Å; L74-N78 PolarHBondContact O-N 3.32Å; L74-V245 HydrophobicContact CD2-CB 4.19Å; L74-V245 HydrophobicContact CD2-CG1 3.77Å; L74-V245 HydrophobicContact CD2-CG2 4.05Å; L74-V282 HydrophobicContact CD1-CG1 4.14Å; L74-F286 HydrophobicContact CD1-CB 3.65Å; L74-F286 HydrophobicContact CD1-CD1 4.31Å; L74-F286 HydrophobicContact CD1-CG 4.01Å; L74-F286 HydrophobicContact CD2-CB 4.49Å; L74-F286 HydrophobicContact CD2-CD1 4.43Å; L74-F286 HydrophobicContact CD2-CD2 4.15Å; L74-F286 HydrophobicContact CD2-CG 4.09Å; L74-L347 HydrophobicContact CD2-CD1 4.42Å; L74-L347 HydrophobicContact CD2-CD2 3.54Å; L74-L347 HydrophobicContact CG-CD1 4.25Å; L74-L347 HydrophobicContact CG-CD2 4.21Å |
| 75 | L | 97 | Very high | 92.9 | Very high | 64 Ų | 64 | 66.2 Ų | 66.2 | 34% | 0.335 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.5 | -44.9 | 175.8 | -71.4 | 171.6 | 0 | 0 | 0 | 110.8 | T71 Q72 N78 F79 I241 | T71-L75 HydrophobicContact CG2-CD1 4.27Å; T71-L75 VanDerWaalsContact O-CG 3.28Å; T71-L75 WeakPolarHBondContact O-CG 3.42Å; T71-L75 PolarHBondContact O-N 2.98Å; Q72-L75 PolarHBondContact O-N 3.26Å; L75-N78 WeakPolarHBondContact O-CB 3.38Å; L75-N78 PolarHBondContact O-N 3.34Å; L75-F79 WeakPolarHBondContact O-CD2 3.36Å; L75-F79 PolarHBondContact O-N 2.75Å; L75-I241 HydrophobicContact CD2-CD1 3.72Å |
| 76 | K | 97.4 | Very high | 93 | Very high | 114 Ų | 114 | 70 Ų | 70 | 50% | 0.496 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -57.1 | -51.9 | 175.7 | -176 | -178.2 | 174.1 | -172.7 | 0 | 111.3 | Q72 D73 N78 F79 E80 L349 | Q72-K76 PolarHBondContact O-N 2.92Å; D73-K76 PolarHBondContact O-N 2.99Å; K76-N78 VanDerWaalsContact C-N 3.3Å; K76-N78 PolarHBondContact O-N 3.24Å; K76-F79 PolarHBondContact O-N 2.9Å; K76-F79 VanDerWaalsContact O-N 3.15Å; K76-E80 PolarHBondContact O-N 3.09Å; K76-L349 HydrophobicContact CB-CD2 4.31Å; K76-L349 HydrophobicContact CD-CD1 4.37Å; K76-L349 HydrophobicContact CD-CD2 3.82Å; K76-L349 HydrophobicContact CG-CD2 3.89Å |
| 77 | R | 97.4 | Very high | 93 | Very high | 33 Ų | 33 | 70 Ų | 70 | 13% | 0.125 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -61.8 | -40.1 | 178.2 | -176.7 | 60.4 | 176.8 | 167 | -1.5 | 111.6 | D73 L74 F79 E80 L81 V245 D248 L347 L349 | D73-R77 PolarHBondContact O-N 3.39Å; L74-R77 PolarHBondContact O-N 2.95Å; R77-F79 VanDerWaalsContact C-N 3.31Å; R77-F79 PolarHBondContact O-N 2.92Å; R77-E80 IonicContact CZ-OE2 3.99Å; R77-E80 IonicContact NH1-OE2 3.51Å; R77-E80 PolarHBondContact NH1-OE2 2.92Å; R77-E80 WeakPolarHBondContact O-CB 3.48Å; R77-E80 PolarHBondContact O-N 3.12Å; R77-L81 HydrophobicContact CG-CD1 3.89Å; R77-L81 HydrophobicContact CG-CG 4.32Å; R77-L81 VanDerWaalsContact O-CG 3.3Å; R77-L81 WeakPolarHBondContact O-CG 3.45Å; R77-L81 PolarHBondContact O-N 3.33Å; R77-L81 VanDerWaalsContact O-N 3.08Å; R77-V245 HydrophobicContact CB-CG2 4.48Å; R77-V245 HydrophobicContact CG-CG2 4.29Å; R77-D248 IonicContact CZ-OD1 2.68Å; R77-D248 IonicContact CZ-OD2 3.09Å; R77-D248 IonicContact NE-OD1 3.85Å; R77-D248 IonicContact NE-OD2 3.98Å; R77-D248 PolarHBondContact NE-OD2 3.47Å; R77-D248 IonicContact NH2-OD1 3.14Å; R77-D248 PolarHBondContact NH2-OD1 2.89Å; R77-D248 IonicContact NH2-OD2 2.65Å; R77-D248 PolarHBondContact NH2-OD2 2.55Å; R77-L347 WeakPolarHBondContact CD-O 3.28Å; R77-L347 VanDerWaalsContact CG-O 3.23Å; R77-L347 WeakPolarHBondContact CG-O 3.49Å; R77-L347 PolarHBondContact NE-O 3.38Å; R77-L347 VanDerWaalsContact NE-O 3.09Å; R77-L349 HydrophobicContact CB-CD2 4.01Å; R77-L349 HydrophobicContact CB-CG 4.36Å |
| 78 | N | 96.8 | Very high | 93.1 | Very high | 11 Ų | 11 | 72.2 Ų | 72.2 | 6% | 0.059 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.9 | -39.6 | 176 | 171.4 | 87.5 | 0 | 0 | 0 | 112.4 | L74 L75 K76 E80 L81 V82 I241 R244 V245 | L74-N78 WeakPolarHBondContact O-CB 3.48Å; L74-N78 PolarHBondContact O-N 3.32Å; L75-N78 WeakPolarHBondContact O-CB 3.38Å; L75-N78 PolarHBondContact O-N 3.34Å; K76-N78 VanDerWaalsContact C-N 3.3Å; K76-N78 PolarHBondContact O-N 3.24Å; N78-E80 VanDerWaalsContact C-N 3.34Å; N78-E80 PolarHBondContact O-N 2.87Å; N78-L81 PolarHBondContact O-N 3.42Å; N78-V82 VanDerWaalsContact O-CG2 3.29Å; N78-V82 WeakPolarHBondContact O-CG2 3.49Å; N78-V82 PolarHBondContact O-N 2.8Å; N78-I241 HydrophobicContact CB-CG2 4.01Å; N78-R244 PolarHBondContact OD1-NE 2.75Å; N78-R244 PolarHBondContact OD1-NH2 3.21Å; N78-V245 HydrophobicContact CB-CG2 4.48Å |
| 79 | F | 95.6 | Very high | 93.2 | Very high | 156 Ų | 156 | 70 Ų | 70 | 68% | 0.684 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -62.6 | -38.9 | 175.2 | -79.4 | -68.1 | 0 | 0 | 0 | 112.6 | L75 K76 R77 L81 | L75-F79 WeakPolarHBondContact O-CD2 3.36Å; L75-F79 PolarHBondContact O-N 2.75Å; K76-F79 PolarHBondContact O-N 2.9Å; K76-F79 VanDerWaalsContact O-N 3.15Å; R77-F79 VanDerWaalsContact C-N 3.31Å; R77-F79 PolarHBondContact O-N 2.92Å; F79-L81 VanDerWaalsContact C-N 3.28Å; F79-L81 PolarHBondContact O-N 2.79Å |
| 80 | E | 95.8 | Very high | 93.1 | Very high | 86 Ų | 86 | 68.7 Ų | 68.7 | 40% | 0.402 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.5 | -30 | 175.2 | -64.2 | 172.2 | -177.5 | 0 | 0 | 112.7 | K76 R77 N78 | K76-E80 PolarHBondContact O-N 3.09Å; R77-E80 IonicContact CZ-OE2 3.99Å; R77-E80 IonicContact NH1-OE2 3.51Å; R77-E80 PolarHBondContact NH1-OE2 2.92Å; R77-E80 WeakPolarHBondContact O-CB 3.48Å; R77-E80 PolarHBondContact O-N 3.12Å; N78-E80 VanDerWaalsContact C-N 3.34Å; N78-E80 PolarHBondContact O-N 2.87Å |
| 81 | L | 96.4 | Very high | 93.1 | Very high | 6 Ų | 6 | 68.8 Ų | 68.8 | 3% | 0.031 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -89.2 | -18.5 | -176.6 | -67.5 | 174.8 | 0 | 0 | 0 | 114.1 | R77 N78 F79 I133 T134 V245 D248 | R77-L81 HydrophobicContact CG-CD1 3.89Å; R77-L81 HydrophobicContact CG-CG 4.32Å; R77-L81 VanDerWaalsContact O-CG 3.3Å; R77-L81 WeakPolarHBondContact O-CG 3.45Å; R77-L81 PolarHBondContact O-N 3.33Å; R77-L81 VanDerWaalsContact O-N 3.08Å; N78-L81 PolarHBondContact O-N 3.42Å; F79-L81 VanDerWaalsContact C-N 3.28Å; F79-L81 PolarHBondContact O-N 2.79Å; L81-I133 HydrophobicContact CB-CG2 4.38Å; L81-I133 HydrophobicContact CD2-CG2 3.96Å; L81-I133 CarbonylContact O-C 3.56Å; L81-I133 VanDerWaalsContact O-CA 3.3Å; L81-I133 WeakPolarHBondContact O-CA 3.46Å; L81-T134 PolarHBondContact O-N 3.24Å; L81-V245 HydrophobicContact CD1-CG2 4.26Å; L81-D248 HydrophobicContact CD1-CB 3.55Å; L81-D248 HydrophobicContact CD2-CB 3.87Å; L81-D248 HydrophobicContact CG-CB 4.38Å |
| 82 | V | 94.4 | Very high | 93.1 | Very high | 60 Ų | 60 | 69.4 Ų | 69.4 | 36% | 0.364 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -70.7 | 127.3 | 178.3 | 166.7 | 0 | 0 | 0 | 0 | 108.9 | N78 | N78-V82 VanDerWaalsContact O-CG2 3.29Å; N78-V82 WeakPolarHBondContact O-CG2 3.49Å; N78-V82 PolarHBondContact O-N 2.8Å |
| 83 | P | 91.9 | Very high | 93 | Very high | 15 Ų | 15 | 66.7 Ų | 66.7 | 10% | 0.097 | 33% | 0.33 | C | S | . | . | P | Polyproline II helix | trans | -61 | 150.2 | 177.5 | -12.2 | 21.1 | 0 | 0 | 0 | 111.9 | V88 L132 | P83-V88 HydrophobicContact CB-CG2 3.74Å; P83-V88 HydrophobicContact CG-CG2 4.21Å; P83-L132 HydrophobicContact CG-CB 3.86Å |
| 84 | E | 88.2 | Confident | 92.8 | Very high | 145 Ų | 145 | 66 Ų | 66 | 68% | 0.678 | 33% | 0.326 | S | S | * | . | P | Polyproline II helix | trans | -62.4 | 146.7 | 179 | -64.3 | -175.2 | 177.2 | 0 | 0 | 112.1 | F86 S87 V88 | E84-F86 PolarHBondContact O-N 2.68Å; E84-F86 VanDerWaalsContact O-N 3.14Å; E84-S87 PolarHBondContact O-N 3.1Å; E84-S87 VanDerWaalsContact O-N 3.11Å; E84-V88 PolarHBondContact O-N 2.92Å; E84-V88 VanDerWaalsContact O-N 3.09Å |
| 85 | R | 86.8 | Confident | 92.7 | Very high | 238 Ų | 238 | 66.3 Ų | 66.3 | 90% | 0.898 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -54.2 | -38.3 | -176 | -67 | -175.1 | -178.6 | -172.9 | 0.9 | 113.1 | V88 G89 | R85-V88 PolarHBondContact O-N 3.49Å; R85-G89 PolarHBondContact O-N 3.19Å |
| 86 | F | 83.8 | Confident | 92.6 | Very high | 177 Ų | 177 | 67.7 Ų | 67.7 | 78% | 0.776 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -64 | -48.1 | 179.9 | -177.7 | -98.9 | 0 | 0 | 0 | 112 | E84 V88 G89 G90 | E84-F86 PolarHBondContact O-N 2.68Å; E84-F86 VanDerWaalsContact O-N 3.14Å; F86-V88 PolarHBondContact O-N 3.27Å; F86-G89 PolarHBondContact O-N 3.14Å; F86-G90 PolarHBondContact O-N 2.9Å; F86-G90 VanDerWaalsContact O-N 3.07Å |
| 87 | S | 86 | Confident | 92.5 | Very high | 38 Ų | 38 | 62.5 Ų | 62.5 | 27% | 0.266 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 176.8 | 166.8 | 0 | 0 | 0 | 0 | 111.8 | E84 L91 S137 | E84-S87 PolarHBondContact O-N 3.1Å; E84-S87 VanDerWaalsContact O-N 3.11Å; S87-L91 WeakPolarHBondContact O-CB 3.48Å; S87-L91 PolarHBondContact O-N 3.49Å; S87-L91 VanDerWaalsContact O-N 3.13Å; S87-S137 PolarHBondContact OG-OG 2.9Å; S87-S137 VanDerWaalsContact OG-OG 3.13Å |
| 88 | V | 89.3 | Confident | 92.4 | Very high | 48 Ų | 48 | 60.9 Ų | 60.9 | 29% | 0.291 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.5 | -38.3 | 177.5 | -177.7 | 0 | 0 | 0 | 0 | 111.5 | P83 E84 R85 F86 L91 S92 | P83-V88 HydrophobicContact CB-CG2 3.74Å; P83-V88 HydrophobicContact CG-CG2 4.21Å; E84-V88 PolarHBondContact O-N 2.92Å; E84-V88 VanDerWaalsContact O-N 3.09Å; R85-V88 PolarHBondContact O-N 3.49Å; F86-V88 PolarHBondContact O-N 3.27Å; V88-L91 PolarHBondContact O-N 3.47Å; V88-S92 WeakPolarHBondContact O-CB 3.37Å; V88-S92 PolarHBondContact O-N 3.41Å |
| 89 | G | 90.8 | Very high | 92.4 | Very high | 39 Ų | 39 | 61.6 Ų | 61.6 | 40% | 0.402 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.1 | -48.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | R85 F86 L91 S92 Y93 | R85-G89 PolarHBondContact O-N 3.19Å; F86-G89 PolarHBondContact O-N 3.14Å; G89-L91 PolarHBondContact O-N 3.13Å; G89-S92 PolarHBondContact O-N 3.49Å; G89-Y93 PolarHBondContact O-N 3.21Å |
| 90 | G | 89.7 | Confident | 92.3 | Very high | 34 Ų | 34 | 60.1 Ų | 60.1 | 35% | 0.351 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -62.2 | -40.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | F86 Y93 L94 | F86-G90 PolarHBondContact O-N 2.9Å; F86-G90 VanDerWaalsContact O-N 3.07Å; G90-Y93 PolarHBondContact O-N 3.25Å; G90-L94 PolarHBondContact O-N 3.47Å; G90-L94 VanDerWaalsContact O-N 3.1Å |
| 91 | L | 93.5 | Very high | 92.2 | Very high | 2 Ų | 2 | 56.1 Ų | 56.1 | 1% | 0.01 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -65 | -43.7 | 175 | -178 | 62.8 | 0 | 0 | 0 | 112.1 | S87 V88 G89 Y93 L94 V95 F127 L132 A139 A190 V192 | S87-L91 WeakPolarHBondContact O-CB 3.48Å; S87-L91 PolarHBondContact O-N 3.49Å; S87-L91 VanDerWaalsContact O-N 3.13Å; V88-L91 PolarHBondContact O-N 3.47Å; G89-L91 PolarHBondContact O-N 3.13Å; L91-Y93 VanDerWaalsContact C-N 3.33Å; L91-Y93 PolarHBondContact O-N 2.98Å; L91-L94 PolarHBondContact O-N 3.49Å; L91-V95 VanDerWaalsContact O-CG2 3.3Å; L91-V95 WeakPolarHBondContact O-CG2 3.5Å; L91-V95 PolarHBondContact O-N 2.84Å; L91-F127 HydrophobicContact CD2-CD2 3.9Å; L91-F127 HydrophobicContact CD2-CE2 4.45Å; L91-F127 HydrophobicContact CG-CD2 4.16Å; L91-F127 HydrophobicContact CG-CE2 4.32Å; L91-L132 HydrophobicContact CD2-CD1 3.84Å; L91-A139 HydrophobicContact CD1-CB 3.69Å; L91-A139 HydrophobicContact CD2-CB 4.05Å; L91-A139 HydrophobicContact CG-CB 3.92Å; L91-A190 HydrophobicContact CB-CB 4.23Å; L91-A190 HydrophobicContact CD1-CB 3.79Å; L91-V192 HydrophobicContact CD1-CG2 4.47Å |
| 92 | S | 94.1 | Very high | 92.2 | Very high | 36 Ų | 36 | 55.9 Ų | 55.9 | 25% | 0.252 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 177.3 | -166.2 | 0 | 0 | 0 | 0 | 111.2 | V88 G89 L94 V95 E96 | V88-S92 WeakPolarHBondContact O-CB 3.37Å; V88-S92 PolarHBondContact O-N 3.41Å; G89-S92 PolarHBondContact O-N 3.49Å; S92-L94 PolarHBondContact O-N 2.84Å; S92-V95 PolarHBondContact O-N 3.07Å; S92-E96 WeakPolarHBondContact O-CG 3.28Å; S92-E96 PolarHBondContact O-N 3.3Å; S92-E96 PolarHBondContact OG-OE1 3.37Å |
| 93 | Y | 92.9 | Very high | 92.1 | Very high | 81 Ų | 81 | 57.6 Ų | 57.6 | 32% | 0.318 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -61.5 | -45.4 | 178.3 | -177.1 | -99.1 | 0 | 0 | 0 | 112.1 | G89 G90 L91 V95 E96 L97 D169 F172 | G89-Y93 PolarHBondContact O-N 3.21Å; G90-Y93 PolarHBondContact O-N 3.25Å; L91-Y93 VanDerWaalsContact C-N 3.33Å; L91-Y93 PolarHBondContact O-N 2.98Å; Y93-V95 VanDerWaalsContact C-N 3.34Å; Y93-V95 PolarHBondContact O-N 2.81Å; Y93-E96 PolarHBondContact O-N 3.5Å; Y93-L97 HydrophobicContact CD1-CD1 3.89Å; Y93-L97 HydrophobicContact CD1-CG 4.32Å; Y93-L97 HydrophobicContact CE1-CD1 3.25Å; Y93-L97 HydrophobicContact CE1-CG 3.85Å; Y93-L97 PolarHBondContact O-N 3Å; Y93-D169 PolarHBondContact OH-OD2 3.5Å; Y93-F172 HydrophobicContact CD1-CE1 4.12Å; Y93-F172 AromaticContact CD1-CE2 3.63Å; Y93-F172 HydrophobicContact CD1-CE2 3.63Å; Y93-F172 AromaticContact CD1-CZ 3.34Å; Y93-F172 HydrophobicContact CD1-CZ 3.34Å; Y93-F172 AromaticContact CE1-CD2 3.94Å; Y93-F172 HydrophobicContact CE1-CD2 3.94Å; Y93-F172 HydrophobicContact CE1-CE1 4.39Å; Y93-F172 AromaticContact CE1-CE2 3.22Å; Y93-F172 HydrophobicContact CE1-CE2 3.22Å; Y93-F172 AromaticContact CE1-CZ 3.5Å; Y93-F172 HydrophobicContact CE1-CZ 3.5Å; Y93-F172 VanDerWaalsContact CE1-CZ 3.5Å |
| 94 | L | 93.9 | Very high | 92.2 | Very high | 2 Ų | 2 | 58.7 Ų | 58.7 | 1% | 0.01 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 176.6 | -175.8 | 60.3 | 0 | 0 | 0 | 112 | G90 L91 S92 L97 V98 V174 I185 A190 V192 | G90-L94 PolarHBondContact O-N 3.47Å; G90-L94 VanDerWaalsContact O-N 3.1Å; L91-L94 PolarHBondContact O-N 3.49Å; S92-L94 PolarHBondContact O-N 2.84Å; L94-L97 PolarHBondContact O-N 2.75Å; L94-V98 HydrophobicContact CD1-CG2 4.46Å; L94-V98 VanDerWaalsContact O-CG2 3.29Å; L94-V98 WeakPolarHBondContact O-CG2 3.49Å; L94-V98 PolarHBondContact O-N 2.87Å; L94-V174 HydrophobicContact CD1-CG1 4.11Å; L94-I185 HydrophobicContact CD1-CG2 4.33Å; L94-A190 HydrophobicContact CD2-CB 3.96Å; L94-V192 HydrophobicContact CB-CG2 4.2Å; L94-V192 HydrophobicContact CD2-CG2 3.84Å; L94-V192 HydrophobicContact CG-CG2 3.67Å |
| 95 | V | 95.7 | Very high | 92.3 | Very high | 7 Ų | 7 | 54.1 Ų | 54.1 | 4% | 0.042 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.9 | -46.3 | 174.1 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | L91 S92 Y93 L97 V98 V99 F127 A139 V141 V192 | L91-V95 VanDerWaalsContact O-CG2 3.3Å; L91-V95 WeakPolarHBondContact O-CG2 3.5Å; L91-V95 PolarHBondContact O-N 2.84Å; S92-V95 PolarHBondContact O-N 3.07Å; Y93-V95 VanDerWaalsContact C-N 3.34Å; Y93-V95 PolarHBondContact O-N 2.81Å; V95-L97 VanDerWaalsContact C-N 3.35Å; V95-L97 PolarHBondContact O-N 2.89Å; V95-V98 PolarHBondContact O-N 2.87Å; V95-V99 HydrophobicContact CG1-CG2 4.35Å; V95-V99 WeakPolarHBondContact O-CG2 3.29Å; V95-V99 PolarHBondContact O-N 3.32Å; V95-F127 HydrophobicContact CB-CE1 4.21Å; V95-F127 HydrophobicContact CB-CZ 4.4Å; V95-F127 HydrophobicContact CG1-CD1 4.45Å; V95-F127 HydrophobicContact CG1-CE1 3.9Å; V95-F127 HydrophobicContact CG2-CD1 4.31Å; V95-F127 HydrophobicContact CG2-CE1 4.1Å; V95-F127 HydrophobicContact CG2-CZ 4.32Å; V95-A139 HydrophobicContact CG2-CB 3.33Å; V95-V141 HydrophobicContact CG1-CG2 4.04Å; V95-V192 HydrophobicContact CG2-CG2 3.68Å |
| 96 | E | 94.8 | Very high | 92.4 | Very high | 94 Ų | 94 | 46 Ų | 46 | 44% | 0.439 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.4 | -41.3 | 178.1 | -73.9 | 169.7 | -148.4 | 0 | 0 | 112.3 | S92 Y93 R100 | S92-E96 WeakPolarHBondContact O-CG 3.28Å; S92-E96 PolarHBondContact O-N 3.3Å; S92-E96 PolarHBondContact OG-OE1 3.37Å; Y93-E96 PolarHBondContact O-N 3.5Å; E96-R100 WeakPolarHBondContact O-CB 3.36Å; E96-R100 PolarHBondContact O-N 3.23Å |
| 97 | L | 94.1 | Very high | 92.5 | Very high | 4 Ų | 4 | 44.6 Ų | 44.6 | 2% | 0.021 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.1 | -48.1 | 174.6 | -76.5 | -178.8 | 0 | 0 | 0 | 112 | Y93 L94 V95 V99 R100 V101 I165 | Y93-L97 HydrophobicContact CD1-CD1 3.89Å; Y93-L97 HydrophobicContact CD1-CG 4.32Å; Y93-L97 HydrophobicContact CE1-CD1 3.25Å; Y93-L97 HydrophobicContact CE1-CG 3.85Å; Y93-L97 PolarHBondContact O-N 3Å; L94-L97 PolarHBondContact O-N 2.75Å; V95-L97 VanDerWaalsContact C-N 3.35Å; V95-L97 PolarHBondContact O-N 2.89Å; L97-V99 PolarHBondContact O-N 2.93Å; L97-R100 PolarHBondContact O-N 3.26Å; L97-V101 WeakPolarHBondContact O-CG2 3.33Å; L97-V101 PolarHBondContact O-N 3.42Å; L97-I165 HydrophobicContact CD1-CG2 4.29Å |
| 98 | V | 95.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59.1 | -47.8 | 178.4 | 169.4 | 0 | 0 | 0 | 0 | 110.7 | L94 V95 V101 I102 I165 I185 V192 V194 | L94-V98 HydrophobicContact CD1-CG2 4.46Å; L94-V98 VanDerWaalsContact O-CG2 3.29Å; L94-V98 WeakPolarHBondContact O-CG2 3.49Å; L94-V98 PolarHBondContact O-N 2.87Å; V95-V98 PolarHBondContact O-N 2.87Å; V98-V101 PolarHBondContact O-N 3.32Å; V98-I102 HydrophobicContact CG1-CD1 3.62Å; V98-I102 WeakPolarHBondContact O-CB 3.29Å; V98-I102 WeakPolarHBondContact O-CD1 3.43Å; V98-I102 VanDerWaalsContact O-CG1 3.22Å; V98-I102 WeakPolarHBondContact O-CG1 3.47Å; V98-I102 PolarHBondContact O-N 3.04Å; V98-I165 HydrophobicContact CG2-CD1 3.7Å; V98-I185 HydrophobicContact CG2-CB 4.26Å; V98-I185 HydrophobicContact CG2-CG1 4.2Å; V98-I185 HydrophobicContact CG2-CG2 4.23Å; V98-V192 HydrophobicContact CB-CG1 4.33Å; V98-V192 HydrophobicContact CG1-CG1 4.12Å; V98-V192 HydrophobicContact CG2-CB 4.23Å; V98-V192 HydrophobicContact CG2-CG1 4.19Å; V98-V192 HydrophobicContact CG2-CG2 4.45Å; V98-V194 HydrophobicContact CG1-CG2 3.92Å |
| 99 | V | 96.3 | Very high | 91.1 | Very high | 26 Ų | 26 | 49.8 Ų | 49.8 | 16% | 0.158 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61 | -47.3 | 177.6 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | V95 L97 V101 I102 E103 V121 V141 | V95-V99 HydrophobicContact CG1-CG2 4.35Å; V95-V99 WeakPolarHBondContact O-CG2 3.29Å; V95-V99 PolarHBondContact O-N 3.32Å; L97-V99 PolarHBondContact O-N 2.93Å; V99-V101 PolarHBondContact O-N 3.11Å; V99-I102 PolarHBondContact O-N 3.47Å; V99-E103 HydrophobicContact CG1-CG 4.17Å; V99-E103 WeakPolarHBondContact O-CB 3.45Å; V99-E103 WeakPolarHBondContact O-CG 3.22Å; V99-E103 PolarHBondContact O-N 2.82Å; V99-V121 HydrophobicContact CG1-CG1 4.26Å; V99-V121 HydrophobicContact CG2-CG2 4.42Å; V99-V141 HydrophobicContact CG2-CG1 4.07Å; V99-V141 HydrophobicContact CG2-CG2 4.18Å |
| 100 | R | 94.8 | Very high | 89.8 | Confident | 124 Ų | 124 | 54.8 Ų | 54.8 | 47% | 0.468 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.1 | -43 | 179.7 | -174.5 | -176.4 | -58.7 | 139.1 | 8.4 | 112.6 | E96 L97 E103 G104 | E96-R100 WeakPolarHBondContact O-CB 3.36Å; E96-R100 PolarHBondContact O-N 3.23Å; L97-R100 PolarHBondContact O-N 3.26Å; R100-E103 PolarHBondContact O-N 3.1Å; R100-G104 PolarHBondContact O-N 3.45Å |
| 101 | V | 94.2 | Very high | 88.5 | Confident | 3 Ų | 3 | 55.9 Ų | 55.9 | 2% | 0.018 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 177.4 | 171.3 | 0 | 0 | 0 | 0 | 110.5 | L97 V98 V99 G104 Y105 I161 K164 I165 F168 | L97-V101 WeakPolarHBondContact O-CG2 3.33Å; L97-V101 PolarHBondContact O-N 3.42Å; V98-V101 PolarHBondContact O-N 3.32Å; V99-V101 PolarHBondContact O-N 3.11Å; V101-G104 PolarHBondContact O-N 3.21Å; V101-Y105 HydrophobicContact CG1-CD2 4.16Å; V101-Y105 HydrophobicContact CG1-CE2 3.87Å; V101-Y105 VanDerWaalsContact O-CD2 3.24Å; V101-Y105 WeakPolarHBondContact O-CD2 3.43Å; V101-Y105 PolarHBondContact O-N 3.27Å; V101-I161 HydrophobicContact CG1-CB 4.42Å; V101-I161 HydrophobicContact CG1-CG1 4.19Å; V101-I161 HydrophobicContact CG1-CG2 4.22Å; V101-K164 HydrophobicContact CG1-CB 3.8Å; V101-K164 HydrophobicContact CG1-CD 4.09Å; V101-K164 HydrophobicContact CG2-CB 4.41Å; V101-I165 HydrophobicContact CG2-CG1 3.9Å; V101-F168 HydrophobicContact CG2-CD2 3.77Å; V101-F168 HydrophobicContact CG2-CE2 3.86Å |
| 102 | I | 94.6 | Very high | 86.6 | Confident | 0 Ų | 0 | 65.4 Ų | 65.4 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.5 | -43.7 | 177.8 | -68 | 163.7 | 0 | 0 | 0 | 111.5 | V98 V99 G104 Y105 M106 I118 V121 V141 V143 F157 I161 V194 | V98-I102 HydrophobicContact CG1-CD1 3.62Å; V98-I102 WeakPolarHBondContact O-CB 3.29Å; V98-I102 WeakPolarHBondContact O-CD1 3.43Å; V98-I102 VanDerWaalsContact O-CG1 3.22Å; V98-I102 WeakPolarHBondContact O-CG1 3.47Å; V98-I102 PolarHBondContact O-N 3.04Å; V99-I102 PolarHBondContact O-N 3.47Å; I102-G104 PolarHBondContact O-N 3.3Å; I102-Y105 WeakPolarHBondContact O-CB 3.17Å; I102-Y105 PolarHBondContact O-N 3.09Å; I102-M106 PolarHBondContact O-N 3.4Å; I102-I118 HydrophobicContact CG2-CD1 3.87Å; I102-I118 HydrophobicContact CG2-CG2 4.41Å; I102-V121 HydrophobicContact CB-CG2 4.23Å; I102-V121 HydrophobicContact CD1-CG2 4.09Å; I102-V121 HydrophobicContact CG2-CB 3.68Å; I102-V121 HydrophobicContact CG2-CG1 3.99Å; I102-V121 HydrophobicContact CG2-CG2 3.78Å; I102-V141 HydrophobicContact CD1-CG1 4.41Å; I102-V143 HydrophobicContact CD1-CG2 3.71Å; I102-V143 HydrophobicContact CG2-CG1 4.48Å; I102-V143 HydrophobicContact CG2-CG2 4.17Å; I102-F157 HydrophobicContact CG1-CZ 4.42Å; I102-I161 HydrophobicContact CD1-CD1 4.21Å; I102-I161 HydrophobicContact CG1-CD1 3.77Å; I102-I161 HydrophobicContact CG1-CG1 4.37Å; I102-V194 HydrophobicContact CD1-CG1 4.47Å |
| 103 | E | 94.1 | Very high | 85.2 | Confident | 96 Ų | 96 | 67.6 Ų | 67.6 | 45% | 0.449 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.8 | -34.8 | 173.9 | -72.5 | 177.7 | 156.7 | 0 | 0 | 111.6 | V99 R100 Y105 M106 L107 V121 | V99-E103 HydrophobicContact CG1-CG 4.17Å; V99-E103 WeakPolarHBondContact O-CB 3.45Å; V99-E103 WeakPolarHBondContact O-CG 3.22Å; V99-E103 PolarHBondContact O-N 2.82Å; R100-E103 PolarHBondContact O-N 3.1Å; E103-Y105 VanDerWaalsContact C-N 3.34Å; E103-Y105 PolarHBondContact O-N 2.78Å; E103-M106 HydrophobicContact CG-SD 4.45Å; E103-M106 WeakPolarHBondContact O-CB 3.37Å; E103-M106 PolarHBondContact O-N 2.89Å; E103-L107 PolarHBondContact O-N 2.97Å; E103-V121 HydrophobicContact CG-CG1 3.65Å |
| 104 | G | 92.3 | Very high | 83.9 | Confident | 38 Ų | 38 | 70.4 Ų | 70.4 | 39% | 0.392 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -59.2 | -42.7 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R100 V101 I102 M106 L107 D108 | R100-G104 PolarHBondContact O-N 3.45Å; V101-G104 PolarHBondContact O-N 3.21Å; I102-G104 PolarHBondContact O-N 3.3Å; G104-M106 VanDerWaalsContact C-N 3.34Å; G104-L107 PolarHBondContact O-N 3.36Å; G104-D108 PolarHBondContact O-N 2.97Å |
| 105 | Y | 90.1 | Very high | 82.6 | Confident | 50 Ų | 50 | 74.3 Ų | 74.3 | 20% | 0.196 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -69.4 | -28.2 | 174.1 | -77.6 | -75.6 | 0 | 0 | 0 | 113.5 | V101 I102 E103 L107 D108 F157 C160 I161 K164 | V101-Y105 HydrophobicContact CG1-CD2 4.16Å; V101-Y105 HydrophobicContact CG1-CE2 3.87Å; V101-Y105 VanDerWaalsContact O-CD2 3.24Å; V101-Y105 WeakPolarHBondContact O-CD2 3.43Å; V101-Y105 PolarHBondContact O-N 3.27Å; I102-Y105 WeakPolarHBondContact O-CB 3.17Å; I102-Y105 PolarHBondContact O-N 3.09Å; E103-Y105 VanDerWaalsContact C-N 3.34Å; E103-Y105 PolarHBondContact O-N 2.78Å; Y105-L107 PolarHBondContact O-N 3.49Å; Y105-D108 PolarHBondContact O-N 2.93Å; Y105-F157 HydrophobicContact CD2-CE2 4.07Å; Y105-F157 HydrophobicContact CE2-CE2 4.44Å; Y105-F157 HydrophobicContact CG-CE2 4.11Å; Y105-C160 WeakPolarHBondContact OH-CB 3.16Å; Y105-I161 HydrophobicContact CE2-CG1 4.3Å; Y105-K164 HydrophobicContact CE2-CD 3.58Å; Y105-K164 VanDerWaalsContact OH-CD 3.29Å; Y105-K164 WeakPolarHBondContact OH-CD 3.23Å; Y105-K164 WeakPolarHBondContact OH-CE 3.48Å; Y105-K164 PolarHBondContact OH-NZ 3.09Å |
| 106 | M | 89.5 | Confident | 81.6 | Confident | 67 Ų | 67 | 75.7 Ų | 75.7 | 33% | 0.33 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -64.7 | -28.7 | 174.5 | -70.9 | 177.8 | 66.8 | 0 | 0 | 112.9 | I102 E103 G104 I118 A119 V121 | I102-M106 PolarHBondContact O-N 3.4Å; E103-M106 HydrophobicContact CG-SD 4.45Å; E103-M106 WeakPolarHBondContact O-CB 3.37Å; E103-M106 PolarHBondContact O-N 2.89Å; G104-M106 VanDerWaalsContact C-N 3.34Å; M106-I118 HydrophobicContact CE-CG2 4.45Å; M106-I118 HydrophobicContact CG-CB 3.57Å; M106-I118 HydrophobicContact CG-CD1 4.34Å; M106-I118 HydrophobicContact CG-CG2 3.42Å; M106-I118 VanDerWaalsContact CG-CG2 3.42Å; M106-I118 HydrophobicContact SD-CG2 3.84Å; M106-A119 WeakPolarHBondContact CE-O 3.3Å; M106-V121 HydrophobicContact SD-CB 4.44Å; M106-V121 HydrophobicContact SD-CG1 3.84Å |
| 107 | L | 86.5 | Confident | 81.3 | Confident | 148 Ų | 148 | 72.3 Ų | 72.3 | 78% | 0.775 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.5 | -5 | -177 | -62.4 | 175.6 | 0 | 0 | 0 | 113.1 | E103 G104 Y105 P109 | E103-L107 PolarHBondContact O-N 2.97Å; G104-L107 PolarHBondContact O-N 3.36Å; Y105-L107 PolarHBondContact O-N 3.49Å; L107-P109 VanDerWaalsContact O-CD 3.25Å; L107-P109 WeakPolarHBondContact O-CD 3.11Å |
| 108 | D | 80.1 | Confident | 81.2 | Confident | 66 Ų | 66 | 72.7 Ų | 72.7 | 35% | 0.353 | 38% | 0.384 | S | S | . | . | trans | -72.1 | 113.1 | -176.6 | -165.9 | -15.7 | 0 | 0 | 0 | 110.6 | G104 Y105 E110 | G104-D108 PolarHBondContact O-N 2.97Å; Y105-D108 PolarHBondContact O-N 2.93Å; D108-E110 PolarHBondContact O-N 3.5Å; D108-E110 PolarHBondContact OD1-N 3.28Å | ||
| 109 | P | 65.9 | Low | 81.1 | Confident | 128 Ų | 128 | 74.1 Ų | 74.1 | 83% | 0.831 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -15.6 | 179.2 | 30.9 | -35 | 0 | 0 | 0 | 112.7 | L107 | L107-P109 VanDerWaalsContact O-CD 3.25Å; L107-P109 WeakPolarHBondContact O-CD 3.11Å |
| 110 | E | 63.6 | Low | 81 | Confident | 144 Ų | 144 | 76.3 Ų | 76.3 | 67% | 0.673 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96 | 18.4 | -177.5 | -60.8 | -164.8 | 172.7 | 0 | 0 | 113.5 | D108 K112 | D108-E110 PolarHBondContact O-N 3.5Å; D108-E110 PolarHBondContact OD1-N 3.28Å; E110-K112 VanDerWaalsContact C-N 3.3Å; E110-K112 WeakPolarHBondContact O-CG 3.45Å; E110-K112 PolarHBondContact O-N 2.97Å |
| 111 | A | 61.1 | Low | 81.1 | Confident | 57 Ų | 57 | 71.2 Ų | 71.2 | 47% | 0.471 | 39% | 0.392 | S | S | . | . | trans | -59.8 | 93.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110 | D113 | A111-D113 PolarHBondContact O-N 3.18Å; A111-D113 VanDerWaalsContact O-N 3.08Å | ||
| 112 | K | 55.4 | Low | 81.2 | Confident | 203 Ų | 203 | 74 Ų | 74 | 88% | 0.883 | 40% | 0.404 | S | S | * | . | trans | -67.6 | -6.4 | -173.9 | -78.2 | 173.7 | -175.5 | 170.1 | 0 | 113.9 | E110 | E110-K112 VanDerWaalsContact C-N 3.3Å; E110-K112 WeakPolarHBondContact O-CG 3.45Å; E110-K112 PolarHBondContact O-N 2.97Å | ||
| 113 | D | 63.5 | Low | 81.3 | Confident | 82 Ų | 82 | 75.2 Ų | 75.2 | 44% | 0.439 | 41% | 0.413 | S | S | . | . | trans | -129.6 | 106.5 | -174.4 | -161.2 | -7.4 | 0 | 0 | 0 | 109.6 | A111 D115 L116 | A111-D113 PolarHBondContact O-N 3.18Å; A111-D113 VanDerWaalsContact O-N 3.08Å; D113-D115 PolarHBondContact O-N 3.44Å; D113-D115 PolarHBondContact OD1-N 3.35Å; D113-L116 PolarHBondContact O-N 3.18Å | ||
| 114 | D | 66.1 | Low | 81.5 | Confident | 139 Ų | 139 | 70.7 Ų | 70.7 | 74% | 0.743 | 39% | 0.392 | S | S | * | . | G | 310 helix | trans | -59.1 | -25.4 | 179 | -87.8 | -23.1 | 0 | 0 | 0 | 111.6 | L116 A117 | D114-L116 VanDerWaalsContact C-N 3.29Å; D114-L116 PolarHBondContact O-N 3.1Å; D114-A117 WeakPolarHBondContact O-CB 3.35Å; D114-A117 PolarHBondContact O-N 2.82Å |
| 115 | D | 66.9 | Low | 81.7 | Confident | 84 Ų | 84 | 69.2 Ų | 69.2 | 45% | 0.449 | 38% | 0.376 | S | S | . | . | G | 310 helix | trans | -68.5 | -28.1 | -176.9 | -74 | -22 | 0 | 0 | 0 | 112.9 | D113 G147 | D113-D115 PolarHBondContact O-N 3.44Å; D113-D115 PolarHBondContact OD1-N 3.35Å; D115-G147 WeakPolarHBondContact O-CA 3.45Å |
| 116 | L | 74.8 | Confident | 81.9 | Confident | 36 Ų | 36 | 68.5 Ų | 68.5 | 19% | 0.188 | 38% | 0.379 | C | S | . | . | G | 310 helix | trans | -103.1 | 12.2 | 179 | -74.1 | 174.3 | 0 | 0 | 0 | 113.8 | D113 D114 I118 F145 A153 F157 | D113-L116 PolarHBondContact O-N 3.18Å; D114-L116 VanDerWaalsContact C-N 3.29Å; D114-L116 PolarHBondContact O-N 3.1Å; L116-I118 WeakPolarHBondContact O-CG1 3.46Å; L116-I118 PolarHBondContact O-N 3.45Å; L116-F145 HydrophobicContact CB-CD1 4.42Å; L116-F145 HydrophobicContact CB-CE1 4.21Å; L116-F145 HydrophobicContact CD2-CD1 3.97Å; L116-F145 HydrophobicContact CD2-CE1 3.46Å; L116-F145 VanDerWaalsContact CD2-CE1 3.46Å; L116-F145 HydrophobicContact CD2-CE2 4.43Å; L116-F145 HydrophobicContact CD2-CZ 3.72Å; L116-F145 HydrophobicContact CG-CE1 4.45Å; L116-F145 WeakPolarHBondContact O-CD1 3.46Å; L116-F145 WeakPolarHBondContact O-CE1 3.42Å; L116-A153 HydrophobicContact CD1-CB 3.91Å; L116-A153 HydrophobicContact CD2-CB 3.92Å; L116-A153 HydrophobicContact CG-CB 3.99Å; L116-F157 HydrophobicContact CD1-CB 4.44Å |
| 117 | A | 87.3 | Confident | 82.2 | Confident | 23 Ų | 23 | 66.8 Ų | 66.8 | 19% | 0.19 | 37% | 0.37 | C | S | . | . | trans | -61.3 | 121 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | D114 F145 R146 | D114-A117 WeakPolarHBondContact O-CB 3.35Å; D114-A117 PolarHBondContact O-N 2.82Å; A117-F145 CarbonylContact O-C 3.42Å; A117-F145 WeakPolarHBondContact O-CA 3.35Å; A117-R146 HydrophobicContact CB-CB 4.22Å; A117-R146 HydrophobicContact CB-CG 4.45Å; A117-R146 WeakPolarHBondContact O-CB 3.43Å; A117-R146 PolarHBondContact O-N 3.24Å | ||
| 118 | I | 92.5 | Very high | 82.6 | Confident | 12 Ų | 12 | 62.6 Ų | 62.6 | 6% | 0.062 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 125.6 | -173 | -55.6 | 175.5 | 0 | 0 | 0 | 109.8 | I102 M106 L116 V143 F145 F157 | I102-I118 HydrophobicContact CG2-CD1 3.87Å; I102-I118 HydrophobicContact CG2-CG2 4.41Å; M106-I118 HydrophobicContact CE-CG2 4.45Å; M106-I118 HydrophobicContact CG-CB 3.57Å; M106-I118 HydrophobicContact CG-CD1 4.34Å; M106-I118 HydrophobicContact CG-CG2 3.42Å; M106-I118 VanDerWaalsContact CG-CG2 3.42Å; M106-I118 HydrophobicContact SD-CG2 3.84Å; L116-I118 WeakPolarHBondContact O-CG1 3.46Å; L116-I118 PolarHBondContact O-N 3.45Å; I118-V143 HydrophobicContact CD1-CG1 4.39Å; I118-V143 HydrophobicContact CG1-CG1 4.36Å; I118-V143 HydrophobicContact CG2-CG1 3.86Å; I118-F145 HydrophobicContact CD1-CE1 4.45Å; I118-F145 HydrophobicContact CG1-CD1 4.02Å; I118-F145 HydrophobicContact CG1-CE1 3.77Å; I118-F157 HydrophobicContact CD1-CE1 4.36Å; I118-F157 HydrophobicContact CD1-CE2 3.95Å; I118-F157 HydrophobicContact CD1-CZ 3.45Å; I118-F157 VanDerWaalsContact CD1-CZ 3.45Å; I118-F157 HydrophobicContact CG1-CZ 4.49Å |
| 119 | A | 93 | Very high | 83.4 | Confident | 31 Ų | 31 | 60 Ų | 60 | 26% | 0.256 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.9 | -45.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | M106 V144 R146 L199 | M106-A119 WeakPolarHBondContact CE-O 3.3Å; A119-V144 WeakPolarHBondContact CA-O 3.22Å; A119-V144 HydrophobicContact CB-CB 4.35Å; A119-V144 HydrophobicContact CB-CG1 4.19Å; A119-V144 WeakPolarHBondContact CB-O 3.48Å; A119-V144 PolarHBondContact N-O 2.86Å; A119-R146 HydrophobicContact CB-CG 3.75Å; A119-L199 HydrophobicContact CB-CD2 4.19Å |
| 120 | T | 94.8 | Very high | 84.8 | Confident | 71 Ų | 71 | 61.9 Ų | 61.9 | 44% | 0.436 | 32% | 0.322 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -161.7 | 152.9 | -179.3 | -175.6 | 0 | 0 | 0 | 0 | 111 | V144 | T120-V144 HydrophobicContact CG2-CB 3.67Å; T120-V144 HydrophobicContact CG2-CG2 3.52Å; T120-V144 PolarHBondContact N-O 3.39Å; T120-V144 PolarHBondContact O-N 3.13Å |
| 121 | V | 96.7 | Very high | 86.3 | Confident | 17 Ų | 17 | 55 Ų | 55 | 10% | 0.103 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 139.5 | 169.6 | 60.9 | 0 | 0 | 0 | 0 | 109.2 | V99 I102 E103 M106 V141 A142 V143 | V99-V121 HydrophobicContact CG1-CG1 4.26Å; V99-V121 HydrophobicContact CG2-CG2 4.42Å; I102-V121 HydrophobicContact CB-CG2 4.23Å; I102-V121 HydrophobicContact CD1-CG2 4.09Å; I102-V121 HydrophobicContact CG2-CB 3.68Å; I102-V121 HydrophobicContact CG2-CG1 3.99Å; I102-V121 HydrophobicContact CG2-CG2 3.78Å; E103-V121 HydrophobicContact CG-CG1 3.65Å; M106-V121 HydrophobicContact SD-CB 4.44Å; M106-V121 HydrophobicContact SD-CG1 3.84Å; V121-V141 HydrophobicContact CG2-CG1 3.49Å; V121-V141 VanDerWaalsContact CG2-CG1 3.49Å; V121-A142 CarbonylContact C-O 3.57Å; V121-A142 VanDerWaalsContact CA-O 3.3Å; V121-A142 WeakPolarHBondContact CA-O 3.32Å; V121-V143 HydrophobicContact CG2-CG2 4.07Å |
| 122 | K | 96.2 | Very high | 88 | Confident | 61 Ų | 61 | 53.2 Ų | 53.2 | 27% | 0.265 | 27% | 0.272 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.9 | 137 | 178.3 | -172 | 172.8 | 176.7 | 177.4 | 0 | 111.8 | V141 A142 E231 | K122-V141 CarbonylContact O-C 3.58Å; K122-A142 PolarHBondContact N-O 3.43Å; K122-A142 PolarHBondContact O-N 2.96Å; K122-E231 WeakPolarHBondContact CE-OE1 3.31Å; K122-E231 IonicContact NZ-OE1 2.75Å; K122-E231 PolarHBondContact NZ-OE1 3.15Å; K122-E231 VanDerWaalsContact NZ-OE1 3.12Å; K122-E231 IonicContact NZ-OE2 3.06Å; K122-E231 PolarHBondContact NZ-OE2 3.08Å |
| 123 | S | 97.2 | Very high | 89.8 | Confident | 27 Ų | 27 | 44.5 Ų | 44.5 | 19% | 0.189 | 24% | 0.235 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 135.7 | 167.2 | 47.8 | 0 | 0 | 0 | 0 | 111 | E128 | S123-E128 WeakPolarHBondContact CB-OE2 3.47Å; S123-E128 WeakPolarHBondContact O-CG 3.36Å; S123-E128 VanDerWaalsContact OG-CD 3.27Å; S123-E128 PolarHBondContact OG-OE2 3.35Å |
| 124 | V | 97.5 | Very high | 91.2 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 24% | 0.235 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -138.7 | 177.8 | -173.9 | -63.2 | 0 | 0 | 0 | 0 | 112.2 | D140 A142 I195 T223 I224 T227 | V124-D140 HydrophobicContact CG2-CB 3.64Å; V124-D140 PolarHBondContact N-O 3.25Å; V124-A142 HydrophobicContact CG1-CB 3.96Å; V124-A142 HydrophobicContact CG2-CB 4.08Å; V124-I195 HydrophobicContact CG2-CD1 3.8Å; V124-I195 HydrophobicContact CG2-CG1 4.39Å; V124-T223 HydrophobicContact CB-CG2 4.25Å; V124-T223 HydrophobicContact CG2-CG2 4.03Å; V124-I224 HydrophobicContact CG1-CG1 4.37Å; V124-T227 HydrophobicContact CB-CG2 4.34Å; V124-T227 WeakPolarHBondContact CB-OG1 3.42Å; V124-T227 HydrophobicContact CG1-CG2 4.33Å |
| 125 | G | 95.9 | Very high | 92.2 | Very high | 7 Ų | 7 | 41 Ų | 41 | 7% | 0.072 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | 76.9 | -154 | 169.7 | 0 | 0 | 0 | 0 | 0 | 114 | F127 E128 K129 T227 | G125-F127 VanDerWaalsContact C-N 3.31Å; G125-F127 PolarHBondContact O-N 3.16Å; G125-E128 PolarHBondContact O-N 3.31Å; G125-K129 WeakPolarHBondContact O-CB 3.46Å; G125-K129 WeakPolarHBondContact O-CD 3.33Å; G125-K129 WeakPolarHBondContact O-CG 2.77Å; G125-K129 PolarHBondContact O-N 3.45Å; G125-T227 PolarHBondContact N-OG1 2.79Å |
| 126 | S | 95.7 | Very high | 93.2 | Very high | 35 Ų | 35 | 43.4 Ų | 43.4 | 25% | 0.245 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -69.1 | -29.3 | -170.4 | -65.1 | 0 | 0 | 0 | 0 | 113.2 | R130 T131 L132 K247 | S126-R130 PolarHBondContact O-N 2.87Å; S126-T131 PolarHBondContact O-N 2.81Å; S126-L132 PolarHBondContact O-N 2.98Å; S126-K247 PolarHBondContact OG-NZ 3.49Å |
| 127 | F | 95.7 | Very high | 94 | Very high | 32 Ų | 32 | 43.3 Ų | 43.3 | 14% | 0.14 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.4 | -57.6 | 174.3 | 174.5 | -98.7 | 0 | 0 | 0 | 110.2 | L91 V95 G125 K129 R130 L132 A139 | L91-F127 HydrophobicContact CD2-CD2 3.9Å; L91-F127 HydrophobicContact CD2-CE2 4.45Å; L91-F127 HydrophobicContact CG-CD2 4.16Å; L91-F127 HydrophobicContact CG-CE2 4.32Å; V95-F127 HydrophobicContact CB-CE1 4.21Å; V95-F127 HydrophobicContact CB-CZ 4.4Å; V95-F127 HydrophobicContact CG1-CD1 4.45Å; V95-F127 HydrophobicContact CG1-CE1 3.9Å; V95-F127 HydrophobicContact CG2-CD1 4.31Å; V95-F127 HydrophobicContact CG2-CE1 4.1Å; V95-F127 HydrophobicContact CG2-CZ 4.32Å; G125-F127 VanDerWaalsContact C-N 3.31Å; G125-F127 PolarHBondContact O-N 3.16Å; F127-K129 VanDerWaalsContact C-N 3.35Å; F127-K129 PolarHBondContact O-N 3.02Å; F127-R130 PolarHBondContact O-N 2.89Å; F127-L132 HydrophobicContact CB-CD1 4.02Å; F127-L132 HydrophobicContact CB-CD2 4.44Å; F127-L132 HydrophobicContact CB-CG 4.35Å; F127-L132 HydrophobicContact CD2-CD1 3.77Å; F127-L132 HydrophobicContact CG-CD1 4.38Å; F127-A139 HydrophobicContact CB-CB 3.64Å; F127-A139 HydrophobicContact CD1-CB 4.15Å; F127-A139 HydrophobicContact CD2-CB 4.16Å; F127-A139 HydrophobicContact CG-CB 3.72Å |
| 128 | E | 95.6 | Very high | 94.4 | Very high | 59 Ų | 59 | 44.6 Ų | 44.6 | 28% | 0.276 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.5 | -42.7 | -179 | -168.1 | 58.4 | -144.6 | 0 | 0 | 112.2 | S123 G125 R130 T227 E231 | S123-E128 WeakPolarHBondContact CB-OE2 3.47Å; S123-E128 WeakPolarHBondContact O-CG 3.36Å; S123-E128 VanDerWaalsContact OG-CD 3.27Å; S123-E128 PolarHBondContact OG-OE2 3.35Å; G125-E128 PolarHBondContact O-N 3.31Å; E128-R130 PolarHBondContact O-N 3.1Å; E128-R130 VanDerWaalsContact O-N 3.11Å; E128-T227 HydrophobicContact CB-CG2 3.96Å; E128-T227 HydrophobicContact CG-CG2 3.67Å; E128-E231 WeakPolarHBondContact CG-OE1 3.3Å |
| 129 | K | 96.2 | Very high | 94.6 | Very high | 11 Ų | 11 | 44 Ų | 44 | 5% | 0.048 | 25% | 0.248 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -7.7 | 178.4 | -64 | 173.1 | -173.6 | -179.9 | 0 | 113.6 | G125 F127 T131 F230 R240 E265 | G125-K129 WeakPolarHBondContact O-CB 3.46Å; G125-K129 WeakPolarHBondContact O-CD 3.33Å; G125-K129 WeakPolarHBondContact O-CG 2.77Å; G125-K129 PolarHBondContact O-N 3.45Å; F127-K129 VanDerWaalsContact C-N 3.35Å; F127-K129 PolarHBondContact O-N 3.02Å; K129-T131 VanDerWaalsContact C-N 3.31Å; K129-T131 HydrophobicContact CB-CG2 4.39Å; K129-T131 PolarHBondContact O-N 3.19Å; K129-F230 HydrophobicContact CB-CD1 3.69Å; K129-F230 HydrophobicContact CB-CE1 3.74Å; K129-F230 HydrophobicContact CB-CG 4.19Å; K129-F230 HydrophobicContact CB-CZ 4.28Å; K129-F230 HydrophobicContact CD-CB 4.03Å; K129-F230 HydrophobicContact CD-CD1 4.18Å; K129-F230 HydrophobicContact CD-CD2 4.01Å; K129-F230 HydrophobicContact CD-CG 3.8Å; K129-F230 HydrophobicContact CG-CB 3.99Å; K129-F230 HydrophobicContact CG-CD1 3.61Å; K129-F230 HydrophobicContact CG-CD2 4.36Å; K129-F230 HydrophobicContact CG-CE1 4.19Å; K129-F230 HydrophobicContact CG-CG 3.72Å; K129-F230 WeakPolarHBondContact O-CE1 3.44Å; K129-R240 PolarHBondContact O-NE 3.15Å; K129-E265 WeakPolarHBondContact CD-OE1 3.42Å; K129-E265 VanDerWaalsContact NZ-CD 3.29Å; K129-E265 IonicContact NZ-OE1 2.79Å; K129-E265 PolarHBondContact NZ-OE1 2.99Å; K129-E265 VanDerWaalsContact NZ-OE1 3.14Å; K129-E265 IonicContact NZ-OE2 3.17Å; K129-E265 PolarHBondContact NZ-OE2 3.09Å |
| 130 | R | 95 | Very high | 94.8 | Very high | 169 Ų | 169 | 43.4 Ų | 43.4 | 64% | 0.638 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56 | 42.1 | -174 | -54.3 | -177.7 | -177.6 | -177.7 | -0.4 | 112.8 | S126 F127 E128 R244 | S126-R130 PolarHBondContact O-N 2.87Å; F127-R130 PolarHBondContact O-N 2.89Å; E128-R130 PolarHBondContact O-N 3.1Å; E128-R130 VanDerWaalsContact O-N 3.11Å; R130-R244 PolarHBondContact O-NH1 2.91Å |
| 131 | T | 96 | Very high | 95 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.22 | C | C | . | . | trans | -122.4 | 25.8 | 178 | 63.2 | 0 | 0 | 0 | 0 | 112.6 | S126 K129 F230 R240 V243 K247 | S126-T131 PolarHBondContact O-N 2.81Å; K129-T131 VanDerWaalsContact C-N 3.31Å; K129-T131 HydrophobicContact CB-CG2 4.39Å; K129-T131 PolarHBondContact O-N 3.19Å; T131-F230 HydrophobicContact CG2-CZ 4.03Å; T131-R240 HydrophobicContact CG2-CB 4.18Å; T131-R240 HydrophobicContact CG2-CG 4.13Å; T131-V243 HydrophobicContact CG2-CB 4.17Å; T131-V243 HydrophobicContact CG2-CG1 3.87Å; T131-K247 PolarHBondContact O-NZ 3.26Å; T131-K247 PolarHBondContact OG1-NZ 3.31Å | ||
| 132 | L | 95 | Very high | 95 | Very high | 19 Ų | 19 | 39.2 Ų | 39.2 | 10% | 0.099 | 22% | 0.215 | C | C | . | . | trans | -60.9 | 150.3 | 168.3 | -70.5 | 174.6 | 0 | 0 | 0 | 111.3 | P83 L91 S126 F127 V138 R244 | P83-L132 HydrophobicContact CG-CB 3.86Å; L91-L132 HydrophobicContact CD2-CD1 3.84Å; S126-L132 PolarHBondContact O-N 2.98Å; F127-L132 HydrophobicContact CB-CD1 4.02Å; F127-L132 HydrophobicContact CB-CD2 4.44Å; F127-L132 HydrophobicContact CB-CG 4.35Å; F127-L132 HydrophobicContact CD2-CD1 3.77Å; F127-L132 HydrophobicContact CG-CD1 4.38Å; L132-V138 WeakPolarHBondContact CD2-O 3.38Å; L132-R244 WeakPolarHBondContact O-CD 3.46Å | ||
| 133 | I | 94.1 | Very high | 95.1 | Very high | 20 Ų | 20 | 36.3 Ų | 36.3 | 10% | 0.103 | 20% | 0.203 | C | C | . | . | trans | -120.7 | 145.5 | 178.2 | -60.7 | 170.2 | 0 | 0 | 0 | 108 | L81 K136 R244 K247 | L81-I133 HydrophobicContact CB-CG2 4.38Å; L81-I133 HydrophobicContact CD2-CG2 3.96Å; L81-I133 CarbonylContact O-C 3.56Å; L81-I133 VanDerWaalsContact O-CA 3.3Å; L81-I133 WeakPolarHBondContact O-CA 3.46Å; I133-K136 PolarHBondContact O-N 2.82Å; I133-R244 HydrophobicContact CG1-CG 4.3Å; I133-K247 HydrophobicContact CD1-CB 3.31Å; I133-K247 HydrophobicContact CD1-CD 3.89Å; I133-K247 HydrophobicContact CD1-CG 4.24Å | ||
| 134 | T | 92.9 | Very high | 95 | Very high | 69 Ų | 69 | 35.7 Ų | 35.7 | 42% | 0.423 | 20% | 0.198 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -49.4 | 144.8 | 176 | -168.7 | 0 | 0 | 0 | 0 | 112.2 | L81 K136 | L81-T134 PolarHBondContact O-N 3.24Å; T134-K136 VanDerWaalsContact C-N 3.27Å; T134-K136 PolarHBondContact O-N 3.14Å |
| 135 | G | 88.1 | Confident | 94.8 | Very high | 77 Ų | 77 | 35.8 Ų | 35.8 | 79% | 0.794 | 20% | 0.198 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 79 | -4.7 | -174.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 136 | K | 87.5 | Confident | 94.7 | Very high | 136 Ų | 136 | 43 Ų | 43 | 59% | 0.591 | 22% | 0.223 | S | C | * | . | trans | -116.3 | 87.1 | 176.4 | -62.9 | -175.1 | -179.8 | -179.1 | 0 | 111.8 | I133 T134 V138 | I133-K136 PolarHBondContact O-N 2.82Å; T134-K136 VanDerWaalsContact C-N 3.27Å; T134-K136 PolarHBondContact O-N 3.14Å; K136-V138 PolarHBondContact O-N 3.27Å; K136-V138 VanDerWaalsContact O-N 3.09Å | ||
| 137 | S | 91.1 | Very high | 94.4 | Very high | 33 Ų | 33 | 41.9 Ų | 41.9 | 23% | 0.231 | 22% | 0.217 | C | C | . | . | trans | -84.3 | 53.4 | 175.1 | -55.4 | 0 | 0 | 0 | 0 | 112.3 | S87 M189 T191 | S87-S137 PolarHBondContact OG-OG 2.9Å; S87-S137 VanDerWaalsContact OG-OG 3.13Å; S137-M189 VanDerWaalsContact CB-O 3.29Å; S137-M189 WeakPolarHBondContact CB-O 3.33Å; S137-T191 PolarHBondContact O-N 3.18Å | ||
| 138 | V | 94.8 | Very high | 94.2 | Very high | 51 Ų | 51 | 41.6 Ų | 41.6 | 31% | 0.309 | 22% | 0.217 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 127.2 | -177 | -172.9 | 0 | 0 | 0 | 0 | 110.6 | L132 K136 T191 R193 | L132-V138 WeakPolarHBondContact CD2-O 3.38Å; K136-V138 PolarHBondContact O-N 3.27Å; K136-V138 VanDerWaalsContact O-N 3.09Å; V138-T191 VanDerWaalsContact CA-O 3.3Å; V138-T191 WeakPolarHBondContact CA-O 3.35Å; V138-R193 HydrophobicContact CG1-CG 3.71Å |
| 139 | A | 97.1 | Very high | 94 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 158 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | L91 V95 F127 T191 V192 R193 | L91-A139 HydrophobicContact CD1-CB 3.69Å; L91-A139 HydrophobicContact CD2-CB 4.05Å; L91-A139 HydrophobicContact CG-CB 3.92Å; V95-A139 HydrophobicContact CG2-CB 3.33Å; F127-A139 HydrophobicContact CB-CB 3.64Å; F127-A139 HydrophobicContact CD1-CB 4.15Å; F127-A139 HydrophobicContact CD2-CB 4.16Å; F127-A139 HydrophobicContact CG-CB 3.72Å; A139-T191 PolarHBondContact N-O 2.81Å; A139-V192 CarbonylContact O-C 3.59Å; A139-V192 WeakPolarHBondContact O-CA 3.47Å; A139-R193 PolarHBondContact O-N 2.83Å |
| 140 | D | 97.7 | Very high | 93.8 | Very high | 17 Ų | 17 | 39.9 Ų | 39.9 | 9% | 0.091 | 21% | 0.213 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 134.9 | -179.4 | -58.5 | -34.1 | 0 | 0 | 0 | 109.3 | V124 R193 | V124-D140 HydrophobicContact CG2-CB 3.64Å; V124-D140 PolarHBondContact N-O 3.25Å; D140-R193 CarbonylContact C-O 3.49Å; D140-R193 VanDerWaalsContact CA-O 3.32Å; D140-R193 WeakPolarHBondContact CA-O 3.39Å; D140-R193 IonicContact OD1-CZ 3.23Å; D140-R193 IonicContact OD1-NE 3.05Å; D140-R193 PolarHBondContact OD1-NE 3.08Å; D140-R193 IonicContact OD1-NH2 3.35Å; D140-R193 PolarHBondContact OD1-NH2 3.21Å; D140-R193 IonicContact OD2-CZ 2.72Å; D140-R193 IonicContact OD2-NH2 3.12Å; D140-R193 PolarHBondContact OD2-NH2 3.29Å |
| 141 | V | 98.2 | Very high | 93.4 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 21% | 0.211 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 125.1 | 173 | 175.1 | 0 | 0 | 0 | 0 | 107.7 | V95 V99 I102 V121 K122 V192 R193 V194 I195 | V95-V141 HydrophobicContact CG1-CG2 4.04Å; V99-V141 HydrophobicContact CG2-CG1 4.07Å; V99-V141 HydrophobicContact CG2-CG2 4.18Å; I102-V141 HydrophobicContact CD1-CG1 4.41Å; V121-V141 HydrophobicContact CG2-CG1 3.49Å; V121-V141 VanDerWaalsContact CG2-CG1 3.49Å; K122-V141 CarbonylContact O-C 3.58Å; V141-V192 HydrophobicContact CB-CG1 4.23Å; V141-V192 HydrophobicContact CG2-CG1 3.68Å; V141-R193 PolarHBondContact N-O 3.02Å; V141-V194 CarbonylContact O-C 3.56Å; V141-V194 WeakPolarHBondContact O-CA 3.16Å; V141-I195 PolarHBondContact O-N 2.87Å |
| 142 | A | 97.7 | Very high | 93 | Very high | 1 Ų | 1 | 43.2 Ų | 43.2 | 1% | 0.008 | 25% | 0.248 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -93.7 | 131.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | V121 K122 V124 I195 I224 | V121-A142 CarbonylContact C-O 3.57Å; V121-A142 VanDerWaalsContact CA-O 3.3Å; V121-A142 WeakPolarHBondContact CA-O 3.32Å; K122-A142 PolarHBondContact N-O 3.43Å; K122-A142 PolarHBondContact O-N 2.96Å; V124-A142 HydrophobicContact CG1-CB 3.96Å; V124-A142 HydrophobicContact CG2-CB 4.08Å; A142-I195 WeakPolarHBondContact CA-O 3.36Å; A142-I195 HydrophobicContact CB-CD1 3.92Å; A142-I195 HydrophobicContact CB-CG1 3.6Å; A142-I224 HydrophobicContact CB-CD1 3.76Å; A142-I224 HydrophobicContact CB-CG1 3.58Å |
| 143 | V | 97 | Very high | 92.8 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 124.8 | 173.2 | -178.8 | 0 | 0 | 0 | 0 | 108.1 | I102 I118 V121 F145 V194 I195 C197 | I102-V143 HydrophobicContact CD1-CG2 3.71Å; I102-V143 HydrophobicContact CG2-CG1 4.48Å; I102-V143 HydrophobicContact CG2-CG2 4.17Å; I118-V143 HydrophobicContact CD1-CG1 4.39Å; I118-V143 HydrophobicContact CG1-CG1 4.36Å; I118-V143 HydrophobicContact CG2-CG1 3.86Å; V121-V143 HydrophobicContact CG2-CG2 4.07Å; V143-F145 HydrophobicContact CG1-CD2 4.46Å; V143-F145 HydrophobicContact CG1-CE1 4.26Å; V143-F145 HydrophobicContact CG1-CE2 4.01Å; V143-F145 HydrophobicContact CG1-CZ 3.9Å; V143-V194 HydrophobicContact CB-CG1 4.33Å; V143-V194 HydrophobicContact CG2-CG1 3.48Å; V143-V194 VanDerWaalsContact CG2-CG1 3.48Å; V143-I195 PolarHBondContact N-O 3.33Å; V143-C197 PolarHBondContact O-N 3.32Å |
| 144 | V | 95.8 | Very high | 92.8 | Very high | 14 Ų | 14 | 42.3 Ų | 42.3 | 9% | 0.085 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.3 | 116.3 | 177.2 | -175.1 | 0 | 0 | 0 | 0 | 108.3 | A119 T120 C197 L199 I224 | A119-V144 WeakPolarHBondContact CA-O 3.22Å; A119-V144 HydrophobicContact CB-CB 4.35Å; A119-V144 HydrophobicContact CB-CG1 4.19Å; A119-V144 WeakPolarHBondContact CB-O 3.48Å; A119-V144 PolarHBondContact N-O 2.86Å; T120-V144 HydrophobicContact CG2-CB 3.67Å; T120-V144 HydrophobicContact CG2-CG2 3.52Å; T120-V144 PolarHBondContact N-O 3.39Å; T120-V144 PolarHBondContact O-N 3.13Å; V144-C197 HydrophobicContact CB-CB 4.38Å; V144-C197 HydrophobicContact CG1-CB 4.5Å; V144-C197 HydrophobicContact CG2-CB 3.93Å; V144-L199 HydrophobicContact CG1-CD2 4Å; V144-I224 HydrophobicContact CG2-CD1 3.6Å |
| 145 | F | 94.3 | Very high | 92.7 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 0% | 0.004 | 24% | 0.238 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -85.1 | 146.9 | 172.6 | -66.3 | -77.2 | 0 | 0 | 0 | 111.4 | L116 A117 I118 V143 P149 F157 V196 C197 T198 L199 | L116-F145 HydrophobicContact CB-CD1 4.42Å; L116-F145 HydrophobicContact CB-CE1 4.21Å; L116-F145 HydrophobicContact CD2-CD1 3.97Å; L116-F145 HydrophobicContact CD2-CE1 3.46Å; L116-F145 VanDerWaalsContact CD2-CE1 3.46Å; L116-F145 HydrophobicContact CD2-CE2 4.43Å; L116-F145 HydrophobicContact CD2-CZ 3.72Å; L116-F145 HydrophobicContact CG-CE1 4.45Å; L116-F145 WeakPolarHBondContact O-CD1 3.46Å; L116-F145 WeakPolarHBondContact O-CE1 3.42Å; A117-F145 CarbonylContact O-C 3.42Å; A117-F145 WeakPolarHBondContact O-CA 3.35Å; I118-F145 HydrophobicContact CD1-CE1 4.45Å; I118-F145 HydrophobicContact CG1-CD1 4.02Å; I118-F145 HydrophobicContact CG1-CE1 3.77Å; V143-F145 HydrophobicContact CG1-CD2 4.46Å; V143-F145 HydrophobicContact CG1-CE1 4.26Å; V143-F145 HydrophobicContact CG1-CE2 4.01Å; V143-F145 HydrophobicContact CG1-CZ 3.9Å; F145-P149 HydrophobicContact CD2-CB 3.97Å; F145-P149 HydrophobicContact CD2-CG 4.47Å; F145-P149 HydrophobicContact CE2-CB 4.43Å; F145-F157 HydrophobicContact CE1-CD1 4.5Å; F145-F157 HydrophobicContact CE1-CE1 4.36Å; F145-F157 AromaticContact CZ-CD1 3.83Å; F145-F157 HydrophobicContact CZ-CD1 3.83Å; F145-F157 AromaticContact CZ-CE1 3.84Å; F145-F157 HydrophobicContact CZ-CE1 3.84Å; F145-F157 HydrophobicContact CZ-CG 4.46Å; F145-V196 HydrophobicContact CD2-CG1 3.76Å; F145-V196 HydrophobicContact CE2-CB 4.49Å; F145-V196 HydrophobicContact CE2-CG1 3.69Å; F145-V196 HydrophobicContact CE2-CG2 4.18Å; F145-C197 PolarHBondContact N-O 2.97Å; F145-T198 WeakPolarHBondContact O-CA 3.41Å; F145-T198 PolarHBondContact O-OG1 3.2Å; F145-L199 PolarHBondContact O-N 2.98Å |
| 146 | R | 92.2 | Very high | 92.9 | Very high | 159 Ų | 159 | 40.4 Ų | 40.4 | 60% | 0.6 | 22% | 0.222 | S | C | * | . | S | Bend | trans | -74.6 | -32.8 | 170.2 | -64.1 | -176.2 | -176.5 | -169.5 | 1.3 | 111.3 | A117 A119 L199 N202 | A117-R146 HydrophobicContact CB-CB 4.22Å; A117-R146 HydrophobicContact CB-CG 4.45Å; A117-R146 WeakPolarHBondContact O-CB 3.43Å; A117-R146 PolarHBondContact O-N 3.24Å; A119-R146 HydrophobicContact CB-CG 3.75Å; R146-L199 HydrophobicContact CB-CD1 4.39Å; R146-L199 HydrophobicContact CG-CD1 4.46Å; R146-N202 PolarHBondContact O-ND2 3.09Å |
| 147 | G | 90.5 | Very high | 93.2 | Very high | 11 Ų | 11 | 34.5 Ų | 34.5 | 11% | 0.113 | 20% | 0.197 | C | C | . | . | S | Bend | trans | -89.9 | -170.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | D115 T198 N202 | D115-G147 WeakPolarHBondContact O-CA 3.45Å; G147-T198 PolarHBondContact O-OG1 3.11Å; G147-N202 PolarHBondContact O-ND2 3.14Å |
| 148 | L | 91.4 | Very high | 93.3 | Very high | 26 Ų | 26 | 33 Ų | 33 | 14% | 0.136 | 19% | 0.186 | C | C | . | . | trans | -96.5 | 114.9 | 177.9 | -72.3 | 166.7 | 0 | 0 | 0 | 109.7 | S150 N202 K205 V206 H211 | L148-S150 PolarHBondContact O-N 3.13Å; L148-N202 HydrophobicContact CD2-CB 3.76Å; L148-N202 HydrophobicContact CG-CB 4.4Å; L148-K205 HydrophobicContact CD1-CB 3.88Å; L148-K205 WeakPolarHBondContact CD1-O 3.39Å; L148-V206 HydrophobicContact CD2-CB 4.5Å; L148-V206 HydrophobicContact CD2-CG2 3.68Å; L148-H211 VanDerWaalsContact CB-CD2 3.45Å; L148-H211 WeakPolarHBondContact CB-CD2 3.48Å; L148-H211 WeakPolarHBondContact CB-NE2 3.32Å | ||
| 149 | P | 91.2 | Very high | 93.3 | Very high | 1 Ų | 1 | 34.2 Ų | 34.2 | 1% | 0.006 | 19% | 0.191 | C | C | . | . | trans | -78.3 | 115.8 | -173.1 | 31.6 | -35.5 | 0 | 0 | 0 | 111.2 | F145 I154 V196 M212 L217 | F145-P149 HydrophobicContact CD2-CB 3.97Å; F145-P149 HydrophobicContact CD2-CG 4.47Å; F145-P149 HydrophobicContact CE2-CB 4.43Å; P149-I154 HydrophobicContact CB-CD1 3.98Å; P149-I154 HydrophobicContact CB-CG1 4.01Å; P149-V196 HydrophobicContact CB-CG1 3.65Å; P149-V196 HydrophobicContact CG-CG1 3.63Å; P149-M212 PolarHBondContact O-N 2.98Å; P149-M212 VanDerWaalsContact O-N 3.16Å; P149-L217 HydrophobicContact CG-CD2 3.89Å | ||
| 150 | S | 91.1 | Very high | 93.1 | Very high | 34 Ų | 34 | 36.6 Ų | 36.6 | 24% | 0.238 | 21% | 0.207 | C | C | . | . | B | Isolated β-bridge | trans | -82.5 | 155.1 | 171.6 | 75.4 | 0 | 0 | 0 | 0 | 111.9 | L148 E152 A153 I154 Y210 | L148-S150 PolarHBondContact O-N 3.13Å; S150-E152 VanDerWaalsContact C-N 3.29Å; S150-E152 PolarHBondContact O-N 2.9Å; S150-A153 PolarHBondContact O-N 3.01Å; S150-A153 WeakPolarHBondContact OG-CB 3.43Å; S150-A153 PolarHBondContact OG-N 3.09Å; S150-I154 WeakPolarHBondContact O-CD1 3.2Å; S150-I154 WeakPolarHBondContact O-CG1 3.19Å; S150-I154 PolarHBondContact O-N 2.89Å; S150-Y210 VanDerWaalsContact CA-O 3.24Å; S150-Y210 WeakPolarHBondContact CA-O 3.43Å; S150-Y210 WeakPolarHBondContact CB-O 3.42Å |
| 151 | A | 87.2 | Confident | 93 | Very high | 72 Ų | 72 | 35.8 Ų | 35.8 | 60% | 0.595 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -60.8 | -38.7 | -179 | 0 | 0 | 0 | 0 | 0 | 112.6 | S155 | A151-S155 PolarHBondContact O-N 2.75Å; A151-S155 VanDerWaalsContact O-N 3.1Å |
| 152 | E | 88.9 | Confident | 92.8 | Very high | 166 Ų | 166 | 36 Ų | 36 | 78% | 0.776 | 21% | 0.205 | S | C | * | . | H | α-helix | trans | -67.5 | -44.9 | 177.5 | -64.2 | -178.1 | 176.1 | 0 | 0 | 111.6 | S150 I154 S155 S156 | S150-E152 VanDerWaalsContact C-N 3.29Å; S150-E152 PolarHBondContact O-N 2.9Å; E152-I154 VanDerWaalsContact C-N 3.34Å; E152-I154 PolarHBondContact O-N 3.03Å; E152-S155 PolarHBondContact O-N 2.82Å; E152-S156 WeakPolarHBondContact O-CB 3.33Å; E152-S156 PolarHBondContact O-N 2.81Å |
| 153 | A | 90.5 | Very high | 92.6 | Very high | 14 Ų | 14 | 39 Ų | 39 | 12% | 0.116 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.5 | -42.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L116 S150 F157 | L116-A153 HydrophobicContact CD1-CB 3.91Å; L116-A153 HydrophobicContact CD2-CB 3.92Å; L116-A153 HydrophobicContact CG-CB 3.99Å; S150-A153 PolarHBondContact O-N 3.01Å; S150-A153 WeakPolarHBondContact OG-CB 3.43Å; S150-A153 PolarHBondContact OG-N 3.09Å; A153-F157 WeakPolarHBondContact O-CB 3.39Å; A153-F157 PolarHBondContact O-N 2.89Å |
| 154 | I | 92.5 | Very high | 92.4 | Very high | 6 Ų | 6 | 41.6 Ų | 41.6 | 3% | 0.031 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.9 | -45.4 | 175.9 | -66.7 | 163.7 | 0 | 0 | 0 | 111.3 | P149 S150 E152 F157 G158 F183 V196 M212 | P149-I154 HydrophobicContact CB-CD1 3.98Å; P149-I154 HydrophobicContact CB-CG1 4.01Å; S150-I154 WeakPolarHBondContact O-CD1 3.2Å; S150-I154 WeakPolarHBondContact O-CG1 3.19Å; S150-I154 PolarHBondContact O-N 2.89Å; E152-I154 VanDerWaalsContact C-N 3.34Å; E152-I154 PolarHBondContact O-N 3.03Å; I154-F157 PolarHBondContact O-N 3.3Å; I154-G158 PolarHBondContact O-N 2.97Å; I154-F183 HydrophobicContact CG2-CD1 3.7Å; I154-F183 HydrophobicContact CG2-CE1 4.41Å; I154-V196 HydrophobicContact CD1-CB 4.37Å; I154-V196 HydrophobicContact CD1-CG1 3.98Å; I154-V196 HydrophobicContact CD1-CG2 4.33Å; I154-V196 HydrophobicContact CG1-CG1 4.19Å; I154-V196 HydrophobicContact CG1-CG2 4.18Å; I154-V196 HydrophobicContact CG2-CG2 4.02Å; I154-M212 HydrophobicContact CD1-CE 3.48Å; I154-M212 VanDerWaalsContact CD1-CE 3.48Å |
| 155 | S | 92.2 | Very high | 92.3 | Very high | 39 Ų | 39 | 40.9 Ų | 40.9 | 27% | 0.273 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.6 | -47.4 | 179.8 | -175.8 | 0 | 0 | 0 | 0 | 111.8 | A151 E152 F157 G158 N159 T178 | A151-S155 PolarHBondContact O-N 2.75Å; A151-S155 VanDerWaalsContact O-N 3.1Å; E152-S155 PolarHBondContact O-N 2.82Å; S155-F157 PolarHBondContact O-N 3.4Å; S155-G158 PolarHBondContact O-N 2.72Å; S155-N159 PolarHBondContact O-N 3.18Å; S155-N159 VanDerWaalsContact O-N 3.09Å; S155-N159 PolarHBondContact O-ND2 2.68Å; S155-T178 WeakPolarHBondContact OG-CG2 3.24Å |
| 156 | S | 92.1 | Very high | 92.2 | Very high | 67 Ų | 67 | 44.5 Ų | 44.5 | 47% | 0.469 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -59.1 | -48.1 | 176.1 | -176 | 0 | 0 | 0 | 0 | 111.2 | E152 G158 N159 C160 | E152-S156 WeakPolarHBondContact O-CB 3.33Å; E152-S156 PolarHBondContact O-N 2.81Å; S156-G158 VanDerWaalsContact C-N 3.35Å; S156-G158 PolarHBondContact O-N 3.07Å; S156-N159 PolarHBondContact O-N 3.35Å; S156-C160 PolarHBondContact O-N 2.86Å; S156-C160 PolarHBondContact O-SG 3.27Å |
| 157 | F | 93.1 | Very high | 92.2 | Very high | 13 Ų | 13 | 44.2 Ų | 44.2 | 6% | 0.057 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.8 | -42.3 | 177.9 | -176.6 | -115.1 | 0 | 0 | 0 | 112.6 | I102 Y105 L116 I118 F145 A153 I154 S155 C160 I161 F183 | I102-F157 HydrophobicContact CG1-CZ 4.42Å; Y105-F157 HydrophobicContact CD2-CE2 4.07Å; Y105-F157 HydrophobicContact CE2-CE2 4.44Å; Y105-F157 HydrophobicContact CG-CE2 4.11Å; L116-F157 HydrophobicContact CD1-CB 4.44Å; I118-F157 HydrophobicContact CD1-CE1 4.36Å; I118-F157 HydrophobicContact CD1-CE2 3.95Å; I118-F157 HydrophobicContact CD1-CZ 3.45Å; I118-F157 VanDerWaalsContact CD1-CZ 3.45Å; I118-F157 HydrophobicContact CG1-CZ 4.49Å; F145-F157 HydrophobicContact CE1-CD1 4.5Å; F145-F157 HydrophobicContact CE1-CE1 4.36Å; F145-F157 AromaticContact CZ-CD1 3.83Å; F145-F157 HydrophobicContact CZ-CD1 3.83Å; F145-F157 AromaticContact CZ-CE1 3.84Å; F145-F157 HydrophobicContact CZ-CE1 3.84Å; F145-F157 HydrophobicContact CZ-CG 4.46Å; A153-F157 WeakPolarHBondContact O-CB 3.39Å; A153-F157 PolarHBondContact O-N 2.89Å; I154-F157 PolarHBondContact O-N 3.3Å; S155-F157 PolarHBondContact O-N 3.4Å; F157-C160 WeakPolarHBondContact O-CB 3.32Å; F157-C160 PolarHBondContact O-N 3.18Å; F157-I161 HydrophobicContact CD1-CD1 3.74Å; F157-I161 HydrophobicContact CE1-CD1 3.33Å; F157-I161 HydrophobicContact CE1-CG1 4.39Å; F157-I161 HydrophobicContact CE2-CD1 4.19Å; F157-I161 HydrophobicContact CE2-CG1 4.44Å; F157-I161 HydrophobicContact CG-CD1 4.33Å; F157-I161 HydrophobicContact CZ-CD1 3.57Å; F157-I161 HydrophobicContact CZ-CG1 4.23Å; F157-I161 WeakPolarHBondContact O-CG1 3.49Å; F157-I161 PolarHBondContact O-N 3.04Å; F157-F183 AromaticContact CD1-CE1 3.92Å; F157-F183 HydrophobicContact CD1-CE1 3.92Å; F157-F183 AromaticContact CD1-CZ 3.96Å; F157-F183 HydrophobicContact CD1-CZ 3.96Å; F157-F183 HydrophobicContact CE1-CE1 4.42Å; F157-F183 HydrophobicContact CE1-CZ 4.18Å |
| 158 | G | 94.8 | Very high | 92 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | I154 S155 S156 I161 A162 C176 | I154-G158 PolarHBondContact O-N 2.97Å; S155-G158 PolarHBondContact O-N 2.72Å; S156-G158 VanDerWaalsContact C-N 3.35Å; S156-G158 PolarHBondContact O-N 3.07Å; G158-I161 PolarHBondContact O-N 2.98Å; G158-A162 PolarHBondContact O-N 3.13Å; G158-C176 VanDerWaalsContact CA-SG 3.55Å |
| 159 | N | 94.5 | Very high | 91.7 | Very high | 77 Ų | 77 | 50.2 Ų | 50.2 | 41% | 0.412 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -66.1 | -39 | 175.9 | -69.7 | -34.2 | 0 | 0 | 0 | 112.1 | S155 S156 A162 S163 C176 | S155-N159 PolarHBondContact O-N 3.18Å; S155-N159 VanDerWaalsContact O-N 3.09Å; S155-N159 PolarHBondContact O-ND2 2.68Å; S156-N159 PolarHBondContact O-N 3.35Å; N159-A162 PolarHBondContact O-N 3.45Å; N159-S163 WeakPolarHBondContact O-CB 3.39Å; N159-S163 PolarHBondContact O-N 3.17Å; N159-S163 PolarHBondContact O-OG 3.24Å; N159-C176 WeakPolarHBondContact OD1-CB 3.3Å |
| 160 | C | 93.2 | Very high | 91.2 | Very high | 50 Ų | 50 | 55 Ų | 55 | 34% | 0.338 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.8 | -42.1 | 173.7 | -73.7 | 0 | 0 | 0 | 0 | 111.9 | Y105 S156 F157 S163 K164 | Y105-C160 WeakPolarHBondContact OH-CB 3.16Å; S156-C160 PolarHBondContact O-N 2.86Å; S156-C160 PolarHBondContact O-SG 3.27Å; F157-C160 WeakPolarHBondContact O-CB 3.32Å; F157-C160 PolarHBondContact O-N 3.18Å; C160-S163 PolarHBondContact O-N 3.18Å; C160-K164 PolarHBondContact O-N 2.65Å |
| 161 | I | 93.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.6 | -48.3 | 174.5 | -71.7 | 163.5 | 0 | 0 | 0 | 111.1 | V101 I102 Y105 F157 G158 S163 K164 I165 F183 I185 | V101-I161 HydrophobicContact CG1-CB 4.42Å; V101-I161 HydrophobicContact CG1-CG1 4.19Å; V101-I161 HydrophobicContact CG1-CG2 4.22Å; I102-I161 HydrophobicContact CD1-CD1 4.21Å; I102-I161 HydrophobicContact CG1-CD1 3.77Å; I102-I161 HydrophobicContact CG1-CG1 4.37Å; Y105-I161 HydrophobicContact CE2-CG1 4.3Å; F157-I161 HydrophobicContact CD1-CD1 3.74Å; F157-I161 HydrophobicContact CE1-CD1 3.33Å; F157-I161 HydrophobicContact CE1-CG1 4.39Å; F157-I161 HydrophobicContact CE2-CD1 4.19Å; F157-I161 HydrophobicContact CE2-CG1 4.44Å; F157-I161 HydrophobicContact CG-CD1 4.33Å; F157-I161 HydrophobicContact CZ-CD1 3.57Å; F157-I161 HydrophobicContact CZ-CG1 4.23Å; F157-I161 WeakPolarHBondContact O-CG1 3.49Å; F157-I161 PolarHBondContact O-N 3.04Å; G158-I161 PolarHBondContact O-N 2.98Å; I161-S163 VanDerWaalsContact C-N 3.29Å; I161-S163 PolarHBondContact O-N 3.39Å; I161-K164 PolarHBondContact O-N 3.14Å; I161-I165 HydrophobicContact CG2-CD1 3.71Å; I161-I165 HydrophobicContact CG2-CG1 4.33Å; I161-I165 VanDerWaalsContact O-CG1 3.28Å; I161-I165 WeakPolarHBondContact O-CG1 3.44Å; I161-I165 PolarHBondContact O-N 3.22Å; I161-F183 HydrophobicContact CD1-CE2 3.83Å; I161-F183 HydrophobicContact CD1-CZ 3.49Å; I161-F183 VanDerWaalsContact CD1-CZ 3.49Å; I161-I185 HydrophobicContact CB-CD1 4.47Å; I161-I185 HydrophobicContact CG2-CD1 4.03Å; I161-I185 HydrophobicContact CG2-CG1 4.27Å |
| 162 | A | 94.5 | Very high | 90.4 | Very high | 6 Ų | 6 | 61.8 Ų | 61.8 | 5% | 0.05 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.7 | -43 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | G158 N159 I165 M166 V174 C176 I185 | G158-A162 PolarHBondContact O-N 3.13Å; N159-A162 PolarHBondContact O-N 3.45Å; A162-I165 PolarHBondContact O-N 3.29Å; A162-M166 WeakPolarHBondContact O-CG 3.47Å; A162-M166 PolarHBondContact O-N 3.33Å; A162-M166 VanDerWaalsContact O-N 3.14Å; A162-V174 HydrophobicContact CB-CG2 4.35Å; A162-C176 HydrophobicContact CB-CB 4.03Å; A162-I185 HydrophobicContact CB-CD1 4.25Å |
| 163 | S | 93.5 | Very high | 90.3 | Very high | 63 Ų | 63 | 59.8 Ų | 59.8 | 44% | 0.441 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.1 | -48.1 | 177.6 | -54.3 | 0 | 0 | 0 | 0 | 111.7 | N159 C160 I161 I165 M166 E167 | N159-S163 WeakPolarHBondContact O-CB 3.39Å; N159-S163 PolarHBondContact O-N 3.17Å; N159-S163 PolarHBondContact O-OG 3.24Å; C160-S163 PolarHBondContact O-N 3.18Å; I161-S163 VanDerWaalsContact C-N 3.29Å; I161-S163 PolarHBondContact O-N 3.39Å; S163-I165 VanDerWaalsContact C-N 3.3Å; S163-I165 PolarHBondContact O-N 3.41Å; S163-M166 PolarHBondContact O-N 3.02Å; S163-M166 VanDerWaalsContact O-N 3.17Å; S163-E167 WeakPolarHBondContact O-CG 3.42Å; S163-E167 PolarHBondContact O-N 2.86Å |
| 164 | K | 93.2 | Very high | 90.5 | Very high | 54 Ų | 54 | 59.1 Ų | 59.1 | 24% | 0.235 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -61.7 | -35.8 | 176.2 | -79.4 | -164.9 | 178.3 | 174.1 | 0 | 112.7 | V101 Y105 C160 I161 E167 F168 | V101-K164 HydrophobicContact CG1-CB 3.8Å; V101-K164 HydrophobicContact CG1-CD 4.09Å; V101-K164 HydrophobicContact CG2-CB 4.41Å; Y105-K164 HydrophobicContact CE2-CD 3.58Å; Y105-K164 VanDerWaalsContact OH-CD 3.29Å; Y105-K164 WeakPolarHBondContact OH-CD 3.23Å; Y105-K164 WeakPolarHBondContact OH-CE 3.48Å; Y105-K164 PolarHBondContact OH-NZ 3.09Å; C160-K164 PolarHBondContact O-N 2.65Å; I161-K164 PolarHBondContact O-N 3.14Å; K164-E167 WeakPolarHBondContact O-CB 3.45Å; K164-E167 PolarHBondContact O-N 3.48Å; K164-F168 WeakPolarHBondContact O-CD2 3.41Å; K164-F168 PolarHBondContact O-N 2.99Å |
| 165 | I | 93.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.2 | -44.6 | 175.7 | -70.9 | 169 | 0 | 0 | 0 | 110.6 | L97 V98 V101 I161 A162 S163 E167 F168 D169 V174 I185 | L97-I165 HydrophobicContact CD1-CG2 4.29Å; V98-I165 HydrophobicContact CG2-CD1 3.7Å; V101-I165 HydrophobicContact CG2-CG1 3.9Å; I161-I165 HydrophobicContact CG2-CD1 3.71Å; I161-I165 HydrophobicContact CG2-CG1 4.33Å; I161-I165 VanDerWaalsContact O-CG1 3.28Å; I161-I165 WeakPolarHBondContact O-CG1 3.44Å; I161-I165 PolarHBondContact O-N 3.22Å; A162-I165 PolarHBondContact O-N 3.29Å; S163-I165 VanDerWaalsContact C-N 3.3Å; S163-I165 PolarHBondContact O-N 3.41Å; I165-E167 VanDerWaalsContact C-N 3.28Å; I165-E167 PolarHBondContact O-N 3.43Å; I165-F168 PolarHBondContact O-N 3.2Å; I165-D169 PolarHBondContact O-N 3.41Å; I165-V174 HydrophobicContact CB-CG2 4Å; I165-V174 HydrophobicContact CG2-CG1 4.25Å; I165-V174 HydrophobicContact CG2-CG2 3.73Å; I165-I185 HydrophobicContact CD1-CG2 4Å |
| 166 | M | 92.5 | Very high | 90.7 | Very high | 76 Ų | 76 | 61.4 Ų | 61.4 | 37% | 0.374 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65 | -31.3 | 176 | -65.6 | -175.3 | -166.9 | 0 | 0 | 112.9 | A162 S163 D169 S170 V174 | A162-M166 WeakPolarHBondContact O-CG 3.47Å; A162-M166 PolarHBondContact O-N 3.33Å; A162-M166 VanDerWaalsContact O-N 3.14Å; S163-M166 PolarHBondContact O-N 3.02Å; S163-M166 VanDerWaalsContact O-N 3.17Å; M166-D169 CarbonylContact O-C 3.04Å; M166-S170 WeakPolarHBondContact O-CA 3.42Å; M166-S170 PolarHBondContact O-N 3.43Å; M166-V174 HydrophobicContact CE-CG2 4.17Å; M166-V174 WeakPolarHBondContact CE-O 3.37Å; M166-V174 HydrophobicContact CG-CG2 3.95Å |
| 167 | E | 91.2 | Very high | 90.9 | Very high | 153 Ų | 153 | 62.9 Ų | 62.9 | 72% | 0.715 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -68.1 | -39.2 | 173.2 | -70.6 | 173 | -172.9 | 0 | 0 | 112 | S163 K164 I165 | S163-E167 WeakPolarHBondContact O-CG 3.42Å; S163-E167 PolarHBondContact O-N 2.86Å; K164-E167 WeakPolarHBondContact O-CB 3.45Å; K164-E167 PolarHBondContact O-N 3.48Å; I165-E167 VanDerWaalsContact C-N 3.28Å; I165-E167 PolarHBondContact O-N 3.43Å |
| 168 | F | 87.7 | Confident | 90.8 | Very high | 132 Ų | 132 | 66.7 Ų | 66.7 | 58% | 0.579 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -72.3 | -39.3 | 177.7 | -82.6 | -64.4 | 0 | 0 | 0 | 113 | V101 K164 I165 | V101-F168 HydrophobicContact CG2-CD2 3.77Å; V101-F168 HydrophobicContact CG2-CE2 3.86Å; K164-F168 WeakPolarHBondContact O-CD2 3.41Å; K164-F168 PolarHBondContact O-N 2.99Å; I165-F168 PolarHBondContact O-N 3.2Å |
| 169 | D | 84.6 | Confident | 90.8 | Very high | 32 Ų | 32 | 68.5 Ų | 68.5 | 17% | 0.171 | 37% | 0.366 | C | S | . | . | trans | -140.7 | 98 | 179.4 | -167 | -20.2 | 0 | 0 | 0 | 110.7 | Y93 I165 M166 F171 F172 | Y93-D169 PolarHBondContact OH-OD2 3.5Å; I165-D169 PolarHBondContact O-N 3.41Å; M166-D169 CarbonylContact O-C 3.04Å; D169-F171 PolarHBondContact O-N 3.25Å; D169-F171 WeakPolarHBondContact OD1-CB 3.5Å; D169-F171 WeakPolarHBondContact OD1-CD2 3.23Å; D169-F171 PolarHBondContact OD1-N 3.31Å; D169-F172 HydrophobicContact CB-CD2 4.1Å; D169-F172 PolarHBondContact O-N 3.36Å; D169-F172 VanDerWaalsContact OD2-CD2 3.29Å; D169-F172 WeakPolarHBondContact OD2-CD2 3.44Å | ||
| 170 | S | 79.9 | Confident | 90.7 | Very high | 100 Ų | 100 | 72.4 Ų | 72.4 | 70% | 0.699 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -12.6 | -179.8 | 59.6 | 0 | 0 | 0 | 0 | 114.1 | M166 | M166-S170 WeakPolarHBondContact O-CA 3.42Å; M166-S170 PolarHBondContact O-N 3.43Å |
| 171 | F | 79.8 | Confident | 90.7 | Very high | 189 Ų | 189 | 76 Ų | 76 | 83% | 0.829 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.5 | -14.3 | 175.8 | -64.2 | -79.7 | 0 | 0 | 0 | 112.7 | D169 | D169-F171 PolarHBondContact O-N 3.25Å; D169-F171 WeakPolarHBondContact OD1-CB 3.5Å; D169-F171 WeakPolarHBondContact OD1-CD2 3.23Å; D169-F171 PolarHBondContact OD1-N 3.31Å |
| 172 | F | 81.6 | Confident | 90.8 | Very high | 60 Ų | 60 | 76.1 Ų | 76.1 | 26% | 0.263 | 39% | 0.39 | S | S | . | . | trans | -92.5 | 100.7 | 177.4 | -87.1 | -94 | 0 | 0 | 0 | 111.2 | Y93 D169 V174 | Y93-F172 HydrophobicContact CD1-CE1 4.12Å; Y93-F172 AromaticContact CD1-CE2 3.63Å; Y93-F172 HydrophobicContact CD1-CE2 3.63Å; Y93-F172 AromaticContact CD1-CZ 3.34Å; Y93-F172 HydrophobicContact CD1-CZ 3.34Å; Y93-F172 AromaticContact CE1-CD2 3.94Å; Y93-F172 HydrophobicContact CE1-CD2 3.94Å; Y93-F172 HydrophobicContact CE1-CE1 4.39Å; Y93-F172 AromaticContact CE1-CE2 3.22Å; Y93-F172 HydrophobicContact CE1-CE2 3.22Å; Y93-F172 AromaticContact CE1-CZ 3.5Å; Y93-F172 HydrophobicContact CE1-CZ 3.5Å; Y93-F172 VanDerWaalsContact CE1-CZ 3.5Å; D169-F172 HydrophobicContact CB-CD2 4.1Å; D169-F172 PolarHBondContact O-N 3.36Å; D169-F172 VanDerWaalsContact OD2-CD2 3.29Å; D169-F172 WeakPolarHBondContact OD2-CD2 3.44Å; F172-V174 HydrophobicContact CB-CG1 4.3Å; F172-V174 PolarHBondContact O-N 3.39Å | ||
| 173 | D | 88.6 | Confident | 90.9 | Very high | 124 Ų | 124 | 75.9 Ų | 75.9 | 66% | 0.663 | 39% | 0.388 | S | S | * | . | trans | -77.3 | 106.9 | 164.9 | -171.1 | 16.9 | 0 | 0 | 0 | 109.3 | ||||
| 174 | V | 93.2 | Very high | 91.1 | Very high | 1 Ų | 1 | 74.5 Ų | 74.5 | 1% | 0.006 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 136.8 | -178 | -68.3 | 0 | 0 | 0 | 0 | 111.4 | L94 A162 I165 M166 F172 I185 V186 | L94-V174 HydrophobicContact CD1-CG1 4.11Å; A162-V174 HydrophobicContact CB-CG2 4.35Å; I165-V174 HydrophobicContact CB-CG2 4Å; I165-V174 HydrophobicContact CG2-CG1 4.25Å; I165-V174 HydrophobicContact CG2-CG2 3.73Å; M166-V174 HydrophobicContact CE-CG2 4.17Å; M166-V174 WeakPolarHBondContact CE-O 3.37Å; M166-V174 HydrophobicContact CG-CG2 3.95Å; F172-V174 HydrophobicContact CB-CG1 4.3Å; F172-V174 PolarHBondContact O-N 3.39Å; V174-I185 HydrophobicContact CB-CG2 4.07Å; V174-I185 HydrophobicContact CG1-CG2 4.27Å; V174-V186 CarbonylContact C-O 3.48Å; V174-V186 WeakPolarHBondContact CA-O 3.48Å |
| 175 | T | 94.4 | Very high | 91.2 | Very high | 68 Ų | 68 | 71.9 Ų | 71.9 | 42% | 0.417 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 146.2 | 175 | 57.4 | 0 | 0 | 0 | 0 | 110.5 | V186 | T175-V186 PolarHBondContact N-O 3.31Å; T175-V186 PolarHBondContact O-N 3.45Å |
| 176 | C | 95.5 | Very high | 91.3 | Very high | 25 Ų | 25 | 73.5 Ų | 73.5 | 17% | 0.169 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | 130.5 | 170 | 178.1 | 0 | 0 | 0 | 0 | 109.5 | G158 N159 A162 N184 I185 | G158-C176 VanDerWaalsContact CA-SG 3.55Å; N159-C176 WeakPolarHBondContact OD1-CB 3.3Å; A162-C176 HydrophobicContact CB-CB 4.03Å; C176-N184 CarbonylContact C-O 3.59Å; C176-N184 WeakPolarHBondContact CA-O 3.29Å; C176-I185 HydrophobicContact CB-CD1 4.28Å |
| 177 | Q | 95.1 | Very high | 91.2 | Very high | 98 Ų | 98 | 70.4 Ų | 70.4 | 46% | 0.458 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 124.2 | 173 | -61.5 | 177.8 | 4.4 | 0 | 0 | 109 | F183 N184 V186 | Q177-F183 CarbonylContact O-C 3.57Å; Q177-F183 WeakPolarHBondContact O-CA 3.34Å; Q177-N184 HydrophobicContact CB-CB 4.42Å; Q177-N184 PolarHBondContact N-O 3.26Å; Q177-N184 PolarHBondContact O-N 3.14Å; Q177-V186 HydrophobicContact CG-CG2 4.23Å |
| 178 | T | 92.7 | Very high | 91 | Very high | 93 Ų | 93 | 71 Ų | 71 | 57% | 0.571 | 36% | 0.364 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -65.9 | 144.8 | 175.8 | 50.1 | 0 | 0 | 0 | 0 | 110.9 | S155 | S155-T178 WeakPolarHBondContact OG-CG2 3.24Å |
| 179 | A | 93.9 | Very high | 90.8 | Very high | 37 Ų | 37 | 71 Ų | 71 | 31% | 0.306 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 158.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111 | R181 G182 | A179-R181 PolarHBondContact O-N 2.96Å; A179-R181 VanDerWaalsContact O-N 3.13Å; A179-G182 CarbonylContact C-O 3.44Å; A179-G182 PolarHBondContact N-O 3.44Å; A179-G182 CarbonylContact O-C 3.57Å; A179-G182 PolarHBondContact O-N 2.9Å |
| 180 | E | 91.8 | Very high | 91.2 | Very high | 160 Ų | 160 | 69.9 Ų | 69.9 | 75% | 0.748 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -35.4 | -179.1 | -173.3 | -173.2 | 175.8 | 0 | 0 | 113.1 | ||
| 181 | R | 93.8 | Very high | 91.9 | Very high | 125 Ų | 125 | 66.7 Ų | 66.7 | 47% | 0.472 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.9 | -0.4 | -178.5 | -60.8 | -173.1 | 179.6 | -173.1 | -1.6 | 114.2 | A179 I195 V196 T216 N220 | A179-R181 PolarHBondContact O-N 2.96Å; A179-R181 VanDerWaalsContact O-N 3.13Å; R181-I195 HydrophobicContact CB-CG2 4.3Å; R181-I195 WeakPolarHBondContact O-CA 3.47Å; R181-V196 PolarHBondContact O-N 2.92Å; R181-T216 HydrophobicContact CB-CG2 4.37Å; R181-T216 HydrophobicContact CG-CG2 4.09Å; R181-N220 PolarHBondContact O-ND2 2.97Å |
| 182 | G | 95.2 | Very high | 92.7 | Very high | 2 Ų | 2 | 57.7 Ų | 57.7 | 2% | 0.021 | 30% | 0.3 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 148.3 | -119.3 | -170 | 0 | 0 | 0 | 0 | 0 | 111.9 | A179 V194 | A179-G182 CarbonylContact C-O 3.44Å; A179-G182 PolarHBondContact N-O 3.44Å; A179-G182 CarbonylContact O-C 3.57Å; A179-G182 PolarHBondContact O-N 2.9Å; G182-V194 WeakPolarHBondContact CA-O 3.41Å |
| 183 | F | 96.7 | Very high | 93.5 | Very high | 1 Ų | 1 | 59.8 Ų | 59.8 | 0% | 0.004 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.9 | 162.1 | 177.9 | 58.7 | -84.1 | 0 | 0 | 0 | 111.2 | I154 F157 I161 Q177 I185 V194 V196 | I154-F183 HydrophobicContact CG2-CD1 3.7Å; I154-F183 HydrophobicContact CG2-CE1 4.41Å; F157-F183 AromaticContact CD1-CE1 3.92Å; F157-F183 HydrophobicContact CD1-CE1 3.92Å; F157-F183 AromaticContact CD1-CZ 3.96Å; F157-F183 HydrophobicContact CD1-CZ 3.96Å; F157-F183 HydrophobicContact CE1-CE1 4.42Å; F157-F183 HydrophobicContact CE1-CZ 4.18Å; I161-F183 HydrophobicContact CD1-CE2 3.83Å; I161-F183 HydrophobicContact CD1-CZ 3.49Å; I161-F183 VanDerWaalsContact CD1-CZ 3.49Å; Q177-F183 CarbonylContact O-C 3.57Å; Q177-F183 WeakPolarHBondContact O-CA 3.34Å; F183-I185 HydrophobicContact CD2-CD1 3.94Å; F183-I185 HydrophobicContact CD2-CG1 4.29Å; F183-I185 HydrophobicContact CE2-CD1 3.92Å; F183-I185 HydrophobicContact CE2-CG1 4.13Å; F183-V194 HydrophobicContact CD1-CB 4.22Å; F183-V194 HydrophobicContact CD1-CG1 4.5Å; F183-V194 HydrophobicContact CD2-CB 4Å; F183-V194 HydrophobicContact CD2-CG2 4.13Å; F183-V194 HydrophobicContact CE1-CB 3.83Å; F183-V194 HydrophobicContact CE1-CG1 3.7Å; F183-V194 HydrophobicContact CE2-CB 3.58Å; F183-V194 HydrophobicContact CE2-CG1 4.06Å; F183-V194 HydrophobicContact CE2-CG2 3.52Å; F183-V194 HydrophobicContact CG-CB 4.31Å; F183-V194 HydrophobicContact CZ-CB 3.48Å; F183-V194 VanDerWaalsContact CZ-CB 3.48Å; F183-V194 HydrophobicContact CZ-CG1 3.44Å; F183-V194 VanDerWaalsContact CZ-CG1 3.44Å; F183-V194 HydrophobicContact CZ-CG2 3.8Å; F183-V194 PolarHBondContact N-O 3.03Å; F183-V194 VanDerWaalsContact N-O 3.07Å; F183-V194 WeakPolarHBondContact O-CA 3.3Å; F183-V194 PolarHBondContact O-N 3Å; F183-V196 HydrophobicContact CD1-CG2 4.45Å; F183-V196 HydrophobicContact CE1-CG2 4.36Å |
| 184 | N | 97.4 | Very high | 94 | Very high | 34 Ų | 34 | 54 Ų | 54 | 18% | 0.182 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 129.7 | 180 | -54.7 | -34.6 | 0 | 0 | 0 | 109.3 | C176 Q177 V186 T191 V192 R193 | C176-N184 CarbonylContact C-O 3.59Å; C176-N184 WeakPolarHBondContact CA-O 3.29Å; Q177-N184 HydrophobicContact CB-CB 4.42Å; Q177-N184 PolarHBondContact N-O 3.26Å; Q177-N184 PolarHBondContact O-N 3.14Å; N184-V186 HydrophobicContact CB-CG2 4.08Å; N184-T191 HydrophobicContact CB-CG2 4.09Å; N184-V192 WeakPolarHBondContact CA-O 3.33Å; N184-R193 WeakPolarHBondContact OD1-CG 3.46Å |
| 185 | I | 96.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 108.8 | 165.8 | -56.6 | -58.4 | 0 | 0 | 0 | 107.2 | L94 V98 I161 A162 I165 V174 C176 F183 T191 V192 V194 | L94-I185 HydrophobicContact CD1-CG2 4.33Å; V98-I185 HydrophobicContact CG2-CB 4.26Å; V98-I185 HydrophobicContact CG2-CG1 4.2Å; V98-I185 HydrophobicContact CG2-CG2 4.23Å; I161-I185 HydrophobicContact CB-CD1 4.47Å; I161-I185 HydrophobicContact CG2-CD1 4.03Å; I161-I185 HydrophobicContact CG2-CG1 4.27Å; A162-I185 HydrophobicContact CB-CD1 4.25Å; I165-I185 HydrophobicContact CD1-CG2 4Å; V174-I185 HydrophobicContact CB-CG2 4.07Å; V174-I185 HydrophobicContact CG1-CG2 4.27Å; C176-I185 HydrophobicContact CB-CD1 4.28Å; F183-I185 HydrophobicContact CD2-CD1 3.94Å; F183-I185 HydrophobicContact CD2-CG1 4.29Å; F183-I185 HydrophobicContact CE2-CD1 3.92Å; F183-I185 HydrophobicContact CE2-CG1 4.13Å; I185-T191 WeakPolarHBondContact O-CA 3.44Å; I185-V192 PolarHBondContact N-O 3.39Å; I185-V192 PolarHBondContact O-N 3.47Å; I185-V194 HydrophobicContact CG1-CG2 4.39Å |
| 186 | V | 95 | Very high | 94.2 | Very high | 33 Ų | 33 | 51.2 Ų | 51.2 | 20% | 0.2 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.6 | 109.2 | -174.3 | -176.1 | 0 | 0 | 0 | 0 | 108.8 | V174 T175 Q177 N184 T191 | V174-V186 CarbonylContact C-O 3.48Å; V174-V186 WeakPolarHBondContact CA-O 3.48Å; T175-V186 PolarHBondContact N-O 3.31Å; T175-V186 PolarHBondContact O-N 3.45Å; Q177-V186 HydrophobicContact CG-CG2 4.23Å; N184-V186 HydrophobicContact CB-CG2 4.08Å; V186-T191 HydrophobicContact CG2-CG2 3.91Å |
| 187 | G | 91.3 | Very high | 94.2 | Very high | 12 Ų | 12 | 50 Ų | 50 | 12% | 0.124 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 178.6 | 167.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | M189 A190 | G187-M189 VanDerWaalsContact C-N 3.31Å; G187-M189 PolarHBondContact O-N 3.12Å; G187-A190 PolarHBondContact N-O 3.43Å |
| 188 | H | 85.9 | Confident | 94.2 | Very high | 166 Ų | 166 | 45.4 Ų | 45.4 | 77% | 0.769 | 23% | 0.228 | S | C | * | . | S | Bend | trans | -56.8 | -38.3 | -176.3 | -172.3 | -113.1 | 0 | 0 | 0 | 114.2 | ||
| 189 | M | 84.5 | Confident | 94.3 | Very high | 130 Ų | 130 | 43.8 Ų | 43.8 | 64% | 0.64 | 22% | 0.215 | S | C | * | . | S | Bend | trans | -124 | -2.3 | -172.7 | -69.1 | -69.3 | 129.7 | 0 | 0 | 114.6 | S137 G187 | S137-M189 VanDerWaalsContact CB-O 3.29Å; S137-M189 WeakPolarHBondContact CB-O 3.33Å; G187-M189 VanDerWaalsContact C-N 3.31Å; G187-M189 PolarHBondContact O-N 3.12Å |
| 190 | A | 92 | Very high | 94.2 | Very high | 9 Ų | 9 | 46.4 Ų | 46.4 | 7% | 0.074 | 23% | 0.229 | C | C | . | . | trans | -151.2 | 147.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | L91 L94 G187 | L91-A190 HydrophobicContact CB-CB 4.23Å; L91-A190 HydrophobicContact CD1-CB 3.79Å; L94-A190 HydrophobicContact CD2-CB 3.96Å; G187-A190 PolarHBondContact N-O 3.43Å | ||
| 191 | T | 95 | Very high | 94.3 | Very high | 34 Ų | 34 | 42.3 Ų | 42.3 | 21% | 0.209 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 131 | 174.2 | -56.2 | 0 | 0 | 0 | 0 | 109.9 | S137 V138 A139 N184 I185 V186 R193 | S137-T191 PolarHBondContact O-N 3.18Å; V138-T191 VanDerWaalsContact CA-O 3.3Å; V138-T191 WeakPolarHBondContact CA-O 3.35Å; A139-T191 PolarHBondContact N-O 2.81Å; N184-T191 HydrophobicContact CB-CG2 4.09Å; I185-T191 WeakPolarHBondContact O-CA 3.44Å; V186-T191 HydrophobicContact CG2-CG2 3.91Å; T191-R193 HydrophobicContact CG2-CG 4.42Å |
| 192 | V | 97.4 | Very high | 94.3 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.199 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 116.2 | 170.6 | 177.8 | 0 | 0 | 0 | 0 | 108.3 | L91 L94 V95 V98 A139 V141 N184 I185 V194 | L91-V192 HydrophobicContact CD1-CG2 4.47Å; L94-V192 HydrophobicContact CB-CG2 4.2Å; L94-V192 HydrophobicContact CD2-CG2 3.84Å; L94-V192 HydrophobicContact CG-CG2 3.67Å; V95-V192 HydrophobicContact CG2-CG2 3.68Å; V98-V192 HydrophobicContact CB-CG1 4.33Å; V98-V192 HydrophobicContact CG1-CG1 4.12Å; V98-V192 HydrophobicContact CG2-CB 4.23Å; V98-V192 HydrophobicContact CG2-CG1 4.19Å; V98-V192 HydrophobicContact CG2-CG2 4.45Å; A139-V192 CarbonylContact O-C 3.59Å; A139-V192 WeakPolarHBondContact O-CA 3.47Å; V141-V192 HydrophobicContact CB-CG1 4.23Å; V141-V192 HydrophobicContact CG2-CG1 3.68Å; N184-V192 WeakPolarHBondContact CA-O 3.33Å; I185-V192 PolarHBondContact N-O 3.39Å; I185-V192 PolarHBondContact O-N 3.47Å; V192-V194 HydrophobicContact CG1-CG2 4.38Å |
| 193 | R | 97.8 | Very high | 94.2 | Very high | 104 Ų | 104 | 39.1 Ų | 39.1 | 39% | 0.392 | 21% | 0.207 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 114.4 | 174.4 | -55.3 | -173.7 | -63.8 | -177.4 | 0.2 | 108.4 | V138 A139 D140 V141 N184 T191 | V138-R193 HydrophobicContact CG1-CG 3.71Å; A139-R193 PolarHBondContact O-N 2.83Å; D140-R193 CarbonylContact C-O 3.49Å; D140-R193 VanDerWaalsContact CA-O 3.32Å; D140-R193 WeakPolarHBondContact CA-O 3.39Å; D140-R193 IonicContact OD1-CZ 3.23Å; D140-R193 IonicContact OD1-NE 3.05Å; D140-R193 PolarHBondContact OD1-NE 3.08Å; D140-R193 IonicContact OD1-NH2 3.35Å; D140-R193 PolarHBondContact OD1-NH2 3.21Å; D140-R193 IonicContact OD2-CZ 2.72Å; D140-R193 IonicContact OD2-NH2 3.12Å; D140-R193 PolarHBondContact OD2-NH2 3.29Å; V141-R193 PolarHBondContact N-O 3.02Å; N184-R193 WeakPolarHBondContact OD1-CG 3.46Å; T191-R193 HydrophobicContact CG2-CG 4.42Å |
| 194 | V | 97.8 | Very high | 94 | Very high | 2 Ų | 2 | 44.6 Ų | 44.6 | 1% | 0.012 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 106.7 | 175.4 | -172.8 | 0 | 0 | 0 | 0 | 108.3 | V98 I102 V141 V143 G182 F183 I185 V192 | V98-V194 HydrophobicContact CG1-CG2 3.92Å; I102-V194 HydrophobicContact CD1-CG1 4.47Å; V141-V194 CarbonylContact O-C 3.56Å; V141-V194 WeakPolarHBondContact O-CA 3.16Å; V143-V194 HydrophobicContact CB-CG1 4.33Å; V143-V194 HydrophobicContact CG2-CG1 3.48Å; V143-V194 VanDerWaalsContact CG2-CG1 3.48Å; G182-V194 WeakPolarHBondContact CA-O 3.41Å; F183-V194 HydrophobicContact CD1-CB 4.22Å; F183-V194 HydrophobicContact CD1-CG1 4.5Å; F183-V194 HydrophobicContact CD2-CB 4Å; F183-V194 HydrophobicContact CD2-CG2 4.13Å; F183-V194 HydrophobicContact CE1-CB 3.83Å; F183-V194 HydrophobicContact CE1-CG1 3.7Å; F183-V194 HydrophobicContact CE2-CB 3.58Å; F183-V194 HydrophobicContact CE2-CG1 4.06Å; F183-V194 HydrophobicContact CE2-CG2 3.52Å; F183-V194 HydrophobicContact CG-CB 4.31Å; F183-V194 HydrophobicContact CZ-CB 3.48Å; F183-V194 VanDerWaalsContact CZ-CB 3.48Å; F183-V194 HydrophobicContact CZ-CG1 3.44Å; F183-V194 VanDerWaalsContact CZ-CG1 3.44Å; F183-V194 HydrophobicContact CZ-CG2 3.8Å; F183-V194 PolarHBondContact N-O 3.03Å; F183-V194 VanDerWaalsContact N-O 3.07Å; F183-V194 WeakPolarHBondContact O-CA 3.3Å; F183-V194 PolarHBondContact O-N 3Å; I185-V194 HydrophobicContact CG1-CG2 4.39Å; V192-V194 HydrophobicContact CG1-CG2 4.38Å |
| 195 | I | 97.1 | Very high | 93.7 | Very high | 10 Ų | 10 | 49 Ų | 49 | 5% | 0.051 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 129 | 177.8 | 67 | 175.7 | 0 | 0 | 0 | 110.1 | V124 V141 A142 V143 R181 N220 T223 | V124-I195 HydrophobicContact CG2-CD1 3.8Å; V124-I195 HydrophobicContact CG2-CG1 4.39Å; V141-I195 PolarHBondContact O-N 2.87Å; A142-I195 WeakPolarHBondContact CA-O 3.36Å; A142-I195 HydrophobicContact CB-CD1 3.92Å; A142-I195 HydrophobicContact CB-CG1 3.6Å; V143-I195 PolarHBondContact N-O 3.33Å; R181-I195 HydrophobicContact CB-CG2 4.3Å; R181-I195 WeakPolarHBondContact O-CA 3.47Å; I195-N220 HydrophobicContact CB-CB 4.45Å; I195-N220 HydrophobicContact CD1-CB 4.38Å; I195-T223 HydrophobicContact CD1-CG2 3.85Å |
| 196 | V | 96.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 129.9 | -174.2 | 172 | 0 | 0 | 0 | 0 | 110.2 | F145 P149 I154 R181 F183 M212 N220 | F145-V196 HydrophobicContact CD2-CG1 3.76Å; F145-V196 HydrophobicContact CE2-CB 4.49Å; F145-V196 HydrophobicContact CE2-CG1 3.69Å; F145-V196 HydrophobicContact CE2-CG2 4.18Å; P149-V196 HydrophobicContact CB-CG1 3.65Å; P149-V196 HydrophobicContact CG-CG1 3.63Å; I154-V196 HydrophobicContact CD1-CB 4.37Å; I154-V196 HydrophobicContact CD1-CG1 3.98Å; I154-V196 HydrophobicContact CD1-CG2 4.33Å; I154-V196 HydrophobicContact CG1-CG1 4.19Å; I154-V196 HydrophobicContact CG1-CG2 4.18Å; I154-V196 HydrophobicContact CG2-CG2 4.02Å; R181-V196 PolarHBondContact O-N 2.92Å; F183-V196 HydrophobicContact CD1-CG2 4.45Å; F183-V196 HydrophobicContact CE1-CG2 4.36Å; V196-M212 HydrophobicContact CB-CE 4.18Å; V196-M212 HydrophobicContact CB-SD 4.27Å; V196-M212 HydrophobicContact CG1-SD 4.46Å; V196-N220 WeakPolarHBondContact O-CB 3.45Å; V196-N220 PolarHBondContact O-ND2 3.15Å |
| 197 | C | 95.5 | Very high | 93.2 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 166.4 | 177.4 | -54.6 | 0 | 0 | 0 | 0 | 109.7 | V143 V144 F145 N220 I224 | V143-C197 PolarHBondContact O-N 3.32Å; V144-C197 HydrophobicContact CB-CB 4.38Å; V144-C197 HydrophobicContact CG1-CB 4.5Å; V144-C197 HydrophobicContact CG2-CB 3.93Å; F145-C197 PolarHBondContact N-O 2.97Å; C197-N220 VanDerWaalsContact SG-C 3.53Å; C197-N220 WeakPolarHBondContact SG-CB 3.28Å; C197-I224 HydrophobicContact CB-CD1 4.49Å |
| 198 | T | 94.6 | Very high | 93 | Very high | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.006 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.2 | 169.4 | 168.4 | -171.2 | 0 | 0 | 0 | 0 | 109.6 | F145 G147 N202 Y203 L217 | F145-T198 WeakPolarHBondContact O-CA 3.41Å; F145-T198 PolarHBondContact O-OG1 3.2Å; G147-T198 PolarHBondContact O-OG1 3.11Å; T198-N202 HydrophobicContact CG2-CB 4.09Å; T198-N202 PolarHBondContact OG1-ND2 2.79Å; T198-Y203 HydrophobicContact CG2-CD1 3.96Å; T198-Y203 HydrophobicContact CG2-CE1 3.81Å; T198-L217 HydrophobicContact CG2-CD1 4.02Å; T198-L217 HydrophobicContact CG2-CD2 4.34Å |
| 199 | L | 94.2 | Very high | 93 | Very high | 59 Ų | 59 | 55.9 Ų | 55.9 | 31% | 0.309 | 30% | 0.304 | S | S | . | . | trans | -64.2 | 142.7 | 175.5 | -63 | 175.6 | 0 | 0 | 0 | 111.2 | A119 V144 F145 R146 S201 N202 | A119-L199 HydrophobicContact CB-CD2 4.19Å; V144-L199 HydrophobicContact CG1-CD2 4Å; F145-L199 PolarHBondContact O-N 2.98Å; R146-L199 HydrophobicContact CB-CD1 4.39Å; R146-L199 HydrophobicContact CG-CD1 4.46Å; L199-S201 PolarHBondContact O-N 3.39Å; L199-S201 VanDerWaalsContact O-N 3.1Å; L199-N202 WeakPolarHBondContact O-CB 3.36Å; L199-N202 PolarHBondContact O-N 3.05Å | ||
| 200 | P | 92.3 | Very high | 93.1 | Very high | 92 Ų | 92 | 57 Ų | 57 | 60% | 0.597 | 30% | 0.302 | S | S | * | . | G | 310 helix | trans | -55.3 | -30.9 | 177.9 | -28.1 | 35.4 | 0 | 0 | 0 | 114.5 | N202 Y203 | P200-N202 PolarHBondContact O-N 3.45Å; P200-N202 VanDerWaalsContact O-N 3.14Å; P200-Y203 HydrophobicContact CB-CD2 4.36Å; P200-Y203 HydrophobicContact CB-CE2 4.07Å; P200-Y203 WeakPolarHBondContact O-CB 3.45Å; P200-Y203 PolarHBondContact O-N 2.78Å |
| 201 | S | 93.4 | Very high | 93.1 | Very high | 75 Ų | 75 | 58.2 Ų | 58.2 | 52% | 0.524 | 31% | 0.306 | S | S | . | . | G | 310 helix | trans | -61.6 | -17.1 | 175.1 | 54.7 | 0 | 0 | 0 | 0 | 114.1 | L199 C204 | L199-S201 PolarHBondContact O-N 3.39Å; L199-S201 VanDerWaalsContact O-N 3.1Å; S201-C204 PolarHBondContact O-SG 3.21Å |
| 202 | N | 93.3 | Very high | 92.9 | Very high | 13 Ų | 13 | 57.6 Ų | 57.6 | 7% | 0.07 | 30% | 0.301 | C | S | . | . | G | 310 helix | trans | -93.7 | -12.4 | -179.2 | -65.1 | -19.2 | 0 | 0 | 0 | 112.8 | R146 G147 L148 T198 L199 P200 C204 K205 V206 | R146-N202 PolarHBondContact O-ND2 3.09Å; G147-N202 PolarHBondContact O-ND2 3.14Å; L148-N202 HydrophobicContact CD2-CB 3.76Å; L148-N202 HydrophobicContact CG-CB 4.4Å; T198-N202 HydrophobicContact CG2-CB 4.09Å; T198-N202 PolarHBondContact OG1-ND2 2.79Å; L199-N202 WeakPolarHBondContact O-CB 3.36Å; L199-N202 PolarHBondContact O-N 3.05Å; P200-N202 PolarHBondContact O-N 3.45Å; P200-N202 VanDerWaalsContact O-N 3.14Å; N202-C204 VanDerWaalsContact C-N 3.25Å; N202-C204 PolarHBondContact O-N 3.24Å; N202-K205 WeakPolarHBondContact O-CA 3.42Å; N202-K205 WeakPolarHBondContact O-CB 3.38Å; N202-K205 PolarHBondContact O-N 3.39Å; N202-V206 PolarHBondContact O-N 2.78Å |
| 203 | Y | 93.3 | Very high | 92.6 | Very high | 46 Ų | 46 | 61.6 Ų | 61.6 | 18% | 0.18 | 32% | 0.322 | C | S | . | . | G | 310 helix | trans | -58.6 | -35.5 | -176.8 | -67.9 | -14 | 0 | 0 | 0 | 113.4 | T198 P200 K205 L214 F218 S221 | T198-Y203 HydrophobicContact CG2-CD1 3.96Å; T198-Y203 HydrophobicContact CG2-CE1 3.81Å; P200-Y203 HydrophobicContact CB-CD2 4.36Å; P200-Y203 HydrophobicContact CB-CE2 4.07Å; P200-Y203 WeakPolarHBondContact O-CB 3.45Å; P200-Y203 PolarHBondContact O-N 2.78Å; Y203-K205 PolarHBondContact O-N 3.34Å; Y203-L214 HydrophobicContact CD1-CD1 3.87Å; Y203-L214 HydrophobicContact CG-CD1 3.86Å; Y203-F218 HydrophobicContact CE2-CD2 4.11Å; Y203-S221 VanDerWaalsContact OH-CB 3.23Å; Y203-S221 WeakPolarHBondContact OH-CB 3.07Å; Y203-S221 PolarHBondContact OH-OG 3.43Å |
| 204 | C | 92.7 | Very high | 92.4 | Very high | 116 Ų | 116 | 60 Ų | 60 | 78% | 0.784 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -72.6 | -10.8 | 175.6 | 57.3 | 0 | 0 | 0 | 0 | 114 | S201 N202 | S201-C204 PolarHBondContact O-SG 3.21Å; N202-C204 VanDerWaalsContact C-N 3.25Å; N202-C204 PolarHBondContact O-N 3.24Å |
| 205 | K | 92.3 | Very high | 92.2 | Very high | 126 Ų | 126 | 67.4 Ų | 67.4 | 55% | 0.548 | 35% | 0.354 | S | S | . | . | G | 310 helix | trans | -105.8 | -5.1 | -177.8 | -53.2 | 178.4 | -173.3 | 173.4 | 0 | 112.9 | L148 N202 Y203 T207 | L148-K205 HydrophobicContact CD1-CB 3.88Å; L148-K205 WeakPolarHBondContact CD1-O 3.39Å; N202-K205 WeakPolarHBondContact O-CA 3.42Å; N202-K205 WeakPolarHBondContact O-CB 3.38Å; N202-K205 PolarHBondContact O-N 3.39Å; Y203-K205 PolarHBondContact O-N 3.34Å; K205-T207 PolarHBondContact O-N 2.93Å |
| 206 | V | 90.6 | Very high | 92 | Very high | 22 Ų | 22 | 67.7 Ų | 67.7 | 13% | 0.133 | 36% | 0.355 | C | S | . | . | trans | -66.7 | 117.8 | -178.8 | 177.5 | 0 | 0 | 0 | 0 | 109.8 | L148 N202 H211 L214 L217 | L148-V206 HydrophobicContact CD2-CB 4.5Å; L148-V206 HydrophobicContact CD2-CG2 3.68Å; N202-V206 PolarHBondContact O-N 2.78Å; V206-H211 HydrophobicContact CG1-CB 4.02Å; V206-L214 HydrophobicContact CB-CD1 4.48Å; V206-L214 HydrophobicContact CG1-CB 4.33Å; V206-L214 HydrophobicContact CG2-CD1 4.08Å; V206-L217 HydrophobicContact CG1-CD1 4.42Å; V206-L217 HydrophobicContact CG2-CD1 3.96Å | ||
| 207 | T | 90.9 | Very high | 92 | Very high | 61 Ų | 61 | 67.7 Ų | 67.7 | 37% | 0.374 | 36% | 0.355 | S | S | . | . | trans | -100 | 118.9 | 170.3 | 53 | 0 | 0 | 0 | 0 | 110.6 | K205 E209 Y210 H211 | K205-T207 PolarHBondContact O-N 2.93Å; T207-E209 PolarHBondContact O-N 3.28Å; T207-E209 VanDerWaalsContact O-N 3.12Å; T207-Y210 PolarHBondContact O-N 3.02Å; T207-H211 PolarHBondContact N-ND1 3.49Å; T207-H211 VanDerWaalsContact N-ND1 3.14Å; T207-H211 WeakPolarHBondContact O-CB 3.45Å; T207-H211 PolarHBondContact O-N 3.38Å; T207-H211 PolarHBondContact O-ND1 3.11Å; T207-H211 PolarHBondContact OG1-CE1 3.31Å; T207-H211 PolarHBondContact OG1-ND1 3.39Å | ||
| 208 | P | 85.5 | Confident | 91.8 | Very high | 109 Ų | 109 | 72.1 Ų | 72.1 | 71% | 0.708 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -21 | -173.4 | -26.4 | 34.6 | 0 | 0 | 0 | 116.2 | ||
| 209 | E | 87.2 | Confident | 91.8 | Very high | 165 Ų | 165 | 74.2 Ų | 74.2 | 77% | 0.771 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.6 | -32.1 | -179.5 | -68.2 | 173.4 | -175.6 | 0 | 0 | 112.9 | T207 | T207-E209 PolarHBondContact O-N 3.28Å; T207-E209 VanDerWaalsContact O-N 3.12Å |
| 210 | Y | 86.8 | Confident | 91.9 | Very high | 154 Ų | 154 | 71.4 Ų | 71.4 | 60% | 0.604 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.8 | -30.3 | -171.7 | -56.8 | -79.2 | 0 | 0 | 0 | 112.3 | S150 T207 | S150-Y210 VanDerWaalsContact CA-O 3.24Å; S150-Y210 WeakPolarHBondContact CA-O 3.43Å; S150-Y210 WeakPolarHBondContact CB-O 3.42Å; T207-Y210 PolarHBondContact O-N 3.02Å |
| 211 | H | 90.7 | Very high | 92 | Very high | 34 Ų | 34 | 68 Ų | 68 | 16% | 0.157 | 35% | 0.354 | C | S | . | . | B | Isolated β-bridge | trans | -108.3 | 160.2 | -170.5 | -55 | 116.7 | 0 | 0 | 0 | 112.2 | L148 V206 T207 D213 | L148-H211 VanDerWaalsContact CB-CD2 3.45Å; L148-H211 WeakPolarHBondContact CB-CD2 3.48Å; L148-H211 WeakPolarHBondContact CB-NE2 3.32Å; V206-H211 HydrophobicContact CG1-CB 4.02Å; T207-H211 PolarHBondContact N-ND1 3.49Å; T207-H211 VanDerWaalsContact N-ND1 3.14Å; T207-H211 WeakPolarHBondContact O-CB 3.45Å; T207-H211 PolarHBondContact O-N 3.38Å; T207-H211 PolarHBondContact O-ND1 3.11Å; T207-H211 PolarHBondContact OG1-CE1 3.31Å; T207-H211 PolarHBondContact OG1-ND1 3.39Å; H211-D213 PolarHBondContact O-N 2.83Å |
| 212 | M | 90.7 | Very high | 92.1 | Very high | 21 Ų | 21 | 65.6 Ų | 65.6 | 10% | 0.103 | 33% | 0.334 | C | S | . | . | trans | -55.3 | 139.6 | 168.6 | -176.9 | 172.1 | -78.8 | 0 | 0 | 111.2 | P149 I154 V196 L214 T216 L217 | P149-M212 PolarHBondContact O-N 2.98Å; P149-M212 VanDerWaalsContact O-N 3.16Å; I154-M212 HydrophobicContact CD1-CE 3.48Å; I154-M212 VanDerWaalsContact CD1-CE 3.48Å; V196-M212 HydrophobicContact CB-CE 4.18Å; V196-M212 HydrophobicContact CB-SD 4.27Å; V196-M212 HydrophobicContact CG1-SD 4.46Å; M212-L214 PolarHBondContact O-N 2.92Å; M212-T216 HydrophobicContact CG-CG2 4.11Å; M212-T216 HydrophobicContact SD-CG2 3.79Å; M212-L217 HydrophobicContact CB-CD1 4.34Å; M212-L217 HydrophobicContact CB-CD2 4.15Å; M212-L217 HydrophobicContact CB-CG 4.09Å; M212-L217 HydrophobicContact CG-CD2 4.19Å; M212-L217 HydrophobicContact CG-CG 4.06Å; M212-L217 WeakPolarHBondContact O-CD1 3.48Å; M212-L217 HydrophobicContact SD-CD2 3.86Å; M212-L217 HydrophobicContact SD-CG 4.28Å | ||
| 213 | D | 92.3 | Very high | 92.3 | Very high | 83 Ų | 83 | 66.2 Ų | 66.2 | 44% | 0.444 | 34% | 0.338 | S | S | . | . | trans | -52.7 | 135.3 | -179.9 | 174.6 | 43.5 | 0 | 0 | 0 | 112.3 | H211 K215 T216 L217 | H211-D213 PolarHBondContact O-N 2.83Å; D213-K215 VanDerWaalsContact C-N 3.25Å; D213-K215 PolarHBondContact O-N 3.49Å; D213-K215 WeakPolarHBondContact OD2-CB 3.45Å; D213-K215 PolarHBondContact OD2-N 3.17Å; D213-T216 WeakPolarHBondContact O-CB 3.3Å; D213-T216 PolarHBondContact O-N 3.06Å; D213-L217 PolarHBondContact O-N 3.4Å | ||
| 214 | L | 93.3 | Very high | 92.4 | Very high | 72 Ų | 72 | 65.7 Ų | 65.7 | 38% | 0.377 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -60.3 | -36.2 | -175.7 | 179.8 | 62.5 | 0 | 0 | 0 | 111.8 | Y203 V206 M212 T216 L217 F218 | Y203-L214 HydrophobicContact CD1-CD1 3.87Å; Y203-L214 HydrophobicContact CG-CD1 3.86Å; V206-L214 HydrophobicContact CB-CD1 4.48Å; V206-L214 HydrophobicContact CG1-CB 4.33Å; V206-L214 HydrophobicContact CG2-CD1 4.08Å; M212-L214 PolarHBondContact O-N 2.92Å; L214-T216 VanDerWaalsContact C-N 3.29Å; L214-T216 PolarHBondContact O-N 3.21Å; L214-L217 PolarHBondContact O-N 3.49Å; L214-F218 VanDerWaalsContact O-CB 3.3Å; L214-F218 WeakPolarHBondContact O-CB 3.26Å; L214-F218 PolarHBondContact O-N 2.86Å |
| 215 | K | 92.5 | Very high | 92.6 | Very high | 157 Ų | 157 | 62.6 Ų | 62.6 | 68% | 0.683 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -64.5 | -37.5 | 177.8 | -172.7 | -172.6 | 175.7 | -174.6 | 0 | 111.1 | D213 S219 | D213-K215 VanDerWaalsContact C-N 3.25Å; D213-K215 PolarHBondContact O-N 3.49Å; D213-K215 WeakPolarHBondContact OD2-CB 3.45Å; D213-K215 PolarHBondContact OD2-N 3.17Å; K215-S219 VanDerWaalsContact O-CB 3.26Å; K215-S219 WeakPolarHBondContact O-CB 3.4Å; K215-S219 PolarHBondContact O-N 3.11Å |
| 216 | T | 94.2 | Very high | 92.9 | Very high | 15 Ų | 15 | 57.9 Ų | 57.9 | 9% | 0.092 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -70 | -47.6 | 176.5 | -63.8 | 0 | 0 | 0 | 0 | 111.4 | R181 M212 D213 L214 F218 S219 N220 | R181-T216 HydrophobicContact CB-CG2 4.37Å; R181-T216 HydrophobicContact CG-CG2 4.09Å; M212-T216 HydrophobicContact CG-CG2 4.11Å; M212-T216 HydrophobicContact SD-CG2 3.79Å; D213-T216 WeakPolarHBondContact O-CB 3.3Å; D213-T216 PolarHBondContact O-N 3.06Å; L214-T216 VanDerWaalsContact C-N 3.29Å; L214-T216 PolarHBondContact O-N 3.21Å; T216-F218 VanDerWaalsContact C-N 3.34Å; T216-F218 PolarHBondContact O-N 3.09Å; T216-S219 PolarHBondContact O-N 3.39Å; T216-N220 WeakPolarHBondContact O-CB 3.42Å; T216-N220 VanDerWaalsContact O-CG 3.25Å; T216-N220 PolarHBondContact O-N 3.3Å |
| 217 | L | 94.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -56.8 | -47.2 | 175.4 | -71.9 | 171.8 | 0 | 0 | 0 | 111.6 | P149 T198 V206 M212 D213 L214 N220 S221 | P149-L217 HydrophobicContact CG-CD2 3.89Å; T198-L217 HydrophobicContact CG2-CD1 4.02Å; T198-L217 HydrophobicContact CG2-CD2 4.34Å; V206-L217 HydrophobicContact CG1-CD1 4.42Å; V206-L217 HydrophobicContact CG2-CD1 3.96Å; M212-L217 HydrophobicContact CB-CD1 4.34Å; M212-L217 HydrophobicContact CB-CD2 4.15Å; M212-L217 HydrophobicContact CB-CG 4.09Å; M212-L217 HydrophobicContact CG-CD2 4.19Å; M212-L217 HydrophobicContact CG-CG 4.06Å; M212-L217 WeakPolarHBondContact O-CD1 3.48Å; M212-L217 HydrophobicContact SD-CD2 3.86Å; M212-L217 HydrophobicContact SD-CG 4.28Å; D213-L217 PolarHBondContact O-N 3.4Å; L214-L217 PolarHBondContact O-N 3.49Å; L217-N220 PolarHBondContact O-N 3.31Å; L217-S221 PolarHBondContact O-N 2.94Å; L217-S221 PolarHBondContact O-OG 2.91Å |
| 218 | F | 93.3 | Very high | 93.5 | Very high | 93 Ų | 93 | 61.1 Ų | 61.1 | 41% | 0.408 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.7 | -46.1 | 176.4 | -177.5 | -95.2 | 0 | 0 | 0 | 112.1 | Y203 L214 T216 N220 S221 M222 | Y203-F218 HydrophobicContact CE2-CD2 4.11Å; L214-F218 VanDerWaalsContact O-CB 3.3Å; L214-F218 WeakPolarHBondContact O-CB 3.26Å; L214-F218 PolarHBondContact O-N 2.86Å; T216-F218 VanDerWaalsContact C-N 3.34Å; T216-F218 PolarHBondContact O-N 3.09Å; F218-N220 VanDerWaalsContact C-N 3.31Å; F218-N220 PolarHBondContact O-N 3.12Å; F218-S221 PolarHBondContact O-N 2.92Å; F218-M222 HydrophobicContact CD1-CG 4.17Å; F218-M222 HydrophobicContact CE1-CG 3.76Å; F218-M222 HydrophobicContact CE1-SD 4.36Å; F218-M222 HydrophobicContact CZ-CG 4.06Å; F218-M222 HydrophobicContact CZ-SD 4.09Å; F218-M222 WeakPolarHBondContact O-CG 3.3Å; F218-M222 PolarHBondContact O-N 2.99Å |
| 219 | S | 93.8 | Very high | 94 | Very high | 46 Ų | 46 | 57 Ų | 57 | 32% | 0.322 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.5 | -37.8 | 177.4 | -178.6 | 0 | 0 | 0 | 0 | 112.6 | K215 T216 M222 T223 | K215-S219 VanDerWaalsContact O-CB 3.26Å; K215-S219 WeakPolarHBondContact O-CB 3.4Å; K215-S219 PolarHBondContact O-N 3.11Å; T216-S219 PolarHBondContact O-N 3.39Å; S219-M222 PolarHBondContact O-N 3.01Å; S219-T223 PolarHBondContact O-N 3.49Å; S219-T223 PolarHBondContact O-OG1 3.37Å; S219-T223 VanDerWaalsContact O-OG1 3.09Å |
| 220 | N | 96.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -68.2 | -44.8 | 176.9 | -70.6 | -12.8 | 0 | 0 | 0 | 110.8 | R181 I195 V196 C197 T216 L217 F218 M222 T223 I224 | R181-N220 PolarHBondContact O-ND2 2.97Å; I195-N220 HydrophobicContact CB-CB 4.45Å; I195-N220 HydrophobicContact CD1-CB 4.38Å; V196-N220 WeakPolarHBondContact O-CB 3.45Å; V196-N220 PolarHBondContact O-ND2 3.15Å; C197-N220 VanDerWaalsContact SG-C 3.53Å; C197-N220 WeakPolarHBondContact SG-CB 3.28Å; T216-N220 WeakPolarHBondContact O-CB 3.42Å; T216-N220 VanDerWaalsContact O-CG 3.25Å; T216-N220 PolarHBondContact O-N 3.3Å; L217-N220 PolarHBondContact O-N 3.31Å; F218-N220 VanDerWaalsContact C-N 3.31Å; F218-N220 PolarHBondContact O-N 3.12Å; N220-M222 VanDerWaalsContact C-N 3.31Å; N220-M222 PolarHBondContact O-N 2.96Å; N220-T223 WeakPolarHBondContact O-CA 3.4Å; N220-T223 VanDerWaalsContact O-CB 3.23Å; N220-T223 WeakPolarHBondContact O-CB 3.44Å; N220-T223 PolarHBondContact O-N 3.42Å; N220-I224 PolarHBondContact O-N 2.87Å |
| 221 | S | 95.2 | Very high | 95 | Very high | 21 Ų | 21 | 45 Ų | 45 | 15% | 0.147 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.7 | -40.5 | 173.8 | -67.3 | 0 | 0 | 0 | 0 | 112.4 | Y203 L217 F218 T223 I224 S225 | Y203-S221 VanDerWaalsContact OH-CB 3.23Å; Y203-S221 WeakPolarHBondContact OH-CB 3.07Å; Y203-S221 PolarHBondContact OH-OG 3.43Å; L217-S221 PolarHBondContact O-N 2.94Å; L217-S221 PolarHBondContact O-OG 2.91Å; F218-S221 PolarHBondContact O-N 2.92Å; S221-T223 PolarHBondContact O-N 3.01Å; S221-I224 WeakPolarHBondContact O-CB 3.28Å; S221-I224 PolarHBondContact O-N 3.29Å; S221-I224 VanDerWaalsContact O-N 3.13Å; S221-S225 PolarHBondContact O-N 2.85Å |
| 222 | M | 95 | Very high | 95.2 | Very high | 23 Ų | 23 | 48.7 Ų | 48.7 | 11% | 0.113 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -61.8 | -31.3 | 174.1 | -71.5 | -57.8 | -61.4 | 0 | 0 | 112.5 | F218 S219 N220 I224 S225 H226 C309 N310 | F218-M222 HydrophobicContact CD1-CG 4.17Å; F218-M222 HydrophobicContact CE1-CG 3.76Å; F218-M222 HydrophobicContact CE1-SD 4.36Å; F218-M222 HydrophobicContact CZ-CG 4.06Å; F218-M222 HydrophobicContact CZ-SD 4.09Å; F218-M222 WeakPolarHBondContact O-CG 3.3Å; F218-M222 PolarHBondContact O-N 2.99Å; S219-M222 PolarHBondContact O-N 3.01Å; N220-M222 VanDerWaalsContact C-N 3.31Å; N220-M222 PolarHBondContact O-N 2.96Å; M222-I224 VanDerWaalsContact C-N 3.28Å; M222-I224 PolarHBondContact O-N 2.86Å; M222-S225 WeakPolarHBondContact O-CB 3.29Å; M222-S225 PolarHBondContact O-N 2.59Å; M222-H226 WeakPolarHBondContact CE-NE2 3.19Å; M222-H226 WeakPolarHBondContact O-CB 3.47Å; M222-H226 PolarHBondContact O-CD2 2.8Å; M222-H226 PolarHBondContact O-N 2.97Å; M222-H226 PolarHBondContact O-ND1 3.4Å; M222-C309 HydrophobicContact CE-CB 3.51Å; M222-N310 HydrophobicContact CE-CB 4.12Å |
| 223 | T | 96.6 | Very high | 95.4 | Very high | 26 Ų | 26 | 53.4 Ų | 53.4 | 16% | 0.16 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.6 | -34.1 | 176.6 | -58 | 0 | 0 | 0 | 0 | 112 | V124 I195 S219 N220 S221 T227 | V124-T223 HydrophobicContact CB-CG2 4.25Å; V124-T223 HydrophobicContact CG2-CG2 4.03Å; I195-T223 HydrophobicContact CD1-CG2 3.85Å; S219-T223 PolarHBondContact O-N 3.49Å; S219-T223 PolarHBondContact O-OG1 3.37Å; S219-T223 VanDerWaalsContact O-OG1 3.09Å; N220-T223 WeakPolarHBondContact O-CA 3.4Å; N220-T223 VanDerWaalsContact O-CB 3.23Å; N220-T223 WeakPolarHBondContact O-CB 3.44Å; N220-T223 PolarHBondContact O-N 3.42Å; S221-T223 PolarHBondContact O-N 3.01Å; T223-T227 WeakPolarHBondContact O-CB 3.18Å; T223-T227 PolarHBondContact O-N 3.38Å; T223-T227 VanDerWaalsContact O-N 3.1Å; T223-T227 PolarHBondContact O-OG1 3.49Å |
| 224 | I | 97.2 | Very high | 95.5 | Very high | 36 Ų | 36 | 49.4 Ų | 49.4 | 19% | 0.185 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.5 | -49.7 | 171.8 | -56.2 | 175.9 | 0 | 0 | 0 | 109.7 | V124 A142 V144 C197 N220 S221 M222 H226 T227 R228 | V124-I224 HydrophobicContact CG1-CG1 4.37Å; A142-I224 HydrophobicContact CB-CD1 3.76Å; A142-I224 HydrophobicContact CB-CG1 3.58Å; V144-I224 HydrophobicContact CG2-CD1 3.6Å; C197-I224 HydrophobicContact CB-CD1 4.49Å; N220-I224 PolarHBondContact O-N 2.87Å; S221-I224 WeakPolarHBondContact O-CB 3.28Å; S221-I224 PolarHBondContact O-N 3.29Å; S221-I224 VanDerWaalsContact O-N 3.13Å; M222-I224 VanDerWaalsContact C-N 3.28Å; M222-I224 PolarHBondContact O-N 2.86Å; I224-H226 PolarHBondContact O-N 3.26Å; I224-T227 PolarHBondContact O-N 3.28Å; I224-R228 PolarHBondContact O-N 2.94Å |
| 225 | S | 96.4 | Very high | 95.4 | Very high | 51 Ų | 51 | 48.4 Ų | 48.4 | 36% | 0.357 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -58.6 | -45.9 | 177.9 | -59.4 | 0 | 0 | 0 | 0 | 112.3 | S221 M222 T227 R228 W229 | S221-S225 PolarHBondContact O-N 2.85Å; M222-S225 WeakPolarHBondContact O-CB 3.29Å; M222-S225 PolarHBondContact O-N 2.59Å; S225-T227 VanDerWaalsContact C-N 3.29Å; S225-T227 PolarHBondContact O-N 3.08Å; S225-R228 PolarHBondContact O-N 3.28Å; S225-W229 WeakPolarHBondContact O-CB 3.25Å; S225-W229 PolarHBondContact O-N 3.49Å |
| 226 | H | 97.5 | Very high | 95.4 | Very high | 26 Ų | 26 | 45.3 Ų | 45.3 | 12% | 0.12 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.8 | -39.7 | 177 | -63.5 | 169.4 | 0 | 0 | 0 | 112 | M222 I224 F230 W262 | M222-H226 WeakPolarHBondContact CE-NE2 3.19Å; M222-H226 WeakPolarHBondContact O-CB 3.47Å; M222-H226 PolarHBondContact O-CD2 2.8Å; M222-H226 PolarHBondContact O-N 2.97Å; M222-H226 PolarHBondContact O-ND1 3.4Å; I224-H226 PolarHBondContact O-N 3.26Å; H226-F230 VanDerWaalsContact O-CB 3.28Å; H226-F230 WeakPolarHBondContact O-CB 3.27Å; H226-F230 PolarHBondContact O-N 2.9Å; H226-W262 HydrophobicContact CB-CD2 4.2Å; H226-W262 HydrophobicContact CB-CE3 3.62Å; H226-W262 HydrophobicContact CB-CH2 3.96Å; H226-W262 HydrophobicContact CB-CZ2 4.47Å; H226-W262 HydrophobicContact CB-CZ3 3.5Å; H226-W262 VanDerWaalsContact CB-CZ3 3.5Å; H226-W262 AromaticContact CD2-CD2 3.6Å; H226-W262 AromaticContact CD2-CE2 3.29Å; H226-W262 AromaticContact CD2-CE3 3.91Å; H226-W262 AromaticContact CD2-CH2 3.67Å; H226-W262 AromaticContact CD2-CZ2 3.32Å; H226-W262 WeakPolarHBondContact CD2-CZ2 3.31Å; H226-W262 AromaticContact CD2-CZ3 3.95Å; H226-W262 AromaticContact CD2-NE1 3.75Å; H226-W262 AromaticContact CE1-CD1 3.58Å; H226-W262 AromaticContact CE1-CD2 3.71Å; H226-W262 AromaticContact CE1-CE2 3.85Å; H226-W262 AromaticContact CE1-CG 3.55Å; H226-W262 AromaticContact CE1-NE1 3.73Å; H226-W262 AromaticContact CG-CD2 3.54Å; H226-W262 AromaticContact CG-CE2 3.76Å; H226-W262 AromaticContact CG-CE3 3.51Å; H226-W262 AromaticContact CG-CH2 3.93Å; H226-W262 AromaticContact CG-CZ2 3.95Å; H226-W262 AromaticContact CG-CZ3 3.72Å; H226-W262 AromaticContact ND1-CD2 3.62Å; H226-W262 AromaticContact ND1-CE3 3.87Å; H226-W262 AromaticContact ND1-CG 3.72Å; H226-W262 AromaticContact NE2-CD1 3.66Å; H226-W262 AromaticContact NE2-CD2 3.74Å; H226-W262 AromaticContact NE2-CE2 3.39Å; H226-W262 AromaticContact NE2-CG 3.9Å; H226-W262 AromaticContact NE2-CZ2 3.86Å; H226-W262 AromaticContact NE2-NE1 3.31Å; H226-W262 PolarHBondContact NE2-NE1 3.13Å |
| 227 | T | 97.5 | Very high | 95.4 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67.6 | -47.7 | 178.2 | -56.4 | 0 | 0 | 0 | 0 | 110.7 | V124 G125 E128 T223 I224 S225 W229 F230 E231 | V124-T227 HydrophobicContact CB-CG2 4.34Å; V124-T227 WeakPolarHBondContact CB-OG1 3.42Å; V124-T227 HydrophobicContact CG1-CG2 4.33Å; G125-T227 PolarHBondContact N-OG1 2.79Å; E128-T227 HydrophobicContact CB-CG2 3.96Å; E128-T227 HydrophobicContact CG-CG2 3.67Å; T223-T227 WeakPolarHBondContact O-CB 3.18Å; T223-T227 PolarHBondContact O-N 3.38Å; T223-T227 VanDerWaalsContact O-N 3.1Å; T223-T227 PolarHBondContact O-OG1 3.49Å; I224-T227 PolarHBondContact O-N 3.28Å; S225-T227 VanDerWaalsContact C-N 3.29Å; S225-T227 PolarHBondContact O-N 3.08Å; T227-W229 PolarHBondContact O-N 3.22Å; T227-F230 PolarHBondContact O-N 3.19Å; T227-E231 WeakPolarHBondContact CG2-OE1 3.39Å; T227-E231 WeakPolarHBondContact O-CG 3.24Å; T227-E231 PolarHBondContact O-N 2.87Å |
| 228 | R | 96.8 | Very high | 95.4 | Very high | 151 Ų | 151 | 48.5 Ų | 48.5 | 57% | 0.57 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -58.7 | -46.2 | 175.7 | -178.4 | 180 | 178.3 | 176.3 | 0.7 | 112.2 | I224 S225 F230 E231 Q232 | I224-R228 PolarHBondContact O-N 2.94Å; S225-R228 PolarHBondContact O-N 3.28Å; R228-F230 VanDerWaalsContact C-N 3.32Å; R228-F230 PolarHBondContact O-N 3.32Å; R228-E231 PolarHBondContact O-N 3.47Å; R228-Q232 WeakPolarHBondContact O-CG 3.43Å; R228-Q232 PolarHBondContact O-N 3.44Å; R228-Q232 VanDerWaalsContact O-N 3.1Å |
| 229 | W | 97.3 | Very high | 95.5 | Very high | 24 Ų | 24 | 44.1 Ų | 44.1 | 9% | 0.091 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.7 | -42.9 | 176.7 | 177.1 | 89.6 | 0 | 0 | 0 | 111.4 | S225 T227 E231 Q232 F233 A234 W262 V266 H269 P308 | S225-W229 WeakPolarHBondContact O-CB 3.25Å; S225-W229 PolarHBondContact O-N 3.49Å; T227-W229 PolarHBondContact O-N 3.22Å; W229-E231 PolarHBondContact O-N 3.09Å; W229-Q232 PolarHBondContact O-N 3.35Å; W229-F233 AromaticContact CD1-CD2 3.34Å; W229-F233 AromaticContact CD1-CE2 3.84Å; W229-F233 HydrophobicContact CD2-CD2 4.44Å; W229-F233 AromaticContact CG-CD2 3.92Å; W229-F233 HydrophobicContact CG-CD2 3.92Å; W229-F233 HydrophobicContact CZ2-CB 4.44Å; W229-F233 AromaticContact NE1-CD2 3.5Å; W229-F233 WeakPolarHBondContact O-CD2 3.39Å; W229-F233 PolarHBondContact O-N 3Å; W229-A234 HydrophobicContact CE3-CB 4.39Å; W229-A234 HydrophobicContact CH2-CB 4.14Å; W229-A234 HydrophobicContact CZ3-CB 3.8Å; W229-W262 HydrophobicContact CB-CH2 4.27Å; W229-W262 AromaticContact CD2-CH2 3.77Å; W229-W262 HydrophobicContact CD2-CH2 3.77Å; W229-W262 HydrophobicContact CD2-CZ3 4.4Å; W229-W262 AromaticContact CE3-CH2 3.4Å; W229-W262 HydrophobicContact CE3-CH2 3.4Å; W229-W262 VanDerWaalsContact CE3-CH2 3.4Å; W229-W262 AromaticContact CE3-CZ3 3.59Å; W229-W262 HydrophobicContact CE3-CZ3 3.59Å; W229-W262 HydrophobicContact CG-CH2 4.14Å; W229-W262 AromaticContact CZ3-CH2 3.99Å; W229-W262 HydrophobicContact CZ3-CH2 3.99Å; W229-W262 AromaticContact CZ3-CZ3 3.97Å; W229-W262 HydrophobicContact CZ3-CZ3 3.97Å; W229-V266 HydrophobicContact CH2-CG2 4.31Å; W229-V266 HydrophobicContact CZ3-CG2 4.41Å; W229-H269 HydrophobicContact CH2-CB 3.65Å; W229-H269 AromaticContact CH2-CG 3.52Å; W229-H269 AromaticContact CH2-ND1 3.7Å; W229-H269 HydrophobicContact CZ2-CB 4.47Å; W229-H269 AromaticContact CZ2-CE1 3.9Å; W229-H269 AromaticContact CZ2-CG 3.89Å; W229-H269 AromaticContact CZ2-ND1 3.64Å; W229-H269 HydrophobicContact CZ3-CB 4.47Å; W229-P308 HydrophobicContact CD2-CG 3.97Å; W229-P308 HydrophobicContact CG-CB 4.46Å; W229-P308 HydrophobicContact CG-CG 4.21Å; W229-P308 HydrophobicContact CZ2-CB 4.41Å; W229-P308 HydrophobicContact CZ2-CG 3.88Å; W229-P308 VanDerWaalsContact NE1-CB 3.32Å |
| 230 | F | 97.8 | Very high | 95.6 | Very high | 1 Ų | 1 | 44.5 Ų | 44.5 | 0% | 0.004 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.5 | -42.3 | -179.9 | -167.9 | -79.5 | 0 | 0 | 0 | 112.1 | K129 T131 H226 T227 R228 Q232 A234 S235 V239 R240 E265 | K129-F230 HydrophobicContact CB-CD1 3.69Å; K129-F230 HydrophobicContact CB-CE1 3.74Å; K129-F230 HydrophobicContact CB-CG 4.19Å; K129-F230 HydrophobicContact CB-CZ 4.28Å; K129-F230 HydrophobicContact CD-CB 4.03Å; K129-F230 HydrophobicContact CD-CD1 4.18Å; K129-F230 HydrophobicContact CD-CD2 4.01Å; K129-F230 HydrophobicContact CD-CG 3.8Å; K129-F230 HydrophobicContact CG-CB 3.99Å; K129-F230 HydrophobicContact CG-CD1 3.61Å; K129-F230 HydrophobicContact CG-CD2 4.36Å; K129-F230 HydrophobicContact CG-CE1 4.19Å; K129-F230 HydrophobicContact CG-CG 3.72Å; K129-F230 WeakPolarHBondContact O-CE1 3.44Å; T131-F230 HydrophobicContact CG2-CZ 4.03Å; H226-F230 VanDerWaalsContact O-CB 3.28Å; H226-F230 WeakPolarHBondContact O-CB 3.27Å; H226-F230 PolarHBondContact O-N 2.9Å; T227-F230 PolarHBondContact O-N 3.19Å; R228-F230 VanDerWaalsContact C-N 3.32Å; R228-F230 PolarHBondContact O-N 3.32Å; F230-Q232 VanDerWaalsContact C-N 3.34Å; F230-Q232 PolarHBondContact O-N 3.25Å; F230-A234 HydrophobicContact CB-CB 4.46Å; F230-A234 HydrophobicContact CD1-CB 4.38Å; F230-A234 HydrophobicContact CD2-CB 3.7Å; F230-A234 WeakPolarHBondContact CE1-O 3.28Å; F230-A234 HydrophobicContact CE2-CB 3.91Å; F230-A234 HydrophobicContact CG-CB 3.94Å; F230-A234 HydrophobicContact CZ-CB 4.35Å; F230-A234 WeakPolarHBondContact CZ-O 3.46Å; F230-A234 CarbonylContact O-C 3.56Å; F230-A234 VanDerWaalsContact O-CA 3.32Å; F230-A234 WeakPolarHBondContact O-CA 3.49Å; F230-A234 PolarHBondContact O-N 3.01Å; F230-S235 PolarHBondContact O-N 3.27Å; F230-S235 VanDerWaalsContact O-N 3.09Å; F230-V239 HydrophobicContact CE2-CG1 4.05Å; F230-V239 HydrophobicContact CZ-CG1 4.08Å; F230-R240 HydrophobicContact CE1-CG 4.29Å; F230-R240 HydrophobicContact CZ-CG 4.25Å; F230-E265 HydrophobicContact CD2-CB 4.21Å; F230-E265 HydrophobicContact CD2-CG 4.08Å; F230-E265 HydrophobicContact CE2-CB 4.24Å; F230-E265 HydrophobicContact CE2-CG 3.92Å |
| 231 | E | 96.1 | Very high | 95.7 | Very high | 66 Ų | 66 | 45.3 Ų | 45.3 | 31% | 0.308 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -59.1 | -45 | 175 | -72.3 | 163.2 | -171 | 0 | 0 | 111.7 | K122 E128 T227 R228 W229 S235 | K122-E231 WeakPolarHBondContact CE-OE1 3.31Å; K122-E231 IonicContact NZ-OE1 2.75Å; K122-E231 PolarHBondContact NZ-OE1 3.15Å; K122-E231 VanDerWaalsContact NZ-OE1 3.12Å; K122-E231 IonicContact NZ-OE2 3.06Å; K122-E231 PolarHBondContact NZ-OE2 3.08Å; E128-E231 WeakPolarHBondContact CG-OE1 3.3Å; T227-E231 WeakPolarHBondContact CG2-OE1 3.39Å; T227-E231 WeakPolarHBondContact O-CG 3.24Å; T227-E231 PolarHBondContact O-N 2.87Å; R228-E231 PolarHBondContact O-N 3.47Å; W229-E231 PolarHBondContact O-N 3.09Å; E231-S235 WeakPolarHBondContact O-CB 3.48Å; E231-S235 PolarHBondContact O-OG 3.07Å |
| 232 | Q | 95.7 | Very high | 95.8 | Very high | 110 Ų | 110 | 44.3 Ų | 44.3 | 51% | 0.514 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -75.5 | -42.8 | -175.1 | -70.9 | -178.6 | -20.5 | 0 | 0 | 113.3 | R228 W229 F230 | R228-Q232 WeakPolarHBondContact O-CG 3.43Å; R228-Q232 PolarHBondContact O-N 3.44Å; R228-Q232 VanDerWaalsContact O-N 3.1Å; W229-Q232 PolarHBondContact O-N 3.35Å; F230-Q232 VanDerWaalsContact C-N 3.34Å; F230-Q232 PolarHBondContact O-N 3.25Å |
| 233 | F | 93.5 | Very high | 95.9 | Very high | 120 Ų | 120 | 43.2 Ų | 43.2 | 53% | 0.526 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -116.1 | -24.4 | -167.9 | -57 | -70.6 | 0 | 0 | 0 | 114.2 | W229 H269 | W229-F233 AromaticContact CD1-CD2 3.34Å; W229-F233 AromaticContact CD1-CE2 3.84Å; W229-F233 HydrophobicContact CD2-CD2 4.44Å; W229-F233 AromaticContact CG-CD2 3.92Å; W229-F233 HydrophobicContact CG-CD2 3.92Å; W229-F233 HydrophobicContact CZ2-CB 4.44Å; W229-F233 AromaticContact NE1-CD2 3.5Å; W229-F233 WeakPolarHBondContact O-CD2 3.39Å; W229-F233 PolarHBondContact O-N 3Å; F233-H269 PolarHBondContact O-CD2 2.74Å; F233-H269 PolarHBondContact O-NE2 2.87Å |
| 234 | A | 94.3 | Very high | 96 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 21% | 0.21 | C | C | . | . | S | Bend | trans | -118.4 | 18.1 | -170.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | W229 F230 H236 V239 H269 | W229-A234 HydrophobicContact CE3-CB 4.39Å; W229-A234 HydrophobicContact CH2-CB 4.14Å; W229-A234 HydrophobicContact CZ3-CB 3.8Å; F230-A234 HydrophobicContact CB-CB 4.46Å; F230-A234 HydrophobicContact CD1-CB 4.38Å; F230-A234 HydrophobicContact CD2-CB 3.7Å; F230-A234 WeakPolarHBondContact CE1-O 3.28Å; F230-A234 HydrophobicContact CE2-CB 3.91Å; F230-A234 HydrophobicContact CG-CB 3.94Å; F230-A234 HydrophobicContact CZ-CB 4.35Å; F230-A234 WeakPolarHBondContact CZ-O 3.46Å; F230-A234 CarbonylContact O-C 3.56Å; F230-A234 VanDerWaalsContact O-CA 3.32Å; F230-A234 WeakPolarHBondContact O-CA 3.49Å; F230-A234 PolarHBondContact O-N 3.01Å; A234-H236 PolarHBondContact O-N 2.79Å; A234-V239 HydrophobicContact CB-CG1 4.19Å; A234-H269 HydrophobicContact CB-CB 4.32Å |
| 235 | S | 91.8 | Very high | 96 | Very high | 51 Ų | 51 | 41.8 Ų | 41.8 | 36% | 0.357 | 20% | 0.201 | S | C | . | . | trans | -75.1 | -3.8 | -176.8 | 57.3 | 0 | 0 | 0 | 0 | 114.8 | F230 E231 R240 | F230-S235 PolarHBondContact O-N 3.27Å; F230-S235 VanDerWaalsContact O-N 3.09Å; E231-S235 WeakPolarHBondContact O-CB 3.48Å; E231-S235 PolarHBondContact O-OG 3.07Å; S235-R240 VanDerWaalsContact O-CZ 3.24Å; S235-R240 PolarHBondContact O-NH1 3.49Å; S235-R240 PolarHBondContact O-NH2 3.36Å | ||
| 236 | H | 92.8 | Very high | 96.1 | Very high | 92 Ų | 92 | 39.4 Ų | 39.4 | 43% | 0.426 | 18% | 0.184 | S | C | . | . | S | Bend | trans | -62.6 | 135.8 | 179.9 | -171.4 | -89.7 | 0 | 0 | 0 | 112.2 | A234 A238 V239 R240 | A234-H236 PolarHBondContact O-N 2.79Å; H236-A238 VanDerWaalsContact C-N 3.3Å; H236-A238 VanDerWaalsContact ND1-CB 3.3Å; H236-A238 WeakPolarHBondContact ND1-CB 3.47Å; H236-A238 PolarHBondContact ND1-N 3.48Å; H236-A238 VanDerWaalsContact ND1-N 3.17Å; H236-A238 PolarHBondContact O-N 2.98Å; H236-V239 HydrophobicContact CB-CG2 4.21Å; H236-V239 WeakPolarHBondContact O-CB 3.48Å; H236-V239 PolarHBondContact O-N 3.48Å; H236-R240 PolarHBondContact O-N 3.07Å |
| 237 | P | 94 | Very high | 96 | Very high | 79 Ų | 79 | 39.6 Ų | 39.6 | 51% | 0.513 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -54.8 | -38.3 | -177.3 | -28.5 | 35.4 | 0 | 0 | 0 | 114.9 | V239 R240 I241 | P237-V239 VanDerWaalsContact C-N 3.28Å; P237-V239 PolarHBondContact O-N 3.44Å; P237-R240 PolarHBondContact O-N 3.2Å; P237-I241 WeakPolarHBondContact O-CG1 3.21Å; P237-I241 PolarHBondContact O-N 3.33Å |
| 238 | A | 94.3 | Very high | 96 | Very high | 3 Ų | 3 | 40.3 Ų | 40.3 | 3% | 0.025 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.4 | -38.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | H236 I241 I242 V272 T280 V282 | H236-A238 VanDerWaalsContact C-N 3.3Å; H236-A238 VanDerWaalsContact ND1-CB 3.3Å; H236-A238 WeakPolarHBondContact ND1-CB 3.47Å; H236-A238 PolarHBondContact ND1-N 3.48Å; H236-A238 VanDerWaalsContact ND1-N 3.17Å; H236-A238 PolarHBondContact O-N 2.98Å; A238-I241 PolarHBondContact O-N 2.87Å; A238-I242 WeakPolarHBondContact O-CB 3.42Å; A238-I242 VanDerWaalsContact O-CG1 3.27Å; A238-I242 WeakPolarHBondContact O-CG1 3.12Å; A238-I242 PolarHBondContact O-N 2.93Å; A238-V272 HydrophobicContact CB-CG1 4.49Å; A238-V272 HydrophobicContact CB-CG2 4.4Å; A238-T280 HydrophobicContact CB-CG2 4.2Å; A238-V282 HydrophobicContact CB-CG2 3.93Å |
| 239 | V | 96.2 | Very high | 96 | Very high | 1 Ų | 1 | 33.1 Ų | 33.1 | 1% | 0.006 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63 | -49.4 | 176.1 | 178.8 | 0 | 0 | 0 | 0 | 109.4 | F230 A234 H236 P237 I241 I242 V243 V268 V272 | F230-V239 HydrophobicContact CE2-CG1 4.05Å; F230-V239 HydrophobicContact CZ-CG1 4.08Å; A234-V239 HydrophobicContact CB-CG1 4.19Å; H236-V239 HydrophobicContact CB-CG2 4.21Å; H236-V239 WeakPolarHBondContact O-CB 3.48Å; H236-V239 PolarHBondContact O-N 3.48Å; P237-V239 VanDerWaalsContact C-N 3.28Å; P237-V239 PolarHBondContact O-N 3.44Å; V239-I241 VanDerWaalsContact C-N 3.34Å; V239-I241 PolarHBondContact O-N 3Å; V239-I242 PolarHBondContact O-N 3.32Å; V239-V243 HydrophobicContact CG1-CG2 4.07Å; V239-V243 WeakPolarHBondContact O-CB 3.3Å; V239-V243 VanDerWaalsContact O-CG2 3.25Å; V239-V243 WeakPolarHBondContact O-CG2 3.45Å; V239-V243 PolarHBondContact O-N 3.28Å; V239-V268 HydrophobicContact CB-CG1 4.5Å; V239-V268 HydrophobicContact CG1-CG1 4.05Å; V239-V272 HydrophobicContact CG2-CB 4.06Å; V239-V272 HydrophobicContact CG2-CG1 4Å; V239-V272 HydrophobicContact CG2-CG2 4.02Å |
| 240 | R | 96.5 | Very high | 95.9 | Very high | 54 Ų | 54 | 34 Ų | 34 | 20% | 0.204 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.8 | -41.4 | -179.4 | -64.7 | -178.7 | 179.7 | 137.8 | 2.4 | 112.7 | K129 T131 F230 S235 H236 P237 R244 | K129-R240 PolarHBondContact O-NE 3.15Å; T131-R240 HydrophobicContact CG2-CB 4.18Å; T131-R240 HydrophobicContact CG2-CG 4.13Å; F230-R240 HydrophobicContact CE1-CG 4.29Å; F230-R240 HydrophobicContact CZ-CG 4.25Å; S235-R240 VanDerWaalsContact O-CZ 3.24Å; S235-R240 PolarHBondContact O-NH1 3.49Å; S235-R240 PolarHBondContact O-NH2 3.36Å; H236-R240 PolarHBondContact O-N 3.07Å; P237-R240 PolarHBondContact O-N 3.2Å; R240-R244 PolarHBondContact O-N 3.49Å; R240-R244 VanDerWaalsContact O-N 3.11Å |
| 241 | I | 97.2 | Very high | 95.8 | Very high | 16 Ų | 16 | 38.4 Ų | 38.4 | 8% | 0.082 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.9 | -54.1 | 176 | -71.2 | 161 | 0 | 0 | 0 | 110 | L75 N78 P237 A238 V239 V243 R244 V245 V282 | L75-I241 HydrophobicContact CD2-CD1 3.72Å; N78-I241 HydrophobicContact CB-CG2 4.01Å; P237-I241 WeakPolarHBondContact O-CG1 3.21Å; P237-I241 PolarHBondContact O-N 3.33Å; A238-I241 PolarHBondContact O-N 2.87Å; V239-I241 VanDerWaalsContact C-N 3.34Å; V239-I241 PolarHBondContact O-N 3Å; I241-V243 PolarHBondContact O-N 2.74Å; I241-R244 PolarHBondContact O-N 3.24Å; I241-V245 WeakPolarHBondContact O-CG2 3.44Å; I241-V245 PolarHBondContact O-N 3.47Å; I241-V282 HydrophobicContact CG2-CG1 4.06Å |
| 242 | I | 97.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -65.8 | -41.7 | -176.7 | -64.7 | 168.3 | 0 | 0 | 0 | 110.6 | A238 V239 R244 V245 V246 V268 V272 V282 A285 F286 | A238-I242 WeakPolarHBondContact O-CB 3.42Å; A238-I242 VanDerWaalsContact O-CG1 3.27Å; A238-I242 WeakPolarHBondContact O-CG1 3.12Å; A238-I242 PolarHBondContact O-N 2.93Å; V239-I242 PolarHBondContact O-N 3.32Å; I242-R244 VanDerWaalsContact C-N 3.35Å; I242-R244 PolarHBondContact O-N 3.24Å; I242-V245 PolarHBondContact O-N 3.11Å; I242-V246 HydrophobicContact CG2-CG2 3.88Å; I242-V246 WeakPolarHBondContact O-CB 3.5Å; I242-V246 VanDerWaalsContact O-CG2 3.24Å; I242-V246 WeakPolarHBondContact O-CG2 3.43Å; I242-V246 PolarHBondContact O-N 3.48Å; I242-V268 HydrophobicContact CB-CG1 3.59Å; I242-V268 HydrophobicContact CB-CG2 4.49Å; I242-V268 HydrophobicContact CD1-CG1 4.45Å; I242-V268 HydrophobicContact CG2-CB 4.19Å; I242-V268 HydrophobicContact CG2-CG1 3.49Å; I242-V268 VanDerWaalsContact CG2-CG1 3.49Å; I242-V268 HydrophobicContact CG2-CG2 3.57Å; I242-V272 HydrophobicContact CD1-CG2 3.93Å; I242-V282 HydrophobicContact CD1-CG1 4Å; I242-V282 HydrophobicContact CG1-CG1 3.83Å; I242-A285 HydrophobicContact CD1-CB 3.69Å; I242-F286 HydrophobicContact CD1-CB 4.39Å; I242-F286 HydrophobicContact CG1-CB 4.4Å; I242-F286 HydrophobicContact CG2-CD2 4.16Å |
| 243 | V | 97.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -58.2 | -44.4 | 176.4 | 168.8 | 0 | 0 | 0 | 0 | 111.5 | T131 V239 I241 V246 K247 I264 E265 V268 | T131-V243 HydrophobicContact CG2-CB 4.17Å; T131-V243 HydrophobicContact CG2-CG1 3.87Å; V239-V243 HydrophobicContact CG1-CG2 4.07Å; V239-V243 WeakPolarHBondContact O-CB 3.3Å; V239-V243 VanDerWaalsContact O-CG2 3.25Å; V239-V243 WeakPolarHBondContact O-CG2 3.45Å; V239-V243 PolarHBondContact O-N 3.28Å; I241-V243 PolarHBondContact O-N 2.74Å; V243-V246 PolarHBondContact O-N 3.4Å; V243-K247 HydrophobicContact CG1-CD 4.16Å; V243-K247 WeakPolarHBondContact O-CB 3.3Å; V243-K247 VanDerWaalsContact O-CG 3.28Å; V243-K247 WeakPolarHBondContact O-CG 3.3Å; V243-K247 PolarHBondContact O-N 2.92Å; V243-I264 HydrophobicContact CG1-CG2 4.38Å; V243-I264 HydrophobicContact CG2-CG2 4.39Å; V243-E265 HydrophobicContact CG1-CG 4.28Å; V243-E265 HydrophobicContact CG2-CG 4.26Å; V243-V268 HydrophobicContact CG2-CB 4.05Å; V243-V268 HydrophobicContact CG2-CG1 3.98Å; V243-V268 HydrophobicContact CG2-CG2 4.29Å |
| 244 | R | 97.3 | Very high | 95.6 | Very high | 32 Ų | 32 | 33.6 Ų | 33.6 | 12% | 0.121 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.5 | -48.3 | 176.6 | -79.9 | -170.2 | -69.7 | -110.8 | -3.3 | 111.9 | N78 R130 L132 I133 R240 I241 I242 V246 K247 D248 | N78-R244 PolarHBondContact OD1-NE 2.75Å; N78-R244 PolarHBondContact OD1-NH2 3.21Å; R130-R244 PolarHBondContact O-NH1 2.91Å; L132-R244 WeakPolarHBondContact O-CD 3.46Å; I133-R244 HydrophobicContact CG1-CG 4.3Å; R240-R244 PolarHBondContact O-N 3.49Å; R240-R244 VanDerWaalsContact O-N 3.11Å; I241-R244 PolarHBondContact O-N 3.24Å; I242-R244 VanDerWaalsContact C-N 3.35Å; I242-R244 PolarHBondContact O-N 3.24Å; R244-V246 PolarHBondContact O-N 3.02Å; R244-K247 PolarHBondContact O-N 2.73Å; R244-D248 PolarHBondContact O-N 2.93Å |
| 245 | V | 97.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63.3 | -41.2 | 179.3 | 173 | 0 | 0 | 0 | 0 | 111.3 | L74 R77 N78 L81 I241 I242 D248 I249 F286 L347 | L74-V245 HydrophobicContact CD2-CB 4.19Å; L74-V245 HydrophobicContact CD2-CG1 3.77Å; L74-V245 HydrophobicContact CD2-CG2 4.05Å; R77-V245 HydrophobicContact CB-CG2 4.48Å; R77-V245 HydrophobicContact CG-CG2 4.29Å; N78-V245 HydrophobicContact CB-CG2 4.48Å; L81-V245 HydrophobicContact CD1-CG2 4.26Å; I241-V245 WeakPolarHBondContact O-CG2 3.44Å; I241-V245 PolarHBondContact O-N 3.47Å; I242-V245 PolarHBondContact O-N 3.11Å; V245-D248 WeakPolarHBondContact O-CB 3.28Å; V245-D248 PolarHBondContact O-N 2.83Å; V245-I249 HydrophobicContact CG1-CD1 3.74Å; V245-I249 HydrophobicContact CG1-CG1 4.25Å; V245-I249 VanDerWaalsContact O-CG1 3.28Å; V245-I249 WeakPolarHBondContact O-CG1 3.44Å; V245-I249 PolarHBondContact O-N 3.11Å; V245-F286 HydrophobicContact CG1-CE2 4.37Å; V245-L347 HydrophobicContact CG1-CD2 3.83Å |
| 246 | V | 97.8 | Very high | 95.8 | Very high | 1 Ų | 1 | 31.5 Ų | 31.5 | 1% | 0.006 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.5 | -38 | 178.3 | 172.3 | 0 | 0 | 0 | 0 | 111.6 | I242 V243 R244 D248 I249 K250 I264 V268 F286 F289 | I242-V246 HydrophobicContact CG2-CG2 3.88Å; I242-V246 WeakPolarHBondContact O-CB 3.5Å; I242-V246 VanDerWaalsContact O-CG2 3.24Å; I242-V246 WeakPolarHBondContact O-CG2 3.43Å; I242-V246 PolarHBondContact O-N 3.48Å; V243-V246 PolarHBondContact O-N 3.4Å; R244-V246 PolarHBondContact O-N 3.02Å; V246-D248 VanDerWaalsContact C-N 3.28Å; V246-D248 PolarHBondContact O-N 3.3Å; V246-I249 PolarHBondContact O-N 3Å; V246-K250 VanDerWaalsContact O-CB 3.3Å; V246-K250 WeakPolarHBondContact O-CB 3.21Å; V246-K250 PolarHBondContact O-N 3.02Å; V246-I264 HydrophobicContact CB-CG2 3.96Å; V246-I264 HydrophobicContact CG1-CB 4.41Å; V246-I264 HydrophobicContact CG1-CD1 4.06Å; V246-I264 HydrophobicContact CG1-CG1 3.96Å; V246-I264 HydrophobicContact CG1-CG2 3.61Å; V246-V268 HydrophobicContact CG2-CG2 4.38Å; V246-F286 HydrophobicContact CG2-CD2 4.42Å; V246-F286 HydrophobicContact CG2-CE2 4.16Å; V246-F289 HydrophobicContact CB-CE1 4.39Å; V246-F289 HydrophobicContact CB-CZ 4.44Å; V246-F289 HydrophobicContact CG1-CE1 3.77Å; V246-F289 HydrophobicContact CG1-CE2 4.46Å; V246-F289 HydrophobicContact CG1-CZ 3.55Å; V246-F289 HydrophobicContact CG2-CD1 3.94Å; V246-F289 HydrophobicContact CG2-CE1 3.6Å; V246-F289 HydrophobicContact CG2-CZ 4Å |
| 247 | K | 97 | Very high | 95.9 | Very high | 30 Ų | 30 | 32 Ų | 32 | 13% | 0.13 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.2 | -36 | 172.4 | -75.3 | 174.9 | -177.3 | 176.1 | 0 | 111.9 | S126 T131 I133 V243 R244 S251 I264 | S126-K247 PolarHBondContact OG-NZ 3.49Å; T131-K247 PolarHBondContact O-NZ 3.26Å; T131-K247 PolarHBondContact OG1-NZ 3.31Å; I133-K247 HydrophobicContact CD1-CB 3.31Å; I133-K247 HydrophobicContact CD1-CD 3.89Å; I133-K247 HydrophobicContact CD1-CG 4.24Å; V243-K247 HydrophobicContact CG1-CD 4.16Å; V243-K247 WeakPolarHBondContact O-CB 3.3Å; V243-K247 VanDerWaalsContact O-CG 3.28Å; V243-K247 WeakPolarHBondContact O-CG 3.3Å; V243-K247 PolarHBondContact O-N 2.92Å; R244-K247 PolarHBondContact O-N 2.73Å; K247-S251 PolarHBondContact O-N 3.3Å; K247-I264 HydrophobicContact CG-CD1 4.38Å |
| 248 | D | 96.2 | Very high | 96 | Very high | 15 Ų | 15 | 29.2 Ų | 29.2 | 8% | 0.08 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -67.8 | -48.8 | 172.2 | 172.2 | 76.4 | 0 | 0 | 0 | 112.1 | R77 L81 R244 V245 V246 K250 S251 R252 | R77-D248 IonicContact CZ-OD1 2.68Å; R77-D248 IonicContact CZ-OD2 3.09Å; R77-D248 IonicContact NE-OD1 3.85Å; R77-D248 IonicContact NE-OD2 3.98Å; R77-D248 PolarHBondContact NE-OD2 3.47Å; R77-D248 IonicContact NH2-OD1 3.14Å; R77-D248 PolarHBondContact NH2-OD1 2.89Å; R77-D248 IonicContact NH2-OD2 2.65Å; R77-D248 PolarHBondContact NH2-OD2 2.55Å; L81-D248 HydrophobicContact CD1-CB 3.55Å; L81-D248 HydrophobicContact CD2-CB 3.87Å; L81-D248 HydrophobicContact CG-CB 4.38Å; R244-D248 PolarHBondContact O-N 2.93Å; V245-D248 WeakPolarHBondContact O-CB 3.28Å; V245-D248 PolarHBondContact O-N 2.83Å; V246-D248 VanDerWaalsContact C-N 3.28Å; V246-D248 PolarHBondContact O-N 3.3Å; D248-K250 VanDerWaalsContact C-N 3.3Å; D248-K250 PolarHBondContact O-N 3.44Å; D248-S251 PolarHBondContact O-N 3.22Å; D248-S251 PolarHBondContact O-OG 3.23Å; D248-R252 PolarHBondContact O-N 3.32Å; D248-R252 IonicContact OD1-NE 2.9Å; D248-R252 IonicContact OD2-CZ 3.05Å; D248-R252 IonicContact OD2-NE 3.36Å; D248-R252 PolarHBondContact OD2-NE 2.91Å; D248-R252 IonicContact OD2-NH2 2.93Å; D248-R252 PolarHBondContact OD2-NH2 3.35Å |
| 249 | I | 96.8 | Very high | 96.1 | Very high | 1 Ų | 1 | 29.1 Ų | 29.1 | 1% | 0.005 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -54.9 | -47.1 | 175 | -70.7 | 169.4 | 0 | 0 | 0 | 110.3 | V245 V246 S251 R252 Y253 F256 F286 L334 V346 | V245-I249 HydrophobicContact CG1-CD1 3.74Å; V245-I249 HydrophobicContact CG1-CG1 4.25Å; V245-I249 VanDerWaalsContact O-CG1 3.28Å; V245-I249 WeakPolarHBondContact O-CG1 3.44Å; V245-I249 PolarHBondContact O-N 3.11Å; V246-I249 PolarHBondContact O-N 3Å; I249-S251 PolarHBondContact O-N 3.13Å; I249-R252 PolarHBondContact O-N 2.8Å; I249-Y253 HydrophobicContact CB-CD2 4.43Å; I249-Y253 HydrophobicContact CG2-CD2 3.53Å; I249-Y253 HydrophobicContact CG2-CE2 3.93Å; I249-Y253 VanDerWaalsContact O-CD2 3.25Å; I249-Y253 WeakPolarHBondContact O-CD2 3.45Å; I249-Y253 PolarHBondContact O-N 3.03Å; I249-F256 HydrophobicContact CG2-CD2 3.82Å; I249-F256 HydrophobicContact CG2-CE2 3.73Å; I249-F286 HydrophobicContact CD1-CE2 3.56Å; I249-F286 HydrophobicContact CD1-CZ 3.49Å; I249-F286 VanDerWaalsContact CD1-CZ 3.49Å; I249-L334 HydrophobicContact CG2-CD1 4.16Å; I249-V346 HydrophobicContact CD1-CG1 4.49Å |
| 250 | K | 96.2 | Very high | 96 | Very high | 43 Ų | 43 | 32.2 Ų | 32.2 | 19% | 0.187 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -52.3 | -42.8 | 175.2 | 172.7 | -172.8 | 173.1 | 73 | 0 | 111.9 | V246 D248 R252 F256 D257 L259 I264 | V246-K250 VanDerWaalsContact O-CB 3.3Å; V246-K250 WeakPolarHBondContact O-CB 3.21Å; V246-K250 PolarHBondContact O-N 3.02Å; D248-K250 VanDerWaalsContact C-N 3.3Å; D248-K250 PolarHBondContact O-N 3.44Å; K250-R252 PolarHBondContact O-N 3.06Å; K250-F256 HydrophobicContact CB-CB 4.27Å; K250-F256 HydrophobicContact CG-CB 4.27Å; K250-F256 PolarHBondContact NZ-O 3.17Å; K250-D257 PolarHBondContact NZ-O 3.01Å; K250-L259 WeakPolarHBondContact CD-O 3.24Å; K250-L259 WeakPolarHBondContact CE-O 3.36Å; K250-L259 PolarHBondContact NZ-O 2.65Å; K250-I264 HydrophobicContact CD-CD1 4.05Å |
| 251 | S | 94 | Very high | 95.9 | Very high | 92 Ų | 92 | 33.1 Ų | 33.1 | 64% | 0.643 | 17% | 0.174 | S | C | * | . | H | α-helix | trans | -70.3 | -15.5 | -180 | 71.7 | 0 | 0 | 0 | 0 | 114.4 | K247 D248 I249 | K247-S251 PolarHBondContact O-N 3.3Å; D248-S251 PolarHBondContact O-N 3.22Å; D248-S251 PolarHBondContact O-OG 3.23Å; I249-S251 PolarHBondContact O-N 3.13Å |
| 252 | R | 94.5 | Very high | 95.9 | Very high | 68 Ų | 68 | 33.3 Ų | 33.3 | 26% | 0.257 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -101.3 | -21.7 | -178.9 | -67.9 | -173.8 | -71.8 | 106.5 | -3.9 | 113.8 | D248 I249 K250 L345 V346 L347 | D248-R252 PolarHBondContact O-N 3.32Å; D248-R252 IonicContact OD1-NE 2.9Å; D248-R252 IonicContact OD2-CZ 3.05Å; D248-R252 IonicContact OD2-NE 3.36Å; D248-R252 PolarHBondContact OD2-NE 2.91Å; D248-R252 IonicContact OD2-NH2 2.93Å; D248-R252 PolarHBondContact OD2-NH2 3.35Å; I249-R252 PolarHBondContact O-N 2.8Å; K250-R252 PolarHBondContact O-N 3.06Å; R252-L345 PolarHBondContact NH1-O 2.81Å; R252-V346 PolarHBondContact NH1-O 2.75Å; R252-V346 VanDerWaalsContact NH1-O 3.09Å; R252-V346 PolarHBondContact NH2-O 3.23Å; R252-L347 VanDerWaalsContact NH2-C 3.27Å; R252-L347 PolarHBondContact NH2-O 2.71Å |
| 253 | Y | 94.9 | Very high | 95.8 | Very high | 10 Ų | 10 | 33.4 Ų | 33.4 | 4% | 0.039 | 17% | 0.174 | C | C | . | . | trans | -124.3 | 109.2 | -175.5 | -61.2 | -69.5 | 0 | 0 | 0 | 110.9 | I249 G255 F256 L334 L345 D355 V356 T357 | I249-Y253 HydrophobicContact CB-CD2 4.43Å; I249-Y253 HydrophobicContact CG2-CD2 3.53Å; I249-Y253 HydrophobicContact CG2-CE2 3.93Å; I249-Y253 VanDerWaalsContact O-CD2 3.25Å; I249-Y253 WeakPolarHBondContact O-CD2 3.45Å; I249-Y253 PolarHBondContact O-N 3.03Å; Y253-G255 PolarHBondContact O-N 3.47Å; Y253-G255 VanDerWaalsContact O-N 3.12Å; Y253-F256 PolarHBondContact O-N 3Å; Y253-L334 HydrophobicContact CD1-CD2 4.22Å; Y253-L334 HydrophobicContact CD2-CD1 4.2Å; Y253-L334 HydrophobicContact CD2-CD2 4.19Å; Y253-L334 HydrophobicContact CE1-CD2 3.84Å; Y253-L334 HydrophobicContact CE2-CD1 4.34Å; Y253-L334 HydrophobicContact CE2-CD2 3.76Å; Y253-L334 HydrophobicContact CG-CD2 4.4Å; Y253-L345 PolarHBondContact OH-O 3.41Å; Y253-D355 WeakPolarHBondContact CA-OD2 3.28Å; Y253-D355 VanDerWaalsContact CD1-OD1 3.28Å; Y253-D355 WeakPolarHBondContact CD1-OD1 3.24Å; Y253-V356 HydrophobicContact CE1-CG2 3.78Å; Y253-T357 HydrophobicContact CD1-CG2 3.61Å; Y253-T357 HydrophobicContact CE1-CG2 3.99Å; Y253-T357 HydrophobicContact CG-CG2 4.47Å | ||
| 254 | K | 92.8 | Very high | 95.8 | Very high | 118 Ų | 118 | 33.5 Ų | 33.5 | 51% | 0.513 | 18% | 0.175 | S | C | . | . | G | 310 helix | trans | -60.6 | -29.4 | -171.7 | -61.1 | -165.2 | -158.8 | 126 | 0 | 113.4 | F256 D257 D355 E358 | K254-F256 PolarHBondContact O-N 3.05Å; K254-D257 WeakPolarHBondContact O-CB 3.46Å; K254-D257 PolarHBondContact O-N 3.32Å; K254-D355 PolarHBondContact N-OD2 3.38Å; K254-E358 VanDerWaalsContact CD-OE1 3.31Å; K254-E358 WeakPolarHBondContact CD-OE1 3.23Å; K254-E358 WeakPolarHBondContact CE-OE1 3.46Å; K254-E358 VanDerWaalsContact NZ-CD 3.29Å; K254-E358 IonicContact NZ-OE1 2.71Å; K254-E358 PolarHBondContact NZ-OE1 3.15Å; K254-E358 IonicContact NZ-OE2 3.55Å; K254-E358 PolarHBondContact NZ-OE2 3.09Å |
| 255 | G | 93 | Very high | 95.8 | Very high | 7 Ų | 7 | 32.1 Ų | 32.1 | 7% | 0.072 | 17% | 0.17 | C | C | . | . | G | 310 helix | trans | -67.3 | -8 | 179 | 0 | 0 | 0 | 0 | 0 | 114.9 | Y253 S326 I327 T330 | Y253-G255 PolarHBondContact O-N 3.47Å; Y253-G255 VanDerWaalsContact O-N 3.12Å; G255-S326 WeakPolarHBondContact CA-OG 3.48Å; G255-S326 CarbonylContact O-C 3.6Å; G255-I327 WeakPolarHBondContact O-CA 3.13Å; G255-I327 WeakPolarHBondContact O-CG1 3.21Å; G255-I327 PolarHBondContact O-N 2.74Å; G255-T330 VanDerWaalsContact CA-OG1 3.29Å; G255-T330 WeakPolarHBondContact CA-OG1 3.49Å |
| 256 | F | 96 | Very high | 95.7 | Very high | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 17% | 0.172 | C | C | . | . | G | 310 helix | trans | -97.3 | 5.6 | 168.4 | -71 | -19 | 0 | 0 | 0 | 113.9 | I249 K250 Y253 K254 S258 L259 L290 L293 I327 T330 A331 L334 | I249-F256 HydrophobicContact CG2-CD2 3.82Å; I249-F256 HydrophobicContact CG2-CE2 3.73Å; K250-F256 HydrophobicContact CB-CB 4.27Å; K250-F256 HydrophobicContact CG-CB 4.27Å; K250-F256 PolarHBondContact NZ-O 3.17Å; Y253-F256 PolarHBondContact O-N 3Å; K254-F256 PolarHBondContact O-N 3.05Å; F256-S258 PolarHBondContact O-N 3.03Å; F256-S258 VanDerWaalsContact O-N 3.16Å; F256-L259 HydrophobicContact CB-CD1 4Å; F256-L259 HydrophobicContact CD1-CD1 3.76Å; F256-L259 HydrophobicContact CE1-CD1 4.34Å; F256-L259 HydrophobicContact CG-CD1 3.85Å; F256-L259 WeakPolarHBondContact O-CB 3.3Å; F256-L259 PolarHBondContact O-N 3.36Å; F256-L290 HydrophobicContact CE2-CD2 4.33Å; F256-L290 HydrophobicContact CZ-CD2 4.07Å; F256-L293 HydrophobicContact CE1-CD1 4Å; F256-L293 HydrophobicContact CZ-CD1 4.09Å; F256-I327 HydrophobicContact CD1-CB 4.4Å; F256-I327 HydrophobicContact CD1-CG1 4.42Å; F256-I327 HydrophobicContact CD1-CG2 4.05Å; F256-I327 HydrophobicContact CE1-CG2 3.99Å; F256-I327 WeakPolarHBondContact CE1-O 3.24Å; F256-T330 HydrophobicContact CD1-CG2 3.87Å; F256-T330 HydrophobicContact CD2-CG2 4.17Å; F256-T330 HydrophobicContact CE1-CG2 3.7Å; F256-T330 HydrophobicContact CE2-CG2 4.01Å; F256-T330 HydrophobicContact CG-CG2 4.11Å; F256-T330 HydrophobicContact CZ-CG2 3.78Å; F256-A331 HydrophobicContact CE1-CB 4.2Å; F256-A331 HydrophobicContact CZ-CB 4.13Å; F256-L334 HydrophobicContact CE2-CD1 3.55Å; F256-L334 HydrophobicContact CZ-CD1 3.85Å |
| 257 | D | 95.1 | Very high | 95.6 | Very high | 102 Ų | 102 | 32.5 Ų | 32.5 | 55% | 0.545 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.4 | -28.6 | -176.4 | -77.1 | -15.1 | 0 | 0 | 0 | 114.1 | K250 K254 | K250-D257 PolarHBondContact NZ-O 3.01Å; K254-D257 WeakPolarHBondContact O-CB 3.46Å; K254-D257 PolarHBondContact O-N 3.32Å |
| 258 | S | 96.1 | Very high | 95.5 | Very high | 21 Ų | 21 | 31 Ų | 31 | 15% | 0.147 | 17% | 0.166 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82 | -13.7 | 176.8 | 59.2 | 0 | 0 | 0 | 0 | 114 | F256 N260 M263 I327 | F256-S258 PolarHBondContact O-N 3.03Å; F256-S258 VanDerWaalsContact O-N 3.16Å; S258-N260 PolarHBondContact O-N 3.01Å; S258-M263 WeakPolarHBondContact O-CE 3.14Å; S258-I327 WeakPolarHBondContact OG-CD1 3.25Å |
| 259 | L | 96.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.17 | C | C | . | . | trans | -68.1 | 95.4 | 174 | -70.7 | 177.6 | 0 | 0 | 0 | 111.2 | K250 F256 M263 I264 L293 L298 I327 | K250-L259 WeakPolarHBondContact CD-O 3.24Å; K250-L259 WeakPolarHBondContact CE-O 3.36Å; K250-L259 PolarHBondContact NZ-O 2.65Å; F256-L259 HydrophobicContact CB-CD1 4Å; F256-L259 HydrophobicContact CD1-CD1 3.76Å; F256-L259 HydrophobicContact CE1-CD1 4.34Å; F256-L259 HydrophobicContact CG-CD1 3.85Å; F256-L259 WeakPolarHBondContact O-CB 3.3Å; F256-L259 PolarHBondContact O-N 3.36Å; L259-M263 HydrophobicContact CD2-SD 4.5Å; L259-I264 HydrophobicContact CB-CD1 4.33Å; L259-I264 HydrophobicContact CB-CG1 4.17Å; L259-L293 HydrophobicContact CD1-CD1 4.08Å; L259-L298 HydrophobicContact CD2-CD1 4.14Å; L259-I327 HydrophobicContact CD1-CG2 4.23Å; L259-I327 HydrophobicContact CD2-CD1 3.58Å; L259-I327 HydrophobicContact CD2-CG1 4.19Å; L259-I327 HydrophobicContact CD2-CG2 4.17Å; L259-I327 HydrophobicContact CG-CD1 3.79Å; L259-I327 HydrophobicContact CG-CG1 3.96Å; L259-I327 HydrophobicContact CG-CG2 4.31Å | ||
| 260 | N | 94.6 | Very high | 95.2 | Very high | 67 Ų | 67 | 37 Ų | 37 | 36% | 0.358 | 19% | 0.189 | S | C | . | . | trans | -64.2 | 157.9 | 172.7 | 75.5 | 43.3 | 0 | 0 | 0 | 111.7 | S258 W262 M263 I264 | S258-N260 PolarHBondContact O-N 3.01Å; N260-W262 PolarHBondContact O-N 3.35Å; N260-W262 WeakPolarHBondContact OD1-CB 3.43Å; N260-W262 PolarHBondContact OD1-N 2.84Å; N260-W262 VanDerWaalsContact OD1-N 3.09Å; N260-M263 HydrophobicContact CB-CE 4.02Å; N260-M263 VanDerWaalsContact CG-CE 3.49Å; N260-M263 VanDerWaalsContact N-CE 3.3Å; N260-M263 WeakPolarHBondContact ND2-CE 3.25Å; N260-M263 PolarHBondContact O-N 3.33Å; N260-M263 PolarHBondContact OD1-N 3.06Å; N260-I264 PolarHBondContact O-N 2.82Å | ||
| 261 | P | 94.9 | Very high | 95 | Very high | 73 Ų | 73 | 35.1 Ų | 35.1 | 47% | 0.474 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -57.2 | -34.3 | -177.4 | -27.9 | 36.1 | 0 | 0 | 0 | 114.5 | I264 E265 | P261-I264 PolarHBondContact O-N 2.81Å; P261-E265 VanDerWaalsContact O-CG 3.31Å; P261-E265 WeakPolarHBondContact O-CG 3.33Å; P261-E265 PolarHBondContact O-N 3.4Å |
| 262 | W | 96.4 | Very high | 94.8 | Very high | 20 Ų | 20 | 31 Ų | 31 | 8% | 0.076 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -68.6 | -43.3 | -180 | 179.4 | -128 | 0 | 0 | 0 | 112.2 | H226 W229 N260 I264 E265 V266 D307 P308 C309 | H226-W262 HydrophobicContact CB-CD2 4.2Å; H226-W262 HydrophobicContact CB-CE3 3.62Å; H226-W262 HydrophobicContact CB-CH2 3.96Å; H226-W262 HydrophobicContact CB-CZ2 4.47Å; H226-W262 HydrophobicContact CB-CZ3 3.5Å; H226-W262 VanDerWaalsContact CB-CZ3 3.5Å; H226-W262 AromaticContact CD2-CD2 3.6Å; H226-W262 AromaticContact CD2-CE2 3.29Å; H226-W262 AromaticContact CD2-CE3 3.91Å; H226-W262 AromaticContact CD2-CH2 3.67Å; H226-W262 AromaticContact CD2-CZ2 3.32Å; H226-W262 WeakPolarHBondContact CD2-CZ2 3.31Å; H226-W262 AromaticContact CD2-CZ3 3.95Å; H226-W262 AromaticContact CD2-NE1 3.75Å; H226-W262 AromaticContact CE1-CD1 3.58Å; H226-W262 AromaticContact CE1-CD2 3.71Å; H226-W262 AromaticContact CE1-CE2 3.85Å; H226-W262 AromaticContact CE1-CG 3.55Å; H226-W262 AromaticContact CE1-NE1 3.73Å; H226-W262 AromaticContact CG-CD2 3.54Å; H226-W262 AromaticContact CG-CE2 3.76Å; H226-W262 AromaticContact CG-CE3 3.51Å; H226-W262 AromaticContact CG-CH2 3.93Å; H226-W262 AromaticContact CG-CZ2 3.95Å; H226-W262 AromaticContact CG-CZ3 3.72Å; H226-W262 AromaticContact ND1-CD2 3.62Å; H226-W262 AromaticContact ND1-CE3 3.87Å; H226-W262 AromaticContact ND1-CG 3.72Å; H226-W262 AromaticContact NE2-CD1 3.66Å; H226-W262 AromaticContact NE2-CD2 3.74Å; H226-W262 AromaticContact NE2-CE2 3.39Å; H226-W262 AromaticContact NE2-CG 3.9Å; H226-W262 AromaticContact NE2-CZ2 3.86Å; H226-W262 AromaticContact NE2-NE1 3.31Å; H226-W262 PolarHBondContact NE2-NE1 3.13Å; W229-W262 HydrophobicContact CB-CH2 4.27Å; W229-W262 AromaticContact CD2-CH2 3.77Å; W229-W262 HydrophobicContact CD2-CH2 3.77Å; W229-W262 HydrophobicContact CD2-CZ3 4.4Å; W229-W262 AromaticContact CE3-CH2 3.4Å; W229-W262 HydrophobicContact CE3-CH2 3.4Å; W229-W262 VanDerWaalsContact CE3-CH2 3.4Å; W229-W262 AromaticContact CE3-CZ3 3.59Å; W229-W262 HydrophobicContact CE3-CZ3 3.59Å; W229-W262 HydrophobicContact CG-CH2 4.14Å; W229-W262 AromaticContact CZ3-CH2 3.99Å; W229-W262 HydrophobicContact CZ3-CH2 3.99Å; W229-W262 AromaticContact CZ3-CZ3 3.97Å; W229-W262 HydrophobicContact CZ3-CZ3 3.97Å; N260-W262 PolarHBondContact O-N 3.35Å; N260-W262 WeakPolarHBondContact OD1-CB 3.43Å; N260-W262 PolarHBondContact OD1-N 2.84Å; N260-W262 VanDerWaalsContact OD1-N 3.09Å; W262-I264 VanDerWaalsContact C-N 3.29Å; W262-I264 PolarHBondContact O-N 3.3Å; W262-E265 HydrophobicContact CE3-CB 4.29Å; W262-E265 PolarHBondContact O-N 2.96Å; W262-E265 VanDerWaalsContact O-N 3.17Å; W262-V266 HydrophobicContact CD2-CG2 3.89Å; W262-V266 HydrophobicContact CE3-CG2 4.13Å; W262-V266 HydrophobicContact CH2-CG2 3.94Å; W262-V266 HydrophobicContact CZ2-CG2 3.68Å; W262-V266 HydrophobicContact CZ3-CG2 4.15Å; W262-V266 WeakPolarHBondContact O-CG2 3.18Å; W262-V266 PolarHBondContact O-N 2.94Å; W262-D307 WeakPolarHBondContact CZ2-OD1 3.4Å; W262-D307 VanDerWaalsContact NE1-CG 3.29Å; W262-D307 PolarHBondContact NE1-OD1 3.25Å; W262-D307 PolarHBondContact NE1-OD2 2.98Å; W262-P308 HydrophobicContact CH2-CG 4.06Å; W262-P308 HydrophobicContact CZ2-CG 3.73Å; W262-C309 HydrophobicContact CZ2-CB 4.28Å |
| 263 | M | 96.2 | Very high | 94.5 | Very high | 2 Ų | 2 | 31.3 Ų | 31.3 | 1% | 0.01 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57.2 | -44.2 | 173.3 | -76.1 | -168.8 | -81.7 | 0 | 0 | 111.2 | S258 L259 N260 E265 L267 I315 H316 L319 | S258-M263 WeakPolarHBondContact O-CE 3.14Å; L259-M263 HydrophobicContact CD2-SD 4.5Å; N260-M263 HydrophobicContact CB-CE 4.02Å; N260-M263 VanDerWaalsContact CG-CE 3.49Å; N260-M263 VanDerWaalsContact N-CE 3.3Å; N260-M263 WeakPolarHBondContact ND2-CE 3.25Å; N260-M263 PolarHBondContact O-N 3.33Å; N260-M263 PolarHBondContact OD1-N 3.06Å; M263-E265 PolarHBondContact O-N 3.44Å; M263-L267 HydrophobicContact CB-CD1 4.48Å; M263-L267 VanDerWaalsContact O-CB 3.25Å; M263-L267 WeakPolarHBondContact O-CB 3.44Å; M263-L267 WeakPolarHBondContact O-CD1 3.46Å; M263-L267 WeakPolarHBondContact O-CG 3.26Å; M263-L267 PolarHBondContact O-N 3.15Å; M263-I315 HydrophobicContact CG-CB 4.14Å; M263-I315 HydrophobicContact CG-CD1 4.48Å; M263-I315 HydrophobicContact CG-CG1 4.31Å; M263-I315 WeakPolarHBondContact CG-O 3.34Å; M263-I315 VanDerWaalsContact SD-O 3.39Å; M263-H316 HydrophobicContact SD-CB 4.26Å; M263-L319 HydrophobicContact CE-CD1 4.12Å; M263-L319 HydrophobicContact CE-CD2 3.8Å; M263-L319 HydrophobicContact CE-CG 4.13Å; M263-L319 HydrophobicContact SD-CD1 3.93Å; M263-L319 HydrophobicContact SD-CG 4.28Å |
| 264 | I | 97.6 | Very high | 93.8 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.005 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -58.7 | -49.2 | 176.5 | -66.3 | 167.9 | 0 | 0 | 0 | 110.4 | V243 V246 K247 K250 L259 N260 P261 W262 V266 V268 | V243-I264 HydrophobicContact CG1-CG2 4.38Å; V243-I264 HydrophobicContact CG2-CG2 4.39Å; V246-I264 HydrophobicContact CB-CG2 3.96Å; V246-I264 HydrophobicContact CG1-CB 4.41Å; V246-I264 HydrophobicContact CG1-CD1 4.06Å; V246-I264 HydrophobicContact CG1-CG1 3.96Å; V246-I264 HydrophobicContact CG1-CG2 3.61Å; K247-I264 HydrophobicContact CG-CD1 4.38Å; K250-I264 HydrophobicContact CD-CD1 4.05Å; L259-I264 HydrophobicContact CB-CD1 4.33Å; L259-I264 HydrophobicContact CB-CG1 4.17Å; N260-I264 PolarHBondContact O-N 2.82Å; P261-I264 PolarHBondContact O-N 2.81Å; W262-I264 VanDerWaalsContact C-N 3.29Å; W262-I264 PolarHBondContact O-N 3.3Å; I264-V266 PolarHBondContact O-N 3.29Å; I264-V268 HydrophobicContact CG2-CG2 4.16Å; I264-V268 VanDerWaalsContact O-CB 3.24Å; I264-V268 WeakPolarHBondContact O-CB 3.28Å; I264-V268 WeakPolarHBondContact O-CG2 3.14Å; I264-V268 PolarHBondContact O-N 3.19Å |
| 265 | E | 97.4 | Very high | 92.9 | Very high | 4 Ų | 4 | 27.4 Ų | 27.4 | 2% | 0.019 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.2 | -47.7 | -178.3 | -70.8 | 169.8 | -170.7 | 0 | 0 | 112.4 | K129 F230 V243 P261 W262 M263 H269 | K129-E265 WeakPolarHBondContact CD-OE1 3.42Å; K129-E265 VanDerWaalsContact NZ-CD 3.29Å; K129-E265 IonicContact NZ-OE1 2.79Å; K129-E265 PolarHBondContact NZ-OE1 2.99Å; K129-E265 VanDerWaalsContact NZ-OE1 3.14Å; K129-E265 IonicContact NZ-OE2 3.17Å; K129-E265 PolarHBondContact NZ-OE2 3.09Å; F230-E265 HydrophobicContact CD2-CB 4.21Å; F230-E265 HydrophobicContact CD2-CG 4.08Å; F230-E265 HydrophobicContact CE2-CB 4.24Å; F230-E265 HydrophobicContact CE2-CG 3.92Å; V243-E265 HydrophobicContact CG1-CG 4.28Å; V243-E265 HydrophobicContact CG2-CG 4.26Å; P261-E265 VanDerWaalsContact O-CG 3.31Å; P261-E265 WeakPolarHBondContact O-CG 3.33Å; P261-E265 PolarHBondContact O-N 3.4Å; W262-E265 HydrophobicContact CE3-CB 4.29Å; W262-E265 PolarHBondContact O-N 2.96Å; W262-E265 VanDerWaalsContact O-N 3.17Å; M263-E265 PolarHBondContact O-N 3.44Å; E265-H269 VanDerWaalsContact O-CB 3.28Å; E265-H269 WeakPolarHBondContact O-CB 3.23Å; E265-H269 PolarHBondContact O-N 3.45Å |
| 266 | V | 95.4 | Very high | 91.6 | Very high | 8 Ų | 8 | 30.4 Ų | 30.4 | 5% | 0.048 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -67.1 | -45.1 | -179.2 | 177.2 | 0 | 0 | 0 | 0 | 111.6 | W229 W262 I264 H269 Y270 L305 P308 I315 | W229-V266 HydrophobicContact CH2-CG2 4.31Å; W229-V266 HydrophobicContact CZ3-CG2 4.41Å; W262-V266 HydrophobicContact CD2-CG2 3.89Å; W262-V266 HydrophobicContact CE3-CG2 4.13Å; W262-V266 HydrophobicContact CH2-CG2 3.94Å; W262-V266 HydrophobicContact CZ2-CG2 3.68Å; W262-V266 HydrophobicContact CZ3-CG2 4.15Å; W262-V266 WeakPolarHBondContact O-CG2 3.18Å; W262-V266 PolarHBondContact O-N 2.94Å; I264-V266 PolarHBondContact O-N 3.29Å; V266-H269 PolarHBondContact O-N 2.97Å; V266-Y270 WeakPolarHBondContact O-CB 3.25Å; V266-Y270 PolarHBondContact O-N 2.64Å; V266-L305 HydrophobicContact CG1-CD2 4.11Å; V266-P308 HydrophobicContact CG2-CG 4.21Å; V266-I315 HydrophobicContact CB-CD1 4.22Å; V266-I315 HydrophobicContact CB-CG2 4.47Å; V266-I315 HydrophobicContact CG1-CD1 4.07Å; V266-I315 HydrophobicContact CG1-CG2 4.22Å; V266-I315 HydrophobicContact CG2-CG2 4.45Å |
| 267 | L | 95.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65 | -40.3 | 179.3 | -71.1 | 167.8 | 0 | 0 | 0 | 112 | M263 S271 F289 L292 L293 L298 L305 I315 | M263-L267 HydrophobicContact CB-CD1 4.48Å; M263-L267 VanDerWaalsContact O-CB 3.25Å; M263-L267 WeakPolarHBondContact O-CB 3.44Å; M263-L267 WeakPolarHBondContact O-CD1 3.46Å; M263-L267 WeakPolarHBondContact O-CG 3.26Å; M263-L267 PolarHBondContact O-N 3.15Å; L267-S271 WeakPolarHBondContact O-CB 3.4Å; L267-S271 PolarHBondContact O-N 3.05Å; L267-S271 PolarHBondContact O-OG 3.02Å; L267-F289 HydrophobicContact CB-CD2 3.95Å; L267-F289 HydrophobicContact CB-CE2 3.72Å; L267-F289 HydrophobicContact CD1-CE2 4.31Å; L267-L292 HydrophobicContact CD2-CD2 3.62Å; L267-L292 HydrophobicContact CD2-CG 4.43Å; L267-L293 HydrophobicContact CD1-CD2 3.87Å; L267-L298 HydrophobicContact CD1-CD2 4.42Å; L267-L298 HydrophobicContact CD2-CD2 4.2Å; L267-L305 HydrophobicContact CD2-CD1 3.77Å; L267-L305 HydrophobicContact CD2-CD2 4.21Å; L267-I315 HydrophobicContact CD1-CD1 4.5Å; L267-I315 HydrophobicContact CD2-CD1 4.02Å; L267-I315 HydrophobicContact CG-CD1 3.87Å |
| 268 | V | 96.5 | Very high | 88.6 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68.5 | -45.3 | 176.9 | 170.4 | 0 | 0 | 0 | 0 | 110.8 | V239 I242 V243 V246 I264 Y270 S271 V272 F289 | V239-V268 HydrophobicContact CB-CG1 4.5Å; V239-V268 HydrophobicContact CG1-CG1 4.05Å; I242-V268 HydrophobicContact CB-CG1 3.59Å; I242-V268 HydrophobicContact CB-CG2 4.49Å; I242-V268 HydrophobicContact CD1-CG1 4.45Å; I242-V268 HydrophobicContact CG2-CB 4.19Å; I242-V268 HydrophobicContact CG2-CG1 3.49Å; I242-V268 VanDerWaalsContact CG2-CG1 3.49Å; I242-V268 HydrophobicContact CG2-CG2 3.57Å; V243-V268 HydrophobicContact CG2-CB 4.05Å; V243-V268 HydrophobicContact CG2-CG1 3.98Å; V243-V268 HydrophobicContact CG2-CG2 4.29Å; V246-V268 HydrophobicContact CG2-CG2 4.38Å; I264-V268 HydrophobicContact CG2-CG2 4.16Å; I264-V268 VanDerWaalsContact O-CB 3.24Å; I264-V268 WeakPolarHBondContact O-CB 3.28Å; I264-V268 WeakPolarHBondContact O-CG2 3.14Å; I264-V268 PolarHBondContact O-N 3.19Å; V268-Y270 VanDerWaalsContact C-N 3.33Å; V268-Y270 PolarHBondContact O-N 3Å; V268-S271 PolarHBondContact O-N 2.9Å; V268-S271 VanDerWaalsContact O-N 3.12Å; V268-V272 WeakPolarHBondContact O-CG2 3.35Å; V268-V272 PolarHBondContact O-N 2.88Å; V268-F289 HydrophobicContact CG2-CD2 3.64Å; V268-F289 HydrophobicContact CG2-CE2 3.8Å; V268-F289 HydrophobicContact CG2-CG 4.29Å |
| 269 | H | 94.6 | Very high | 87.4 | Confident | 35 Ų | 35 | 36.5 Ų | 36.5 | 16% | 0.162 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -53.8 | -51.8 | 173.8 | 165.9 | -94.4 | 0 | 0 | 0 | 110.5 | W229 F233 A234 E265 V266 S271 V272 T273 | W229-H269 HydrophobicContact CH2-CB 3.65Å; W229-H269 AromaticContact CH2-CG 3.52Å; W229-H269 AromaticContact CH2-ND1 3.7Å; W229-H269 HydrophobicContact CZ2-CB 4.47Å; W229-H269 AromaticContact CZ2-CE1 3.9Å; W229-H269 AromaticContact CZ2-CG 3.89Å; W229-H269 AromaticContact CZ2-ND1 3.64Å; W229-H269 HydrophobicContact CZ3-CB 4.47Å; F233-H269 PolarHBondContact O-CD2 2.74Å; F233-H269 PolarHBondContact O-NE2 2.87Å; A234-H269 HydrophobicContact CB-CB 4.32Å; E265-H269 VanDerWaalsContact O-CB 3.28Å; E265-H269 WeakPolarHBondContact O-CB 3.23Å; E265-H269 PolarHBondContact O-N 3.45Å; V266-H269 PolarHBondContact O-N 2.97Å; H269-S271 VanDerWaalsContact C-N 3.29Å; H269-S271 PolarHBondContact O-N 3.39Å; H269-V272 PolarHBondContact O-N 3.28Å; H269-V272 VanDerWaalsContact O-N 3.11Å; H269-T273 PolarHBondContact CE1-OG1 3.35Å; H269-T273 WeakPolarHBondContact NE2-CG2 3.28Å; H269-T273 PolarHBondContact O-N 3.5Å; H269-T273 PolarHBondContact O-OG1 3.16Å |
| 270 | Y | 91.9 | Very high | 86.5 | Confident | 107 Ų | 107 | 38.5 Ų | 38.5 | 42% | 0.42 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -56.6 | -43.2 | 176.9 | 178.2 | -94.6 | 0 | 0 | 0 | 112 | V266 V268 V272 T273 S274 L292 L305 | V266-Y270 WeakPolarHBondContact O-CB 3.25Å; V266-Y270 PolarHBondContact O-N 2.64Å; V268-Y270 VanDerWaalsContact C-N 3.33Å; V268-Y270 PolarHBondContact O-N 3Å; Y270-V272 PolarHBondContact O-N 3.42Å; Y270-T273 PolarHBondContact O-N 3.37Å; Y270-S274 WeakPolarHBondContact O-CB 3.3Å; Y270-S274 PolarHBondContact O-N 3.17Å; Y270-S274 PolarHBondContact O-OG 2.85Å; Y270-L292 HydrophobicContact CD1-CD2 3.85Å; Y270-L292 HydrophobicContact CE1-CD1 4.45Å; Y270-L292 HydrophobicContact CE1-CD2 4.27Å; Y270-L305 HydrophobicContact CD1-CD2 4.39Å; Y270-L305 HydrophobicContact CD2-CD2 4.11Å; Y270-L305 HydrophobicContact CG-CD2 3.82Å |
| 271 | S | 90.3 | Very high | 86.1 | Confident | 2 Ų | 2 | 36.3 Ų | 36.3 | 1% | 0.014 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64.7 | -29.2 | -179.2 | -58.4 | 0 | 0 | 0 | 0 | 113 | L267 V268 H269 I275 A285 F289 | L267-S271 WeakPolarHBondContact O-CB 3.4Å; L267-S271 PolarHBondContact O-N 3.05Å; L267-S271 PolarHBondContact O-OG 3.02Å; V268-S271 PolarHBondContact O-N 2.9Å; V268-S271 VanDerWaalsContact O-N 3.12Å; H269-S271 VanDerWaalsContact C-N 3.29Å; H269-S271 PolarHBondContact O-N 3.39Å; S271-I275 WeakPolarHBondContact O-CD1 3.42Å; S271-I275 WeakPolarHBondContact O-CG1 3.34Å; S271-A285 WeakPolarHBondContact CB-O 3.35Å; S271-F289 VanDerWaalsContact OG-CA 3.31Å; S271-F289 WeakPolarHBondContact OG-CA 3.19Å; S271-F289 PolarHBondContact OG-N 2.64Å |
| 272 | V | 91.1 | Very high | 85.9 | Confident | 5 Ų | 5 | 33.7 Ų | 33.7 | 3% | 0.03 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -83.1 | -48.2 | 176.8 | 168.4 | 0 | 0 | 0 | 0 | 111.8 | A238 V239 I242 V268 H269 Y270 T280 A285 | A238-V272 HydrophobicContact CB-CG1 4.49Å; A238-V272 HydrophobicContact CB-CG2 4.4Å; V239-V272 HydrophobicContact CG2-CB 4.06Å; V239-V272 HydrophobicContact CG2-CG1 4Å; V239-V272 HydrophobicContact CG2-CG2 4.02Å; I242-V272 HydrophobicContact CD1-CG2 3.93Å; V268-V272 WeakPolarHBondContact O-CG2 3.35Å; V268-V272 PolarHBondContact O-N 2.88Å; H269-V272 PolarHBondContact O-N 3.28Å; H269-V272 VanDerWaalsContact O-N 3.11Å; Y270-V272 PolarHBondContact O-N 3.42Å; V272-T280 HydrophobicContact CG1-CG2 3.87Å; V272-A285 HydrophobicContact CG2-CB 3.76Å |
| 273 | T | 86.9 | Confident | 85.8 | Confident | 76 Ų | 76 | 32.7 Ų | 32.7 | 47% | 0.466 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -86.4 | -20.6 | -169.9 | 57.2 | 0 | 0 | 0 | 0 | 114.1 | H269 Y270 I275 | H269-T273 PolarHBondContact CE1-OG1 3.35Å; H269-T273 WeakPolarHBondContact NE2-CG2 3.28Å; H269-T273 PolarHBondContact O-N 3.5Å; H269-T273 PolarHBondContact O-OG1 3.16Å; Y270-T273 PolarHBondContact O-N 3.37Å; T273-I275 PolarHBondContact O-N 3.44Å |
| 274 | S | 80.9 | Confident | 85.4 | Confident | 33 Ų | 33 | 32.6 Ų | 32.6 | 23% | 0.231 | 19% | 0.193 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -3.6 | 173.6 | 62.7 | 0 | 0 | 0 | 0 | 114 | Y270 P276 R288 | Y270-S274 WeakPolarHBondContact O-CB 3.3Å; Y270-S274 PolarHBondContact O-N 3.17Å; Y270-S274 PolarHBondContact O-OG 2.85Å; S274-P276 WeakPolarHBondContact O-CD 3.2Å; S274-R288 PolarHBondContact OG-NH2 2.81Å |
| 275 | I | 73.5 | Confident | 85 | Confident | 12 Ų | 12 | 32.6 Ų | 32.6 | 6% | 0.062 | 19% | 0.193 | C | C | . | . | trans | -82.1 | 116.3 | 177.7 | -58.2 | 175.6 | 0 | 0 | 0 | 108.2 | S271 T273 L277 T280 A285 | S271-I275 WeakPolarHBondContact O-CD1 3.42Å; S271-I275 WeakPolarHBondContact O-CG1 3.34Å; T273-I275 PolarHBondContact O-N 3.44Å; I275-L277 HydrophobicContact CG2-CB 3.8Å; I275-L277 HydrophobicContact CG2-CD1 3.65Å; I275-L277 HydrophobicContact CG2-CG 3.58Å; I275-L277 PolarHBondContact O-N 3.45Å; I275-T280 HydrophobicContact CD1-CG2 4.41Å; I275-A285 HydrophobicContact CD1-CB 4Å | ||
| 276 | P | 66.4 | Low | 84.9 | Confident | 70 Ų | 70 | 32.4 Ų | 32.4 | 46% | 0.455 | 19% | 0.192 | S | C | . | . | trans | -77.7 | 34.1 | -175.6 | 34.5 | -36.5 | 0 | 0 | 0 | 113.2 | R55 L58 S274 | R55-P276 HydrophobicContact CG-CG 4.48Å; L58-P276 HydrophobicContact CD1-CG 4.33Å; S274-P276 WeakPolarHBondContact O-CD 3.2Å | ||
| 277 | L | 66.9 | Low | 84.6 | Confident | 29 Ų | 29 | 32 Ų | 32 | 15% | 0.152 | 19% | 0.19 | C | C | . | . | S | Bend | trans | -111.4 | 148.6 | -173.5 | -60.9 | 179.9 | 0 | 0 | 0 | 111.6 | K59 Q62 I275 S279 | K59-L277 HydrophobicContact CG-CD2 4.29Å; Q62-L277 HydrophobicContact CG-CD1 3.76Å; I275-L277 HydrophobicContact CG2-CB 3.8Å; I275-L277 HydrophobicContact CG2-CD1 3.65Å; I275-L277 HydrophobicContact CG2-CG 3.58Å; I275-L277 PolarHBondContact O-N 3.45Å; L277-S279 PolarHBondContact O-N 3.05Å |
| 278 | C | 60.6 | Low | 84.4 | Confident | 149 Ų | 149 | 33.9 Ų | 33.9 | 100% | 1.007 | 20% | 0.197 | S | C | * | . | S | Bend | trans | -65.7 | -24.2 | 178.4 | -59.6 | 0 | 0 | 0 | 0 | 113.3 | ||
| 279 | S | 71.2 | Confident | 84.2 | Confident | 74 Ų | 74 | 33.9 Ų | 33.9 | 52% | 0.517 | 20% | 0.197 | S | C | . | . | S | Bend | trans | -132.6 | 125 | 177.4 | 59.5 | 0 | 0 | 0 | 0 | 111.1 | L277 I281 | L277-S279 PolarHBondContact O-N 3.05Å; S279-I281 PolarHBondContact O-N 3.44Å |
| 280 | T | 78 | Confident | 84.2 | Confident | 42 Ų | 42 | 32.2 Ų | 32.2 | 26% | 0.258 | 19% | 0.189 | S | C | . | . | trans | -73.7 | 120.6 | 176 | -50.8 | 0 | 0 | 0 | 0 | 110.9 | A238 V272 I275 A285 | A238-T280 HydrophobicContact CB-CG2 4.2Å; V272-T280 HydrophobicContact CG1-CG2 3.87Å; I275-T280 HydrophobicContact CD1-CG2 4.41Å; T280-A285 HydrophobicContact CG2-CB 4.12Å | ||
| 281 | I | 85.1 | Confident | 84.1 | Confident | 21 Ų | 21 | 28.5 Ų | 28.5 | 11% | 0.108 | 18% | 0.176 | C | C | . | . | trans | -84.1 | 112.9 | 165.9 | -59.6 | 167.8 | 0 | 0 | 0 | 107.9 | Q62 D67 S279 G283 L284 A285 | Q62-I281 HydrophobicContact CB-CD1 4.25Å; Q62-I281 HydrophobicContact CG-CD1 4.36Å; Q62-I281 WeakPolarHBondContact O-CD1 3.38Å; D67-I281 HydrophobicContact CB-CG2 4.19Å; S279-I281 PolarHBondContact O-N 3.44Å; I281-G283 VanDerWaalsContact C-N 3.33Å; I281-G283 PolarHBondContact O-N 3Å; I281-L284 HydrophobicContact CB-CB 3.97Å; I281-L284 HydrophobicContact CG2-CB 4.06Å; I281-L284 WeakPolarHBondContact O-CB 3.31Å; I281-L284 PolarHBondContact O-N 2.91Å; I281-L284 VanDerWaalsContact O-N 3.15Å; I281-A285 PolarHBondContact O-N 3.43Å | ||
| 282 | V | 92.6 | Very high | 84.1 | Confident | 17 Ų | 17 | 29.8 Ų | 29.8 | 10% | 0.103 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.6 | -41.8 | -172.6 | -172.6 | 0 | 0 | 0 | 0 | 111.7 | T71 L74 A238 I241 I242 L284 A285 F286 | T71-V282 HydrophobicContact CG2-CB 4.06Å; T71-V282 HydrophobicContact CG2-CG2 4.3Å; L74-V282 HydrophobicContact CD1-CG1 4.14Å; A238-V282 HydrophobicContact CB-CG2 3.93Å; I241-V282 HydrophobicContact CG2-CG1 4.06Å; I242-V282 HydrophobicContact CD1-CG1 4Å; I242-V282 HydrophobicContact CG1-CG1 3.83Å; V282-L284 PolarHBondContact O-N 2.95Å; V282-A285 PolarHBondContact O-N 3Å; V282-F286 PolarHBondContact O-N 2.9Å |
| 283 | G | 92.3 | Very high | 84.2 | Confident | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -59.5 | -44.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L70 T71 I281 F286 M287 | L70-G283 WeakPolarHBondContact CD2-O 3.49Å; T71-G283 WeakPolarHBondContact OG1-CA 3.39Å; T71-G283 PolarHBondContact OG1-N 3.21Å; I281-G283 VanDerWaalsContact C-N 3.33Å; I281-G283 PolarHBondContact O-N 3Å; G283-F286 PolarHBondContact O-N 3.16Å; G283-M287 WeakPolarHBondContact O-CG 3.29Å; G283-M287 PolarHBondContact O-N 3.15Å |
| 284 | L | 88 | Confident | 84.4 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -63.6 | -43.1 | 176.1 | 179.6 | 60.3 | 0 | 0 | 0 | 111.6 | V53 L58 D67 I281 V282 F286 M287 R288 | V53-L284 HydrophobicContact CG1-CD1 4.16Å; L58-L284 HydrophobicContact CD2-CD1 4.37Å; L58-L284 HydrophobicContact CD2-CD2 4.07Å; D67-L284 HydrophobicContact CB-CB 4.35Å; I281-L284 HydrophobicContact CB-CB 3.97Å; I281-L284 HydrophobicContact CG2-CB 4.06Å; I281-L284 WeakPolarHBondContact O-CB 3.31Å; I281-L284 PolarHBondContact O-N 2.91Å; I281-L284 VanDerWaalsContact O-N 3.15Å; V282-L284 PolarHBondContact O-N 2.95Å; L284-F286 VanDerWaalsContact C-N 3.34Å; L284-F286 PolarHBondContact O-N 2.92Å; L284-M287 PolarHBondContact O-N 3.45Å; L284-R288 VanDerWaalsContact O-CG 3.3Å; L284-R288 WeakPolarHBondContact O-CG 3.37Å; L284-R288 PolarHBondContact O-N 3.25Å |
| 285 | A | 90.8 | Very high | 84.6 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63.2 | -39.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | I242 S271 V272 I275 T280 I281 V282 R288 F289 | I242-A285 HydrophobicContact CD1-CB 3.69Å; S271-A285 WeakPolarHBondContact CB-O 3.35Å; V272-A285 HydrophobicContact CG2-CB 3.76Å; I275-A285 HydrophobicContact CD1-CB 4Å; T280-A285 HydrophobicContact CG2-CB 4.12Å; I281-A285 PolarHBondContact O-N 3.43Å; V282-A285 PolarHBondContact O-N 3Å; A285-R288 PolarHBondContact O-N 3.28Å; A285-F289 PolarHBondContact O-N 3.12Å |
| 286 | F | 94.7 | Very high | 85 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.2 | -42.4 | 173.6 | 176.1 | -101.6 | 0 | 0 | 0 | 112.4 | L70 L74 I242 V245 V246 I249 V282 G283 L284 R288 F289 L290 M338 V346 L347 | L70-F286 HydrophobicContact CD1-CD1 4.48Å; L70-F286 HydrophobicContact CD2-CD1 4.12Å; L74-F286 HydrophobicContact CD1-CB 3.65Å; L74-F286 HydrophobicContact CD1-CD1 4.31Å; L74-F286 HydrophobicContact CD1-CG 4.01Å; L74-F286 HydrophobicContact CD2-CB 4.49Å; L74-F286 HydrophobicContact CD2-CD1 4.43Å; L74-F286 HydrophobicContact CD2-CD2 4.15Å; L74-F286 HydrophobicContact CD2-CG 4.09Å; I242-F286 HydrophobicContact CD1-CB 4.39Å; I242-F286 HydrophobicContact CG1-CB 4.4Å; I242-F286 HydrophobicContact CG2-CD2 4.16Å; V245-F286 HydrophobicContact CG1-CE2 4.37Å; V246-F286 HydrophobicContact CG2-CD2 4.42Å; V246-F286 HydrophobicContact CG2-CE2 4.16Å; I249-F286 HydrophobicContact CD1-CE2 3.56Å; I249-F286 HydrophobicContact CD1-CZ 3.49Å; I249-F286 VanDerWaalsContact CD1-CZ 3.49Å; V282-F286 PolarHBondContact O-N 2.9Å; G283-F286 PolarHBondContact O-N 3.16Å; L284-F286 VanDerWaalsContact C-N 3.34Å; L284-F286 PolarHBondContact O-N 2.92Å; F286-R288 VanDerWaalsContact C-N 3.32Å; F286-R288 PolarHBondContact O-N 2.91Å; F286-F289 WeakPolarHBondContact O-CB 3.14Å; F286-F289 PolarHBondContact O-N 2.95Å; F286-L290 HydrophobicContact CD1-CD1 4.36Å; F286-L290 HydrophobicContact CE1-CD1 3.59Å; F286-L290 HydrophobicContact CE1-CG 4.44Å; F286-L290 HydrophobicContact CE2-CD1 4.42Å; F286-L290 HydrophobicContact CZ-CD1 3.62Å; F286-L290 HydrophobicContact CZ-CG 4.24Å; F286-L290 PolarHBondContact O-N 3.1Å; F286-L290 VanDerWaalsContact O-N 3.15Å; F286-M338 HydrophobicContact CE1-SD 4.11Å; F286-V346 HydrophobicContact CZ-CG1 4.39Å; F286-L347 HydrophobicContact CE1-CD2 4.06Å; F286-L347 HydrophobicContact CZ-CD2 3.96Å |
| 287 | M | 89.9 | Confident | 86 | Confident | 1 Ų | 1 | 25.8 Ų | 25.8 | 1% | 0.005 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.9 | -42.8 | 174.6 | -73.4 | -60.8 | -67.5 | 0 | 0 | 111.7 | Y48 F50 F66 L70 G283 L284 F289 L290 M291 L335 M338 | Y48-M287 HydrophobicContact CD1-CE 4.16Å; Y48-M287 HydrophobicContact CE1-CE 3.44Å; Y48-M287 VanDerWaalsContact CE1-CE 3.44Å; Y48-M287 WeakPolarHBondContact OH-CE 3.37Å; Y48-M287 WeakPolarHBondContact OH-CG 3.42Å; F50-M287 HydrophobicContact CE1-CE 3.87Å; F66-M287 HydrophobicContact CE1-SD 4.23Å; L70-M287 HydrophobicContact CD2-CG 3.44Å; L70-M287 VanDerWaalsContact CD2-CG 3.44Å; L70-M287 HydrophobicContact CD2-SD 3.75Å; G283-M287 WeakPolarHBondContact O-CG 3.29Å; G283-M287 PolarHBondContact O-N 3.15Å; L284-M287 PolarHBondContact O-N 3.45Å; M287-F289 VanDerWaalsContact C-N 3.3Å; M287-F289 PolarHBondContact O-N 2.89Å; M287-L290 PolarHBondContact O-N 3.08Å; M287-M291 WeakPolarHBondContact O-CB 3.44Å; M287-M291 VanDerWaalsContact O-CG 3.28Å; M287-M291 WeakPolarHBondContact O-CG 3.28Å; M287-M291 PolarHBondContact O-N 3.37Å; M287-L335 HydrophobicContact CE-CD2 3.79Å; M287-M338 HydrophobicContact CE-CE 3.75Å; M287-M338 HydrophobicContact CE-SD 4.5Å; M287-M338 HydrophobicContact SD-CE 3.31Å; M287-M338 WeakPolarHBondContact SD-CE 3.19Å; M287-M338 HydrophobicContact SD-SD 3.56Å |
| 288 | R | 89.5 | Confident | 87.1 | Confident | 38 Ų | 38 | 24.8 Ų | 24.8 | 14% | 0.143 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.5 | -39.5 | 175 | -73.3 | 173.9 | 63 | 71.5 | 0.4 | 112.2 | V53 S274 L284 A285 F286 M291 L292 | V53-R288 HydrophobicContact CG1-CG 3.75Å; S274-R288 PolarHBondContact OG-NH2 2.81Å; L284-R288 VanDerWaalsContact O-CG 3.3Å; L284-R288 WeakPolarHBondContact O-CG 3.37Å; L284-R288 PolarHBondContact O-N 3.25Å; A285-R288 PolarHBondContact O-N 3.28Å; F286-R288 VanDerWaalsContact C-N 3.32Å; F286-R288 PolarHBondContact O-N 2.91Å; R288-M291 PolarHBondContact O-N 3.3Å; R288-L292 VanDerWaalsContact O-CB 3.29Å; R288-L292 WeakPolarHBondContact O-CB 3.49Å; R288-L292 PolarHBondContact O-N 3.04Å |
| 289 | F | 93.8 | Very high | 88.2 | Confident | 1 Ų | 1 | 18.6 Ų | 18.6 | 0% | 0.004 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -58.9 | -50 | 175 | 168.9 | -93.3 | 0 | 0 | 0 | 111.6 | V246 L267 V268 S271 A285 F286 M287 M291 L292 L293 | V246-F289 HydrophobicContact CB-CE1 4.39Å; V246-F289 HydrophobicContact CB-CZ 4.44Å; V246-F289 HydrophobicContact CG1-CE1 3.77Å; V246-F289 HydrophobicContact CG1-CE2 4.46Å; V246-F289 HydrophobicContact CG1-CZ 3.55Å; V246-F289 HydrophobicContact CG2-CD1 3.94Å; V246-F289 HydrophobicContact CG2-CE1 3.6Å; V246-F289 HydrophobicContact CG2-CZ 4Å; L267-F289 HydrophobicContact CB-CD2 3.95Å; L267-F289 HydrophobicContact CB-CE2 3.72Å; L267-F289 HydrophobicContact CD1-CE2 4.31Å; V268-F289 HydrophobicContact CG2-CD2 3.64Å; V268-F289 HydrophobicContact CG2-CE2 3.8Å; V268-F289 HydrophobicContact CG2-CG 4.29Å; S271-F289 VanDerWaalsContact OG-CA 3.31Å; S271-F289 WeakPolarHBondContact OG-CA 3.19Å; S271-F289 PolarHBondContact OG-N 2.64Å; A285-F289 PolarHBondContact O-N 3.12Å; F286-F289 WeakPolarHBondContact O-CB 3.14Å; F286-F289 PolarHBondContact O-N 2.95Å; M287-F289 VanDerWaalsContact C-N 3.3Å; M287-F289 PolarHBondContact O-N 2.89Å; F289-M291 PolarHBondContact O-N 2.96Å; F289-L292 PolarHBondContact O-N 3.47Å; F289-L293 HydrophobicContact CD1-CD1 4.41Å; F289-L293 HydrophobicContact CE1-CD1 3.66Å; F289-L293 HydrophobicContact CE2-CD1 4.26Å; F289-L293 HydrophobicContact CZ-CD1 3.57Å; F289-L293 HydrophobicContact CZ-CG 4.38Å; F289-L293 PolarHBondContact O-N 3.31Å; F289-L293 VanDerWaalsContact O-N 3.17Å |
| 290 | L | 94.2 | Very high | 88.6 | Confident | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -66.3 | -38.9 | 178.1 | -71.8 | 176.6 | 0 | 0 | 0 | 112.1 | F256 F286 M287 L292 L293 S294 L334 L335 M338 | F256-L290 HydrophobicContact CE2-CD2 4.33Å; F256-L290 HydrophobicContact CZ-CD2 4.07Å; F286-L290 HydrophobicContact CD1-CD1 4.36Å; F286-L290 HydrophobicContact CE1-CD1 3.59Å; F286-L290 HydrophobicContact CE1-CG 4.44Å; F286-L290 HydrophobicContact CE2-CD1 4.42Å; F286-L290 HydrophobicContact CZ-CD1 3.62Å; F286-L290 HydrophobicContact CZ-CG 4.24Å; F286-L290 PolarHBondContact O-N 3.1Å; F286-L290 VanDerWaalsContact O-N 3.15Å; M287-L290 PolarHBondContact O-N 3.08Å; L290-L292 PolarHBondContact O-N 3.37Å; L290-L293 PolarHBondContact O-N 3.4Å; L290-S294 WeakPolarHBondContact O-CB 3.27Å; L290-S294 PolarHBondContact O-N 3.09Å; L290-L334 HydrophobicContact CD2-CD1 4.28Å; L290-L335 HydrophobicContact CB-CD2 3.78Å; L290-L335 HydrophobicContact CB-CG 4.03Å; L290-M338 HydrophobicContact CD1-CE 3.33Å; L290-M338 HydrophobicContact CD1-SD 4.15Å |
| 291 | M | 90.3 | Very high | 88.6 | Confident | 29 Ų | 29 | 18 Ų | 18 | 14% | 0.143 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -61 | -43.6 | 174.7 | -75.6 | 177.1 | 151.8 | 0 | 0 | 112.4 | Y48 F50 V53 M287 R288 F289 L293 S294 S295 L335 | Y48-M291 HydrophobicContact CE1-CE 4.45Å; F50-M291 HydrophobicContact CB-CE 3.83Å; F50-M291 HydrophobicContact CD1-CE 3.33Å; F50-M291 HydrophobicContact CE1-CE 4.28Å; F50-M291 HydrophobicContact CG-CE 4.03Å; V53-M291 HydrophobicContact CB-CE 3.59Å; V53-M291 HydrophobicContact CB-SD 3.42Å; V53-M291 WeakPolarHBondContact CB-SD 3.43Å; V53-M291 HydrophobicContact CG1-CE 4.21Å; V53-M291 HydrophobicContact CG1-SD 3.42Å; V53-M291 WeakPolarHBondContact CG1-SD 3.42Å; V53-M291 HydrophobicContact CG2-CE 3.38Å; V53-M291 HydrophobicContact CG2-SD 3.77Å; M287-M291 WeakPolarHBondContact O-CB 3.44Å; M287-M291 VanDerWaalsContact O-CG 3.28Å; M287-M291 WeakPolarHBondContact O-CG 3.28Å; M287-M291 PolarHBondContact O-N 3.37Å; R288-M291 PolarHBondContact O-N 3.3Å; F289-M291 PolarHBondContact O-N 2.96Å; M291-L293 VanDerWaalsContact C-N 3.33Å; M291-L293 PolarHBondContact O-N 3.24Å; M291-S294 WeakPolarHBondContact CA-OG 3.23Å; M291-S294 PolarHBondContact O-N 3.15Å; M291-S294 VanDerWaalsContact O-N 3.12Å; M291-S294 PolarHBondContact O-OG 3.07Å; M291-S295 WeakPolarHBondContact O-CB 3.4Å; M291-S295 PolarHBondContact O-N 3.05Å; M291-S295 PolarHBondContact O-OG 3.03Å; M291-L335 HydrophobicContact CG-CD1 4.2Å; M291-L335 HydrophobicContact CG-CD2 3.91Å |
| 292 | L | 90.1 | Very high | 88.4 | Confident | 29 Ų | 29 | 18.4 Ų | 18.4 | 15% | 0.152 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -59.2 | -44.2 | 177.2 | -178.7 | 65.9 | 0 | 0 | 0 | 111.2 | L267 Y270 R288 F289 L290 S294 S295 A297 L305 | L267-L292 HydrophobicContact CD2-CD2 3.62Å; L267-L292 HydrophobicContact CD2-CG 4.43Å; Y270-L292 HydrophobicContact CD1-CD2 3.85Å; Y270-L292 HydrophobicContact CE1-CD1 4.45Å; Y270-L292 HydrophobicContact CE1-CD2 4.27Å; R288-L292 VanDerWaalsContact O-CB 3.29Å; R288-L292 WeakPolarHBondContact O-CB 3.49Å; R288-L292 PolarHBondContact O-N 3.04Å; F289-L292 PolarHBondContact O-N 3.47Å; L290-L292 PolarHBondContact O-N 3.37Å; L292-S294 VanDerWaalsContact C-N 3.35Å; L292-S295 PolarHBondContact O-N 2.96Å; L292-S295 PolarHBondContact O-OG 3.12Å; L292-S295 VanDerWaalsContact O-OG 3.05Å; L292-A297 HydrophobicContact CD1-CB 3.59Å; L292-A297 HydrophobicContact CG-CB 3.97Å; L292-A297 WeakPolarHBondContact O-CB 3.31Å; L292-L305 HydrophobicContact CD2-CD1 4.36Å |
| 293 | L | 93.2 | Very high | 87.8 | Confident | 4 Ų | 4 | 24 Ų | 24 | 2% | 0.021 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65.1 | -39.4 | 174.6 | -68.4 | -178 | 0 | 0 | 0 | 112.1 | F256 L259 L267 F289 L290 M291 S295 L298 I327 A331 | F256-L293 HydrophobicContact CE1-CD1 4Å; F256-L293 HydrophobicContact CZ-CD1 4.09Å; L259-L293 HydrophobicContact CD1-CD1 4.08Å; L267-L293 HydrophobicContact CD1-CD2 3.87Å; F289-L293 HydrophobicContact CD1-CD1 4.41Å; F289-L293 HydrophobicContact CE1-CD1 3.66Å; F289-L293 HydrophobicContact CE2-CD1 4.26Å; F289-L293 HydrophobicContact CZ-CD1 3.57Å; F289-L293 HydrophobicContact CZ-CG 4.38Å; F289-L293 PolarHBondContact O-N 3.31Å; F289-L293 VanDerWaalsContact O-N 3.17Å; L290-L293 PolarHBondContact O-N 3.4Å; M291-L293 VanDerWaalsContact C-N 3.33Å; M291-L293 PolarHBondContact O-N 3.24Å; L293-S295 VanDerWaalsContact C-N 3.28Å; L293-S295 PolarHBondContact O-N 3.21Å; L293-L298 HydrophobicContact CD2-CD1 3.66Å; L293-L298 HydrophobicContact CD2-CG 4.15Å; L293-I327 HydrophobicContact CB-CG2 4.33Å; L293-I327 HydrophobicContact CD1-CG2 4.12Å; L293-I327 HydrophobicContact CD2-CG2 3.78Å; L293-I327 HydrophobicContact CG-CG2 4.31Å; L293-A331 HydrophobicContact CB-CB 3.49Å; L293-A331 VanDerWaalsContact CB-CB 3.49Å |
| 294 | S | 90.2 | Very high | 87.3 | Confident | 9 Ų | 9 | 24.8 Ų | 24.8 | 6% | 0.063 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -68.7 | -24.7 | -179.8 | 81.2 | 0 | 0 | 0 | 0 | 114 | L290 M291 L292 N296 Q332 L335 | L290-S294 WeakPolarHBondContact O-CB 3.27Å; L290-S294 PolarHBondContact O-N 3.09Å; M291-S294 WeakPolarHBondContact CA-OG 3.23Å; M291-S294 PolarHBondContact O-N 3.15Å; M291-S294 VanDerWaalsContact O-N 3.12Å; M291-S294 PolarHBondContact O-OG 3.07Å; L292-S294 VanDerWaalsContact C-N 3.35Å; S294-N296 VanDerWaalsContact C-N 3.28Å; S294-N296 PolarHBondContact O-N 3.04Å; S294-Q332 PolarHBondContact O-NE2 3.17Å; S294-L335 VanDerWaalsContact OG-CD1 3.31Å; S294-L335 WeakPolarHBondContact OG-CD1 3.47Å |
| 295 | S | 85.1 | Confident | 87.2 | Confident | 68 Ų | 68 | 25.7 Ų | 25.7 | 48% | 0.476 | 15% | 0.152 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | 21.6 | -172.3 | 73.9 | 0 | 0 | 0 | 0 | 113.8 | M291 L292 L293 A297 | M291-S295 WeakPolarHBondContact O-CB 3.4Å; M291-S295 PolarHBondContact O-N 3.05Å; M291-S295 PolarHBondContact O-OG 3.03Å; L292-S295 PolarHBondContact O-N 2.96Å; L292-S295 PolarHBondContact O-OG 3.12Å; L292-S295 VanDerWaalsContact O-OG 3.05Å; L293-S295 VanDerWaalsContact C-N 3.28Å; L293-S295 PolarHBondContact O-N 3.21Å; S295-A297 PolarHBondContact O-N 3.24Å |
| 296 | N | 83.2 | Confident | 87.1 | Confident | 23 Ų | 23 | 31.1 Ų | 31.1 | 12% | 0.123 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 63.2 | 24.6 | 179.7 | -154.6 | 48.6 | 0 | 0 | 0 | 114.2 | L19 S294 L298 S299 R328 | L19-N296 HydrophobicContact CD1-CB 3.66Å; L19-N296 HydrophobicContact CD2-CB 3.87Å; L19-N296 WeakPolarHBondContact CD2-ND2 3.13Å; L19-N296 HydrophobicContact CG-CB 4.35Å; S294-N296 VanDerWaalsContact C-N 3.28Å; S294-N296 PolarHBondContact O-N 3.04Å; N296-L298 PolarHBondContact O-N 2.89Å; N296-S299 WeakPolarHBondContact ND2-CB 3.39Å; N296-S299 PolarHBondContact ND2-OG 2.98Å; N296-S299 VanDerWaalsContact ND2-OG 3.11Å; N296-S299 VanDerWaalsContact O-CB 3.24Å; N296-S299 WeakPolarHBondContact O-CB 3.42Å; N296-S299 PolarHBondContact O-N 3.5Å; N296-S299 VanDerWaalsContact O-N 3.16Å; N296-S299 VanDerWaalsContact OD1-CB 3.25Å; N296-S299 WeakPolarHBondContact OD1-CB 3.43Å; N296-R328 WeakPolarHBondContact OD1-CD 3.24Å |
| 297 | A | 86.8 | Confident | 87 | Confident | 7 Ų | 7 | 31.9 Ų | 31.9 | 6% | 0.058 | 18% | 0.179 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -20.3 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | L292 S295 S302 G304 | L292-A297 HydrophobicContact CD1-CB 3.59Å; L292-A297 HydrophobicContact CG-CB 3.97Å; L292-A297 WeakPolarHBondContact O-CB 3.31Å; S295-A297 PolarHBondContact O-N 3.24Å; A297-S302 WeakPolarHBondContact O-CB 3.43Å; A297-S302 PolarHBondContact O-OG 3.4Å; A297-G304 VanDerWaalsContact O-CA 3.26Å; A297-G304 WeakPolarHBondContact O-CA 3.34Å |
| 298 | L | 89.7 | Confident | 87.1 | Confident | 8 Ų | 8 | 34.7 Ų | 34.7 | 4% | 0.042 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | 7.9 | 178.6 | -53.8 | -173.2 | 0 | 0 | 0 | 113.2 | L259 L267 L293 N296 H316 L319 M324 I327 | L259-L298 HydrophobicContact CD2-CD1 4.14Å; L267-L298 HydrophobicContact CD1-CD2 4.42Å; L267-L298 HydrophobicContact CD2-CD2 4.2Å; L293-L298 HydrophobicContact CD2-CD1 3.66Å; L293-L298 HydrophobicContact CD2-CG 4.15Å; N296-L298 PolarHBondContact O-N 2.89Å; L298-H316 HydrophobicContact CB-CB 4.06Å; L298-H316 HydrophobicContact CD2-CB 4.05Å; L298-H316 HydrophobicContact CG-CB 4.46Å; L298-H316 PolarHBondContact O-CD2 3.43Å; L298-L319 HydrophobicContact CD1-CD1 4.46Å; L298-M324 VanDerWaalsContact O-CG 3.31Å; L298-M324 WeakPolarHBondContact O-CG 3.47Å; L298-I327 HydrophobicContact CD1-CD1 4.2Å; L298-I327 HydrophobicContact CD1-CG2 4.15Å |
| 299 | S | 84.1 | Confident | 87.3 | Confident | 19 Ų | 19 | 34.7 Ų | 34.7 | 13% | 0.133 | 20% | 0.203 | C | C | . | . | S | Bend | trans | -77.3 | 154.5 | -177.8 | -172.4 | 0 | 0 | 0 | 0 | 112.3 | N296 V301 S302 | N296-S299 WeakPolarHBondContact ND2-CB 3.39Å; N296-S299 PolarHBondContact ND2-OG 2.98Å; N296-S299 VanDerWaalsContact ND2-OG 3.11Å; N296-S299 VanDerWaalsContact O-CB 3.24Å; N296-S299 WeakPolarHBondContact O-CB 3.42Å; N296-S299 PolarHBondContact O-N 3.5Å; N296-S299 VanDerWaalsContact O-N 3.16Å; N296-S299 VanDerWaalsContact OD1-CB 3.25Å; N296-S299 WeakPolarHBondContact OD1-CB 3.43Å; S299-V301 PolarHBondContact O-N 2.92Å; S299-V301 VanDerWaalsContact O-N 3.12Å; S299-S302 VanDerWaalsContact O-CB 3.3Å; S299-S302 WeakPolarHBondContact O-CB 3.22Å; S299-S302 PolarHBondContact O-N 3.34Å |
| 300 | P | 79.4 | Confident | 87 | Confident | 38 Ų | 38 | 37 Ų | 37 | 25% | 0.247 | 22% | 0.215 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -30.4 | -179.1 | -23.1 | 34.1 | 0 | 0 | 0 | 113.7 | S302 R314 L321 M324 L387 | P300-S302 VanDerWaalsContact C-N 3.33Å; P300-R314 PolarHBondContact O-NH1 3.24Å; P300-L321 HydrophobicContact CG-CD2 3.36Å; P300-M324 VanDerWaalsContact CD-SD 3.58Å; P300-M324 HydrophobicContact CG-CE 4.49Å; P300-M324 HydrophobicContact CG-SD 3.93Å; P300-L387 HydrophobicContact CB-CD2 4.15Å; P300-L387 HydrophobicContact CG-CD2 3.89Å |
| 301 | V | 78 | Confident | 86.4 | Confident | 65 Ų | 65 | 40.8 Ų | 40.8 | 39% | 0.394 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | -13.4 | 177.4 | -61.4 | 0 | 0 | 0 | 0 | 114 | S299 Y386 L390 | S299-V301 PolarHBondContact O-N 2.92Å; S299-V301 VanDerWaalsContact O-N 3.12Å; V301-Y386 HydrophobicContact CG1-CE1 4.02Å; V301-Y386 WeakPolarHBondContact CG1-OH 3.3Å; V301-L390 HydrophobicContact CG1-CD1 3.29Å; V301-L390 HydrophobicContact CG1-CD2 3.65Å; V301-L390 HydrophobicContact CG1-CG 4.11Å |
| 302 | S | 81.4 | Confident | 86.1 | Confident | 31 Ų | 31 | 43.8 Ų | 43.8 | 22% | 0.217 | 28% | 0.276 | C | S | . | . | S | Bend | trans | -78 | 143.9 | 174.5 | -166.8 | 0 | 0 | 0 | 0 | 109.8 | A297 S299 P300 G304 R314 | A297-S302 WeakPolarHBondContact O-CB 3.43Å; A297-S302 PolarHBondContact O-OG 3.4Å; S299-S302 VanDerWaalsContact O-CB 3.3Å; S299-S302 WeakPolarHBondContact O-CB 3.22Å; S299-S302 PolarHBondContact O-N 3.34Å; P300-S302 VanDerWaalsContact C-N 3.33Å; S302-G304 PolarHBondContact O-N 3.47Å; S302-G304 PolarHBondContact OG-N 3.45Å; S302-G304 VanDerWaalsContact OG-N 3.13Å; S302-R314 PolarHBondContact O-NH1 3.38Å |
| 303 | I | 79.4 | Confident | 85.9 | Confident | 133 Ų | 133 | 45 Ų | 45 | 68% | 0.682 | 29% | 0.285 | S | S | * | . | trans | -57.3 | -32.7 | 163.2 | -164.9 | 167.9 | 0 | 0 | 0 | 110.4 | F306 R314 | I303-F306 HydrophobicContact CG1-CE2 4.31Å; I303-R314 WeakPolarHBondContact O-CD 3.26Å | ||
| 304 | G | 81.3 | Confident | 85.7 | Confident | 17 Ų | 17 | 49 Ų | 49 | 18% | 0.175 | 30% | 0.3 | C | S | . | . | trans | 54.9 | -148.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A297 S302 | A297-G304 VanDerWaalsContact O-CA 3.26Å; A297-G304 WeakPolarHBondContact O-CA 3.34Å; S302-G304 PolarHBondContact O-N 3.47Å; S302-G304 PolarHBondContact OG-N 3.45Å; S302-G304 VanDerWaalsContact OG-N 3.13Å | ||
| 305 | L | 86.3 | Confident | 85.8 | Confident | 20 Ų | 20 | 49.3 Ų | 49.3 | 11% | 0.105 | 30% | 0.3 | C | S | . | . | trans | -117.5 | 130.4 | 176.8 | -71.7 | 84.5 | 0 | 0 | 0 | 109.7 | V266 L267 Y270 L292 R314 I315 | V266-L305 HydrophobicContact CG1-CD2 4.11Å; L267-L305 HydrophobicContact CD2-CD1 3.77Å; L267-L305 HydrophobicContact CD2-CD2 4.21Å; Y270-L305 HydrophobicContact CD1-CD2 4.39Å; Y270-L305 HydrophobicContact CD2-CD2 4.11Å; Y270-L305 HydrophobicContact CG-CD2 3.82Å; L292-L305 HydrophobicContact CD2-CD1 4.36Å; L305-R314 WeakPolarHBondContact O-CA 3.25Å; L305-I315 HydrophobicContact CB-CD1 3.82Å; L305-I315 HydrophobicContact CB-CG1 4.17Å; L305-I315 PolarHBondContact O-N 3.12Å | ||
| 306 | F | 88.9 | Confident | 86 | Confident | 114 Ų | 114 | 46 Ų | 46 | 50% | 0.5 | 28% | 0.278 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.9 | 148.5 | 170.2 | -69.1 | -78.2 | 0 | 0 | 0 | 110.7 | I303 P308 A311 T313 R314 | I303-F306 HydrophobicContact CG1-CE2 4.31Å; F306-P308 WeakPolarHBondContact O-CD 3.39Å; F306-A311 VanDerWaalsContact CD1-O 3.3Å; F306-A311 WeakPolarHBondContact CD1-O 3.36Å; F306-T313 CarbonylContact C-O 3.46Å; F306-T313 WeakPolarHBondContact CA-O 3.41Å; F306-R314 HydrophobicContact CD1-CG 4.31Å; F306-R314 HydrophobicContact CE1-CG 4.23Å |
| 307 | D | 91.4 | Very high | 86.3 | Confident | 15 Ų | 15 | 47.4 Ų | 47.4 | 8% | 0.08 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72 | 117.5 | 173.8 | -170.7 | -33.9 | 0 | 0 | 0 | 109.1 | W262 C309 N310 A311 T313 I315 | W262-D307 WeakPolarHBondContact CZ2-OD1 3.4Å; W262-D307 VanDerWaalsContact NE1-CG 3.29Å; W262-D307 PolarHBondContact NE1-OD1 3.25Å; W262-D307 PolarHBondContact NE1-OD2 2.98Å; D307-C309 PolarHBondContact O-N 3.09Å; D307-C309 WeakPolarHBondContact OD1-CA 3.42Å; D307-C309 WeakPolarHBondContact OD1-CB 3.33Å; D307-C309 PolarHBondContact OD1-N 3.03Å; D307-N310 HydrophobicContact CB-CB 4.34Å; D307-N310 CarbonylContact O-C 3.2Å; D307-N310 PolarHBondContact O-N 3.31Å; D307-N310 PolarHBondContact OD1-N 3.39Å; D307-A311 PolarHBondContact O-N 3.3Å; D307-T313 WeakPolarHBondContact CB-OG1 3.27Å; D307-T313 PolarHBondContact N-O 3.34Å; D307-I315 HydrophobicContact CB-CG2 4Å |
| 308 | P | 93.1 | Very high | 86.3 | Confident | 61 Ų | 61 | 56.1 Ų | 56.1 | 40% | 0.396 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.9 | -15.3 | -178.9 | 29.3 | -35.7 | 0 | 0 | 0 | 113.2 | W229 W262 V266 F306 | W229-P308 HydrophobicContact CD2-CG 3.97Å; W229-P308 HydrophobicContact CG-CB 4.46Å; W229-P308 HydrophobicContact CG-CG 4.21Å; W229-P308 HydrophobicContact CZ2-CB 4.41Å; W229-P308 HydrophobicContact CZ2-CG 3.88Å; W229-P308 VanDerWaalsContact NE1-CB 3.32Å; W262-P308 HydrophobicContact CH2-CG 4.06Å; W262-P308 HydrophobicContact CZ2-CG 3.73Å; V266-P308 HydrophobicContact CG2-CG 4.21Å; F306-P308 WeakPolarHBondContact O-CD 3.39Å |
| 309 | C | 93.2 | Very high | 86.4 | Confident | 38 Ų | 38 | 56.9 Ų | 56.9 | 26% | 0.257 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.5 | -8.9 | 173.7 | -64.4 | 0 | 0 | 0 | 0 | 112.6 | M222 W262 D307 | M222-C309 HydrophobicContact CE-CB 3.51Å; W262-C309 HydrophobicContact CZ2-CB 4.28Å; D307-C309 PolarHBondContact O-N 3.09Å; D307-C309 WeakPolarHBondContact OD1-CA 3.42Å; D307-C309 WeakPolarHBondContact OD1-CB 3.33Å; D307-C309 PolarHBondContact OD1-N 3.03Å |
| 310 | N | 88.6 | Confident | 86.7 | Confident | 48 Ų | 48 | 58 Ų | 58 | 26% | 0.257 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.6 | 85.3 | 175.1 | -176.1 | -9.1 | 0 | 0 | 0 | 110.5 | M222 D307 A312 T313 | M222-N310 HydrophobicContact CE-CB 4.12Å; D307-N310 HydrophobicContact CB-CB 4.34Å; D307-N310 CarbonylContact O-C 3.2Å; D307-N310 PolarHBondContact O-N 3.31Å; D307-N310 PolarHBondContact OD1-N 3.39Å; N310-A312 PolarHBondContact O-N 3.12Å; N310-T313 PolarHBondContact O-N 3.49Å; N310-T313 PolarHBondContact O-OG1 3.35Å |
| 311 | A | 80.1 | Confident | 86.9 | Confident | 80 Ų | 80 | 57.6 Ų | 57.6 | 66% | 0.661 | 34% | 0.341 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -58.9 | -21.4 | -169.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | F306 D307 T313 | F306-A311 VanDerWaalsContact CD1-O 3.3Å; F306-A311 WeakPolarHBondContact CD1-O 3.36Å; D307-A311 PolarHBondContact O-N 3.3Å; A311-T313 PolarHBondContact O-N 2.67Å |
| 312 | A | 83.7 | Confident | 87.4 | Confident | 92 Ų | 92 | 57.8 Ų | 57.8 | 76% | 0.76 | 34% | 0.338 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75.2 | -12.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | N310 | N310-A312 PolarHBondContact O-N 3.12Å |
| 313 | T | 86.6 | Confident | 88 | Confident | 55 Ų | 55 | 59.9 Ų | 59.9 | 34% | 0.337 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 140.7 | -171.1 | 63.1 | 0 | 0 | 0 | 0 | 112 | F306 D307 N310 A311 | F306-T313 CarbonylContact C-O 3.46Å; F306-T313 WeakPolarHBondContact CA-O 3.41Å; D307-T313 WeakPolarHBondContact CB-OG1 3.27Å; D307-T313 PolarHBondContact N-O 3.34Å; N310-T313 PolarHBondContact O-N 3.49Å; N310-T313 PolarHBondContact O-OG1 3.35Å; A311-T313 PolarHBondContact O-N 2.67Å |
| 314 | R | 90 | Very high | 88.5 | Confident | 89 Ų | 89 | 54.6 Ų | 54.6 | 34% | 0.336 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 140.4 | 167.9 | -67.5 | -176.7 | -66.7 | 176.6 | -3.9 | 109.4 | P300 S302 I303 L305 F306 H316 G317 | P300-R314 PolarHBondContact O-NH1 3.24Å; S302-R314 PolarHBondContact O-NH1 3.38Å; I303-R314 WeakPolarHBondContact O-CD 3.26Å; L305-R314 WeakPolarHBondContact O-CA 3.25Å; F306-R314 HydrophobicContact CD1-CG 4.31Å; F306-R314 HydrophobicContact CE1-CG 4.23Å; R314-H316 PolarHBondContact O-N 3.2Å; R314-H316 VanDerWaalsContact O-N 3.11Å; R314-G317 PolarHBondContact O-N 3.43Å |
| 315 | I | 91.8 | Very high | 88.9 | Confident | 14 Ų | 14 | 54.3 Ų | 54.3 | 7% | 0.072 | 31% | 0.311 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -27.6 | -178.4 | 64 | 175.7 | 0 | 0 | 0 | 113.4 | M263 V266 L267 L305 D307 | M263-I315 HydrophobicContact CG-CB 4.14Å; M263-I315 HydrophobicContact CG-CD1 4.48Å; M263-I315 HydrophobicContact CG-CG1 4.31Å; M263-I315 WeakPolarHBondContact CG-O 3.34Å; M263-I315 VanDerWaalsContact SD-O 3.39Å; V266-I315 HydrophobicContact CB-CD1 4.22Å; V266-I315 HydrophobicContact CB-CG2 4.47Å; V266-I315 HydrophobicContact CG1-CD1 4.07Å; V266-I315 HydrophobicContact CG1-CG2 4.22Å; V266-I315 HydrophobicContact CG2-CG2 4.45Å; L267-I315 HydrophobicContact CD1-CD1 4.5Å; L267-I315 HydrophobicContact CD2-CD1 4.02Å; L267-I315 HydrophobicContact CG-CD1 3.87Å; L305-I315 HydrophobicContact CB-CD1 3.82Å; L305-I315 HydrophobicContact CB-CG1 4.17Å; L305-I315 PolarHBondContact O-N 3.12Å; D307-I315 HydrophobicContact CB-CG2 4Å |
| 316 | H | 90.2 | Very high | 89.2 | Confident | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 32% | 0.321 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.9 | 6.1 | 178.3 | 61.9 | -84.1 | 0 | 0 | 0 | 112.9 | M263 L298 R314 K318 L319 M324 | M263-H316 HydrophobicContact SD-CB 4.26Å; L298-H316 HydrophobicContact CB-CB 4.06Å; L298-H316 HydrophobicContact CD2-CB 4.05Å; L298-H316 HydrophobicContact CG-CB 4.46Å; L298-H316 PolarHBondContact O-CD2 3.43Å; R314-H316 PolarHBondContact O-N 3.2Å; R314-H316 VanDerWaalsContact O-N 3.11Å; H316-K318 PolarHBondContact O-N 3.24Å; H316-L319 HydrophobicContact CB-CD1 3.95Å; H316-L319 HydrophobicContact CB-CG 4.36Å; H316-L319 WeakPolarHBondContact O-CB 3.29Å; H316-L319 PolarHBondContact O-N 3.1Å; H316-M324 WeakPolarHBondContact O-CE 3.4Å |
| 317 | G | 87.5 | Confident | 89.5 | Confident | 51 Ų | 51 | 50 Ų | 50 | 53% | 0.526 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -14.3 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | R314 | R314-G317 PolarHBondContact O-N 3.43Š|
| 318 | K | 88.1 | Confident | 89.5 | Confident | 191 Ų | 191 | 49.8 Ų | 49.8 | 83% | 0.83 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.9 | -6.3 | 176.1 | -65.7 | -175.7 | 179.3 | 177 | 0 | 114.1 | H316 | H316-K318 PolarHBondContact O-N 3.24Š|
| 319 | L | 91.5 | Very high | 89.4 | Confident | 23 Ų | 23 | 47.7 Ų | 47.7 | 12% | 0.12 | 28% | 0.28 | C | S | . | . | trans | -75.1 | 145.6 | -179.5 | -64.7 | -175.9 | 0 | 0 | 0 | 110.9 | M263 L298 H316 E323 M324 I327 | M263-L319 HydrophobicContact CE-CD1 4.12Å; M263-L319 HydrophobicContact CE-CD2 3.8Å; M263-L319 HydrophobicContact CE-CG 4.13Å; M263-L319 HydrophobicContact SD-CD1 3.93Å; M263-L319 HydrophobicContact SD-CG 4.28Å; L298-L319 HydrophobicContact CD1-CD1 4.46Å; H316-L319 HydrophobicContact CB-CD1 3.95Å; H316-L319 HydrophobicContact CB-CG 4.36Å; H316-L319 WeakPolarHBondContact O-CB 3.29Å; H316-L319 PolarHBondContact O-N 3.1Å; L319-E323 VanDerWaalsContact CA-OE2 3.27Å; L319-E323 WeakPolarHBondContact CA-OE2 3.31Å; L319-E323 HydrophobicContact CB-CB 4.32Å; L319-E323 HydrophobicContact CD2-CB 4.35Å; L319-E323 WeakPolarHBondContact CD2-OE2 3.18Å; L319-M324 HydrophobicContact CB-CE 3.83Å; L319-M324 HydrophobicContact CB-CG 3.77Å; L319-M324 HydrophobicContact CD1-CG 4.19Å; L319-M324 WeakPolarHBondContact O-CE 3.44Å; L319-I327 HydrophobicContact CD1-CD1 3.67Å | ||
| 320 | S | 89.6 | Confident | 89.4 | Confident | 44 Ų | 44 | 46.3 Ų | 46.3 | 31% | 0.308 | 27% | 0.27 | S | S | . | . | trans | -73.9 | 166 | 165.9 | 98.6 | 0 | 0 | 0 | 0 | 110.8 | E322 E323 M324 | S320-E322 VanDerWaalsContact C-N 3.32Å; S320-E322 VanDerWaalsContact CB-OE2 3.32Å; S320-E322 WeakPolarHBondContact CB-OE2 3.16Å; S320-E322 PolarHBondContact O-N 2.97Å; S320-E322 PolarHBondContact OG-N 3.37Å; S320-E322 PolarHBondContact OG-OE2 2.68Å; S320-E323 PolarHBondContact N-OE2 3.11Å; S320-E323 PolarHBondContact O-N 2.92Å; S320-E323 PolarHBondContact OG-N 2.86Å; S320-E323 VanDerWaalsContact OG-N 3.12Å; S320-M324 VanDerWaalsContact O-CG 3.25Å; S320-M324 WeakPolarHBondContact O-CG 3.3Å; S320-M324 PolarHBondContact O-N 3.35Å | ||
| 321 | L | 85.3 | Confident | 89.7 | Confident | 28 Ų | 28 | 44 Ų | 44 | 15% | 0.147 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.1 | -40.6 | 175 | -66 | -170.7 | 0 | 0 | 0 | 112.7 | P300 E323 M324 N325 I375 L387 | P300-L321 HydrophobicContact CG-CD2 3.36Å; L321-E323 VanDerWaalsContact C-N 3.28Å; L321-E323 PolarHBondContact O-N 2.97Å; L321-M324 HydrophobicContact CD2-SD 4.3Å; L321-M324 PolarHBondContact O-N 2.86Å; L321-N325 WeakPolarHBondContact O-CB 3.33Å; L321-N325 PolarHBondContact O-N 3.19Å; L321-I375 HydrophobicContact CB-CD1 3.6Å; L321-I375 HydrophobicContact CD1-CD1 4.3Å; L321-L387 HydrophobicContact CD1-CD1 3.16Å; L321-L387 HydrophobicContact CD1-CD2 3.99Å; L321-L387 HydrophobicContact CD1-CG 3.59Å; L321-L387 HydrophobicContact CD2-CD1 3.9Å; L321-L387 HydrophobicContact CD2-CD2 3.81Å; L321-L387 HydrophobicContact CD2-CG 4.29Å; L321-L387 HydrophobicContact CG-CD1 3.62Å; L321-L387 HydrophobicContact CG-CD2 4.39Å; L321-L387 HydrophobicContact CG-CG 4.34Å |
| 322 | E | 88.5 | Confident | 90.2 | Very high | 70 Ų | 70 | 40.2 Ų | 40.2 | 33% | 0.327 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60.8 | -43.1 | 177.7 | -57.4 | 86 | 166.3 | 0 | 0 | 109.7 | S320 N325 S326 I375 R380 | S320-E322 VanDerWaalsContact C-N 3.32Å; S320-E322 VanDerWaalsContact CB-OE2 3.32Å; S320-E322 WeakPolarHBondContact CB-OE2 3.16Å; S320-E322 PolarHBondContact O-N 2.97Å; S320-E322 PolarHBondContact OG-N 3.37Å; S320-E322 PolarHBondContact OG-OE2 2.68Å; E322-N325 PolarHBondContact O-N 3.12Å; E322-S326 VanDerWaalsContact O-CB 3.24Å; E322-S326 WeakPolarHBondContact O-CB 3.39Å; E322-S326 PolarHBondContact O-N 3.13Å; E322-I375 HydrophobicContact CG-CG2 4.43Å; E322-R380 IonicContact OE1-CZ 3.33Å; E322-R380 IonicContact OE1-NH1 3.28Å; E322-R380 PolarHBondContact OE1-NH1 3.32Å; E322-R380 IonicContact OE1-NH2 3.75Å; E322-R380 PolarHBondContact OE1-NH2 3.01Å |
| 323 | E | 92.7 | Very high | 90.7 | Very high | 75 Ų | 75 | 36 Ų | 36 | 35% | 0.35 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64 | -47.9 | 175.3 | -70.1 | -179.7 | 141.4 | 0 | 0 | 112.4 | L319 S320 L321 N325 S326 I327 | L319-E323 VanDerWaalsContact CA-OE2 3.27Å; L319-E323 WeakPolarHBondContact CA-OE2 3.31Å; L319-E323 HydrophobicContact CB-CB 4.32Å; L319-E323 HydrophobicContact CD2-CB 4.35Å; L319-E323 WeakPolarHBondContact CD2-OE2 3.18Å; S320-E323 PolarHBondContact N-OE2 3.11Å; S320-E323 PolarHBondContact O-N 2.92Å; S320-E323 PolarHBondContact OG-N 2.86Å; S320-E323 VanDerWaalsContact OG-N 3.12Å; L321-E323 VanDerWaalsContact C-N 3.28Å; L321-E323 PolarHBondContact O-N 2.97Å; E323-N325 VanDerWaalsContact C-N 3.28Å; E323-N325 PolarHBondContact O-N 3.35Å; E323-S326 PolarHBondContact O-N 3.49Å; E323-I327 WeakPolarHBondContact O-CG1 3.45Å; E323-I327 PolarHBondContact O-N 3.35Å |
| 324 | M | 91.3 | Very high | 91.1 | Very high | 22 Ų | 22 | 33.3 Ų | 33.3 | 11% | 0.108 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.8 | -42.7 | 176.4 | -68.5 | 171.5 | -175.1 | 0 | 0 | 111.5 | L298 P300 H316 L319 S320 L321 R328 | L298-M324 VanDerWaalsContact O-CG 3.31Å; L298-M324 WeakPolarHBondContact O-CG 3.47Å; P300-M324 VanDerWaalsContact CD-SD 3.58Å; P300-M324 HydrophobicContact CG-CE 4.49Å; P300-M324 HydrophobicContact CG-SD 3.93Å; H316-M324 WeakPolarHBondContact O-CE 3.4Å; L319-M324 HydrophobicContact CB-CE 3.83Å; L319-M324 HydrophobicContact CB-CG 3.77Å; L319-M324 HydrophobicContact CD1-CG 4.19Å; L319-M324 WeakPolarHBondContact O-CE 3.44Å; S320-M324 VanDerWaalsContact O-CG 3.25Å; S320-M324 WeakPolarHBondContact O-CG 3.3Å; S320-M324 PolarHBondContact O-N 3.35Å; L321-M324 HydrophobicContact CD2-SD 4.3Å; L321-M324 PolarHBondContact O-N 2.86Å; M324-R328 WeakPolarHBondContact O-CB 3.32Å; M324-R328 PolarHBondContact O-N 3.46Å; M324-R328 VanDerWaalsContact O-N 3.09Å |
| 325 | N | 89.3 | Confident | 91.2 | Very high | 11 Ų | 11 | 29.1 Ų | 29.1 | 6% | 0.059 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -68.8 | -41.2 | 179.6 | -176.1 | 52 | 0 | 0 | 0 | 112 | L321 E322 E323 R328 Q329 L374 I375 | L321-N325 WeakPolarHBondContact O-CB 3.33Å; L321-N325 PolarHBondContact O-N 3.19Å; E322-N325 PolarHBondContact O-N 3.12Å; E323-N325 VanDerWaalsContact C-N 3.28Å; E323-N325 PolarHBondContact O-N 3.35Å; N325-R328 PolarHBondContact O-N 2.92Å; N325-R328 PolarHBondContact OD1-NE 3.47Å; N325-R328 PolarHBondContact OD1-NH2 2.97Å; N325-Q329 PolarHBondContact ND2-NE2 3.48Å; N325-Q329 WeakPolarHBondContact O-CB 3.25Å; N325-Q329 VanDerWaalsContact O-CG 3.24Å; N325-Q329 WeakPolarHBondContact O-CG 3.24Å; N325-Q329 PolarHBondContact O-N 3.44Å; N325-Q329 PolarHBondContact O-NE2 2.99Å; N325-L374 PolarHBondContact ND2-N 3.18Å; N325-L374 WeakPolarHBondContact OD1-CB 3.4Å; N325-I375 HydrophobicContact CB-CD1 4.25Å |
| 326 | S | 92.1 | Very high | 91.1 | Very high | 43 Ų | 43 | 28.8 Ų | 28.8 | 30% | 0.301 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -57.7 | -50.7 | 175.3 | -166.5 | 0 | 0 | 0 | 0 | 110.8 | G255 E322 E323 R328 Q329 T330 | G255-S326 WeakPolarHBondContact CA-OG 3.48Å; G255-S326 CarbonylContact O-C 3.6Å; E322-S326 VanDerWaalsContact O-CB 3.24Å; E322-S326 WeakPolarHBondContact O-CB 3.39Å; E322-S326 PolarHBondContact O-N 3.13Å; E323-S326 PolarHBondContact O-N 3.49Å; S326-R328 VanDerWaalsContact C-N 3.34Å; S326-R328 PolarHBondContact O-N 2.91Å; S326-Q329 PolarHBondContact O-N 3.2Å; S326-T330 PolarHBondContact O-N 2.8Å; S326-T330 PolarHBondContact O-OG1 2.61Å; S326-T330 VanDerWaalsContact O-OG1 3.13Å |
| 327 | I | 94.4 | Very high | 91.1 | Very high | 1 Ų | 1 | 28.8 Ų | 28.8 | 1% | 0.005 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -56.2 | -48.7 | 176.1 | -66.9 | 162.1 | 0 | 0 | 0 | 111.2 | G255 F256 S258 L259 L293 L298 L319 E323 Q329 T330 A331 | G255-I327 WeakPolarHBondContact O-CA 3.13Å; G255-I327 WeakPolarHBondContact O-CG1 3.21Å; G255-I327 PolarHBondContact O-N 2.74Å; F256-I327 HydrophobicContact CD1-CB 4.4Å; F256-I327 HydrophobicContact CD1-CG1 4.42Å; F256-I327 HydrophobicContact CD1-CG2 4.05Å; F256-I327 HydrophobicContact CE1-CG2 3.99Å; F256-I327 WeakPolarHBondContact CE1-O 3.24Å; S258-I327 WeakPolarHBondContact OG-CD1 3.25Å; L259-I327 HydrophobicContact CD1-CG2 4.23Å; L259-I327 HydrophobicContact CD2-CD1 3.58Å; L259-I327 HydrophobicContact CD2-CG1 4.19Å; L259-I327 HydrophobicContact CD2-CG2 4.17Å; L259-I327 HydrophobicContact CG-CD1 3.79Å; L259-I327 HydrophobicContact CG-CG1 3.96Å; L259-I327 HydrophobicContact CG-CG2 4.31Å; L293-I327 HydrophobicContact CB-CG2 4.33Å; L293-I327 HydrophobicContact CD1-CG2 4.12Å; L293-I327 HydrophobicContact CD2-CG2 3.78Å; L293-I327 HydrophobicContact CG-CG2 4.31Å; L298-I327 HydrophobicContact CD1-CD1 4.2Å; L298-I327 HydrophobicContact CD1-CG2 4.15Å; L319-I327 HydrophobicContact CD1-CD1 3.67Å; E323-I327 WeakPolarHBondContact O-CG1 3.45Å; E323-I327 PolarHBondContact O-N 3.35Å; I327-Q329 PolarHBondContact O-N 3.42Å; I327-T330 PolarHBondContact O-N 3.11Å; I327-A331 WeakPolarHBondContact O-CB 3.43Å; I327-A331 PolarHBondContact O-N 3.35Å |
| 328 | R | 91.8 | Very high | 91.3 | Very high | 9 Ų | 9 | 26.5 Ų | 26.5 | 3% | 0.034 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.9 | -47.9 | -178.8 | -178.9 | -171.4 | 64.6 | 75 | -4.9 | 111.6 | N296 M324 N325 S326 A331 Q332 | N296-R328 WeakPolarHBondContact OD1-CD 3.24Å; M324-R328 WeakPolarHBondContact O-CB 3.32Å; M324-R328 PolarHBondContact O-N 3.46Å; M324-R328 VanDerWaalsContact O-N 3.09Å; N325-R328 PolarHBondContact O-N 2.92Å; N325-R328 PolarHBondContact OD1-NE 3.47Å; N325-R328 PolarHBondContact OD1-NH2 2.97Å; S326-R328 VanDerWaalsContact C-N 3.34Å; S326-R328 PolarHBondContact O-N 2.91Å; R328-A331 PolarHBondContact O-N 2.84Å; R328-Q332 VanDerWaalsContact NH1-CD 3.29Å; R328-Q332 VanDerWaalsContact O-CG 3.28Å; R328-Q332 WeakPolarHBondContact O-CG 3.45Å; R328-Q332 PolarHBondContact O-N 2.75Å |
| 329 | Q | 91 | Very high | 91.2 | Very high | 18 Ų | 18 | 18.4 Ų | 18.4 | 8% | 0.084 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -66.8 | -44.7 | -177.9 | -69.8 | 174.9 | 125 | 0 | 0 | 111.4 | N325 S326 I327 A331 Q332 F333 I371 V372 | N325-Q329 PolarHBondContact ND2-NE2 3.48Å; N325-Q329 WeakPolarHBondContact O-CB 3.25Å; N325-Q329 VanDerWaalsContact O-CG 3.24Å; N325-Q329 WeakPolarHBondContact O-CG 3.24Å; N325-Q329 PolarHBondContact O-N 3.44Å; N325-Q329 PolarHBondContact O-NE2 2.99Å; S326-Q329 PolarHBondContact O-N 3.2Å; I327-Q329 PolarHBondContact O-N 3.42Å; Q329-A331 VanDerWaalsContact C-N 3.32Å; Q329-A331 PolarHBondContact O-N 3.11Å; Q329-Q332 WeakPolarHBondContact O-CB 3.36Å; Q329-Q332 PolarHBondContact O-N 2.98Å; Q329-Q332 VanDerWaalsContact O-N 3.13Å; Q329-F333 PolarHBondContact O-N 3.17Å; Q329-I371 HydrophobicContact CB-CB 4.35Å; Q329-I371 HydrophobicContact CB-CD1 4.03Å; Q329-I371 HydrophobicContact CB-CG2 4.23Å; Q329-I371 HydrophobicContact CG-CG2 3.92Å; Q329-I371 WeakPolarHBondContact O-CD1 3.07Å; Q329-V372 PolarHBondContact OE1-O 3.02Å |
| 330 | T | 94.1 | Very high | 90.9 | Very high | 9 Ų | 9 | 17.9 Ų | 17.9 | 6% | 0.055 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -57.5 | -46.1 | 174.2 | -61.1 | 0 | 0 | 0 | 0 | 111.1 | G255 F256 S326 I327 Q332 F333 L334 T357 | G255-T330 VanDerWaalsContact CA-OG1 3.29Å; G255-T330 WeakPolarHBondContact CA-OG1 3.49Å; F256-T330 HydrophobicContact CD1-CG2 3.87Å; F256-T330 HydrophobicContact CD2-CG2 4.17Å; F256-T330 HydrophobicContact CE1-CG2 3.7Å; F256-T330 HydrophobicContact CE2-CG2 4.01Å; F256-T330 HydrophobicContact CG-CG2 4.11Å; F256-T330 HydrophobicContact CZ-CG2 3.78Å; S326-T330 PolarHBondContact O-N 2.8Å; S326-T330 PolarHBondContact O-OG1 2.61Å; S326-T330 VanDerWaalsContact O-OG1 3.13Å; I327-T330 PolarHBondContact O-N 3.11Å; T330-Q332 VanDerWaalsContact C-N 3.33Å; T330-Q332 PolarHBondContact O-N 3.49Å; T330-F333 PolarHBondContact O-N 3.44Å; T330-L334 HydrophobicContact CG2-CD1 4.09Å; T330-L334 HydrophobicContact CG2-CG 4.38Å; T330-L334 VanDerWaalsContact O-CG 3.27Å; T330-L334 WeakPolarHBondContact O-CG 3.41Å; T330-L334 PolarHBondContact O-N 2.74Å; T330-T357 HydrophobicContact CG2-CG2 4.23Å |
| 331 | A | 94.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -60.6 | -40 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | F256 L293 I327 R328 Q329 L334 L335 | F256-A331 HydrophobicContact CE1-CB 4.2Å; F256-A331 HydrophobicContact CZ-CB 4.13Å; L293-A331 HydrophobicContact CB-CB 3.49Å; L293-A331 VanDerWaalsContact CB-CB 3.49Å; I327-A331 WeakPolarHBondContact O-CB 3.43Å; I327-A331 PolarHBondContact O-N 3.35Å; R328-A331 PolarHBondContact O-N 2.84Å; Q329-A331 VanDerWaalsContact C-N 3.32Å; Q329-A331 PolarHBondContact O-N 3.11Å; A331-L334 PolarHBondContact O-N 3.09Å; A331-L335 VanDerWaalsContact O-CG 3.3Å; A331-L335 WeakPolarHBondContact O-CG 3.43Å; A331-L335 PolarHBondContact O-N 3.29Å |
| 332 | Q | 91.6 | Very high | 91 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -64 | -44 | 175.7 | -72.8 | 170.2 | -8.2 | 0 | 0 | 112.4 | S294 R328 Q329 T330 L335 N336 I371 | S294-Q332 PolarHBondContact O-NE2 3.17Å; R328-Q332 VanDerWaalsContact NH1-CD 3.29Å; R328-Q332 VanDerWaalsContact O-CG 3.28Å; R328-Q332 WeakPolarHBondContact O-CG 3.45Å; R328-Q332 PolarHBondContact O-N 2.75Å; Q329-Q332 WeakPolarHBondContact O-CB 3.36Å; Q329-Q332 PolarHBondContact O-N 2.98Å; Q329-Q332 VanDerWaalsContact O-N 3.13Å; T330-Q332 VanDerWaalsContact C-N 3.33Å; T330-Q332 PolarHBondContact O-N 3.49Å; Q332-L335 PolarHBondContact O-N 3.22Å; Q332-N336 PolarHBondContact O-N 2.98Å; Q332-N336 VanDerWaalsContact O-N 3.13Å; Q332-I371 HydrophobicContact CB-CD1 3.91Å |
| 333 | F | 93.2 | Very high | 91.2 | Very high | 2 Ų | 2 | 13.6 Ų | 13.6 | 1% | 0.009 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.4 | -48.4 | 176 | -172.3 | -80.6 | 0 | 0 | 0 | 111 | Q329 T330 L335 N336 L337 V356 T357 I361 L368 I371 | Q329-F333 PolarHBondContact O-N 3.17Å; T330-F333 PolarHBondContact O-N 3.44Å; F333-L335 PolarHBondContact O-N 3.15Å; F333-N336 PolarHBondContact O-N 3.46Å; F333-N336 VanDerWaalsContact O-N 3.17Å; F333-L337 HydrophobicContact CE1-CB 4.46Å; F333-L337 HydrophobicContact CE1-CD2 4.33Å; F333-L337 WeakPolarHBondContact O-CB 3.28Å; F333-L337 PolarHBondContact O-N 3.36Å; F333-V356 HydrophobicContact CE1-CB 4.2Å; F333-V356 HydrophobicContact CE1-CG2 3.94Å; F333-V356 WeakPolarHBondContact CE1-O 3.43Å; F333-V356 WeakPolarHBondContact CZ-O 3.34Å; F333-T357 HydrophobicContact CB-CG2 4.24Å; F333-T357 HydrophobicContact CD1-CG2 3.49Å; F333-T357 VanDerWaalsContact CD1-CG2 3.49Å; F333-T357 HydrophobicContact CE1-CG2 4.06Å; F333-T357 HydrophobicContact CG-CG2 3.96Å; F333-I361 HydrophobicContact CZ-CG2 4.31Å; F333-L368 HydrophobicContact CE2-CB 4.05Å; F333-L368 HydrophobicContact CZ-CB 4.05Å; F333-I371 HydrophobicContact CB-CD1 4.16Å; F333-I371 HydrophobicContact CD2-CG1 4.46Å |
| 334 | L | 94.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -63.2 | -38.8 | -179.5 | -64 | 177.8 | 0 | 0 | 0 | 112.4 | I249 Y253 F256 L290 T330 A331 N336 L337 M338 V346 T357 | I249-L334 HydrophobicContact CG2-CD1 4.16Å; Y253-L334 HydrophobicContact CD1-CD2 4.22Å; Y253-L334 HydrophobicContact CD2-CD1 4.2Å; Y253-L334 HydrophobicContact CD2-CD2 4.19Å; Y253-L334 HydrophobicContact CE1-CD2 3.84Å; Y253-L334 HydrophobicContact CE2-CD1 4.34Å; Y253-L334 HydrophobicContact CE2-CD2 3.76Å; Y253-L334 HydrophobicContact CG-CD2 4.4Å; F256-L334 HydrophobicContact CE2-CD1 3.55Å; F256-L334 HydrophobicContact CZ-CD1 3.85Å; L290-L334 HydrophobicContact CD2-CD1 4.28Å; T330-L334 HydrophobicContact CG2-CD1 4.09Å; T330-L334 HydrophobicContact CG2-CG 4.38Å; T330-L334 VanDerWaalsContact O-CG 3.27Å; T330-L334 WeakPolarHBondContact O-CG 3.41Å; T330-L334 PolarHBondContact O-N 2.74Å; A331-L334 PolarHBondContact O-N 3.09Å; L334-N336 VanDerWaalsContact C-N 3.34Å; L334-N336 PolarHBondContact O-N 3.3Å; L334-L337 PolarHBondContact O-N 2.85Å; L334-M338 WeakPolarHBondContact O-CG 3.31Å; L334-M338 PolarHBondContact O-N 3.17Å; L334-V346 HydrophobicContact CB-CG1 4.43Å; L334-V346 HydrophobicContact CB-CG2 4.38Å; L334-V346 HydrophobicContact CD2-CG1 4.32Å; L334-V346 HydrophobicContact CD2-CG2 3.98Å; L334-T357 HydrophobicContact CD2-CG2 4.16Å |
| 335 | L | 92 | Very high | 91.5 | Very high | 1 Ų | 1 | 14 Ų | 14 | 1% | 0.005 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.7 | -43.9 | 173.9 | -73.4 | 164.8 | 0 | 0 | 0 | 111.7 | F50 M287 L290 M291 S294 A331 Q332 F333 M338 A339 | F50-L335 HydrophobicContact CD1-CD2 4.4Å; F50-L335 HydrophobicContact CE1-CB 3.95Å; F50-L335 HydrophobicContact CE1-CD2 3.79Å; F50-L335 HydrophobicContact CE1-CG 4.4Å; F50-L335 HydrophobicContact CZ-CB 4.37Å; F50-L335 WeakPolarHBondContact CZ-O 3.22Å; M287-L335 HydrophobicContact CE-CD2 3.79Å; L290-L335 HydrophobicContact CB-CD2 3.78Å; L290-L335 HydrophobicContact CB-CG 4.03Å; M291-L335 HydrophobicContact CG-CD1 4.2Å; M291-L335 HydrophobicContact CG-CD2 3.91Å; S294-L335 VanDerWaalsContact OG-CD1 3.31Å; S294-L335 WeakPolarHBondContact OG-CD1 3.47Å; A331-L335 VanDerWaalsContact O-CG 3.3Å; A331-L335 WeakPolarHBondContact O-CG 3.43Å; A331-L335 PolarHBondContact O-N 3.29Å; Q332-L335 PolarHBondContact O-N 3.22Å; F333-L335 PolarHBondContact O-N 3.15Å; L335-M338 HydrophobicContact CD2-CE 3.72Å; L335-M338 HydrophobicContact CG-CE 4.31Å; L335-M338 PolarHBondContact O-N 3.41Å; L335-A339 PolarHBondContact O-N 3.02Å |
| 336 | N | 90 | Very high | 91.8 | Very high | 6 Ų | 6 | 13.4 Ų | 13.4 | 3% | 0.032 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -69.9 | -35.5 | 178.2 | -76.1 | -2.7 | 0 | 0 | 0 | 112.7 | P24 I26 Q332 F333 L334 M338 A339 I340 L368 | P24-N336 HydrophobicContact CB-CB 4.41Å; P24-N336 VanDerWaalsContact CB-ND2 3.28Å; P24-N336 WeakPolarHBondContact CB-ND2 3.4Å; P24-N336 WeakPolarHBondContact CD-ND2 3.29Å; P24-N336 HydrophobicContact CG-CB 4.08Å; P24-N336 WeakPolarHBondContact CG-ND2 3.3Å; P24-N336 VanDerWaalsContact N-ND2 3.15Å; P24-N336 PolarHBondContact O-ND2 2.97Å; I26-N336 HydrophobicContact CD1-CB 4.47Å; I26-N336 HydrophobicContact CG1-CB 4.38Å; Q332-N336 PolarHBondContact O-N 2.98Å; Q332-N336 VanDerWaalsContact O-N 3.13Å; F333-N336 PolarHBondContact O-N 3.46Å; F333-N336 VanDerWaalsContact O-N 3.17Å; L334-N336 VanDerWaalsContact C-N 3.34Å; L334-N336 PolarHBondContact O-N 3.3Å; N336-M338 VanDerWaalsContact C-N 3.31Å; N336-M338 PolarHBondContact O-N 3.44Å; N336-A339 VanDerWaalsContact O-CB 3.3Å; N336-A339 WeakPolarHBondContact O-CB 3.47Å; N336-A339 PolarHBondContact O-N 3.46Å; N336-A339 VanDerWaalsContact O-N 3.15Å; N336-I340 PolarHBondContact O-N 2.95Å; N336-L368 HydrophobicContact CB-CD1 4.41Å; N336-L368 HydrophobicContact CB-CD2 3.95Å |
| 337 | L | 91.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 11.4 Ų | 11.4 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -59.9 | -43.1 | 171.6 | -178.6 | 55.3 | 0 | 0 | 0 | 111.2 | F333 L334 A339 I340 G341 G342 L345 V346 V356 I361 L363 L368 | F333-L337 HydrophobicContact CE1-CB 4.46Å; F333-L337 HydrophobicContact CE1-CD2 4.33Å; F333-L337 WeakPolarHBondContact O-CB 3.28Å; F333-L337 PolarHBondContact O-N 3.36Å; L334-L337 PolarHBondContact O-N 2.85Å; L337-A339 VanDerWaalsContact C-N 3.34Å; L337-A339 PolarHBondContact O-N 3.13Å; L337-I340 HydrophobicContact CD1-CD1 4.37Å; L337-I340 HydrophobicContact CD1-CG1 4.41Å; L337-I340 VanDerWaalsContact O-CG1 3.29Å; L337-I340 WeakPolarHBondContact O-CG1 3.49Å; L337-I340 PolarHBondContact O-N 3.49Å; L337-G341 PolarHBondContact O-N 3.25Å; L337-G342 VanDerWaalsContact O-CA 3.3Å; L337-G342 WeakPolarHBondContact O-CA 3.31Å; L337-G342 PolarHBondContact O-N 3.1Å; L337-L345 HydrophobicContact CD2-CB 4.42Å; L337-V346 HydrophobicContact CB-CG2 4.18Å; L337-V346 HydrophobicContact CD2-CG2 3.69Å; L337-V346 HydrophobicContact CG-CG2 3.93Å; L337-V356 HydrophobicContact CD2-CG2 3.86Å; L337-I361 HydrophobicContact CD1-CG2 3.8Å; L337-L363 HydrophobicContact CD1-CD2 4.12Å; L337-L368 VanDerWaalsContact CA-CD1 3.45Å; L337-L368 HydrophobicContact CB-CD1 3.93Å; L337-L368 HydrophobicContact CD1-CD1 4.09Å |
| 338 | M | 90.5 | Very high | 92.1 | Very high | 3 Ų | 3 | 11.8 Ų | 11.8 | 2% | 0.015 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -63.9 | -38.8 | 173.6 | -68.8 | -173.6 | -65.4 | 0 | 0 | 112.4 | F66 F286 M287 L290 L334 L335 N336 I340 G341 H343 V346 | F66-M338 HydrophobicContact CZ-CB 4.33Å; F286-M338 HydrophobicContact CE1-SD 4.11Å; M287-M338 HydrophobicContact CE-CE 3.75Å; M287-M338 HydrophobicContact CE-SD 4.5Å; M287-M338 HydrophobicContact SD-CE 3.31Å; M287-M338 WeakPolarHBondContact SD-CE 3.19Å; M287-M338 HydrophobicContact SD-SD 3.56Å; L290-M338 HydrophobicContact CD1-CE 3.33Å; L290-M338 HydrophobicContact CD1-SD 4.15Å; L334-M338 WeakPolarHBondContact O-CG 3.31Å; L334-M338 PolarHBondContact O-N 3.17Å; L335-M338 HydrophobicContact CD2-CE 3.72Å; L335-M338 HydrophobicContact CG-CE 4.31Å; L335-M338 PolarHBondContact O-N 3.41Å; N336-M338 VanDerWaalsContact C-N 3.31Å; N336-M338 PolarHBondContact O-N 3.44Å; M338-I340 VanDerWaalsContact C-N 3.25Å; M338-I340 PolarHBondContact O-N 3.36Å; M338-G341 PolarHBondContact O-N 3.13Å; M338-H343 HydrophobicContact CB-CB 4.48Å; M338-H343 HydrophobicContact CG-CB 4.02Å; M338-V346 HydrophobicContact CG-CB 4.3Å; M338-V346 HydrophobicContact CG-CG2 3.85Å; M338-V346 HydrophobicContact SD-CG1 4.39Å |
| 339 | A | 86.3 | Confident | 92.3 | Very high | 22 Ų | 22 | 12.6 Ų | 12.6 | 18% | 0.182 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -59.2 | -34.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | I26 F50 L335 N336 L337 G341 | I26-A339 HydrophobicContact CD1-CB 4.07Å; F50-A339 HydrophobicContact CE2-CB 3.57Å; F50-A339 HydrophobicContact CZ-CB 3.75Å; L335-A339 PolarHBondContact O-N 3.02Å; N336-A339 VanDerWaalsContact O-CB 3.3Å; N336-A339 WeakPolarHBondContact O-CB 3.47Å; N336-A339 PolarHBondContact O-N 3.46Å; N336-A339 VanDerWaalsContact O-N 3.15Å; L337-A339 VanDerWaalsContact C-N 3.34Å; L337-A339 PolarHBondContact O-N 3.13Å; A339-G341 VanDerWaalsContact C-N 3.32Å |
| 340 | I | 85.4 | Confident | 92.5 | Very high | 11 Ų | 11 | 15.7 Ų | 15.7 | 6% | 0.056 | 9% | 0.093 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 9.1 | 177.5 | 67.3 | 168.3 | 0 | 0 | 0 | 113.1 | I26 N336 L337 M338 L363 N364 F366 L368 | I26-I340 HydrophobicContact CD1-CG2 4.03Å; I26-I340 HydrophobicContact CG1-CG2 4.26Å; I26-I340 HydrophobicContact CG2-CG2 3.81Å; N336-I340 PolarHBondContact O-N 2.95Å; L337-I340 HydrophobicContact CD1-CD1 4.37Å; L337-I340 HydrophobicContact CD1-CG1 4.41Å; L337-I340 VanDerWaalsContact O-CG1 3.29Å; L337-I340 WeakPolarHBondContact O-CG1 3.49Å; L337-I340 PolarHBondContact O-N 3.49Å; M338-I340 VanDerWaalsContact C-N 3.25Å; M338-I340 PolarHBondContact O-N 3.36Å; I340-L363 HydrophobicContact CD1-CB 3.89Å; I340-L363 HydrophobicContact CD1-CD2 4.48Å; I340-L363 HydrophobicContact CG1-CD2 4.39Å; I340-N364 PolarHBondContact O-ND2 3.48Å; I340-F366 HydrophobicContact CB-CB 4.33Å; I340-F366 HydrophobicContact CB-CD2 4.09Å; I340-F366 HydrophobicContact CB-CG 4.45Å; I340-F366 HydrophobicContact CD1-CB 4.2Å; I340-F366 HydrophobicContact CG2-CB 3.85Å; I340-F366 HydrophobicContact CG2-CD2 3.86Å; I340-F366 HydrophobicContact CG2-CG 3.86Å; I340-L368 HydrophobicContact CD1-CD1 3.45Å; I340-L368 VanDerWaalsContact CD1-CD1 3.45Å; I340-L368 HydrophobicContact CD1-CG 3.72Å; I340-L368 HydrophobicContact CG1-CD1 4.04Å |
| 341 | G | 86.2 | Confident | 92.2 | Very high | 31 Ų | 31 | 24.8 Ų | 24.8 | 32% | 0.32 | 13% | 0.131 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 96.9 | 4.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | L337 M338 A339 H343 | L337-G341 PolarHBondContact O-N 3.25Å; M338-G341 PolarHBondContact O-N 3.13Å; A339-G341 VanDerWaalsContact C-N 3.32Å; G341-H343 PolarHBondContact O-N 3.28Å; G341-H343 PolarHBondContact O-ND1 3.03Å; G341-H343 VanDerWaalsContact O-ND1 3.15Å |
| 342 | G | 91 | Very high | 91.9 | Very high | 3 Ų | 3 | 27.4 Ų | 27.4 | 3% | 0.031 | 15% | 0.149 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | 23.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | L337 K344 L345 V346 | L337-G342 VanDerWaalsContact O-CA 3.3Å; L337-G342 WeakPolarHBondContact O-CA 3.31Å; L337-G342 PolarHBondContact O-N 3.1Å; G342-K344 VanDerWaalsContact C-N 3.32Å; G342-K344 PolarHBondContact O-N 2.95Å; G342-L345 WeakPolarHBondContact O-CB 3.32Å; G342-L345 PolarHBondContact O-N 3.28Å; G342-L345 VanDerWaalsContact O-N 3.15Å; G342-V346 PolarHBondContact O-N 3.42Å |
| 343 | H | 93 | Very high | 91.8 | Very high | 19 Ų | 19 | 33.3 Ų | 33.3 | 9% | 0.088 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.7 | -36.4 | -177.5 | 57.6 | -78.1 | 0 | 0 | 0 | 113.2 | F66 M69 L70 D73 M338 G341 L345 V346 L347 | F66-H343 HydrophobicContact CE2-CB 4.37Å; F66-H343 AromaticContact CE2-ND1 3.91Å; F66-H343 HydrophobicContact CZ-CB 4.09Å; M69-H343 WeakPolarHBondContact CE-CE1 3.3Å; M69-H343 VanDerWaalsContact CE-NE2 3.26Å; M69-H343 WeakPolarHBondContact CE-NE2 3.35Å; L70-H343 HydrophobicContact CD1-CB 4.36Å; D73-H343 IonicContact OD2-CD2 3.97Å; D73-H343 PolarHBondContact OD2-CD2 2.97Å; D73-H343 VanDerWaalsContact OD2-CD2 3.23Å; D73-H343 IonicContact OD2-NE2 3.03Å; D73-H343 PolarHBondContact OD2-NE2 2.98Å; M338-H343 HydrophobicContact CB-CB 4.48Å; M338-H343 HydrophobicContact CG-CB 4.02Å; G341-H343 PolarHBondContact O-N 3.28Å; G341-H343 PolarHBondContact O-ND1 3.03Å; G341-H343 VanDerWaalsContact O-ND1 3.15Å; H343-L345 VanDerWaalsContact C-N 3.32Å; H343-L345 PolarHBondContact O-N 2.99Å; H343-V346 PolarHBondContact O-N 2.9Å; H343-L347 WeakPolarHBondContact O-CG 3.45Å; H343-L347 PolarHBondContact O-N 3.13Å |
| 344 | K | 95.5 | Very high | 91.6 | Very high | 80 Ų | 80 | 38.1 Ų | 38.1 | 35% | 0.348 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -65.6 | -33.6 | 175.1 | -69.4 | -175.1 | 178 | -179.5 | 0 | 113.2 | D73 G342 G348 L349 D350 | D73-K344 VanDerWaalsContact OD2-CE 3.28Å; D73-K344 WeakPolarHBondContact OD2-CE 3.35Å; G342-K344 VanDerWaalsContact C-N 3.32Å; G342-K344 PolarHBondContact O-N 2.95Å; K344-G348 PolarHBondContact O-N 3.25Å; K344-G348 VanDerWaalsContact O-N 3.08Å; K344-L349 HydrophobicContact CB-CB 4.14Å; K344-L349 HydrophobicContact CG-CB 4.47Å; K344-L349 HydrophobicContact CG-CD1 4.31Å; K344-L349 PolarHBondContact O-N 2.95Å; K344-D350 HydrophobicContact CB-CB 4.15Å; K344-D350 VanDerWaalsContact CB-OD2 3.22Å; K344-D350 WeakPolarHBondContact CB-OD2 3.5Å; K344-D350 PolarHBondContact O-N 2.89Å; K344-D350 VanDerWaalsContact O-N 3.1Å |
| 345 | L | 95.2 | Very high | 91.4 | Very high | 24 Ų | 24 | 39 Ų | 39 | 13% | 0.126 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.3 | -45.4 | 171.8 | -67.5 | 166.9 | 0 | 0 | 0 | 110.8 | R252 Y253 L337 G342 H343 L347 G348 D350 C352 I361 L363 | R252-L345 PolarHBondContact NH1-O 2.81Å; Y253-L345 PolarHBondContact OH-O 3.41Å; L337-L345 HydrophobicContact CD2-CB 4.42Å; G342-L345 WeakPolarHBondContact O-CB 3.32Å; G342-L345 PolarHBondContact O-N 3.28Å; G342-L345 VanDerWaalsContact O-N 3.15Å; H343-L345 VanDerWaalsContact C-N 3.32Å; H343-L345 PolarHBondContact O-N 2.99Å; L345-L347 VanDerWaalsContact C-N 3.26Å; L345-L347 PolarHBondContact O-N 2.69Å; L345-G348 PolarHBondContact O-N 3.28Å; L345-D350 HydrophobicContact CD2-CB 3.58Å; L345-D350 HydrophobicContact CG-CB 4Å; L345-C352 HydrophobicContact CD2-CB 4.43Å; L345-I361 HydrophobicContact CD1-CD1 3.68Å; L345-L363 HydrophobicContact CD1-CD2 4.18Å |
| 346 | V | 95.6 | Very high | 91.4 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -56.8 | -42.7 | 176.2 | 174.3 | 0 | 0 | 0 | 0 | 110.9 | I249 R252 F286 L334 L337 M338 G342 H343 G348 | I249-V346 HydrophobicContact CD1-CG1 4.49Å; R252-V346 PolarHBondContact NH1-O 2.75Å; R252-V346 VanDerWaalsContact NH1-O 3.09Å; R252-V346 PolarHBondContact NH2-O 3.23Å; F286-V346 HydrophobicContact CZ-CG1 4.39Å; L334-V346 HydrophobicContact CB-CG1 4.43Å; L334-V346 HydrophobicContact CB-CG2 4.38Å; L334-V346 HydrophobicContact CD2-CG1 4.32Å; L334-V346 HydrophobicContact CD2-CG2 3.98Å; L337-V346 HydrophobicContact CB-CG2 4.18Å; L337-V346 HydrophobicContact CD2-CG2 3.69Å; L337-V346 HydrophobicContact CG-CG2 3.93Å; M338-V346 HydrophobicContact CG-CB 4.3Å; M338-V346 HydrophobicContact CG-CG2 3.85Å; M338-V346 HydrophobicContact SD-CG1 4.39Å; G342-V346 PolarHBondContact O-N 3.42Å; H343-V346 PolarHBondContact O-N 2.9Å; V346-G348 VanDerWaalsContact C-N 3.31Å; V346-G348 PolarHBondContact O-N 2.89Å |
| 347 | L | 96.9 | Very high | 91.5 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -78.3 | -10.4 | 179.4 | -64.2 | -179.6 | 0 | 0 | 0 | 114.1 | L70 D73 L74 R77 V245 R252 F286 H343 L345 L349 | L70-L347 HydrophobicContact CD1-CD1 3.89Å; D73-L347 HydrophobicContact CB-CD1 3.63Å; L74-L347 HydrophobicContact CD2-CD1 4.42Å; L74-L347 HydrophobicContact CD2-CD2 3.54Å; L74-L347 HydrophobicContact CG-CD1 4.25Å; L74-L347 HydrophobicContact CG-CD2 4.21Å; R77-L347 WeakPolarHBondContact CD-O 3.28Å; R77-L347 VanDerWaalsContact CG-O 3.23Å; R77-L347 WeakPolarHBondContact CG-O 3.49Å; R77-L347 PolarHBondContact NE-O 3.38Å; R77-L347 VanDerWaalsContact NE-O 3.09Å; V245-L347 HydrophobicContact CG1-CD2 3.83Å; R252-L347 VanDerWaalsContact NH2-C 3.27Å; R252-L347 PolarHBondContact NH2-O 2.71Å; F286-L347 HydrophobicContact CE1-CD2 4.06Å; F286-L347 HydrophobicContact CZ-CD2 3.96Å; H343-L347 WeakPolarHBondContact O-CG 3.45Å; H343-L347 PolarHBondContact O-N 3.13Å; L345-L347 VanDerWaalsContact C-N 3.26Å; L345-L347 PolarHBondContact O-N 2.69Å; L347-L349 VanDerWaalsContact C-N 3.28Å; L347-L349 HydrophobicContact CB-CD1 4.45Å; L347-L349 HydrophobicContact CB-CG 4.26Å; L347-L349 HydrophobicContact CD1-CD1 4.42Å |
| 348 | G | 95.1 | Very high | 91.4 | Very high | 9 Ų | 9 | 44.3 Ų | 44.3 | 9% | 0.093 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 74.7 | 16.6 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | K344 L345 V346 | K344-G348 PolarHBondContact O-N 3.25Å; K344-G348 VanDerWaalsContact O-N 3.08Å; L345-G348 PolarHBondContact O-N 3.28Å; V346-G348 VanDerWaalsContact C-N 3.31Å; V346-G348 PolarHBondContact O-N 2.89Å |
| 349 | L | 96.1 | Very high | 91.3 | Very high | 26 Ų | 26 | 48 Ų | 48 | 14% | 0.136 | 27% | 0.265 | C | S | . | . | S | Bend | trans | -74.5 | -40.1 | 170.4 | -68.1 | 175.8 | 0 | 0 | 0 | 110.8 | D73 K76 R77 K344 L347 | D73-L349 HydrophobicContact CB-CD1 3.56Å; K76-L349 HydrophobicContact CB-CD2 4.31Å; K76-L349 HydrophobicContact CD-CD1 4.37Å; K76-L349 HydrophobicContact CD-CD2 3.82Å; K76-L349 HydrophobicContact CG-CD2 3.89Å; R77-L349 HydrophobicContact CB-CD2 4.01Å; R77-L349 HydrophobicContact CB-CG 4.36Å; K344-L349 HydrophobicContact CB-CB 4.14Å; K344-L349 HydrophobicContact CG-CB 4.47Å; K344-L349 HydrophobicContact CG-CD1 4.31Å; K344-L349 PolarHBondContact O-N 2.95Å; L347-L349 VanDerWaalsContact C-N 3.28Å; L347-L349 HydrophobicContact CB-CD1 4.45Å; L347-L349 HydrophobicContact CB-CG 4.26Å; L347-L349 HydrophobicContact CD1-CD1 4.42Å |
| 350 | D | 94.7 | Very high | 91.5 | Very high | 84 Ų | 84 | 47.2 Ų | 47.2 | 45% | 0.449 | 26% | 0.259 | S | S | . | . | S | Bend | trans | -96.7 | 136.5 | 165.5 | -65.9 | -17 | 0 | 0 | 0 | 107.8 | K344 L345 | K344-D350 HydrophobicContact CB-CB 4.15Å; K344-D350 VanDerWaalsContact CB-OD2 3.22Å; K344-D350 WeakPolarHBondContact CB-OD2 3.5Å; K344-D350 PolarHBondContact O-N 2.89Å; K344-D350 VanDerWaalsContact O-N 3.1Å; L345-D350 HydrophobicContact CD2-CB 3.58Å; L345-D350 HydrophobicContact CG-CB 4Å |
| 351 | K | 88.8 | Confident | 91.8 | Very high | 199 Ų | 199 | 47.7 Ų | 47.7 | 87% | 0.865 | 26% | 0.261 | S | S | * | . | trans | -96.5 | 140.1 | -176.2 | -62.8 | -175.8 | -179.7 | -178.5 | 0 | 110.7 | ||||
| 352 | C | 87.7 | Confident | 92 | Very high | 56 Ų | 56 | 49.6 Ų | 49.6 | 38% | 0.378 | 27% | 0.27 | S | S | . | . | trans | -123.3 | 143.6 | 167.1 | -163.6 | 0 | 0 | 0 | 0 | 108.2 | L345 Y354 V356 | L345-C352 HydrophobicContact CD2-CB 4.43Å; C352-Y354 VanDerWaalsContact C-N 3.25Å; C352-Y354 PolarHBondContact O-N 3.39Å; C352-Y354 WeakPolarHBondContact SG-CE1 3.16Å; C352-V356 HydrophobicContact CB-CG1 4.2Å | ||
| 353 | S | 88.9 | Confident | 91.8 | Very high | 124 Ų | 124 | 51.3 Ų | 51.3 | 87% | 0.867 | 28% | 0.278 | S | S | * | . | S | Bend | trans | -79.2 | -7.4 | -177.4 | 54.2 | 0 | 0 | 0 | 0 | 113.8 | ||
| 354 | Y | 90.1 | Very high | 91.4 | Very high | 103 Ų | 103 | 54.4 Ų | 54.4 | 40% | 0.404 | 30% | 0.295 | S | S | . | . | S | Bend | trans | -138.8 | 164.6 | -177 | 60.8 | -91.8 | 0 | 0 | 0 | 111 | C352 V356 C359 G360 | C352-Y354 VanDerWaalsContact C-N 3.25Å; C352-Y354 PolarHBondContact O-N 3.39Å; C352-Y354 WeakPolarHBondContact SG-CE1 3.16Å; Y354-V356 HydrophobicContact CD2-CG1 4.37Å; Y354-V356 HydrophobicContact CE2-CB 4.46Å; Y354-V356 HydrophobicContact CE2-CG1 3.88Å; Y354-V356 PolarHBondContact O-N 3Å; Y354-C359 HydrophobicContact CD2-CB 3.61Å; Y354-C359 HydrophobicContact CE2-CB 3.66Å; Y354-G360 PolarHBondContact OH-O 2.92Å |
| 355 | D | 90.4 | Very high | 90.7 | Very high | 18 Ų | 18 | 52.6 Ų | 52.6 | 10% | 0.096 | 30% | 0.299 | C | S | . | . | trans | -73.9 | 105.5 | 172.2 | -172.9 | -22.7 | 0 | 0 | 0 | 109.4 | Y253 K254 T357 E358 C359 | Y253-D355 WeakPolarHBondContact CA-OD2 3.28Å; Y253-D355 VanDerWaalsContact CD1-OD1 3.28Å; Y253-D355 WeakPolarHBondContact CD1-OD1 3.24Å; K254-D355 PolarHBondContact N-OD2 3.38Å; D355-T357 VanDerWaalsContact CG-OG1 3.26Å; D355-T357 PolarHBondContact O-N 3.29Å; D355-T357 VanDerWaalsContact O-N 3.11Å; D355-T357 WeakPolarHBondContact OD1-CA 3.46Å; D355-T357 VanDerWaalsContact OD1-CB 3.31Å; D355-T357 WeakPolarHBondContact OD1-CB 3.24Å; D355-T357 PolarHBondContact OD1-N 2.91Å; D355-T357 PolarHBondContact OD1-OG1 3.45Å; D355-T357 PolarHBondContact OD2-OG1 3.48Å; D355-E358 HydrophobicContact CB-CB 4.36Å; D355-E358 HydrophobicContact CB-CG 4.07Å; D355-E358 PolarHBondContact O-N 3.31Å; D355-C359 PolarHBondContact O-N 3.03Å | ||
| 356 | V | 91.8 | Very high | 90.2 | Very high | 2 Ų | 2 | 53.4 Ų | 53.4 | 1% | 0.012 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.5 | -21.3 | -179.7 | -66.1 | 0 | 0 | 0 | 0 | 113.2 | Y253 F333 L337 C352 Y354 E358 G360 I361 | Y253-V356 HydrophobicContact CE1-CG2 3.78Å; F333-V356 HydrophobicContact CE1-CB 4.2Å; F333-V356 HydrophobicContact CE1-CG2 3.94Å; F333-V356 WeakPolarHBondContact CE1-O 3.43Å; F333-V356 WeakPolarHBondContact CZ-O 3.34Å; L337-V356 HydrophobicContact CD2-CG2 3.86Å; C352-V356 HydrophobicContact CB-CG1 4.2Å; Y354-V356 HydrophobicContact CD2-CG1 4.37Å; Y354-V356 HydrophobicContact CE2-CB 4.46Å; Y354-V356 HydrophobicContact CE2-CG1 3.88Å; Y354-V356 PolarHBondContact O-N 3Å; V356-E358 VanDerWaalsContact C-N 3.32Å; V356-G360 VanDerWaalsContact O-CA 3.27Å; V356-G360 WeakPolarHBondContact O-CA 3.4Å; V356-G360 PolarHBondContact O-N 3.47Å; V356-I361 HydrophobicContact CB-CB 4.43Å; V356-I361 HydrophobicContact CB-CG2 4.48Å; V356-I361 HydrophobicContact CG1-CB 4.31Å; V356-I361 HydrophobicContact CG1-CD1 3.98Å |
| 357 | T | 91 | Very high | 89.8 | Confident | 18 Ų | 18 | 54.3 Ų | 54.3 | 11% | 0.11 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -75.3 | -23.5 | 177.3 | 70.5 | 0 | 0 | 0 | 0 | 112.2 | Y253 T330 F333 L334 D355 | Y253-T357 HydrophobicContact CD1-CG2 3.61Å; Y253-T357 HydrophobicContact CE1-CG2 3.99Å; Y253-T357 HydrophobicContact CG-CG2 4.47Å; T330-T357 HydrophobicContact CG2-CG2 4.23Å; F333-T357 HydrophobicContact CB-CG2 4.24Å; F333-T357 HydrophobicContact CD1-CG2 3.49Å; F333-T357 VanDerWaalsContact CD1-CG2 3.49Å; F333-T357 HydrophobicContact CE1-CG2 4.06Å; F333-T357 HydrophobicContact CG-CG2 3.96Å; L334-T357 HydrophobicContact CD2-CG2 4.16Å; D355-T357 VanDerWaalsContact CG-OG1 3.26Å; D355-T357 PolarHBondContact O-N 3.29Å; D355-T357 VanDerWaalsContact O-N 3.11Å; D355-T357 WeakPolarHBondContact OD1-CA 3.46Å; D355-T357 VanDerWaalsContact OD1-CB 3.31Å; D355-T357 WeakPolarHBondContact OD1-CB 3.24Å; D355-T357 PolarHBondContact OD1-N 2.91Å; D355-T357 PolarHBondContact OD1-OG1 3.45Å; D355-T357 PolarHBondContact OD2-OG1 3.48Å |
| 358 | E | 88.8 | Confident | 89.4 | Confident | 98 Ų | 98 | 54.3 Ų | 54.3 | 46% | 0.458 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -89.4 | -37.2 | 177.6 | -64.2 | -173.7 | 163.6 | 0 | 0 | 112.1 | K254 D355 V356 P370 | K254-E358 VanDerWaalsContact CD-OE1 3.31Å; K254-E358 WeakPolarHBondContact CD-OE1 3.23Å; K254-E358 WeakPolarHBondContact CE-OE1 3.46Å; K254-E358 VanDerWaalsContact NZ-CD 3.29Å; K254-E358 IonicContact NZ-OE1 2.71Å; K254-E358 PolarHBondContact NZ-OE1 3.15Å; K254-E358 IonicContact NZ-OE2 3.55Å; K254-E358 PolarHBondContact NZ-OE2 3.09Å; D355-E358 HydrophobicContact CB-CB 4.36Å; D355-E358 HydrophobicContact CB-CG 4.07Å; D355-E358 PolarHBondContact O-N 3.31Å; V356-E358 VanDerWaalsContact C-N 3.32Å; E358-P370 WeakPolarHBondContact O-CG 3.18Å |
| 359 | C | 88.2 | Confident | 89.1 | Confident | 81 Ų | 81 | 59.1 Ų | 59.1 | 55% | 0.547 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -105 | -13.6 | -174 | -55.3 | 0 | 0 | 0 | 0 | 114.8 | Y354 D355 | Y354-C359 HydrophobicContact CD2-CB 3.61Å; Y354-C359 HydrophobicContact CE2-CB 3.66Å; D355-C359 PolarHBondContact O-N 3.03Å |
| 360 | G | 90.4 | Very high | 88.5 | Confident | 5 Ų | 5 | 60.1 Ų | 60.1 | 5% | 0.052 | 34% | 0.337 | C | S | . | . | trans | 77.8 | 173.7 | -171.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y354 V356 L368 | Y354-G360 PolarHBondContact OH-O 2.92Å; V356-G360 VanDerWaalsContact O-CA 3.27Å; V356-G360 WeakPolarHBondContact O-CA 3.4Å; V356-G360 PolarHBondContact O-N 3.47Å; G360-L368 CarbonylContact C-O 3.55Å; G360-L368 WeakPolarHBondContact CA-O 3.24Å | ||
| 361 | I | 92.2 | Very high | 87.8 | Confident | 21 Ų | 21 | 57.7 Ų | 57.7 | 11% | 0.108 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.9 | 141.6 | 179.7 | -171.1 | 167.3 | 0 | 0 | 0 | 112.2 | F333 L337 L345 V356 L368 | F333-I361 HydrophobicContact CZ-CG2 4.31Å; L337-I361 HydrophobicContact CD1-CG2 3.8Å; L345-I361 HydrophobicContact CD1-CD1 3.68Å; V356-I361 HydrophobicContact CB-CB 4.43Å; V356-I361 HydrophobicContact CB-CG2 4.48Å; V356-I361 HydrophobicContact CG1-CB 4.31Å; V356-I361 HydrophobicContact CG1-CD1 3.98Å; I361-L368 HydrophobicContact CG2-CB 4.22Å; I361-L368 HydrophobicContact CG2-CD1 4.38Å; I361-L368 PolarHBondContact N-O 2.97Å; I361-L368 PolarHBondContact O-N 3.08Å |
| 362 | S | 90.2 | Very high | 87.4 | Confident | 71 Ų | 71 | 53.8 Ų | 53.8 | 50% | 0.497 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 114.3 | 169.3 | -88.1 | 0 | 0 | 0 | 0 | 109.9 | M29 F366 S367 | M29-S362 VanDerWaalsContact CE-CB 3.4Å; S362-F366 CarbonylContact C-O 3.51Å; S362-F366 WeakPolarHBondContact CA-O 3.47Å; S362-S367 PolarHBondContact OG-OG 3.23Å |
| 363 | L | 86.6 | Confident | 86.9 | Confident | 40 Ų | 40 | 54.7 Ų | 54.7 | 21% | 0.209 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 134.7 | -176.4 | -176.3 | 68.6 | 0 | 0 | 0 | 111.1 | L337 I340 L345 G365 F366 | L337-L363 HydrophobicContact CD1-CD2 4.12Å; I340-L363 HydrophobicContact CD1-CB 3.89Å; I340-L363 HydrophobicContact CD1-CD2 4.48Å; I340-L363 HydrophobicContact CG1-CD2 4.39Å; L345-L363 HydrophobicContact CD1-CD2 4.18Å; L363-G365 PolarHBondContact O-N 3.47Å; L363-G365 VanDerWaalsContact O-N 3.14Å; L363-F366 PolarHBondContact N-O 2.97Å; L363-F366 PolarHBondContact O-N 3.26Å |
| 364 | N | 85 | Confident | 86.3 | Confident | 83 Ų | 83 | 52.3 Ų | 52.3 | 44% | 0.444 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.1 | 36.1 | 175.5 | -64.2 | -29.9 | 0 | 0 | 0 | 114.9 | I340 F366 | I340-N364 PolarHBondContact O-ND2 3.48Å; N364-F366 VanDerWaalsContact C-N 3.32Å; N364-F366 WeakPolarHBondContact O-CD2 3.24Å |
| 365 | G | 82.4 | Confident | 85.6 | Confident | 42 Ų | 42 | 48.5 Ų | 48.5 | 43% | 0.433 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 79.9 | 9.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | M29 L363 | M29-G365 WeakPolarHBondContact CB-O 3.49Å; M29-G365 PolarHBondContact N-O 2.81Å; L363-G365 PolarHBondContact O-N 3.47Å; L363-G365 VanDerWaalsContact O-N 3.14Å |
| 366 | F | 84.2 | Confident | 85 | Confident | 41 Ų | 41 | 50.3 Ų | 50.3 | 18% | 0.18 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 145.1 | 172.8 | -61.5 | -80 | 0 | 0 | 0 | 110.4 | I26 Q27 P28 M29 I340 S362 L363 N364 | I26-F366 HydrophobicContact CG2-CB 4.01Å; I26-F366 HydrophobicContact CG2-CD1 3.26Å; I26-F366 HydrophobicContact CG2-CE1 3.87Å; I26-F366 HydrophobicContact CG2-CG 3.76Å; Q27-F366 WeakPolarHBondContact O-CA 3.16Å; P28-F366 HydrophobicContact CB-CD1 4.46Å; P28-F366 HydrophobicContact CB-CE1 4.38Å; M29-F366 WeakPolarHBondContact CE-O 3.46Å; I340-F366 HydrophobicContact CB-CB 4.33Å; I340-F366 HydrophobicContact CB-CD2 4.09Å; I340-F366 HydrophobicContact CB-CG 4.45Å; I340-F366 HydrophobicContact CD1-CB 4.2Å; I340-F366 HydrophobicContact CG2-CB 3.85Å; I340-F366 HydrophobicContact CG2-CD2 3.86Å; I340-F366 HydrophobicContact CG2-CG 3.86Å; S362-F366 CarbonylContact C-O 3.51Å; S362-F366 WeakPolarHBondContact CA-O 3.47Å; L363-F366 PolarHBondContact N-O 2.97Å; L363-F366 PolarHBondContact O-N 3.26Å; N364-F366 VanDerWaalsContact C-N 3.32Å; N364-F366 WeakPolarHBondContact O-CD2 3.24Å |
| 367 | S | 87.1 | Confident | 84.5 | Confident | 20 Ų | 20 | 59.1 Ų | 59.1 | 14% | 0.14 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 134.8 | 166.4 | -159.5 | 0 | 0 | 0 | 0 | 109.8 | Q27 S362 E369 | Q27-S367 PolarHBondContact N-O 2.89Å; Q27-S367 PolarHBondContact O-N 3.14Å; S362-S367 PolarHBondContact OG-OG 3.23Å; S367-E369 PolarHBondContact OG-OE1 2.93Å |
| 368 | L | 88.2 | Confident | 84 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 109.6 | 167.9 | -70.2 | 177 | 0 | 0 | 0 | 108.4 | P24 I26 F333 N336 L337 I340 G360 I361 | P24-L368 HydrophobicContact CB-CD2 4.37Å; I26-L368 HydrophobicContact CG1-CD2 3.9Å; F333-L368 HydrophobicContact CE2-CB 4.05Å; F333-L368 HydrophobicContact CZ-CB 4.05Å; N336-L368 HydrophobicContact CB-CD1 4.41Å; N336-L368 HydrophobicContact CB-CD2 3.95Å; L337-L368 VanDerWaalsContact CA-CD1 3.45Å; L337-L368 HydrophobicContact CB-CD1 3.93Å; L337-L368 HydrophobicContact CD1-CD1 4.09Å; I340-L368 HydrophobicContact CD1-CD1 3.45Å; I340-L368 VanDerWaalsContact CD1-CD1 3.45Å; I340-L368 HydrophobicContact CD1-CG 3.72Å; I340-L368 HydrophobicContact CG1-CD1 4.04Å; G360-L368 CarbonylContact C-O 3.55Å; G360-L368 WeakPolarHBondContact CA-O 3.24Å; I361-L368 HydrophobicContact CG2-CB 4.22Å; I361-L368 HydrophobicContact CG2-CD1 4.38Å; I361-L368 PolarHBondContact N-O 2.97Å; I361-L368 PolarHBondContact O-N 3.08Å |
| 369 | E | 88.6 | Confident | 83.7 | Confident | 109 Ų | 109 | 64.4 Ų | 64.4 | 51% | 0.509 | 36% | 0.36 | S | S | . | . | P | Polyproline II helix | trans | -81.8 | 151 | 173.8 | -58.2 | -54.8 | 137.4 | 0 | 0 | 110.7 | S367 | S367-E369 PolarHBondContact OG-OE1 2.93Š|
| 370 | P | 84.8 | Confident | 83.3 | Confident | 48 Ų | 48 | 65.5 Ų | 65.5 | 31% | 0.312 | 35% | 0.353 | S | S | . | . | P | Polyproline II helix | trans | -53.8 | 146.1 | 171.9 | -24.3 | 34.1 | 0 | 0 | 0 | 112.2 | E358 V372 | E358-P370 WeakPolarHBondContact O-CG 3.18Å; P370-V372 PolarHBondContact O-N 3.24Å |
| 371 | I | 79.5 | Confident | 82.9 | Confident | 32 Ų | 32 | 71.5 Ų | 71.5 | 16% | 0.164 | 38% | 0.384 | C | S | . | . | P | Polyproline II helix | trans | -79.9 | 123 | 176 | -55.1 | -178.9 | 0 | 0 | 0 | 108.9 | P24 Q329 Q332 F333 | P24-I371 HydrophobicContact CB-CG1 4.45Å; P24-I371 HydrophobicContact CG-CD1 3.7Å; P24-I371 HydrophobicContact CG-CG1 3.88Å; Q329-I371 HydrophobicContact CB-CB 4.35Å; Q329-I371 HydrophobicContact CB-CD1 4.03Å; Q329-I371 HydrophobicContact CB-CG2 4.23Å; Q329-I371 HydrophobicContact CG-CG2 3.92Å; Q329-I371 WeakPolarHBondContact O-CD1 3.07Å; Q332-I371 HydrophobicContact CB-CD1 3.91Å; F333-I371 HydrophobicContact CB-CD1 4.16Å; F333-I371 HydrophobicContact CD2-CG1 4.46Å |
| 372 | V | 79.7 | Confident | 82.3 | Confident | 118 Ų | 118 | 80.4 Ų | 80.4 | 72% | 0.715 | 42% | 0.416 | S | S | * | . | P | Polyproline II helix | trans | -61 | 125.9 | 171.7 | -179.3 | 0 | 0 | 0 | 0 | 109.2 | Q329 P370 L374 | Q329-V372 PolarHBondContact OE1-O 3.02Å; P370-V372 PolarHBondContact O-N 3.24Å; V372-L374 PolarHBondContact O-N 3.34Å; V372-L374 VanDerWaalsContact O-N 3.15Å |
| 373 | P | 77.4 | Confident | 81.7 | Confident | 74 Ų | 74 | 79.4 Ų | 79.4 | 48% | 0.481 | 40% | 0.403 | S | S | . | . | P | Polyproline II helix | trans | -52.2 | 121.2 | 178.9 | -27.5 | 34.6 | 0 | 0 | 0 | 112 | I375 | P373-I375 PolarHBondContact O-N 3.14Š|
| 374 | L | 75.4 | Confident | 81.4 | Confident | 75 Ų | 75 | 80.7 Ų | 80.7 | 39% | 0.393 | 41% | 0.41 | S | S | . | . | S | Bend | trans | -58.1 | -33.5 | 176.5 | -176.4 | 68.2 | 0 | 0 | 0 | 112.9 | N325 V372 N379 F383 | N325-L374 PolarHBondContact ND2-N 3.18Å; N325-L374 WeakPolarHBondContact OD1-CB 3.4Å; V372-L374 PolarHBondContact O-N 3.34Å; V372-L374 VanDerWaalsContact O-N 3.15Å; L374-N379 PolarHBondContact O-ND2 3.28Å; L374-F383 HydrophobicContact CD1-CZ 4.38Å; L374-F383 HydrophobicContact CD2-CE1 4.34Å; L374-F383 HydrophobicContact CD2-CZ 3.94Å; L374-F383 HydrophobicContact CG-CE2 4.41Å; L374-F383 HydrophobicContact CG-CZ 3.76Å; L374-F383 WeakPolarHBondContact O-CE2 3.27Å |
| 375 | I | 75.5 | Confident | 81.1 | Confident | 22 Ų | 22 | 85.6 Ų | 85.6 | 11% | 0.113 | 42% | 0.422 | C | S | . | . | S | Bend | trans | -107.7 | 120.4 | 176.4 | -56.4 | 172.8 | 0 | 0 | 0 | 107 | L321 E322 N325 P373 N379 F383 | L321-I375 HydrophobicContact CB-CD1 3.6Å; L321-I375 HydrophobicContact CD1-CD1 4.3Å; E322-I375 HydrophobicContact CG-CG2 4.43Å; N325-I375 HydrophobicContact CB-CD1 4.25Å; P373-I375 PolarHBondContact O-N 3.14Å; I375-N379 WeakPolarHBondContact CA-OD1 3.46Å; I375-F383 HydrophobicContact CD1-CD1 4.26Å; I375-F383 HydrophobicContact CD1-CG 4.42Å; I375-F383 HydrophobicContact CG1-CD1 4.13Å; I375-F383 HydrophobicContact CG1-CD2 4Å; I375-F383 HydrophobicContact CG1-CE1 4.18Å; I375-F383 HydrophobicContact CG1-CE2 4.04Å; I375-F383 HydrophobicContact CG1-CG 4.06Å; I375-F383 HydrophobicContact CG1-CZ 4.15Å |
| 376 | N | 79.2 | Confident | 80.6 | Confident | 56 Ų | 56 | 87.6 Ų | 87.6 | 30% | 0.299 | 42% | 0.417 | S | S | . | . | trans | -136 | 174.4 | 176.9 | 68.6 | 6.2 | 0 | 0 | 0 | 109.9 | E378 N379 R380 | N376-E378 PolarHBondContact O-N 2.77Å; N376-E378 PolarHBondContact OD1-N 3.15Å; N376-N379 PolarHBondContact N-OD1 3.21Å; N376-N379 PolarHBondContact O-N 2.91Å; N376-N379 PolarHBondContact O-OD1 2.78Å; N376-N379 WeakPolarHBondContact OD1-CB 3.04Å; N376-N379 PolarHBondContact OD1-N 2.83Å; N376-N379 PolarHBondContact OD1-ND2 3.25Å; N376-N379 PolarHBondContact OD1-OD1 3.26Å; N376-R380 WeakPolarHBondContact O-CB 3.19Å; N376-R380 PolarHBondContact O-N 3Å | ||
| 377 | E | 79.5 | Confident | 80.1 | Confident | 187 Ų | 187 | 88 Ų | 88 | 87% | 0.874 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -35.2 | -178.7 | -65.2 | -178.5 | 173.8 | 0 | 0 | 112.3 | N379 | E377-N379 PolarHBondContact O-N 2.9Š|
| 378 | E | 81.2 | Confident | 79.5 | Confident | 182 Ų | 182 | 94.1 Ų | 94.1 | 85% | 0.85 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70 | -29.1 | -178 | -58.4 | 174.9 | 166.7 | 0 | 0 | 113.6 | N376 | N376-E378 PolarHBondContact O-N 2.77Å; N376-E378 PolarHBondContact OD1-N 3.15Å |
| 379 | N | 81.7 | Confident | 78.9 | Confident | 45 Ų | 45 | 95.6 Ų | 95.6 | 24% | 0.241 | 45% | 0.45 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -115.9 | 0.4 | -174.2 | 75.3 | 16.7 | 0 | 0 | 0 | 114.7 | L374 I375 N376 E377 D381 R382 F383 | L374-N379 PolarHBondContact O-ND2 3.28Å; I375-N379 WeakPolarHBondContact CA-OD1 3.46Å; N376-N379 PolarHBondContact N-OD1 3.21Å; N376-N379 PolarHBondContact O-N 2.91Å; N376-N379 PolarHBondContact O-OD1 2.78Å; N376-N379 WeakPolarHBondContact OD1-CB 3.04Å; N376-N379 PolarHBondContact OD1-N 2.83Å; N376-N379 PolarHBondContact OD1-ND2 3.25Å; N376-N379 PolarHBondContact OD1-OD1 3.26Å; E377-N379 PolarHBondContact O-N 2.9Å; N379-D381 VanDerWaalsContact C-N 3.34Å; N379-D381 PolarHBondContact O-N 2.96Å; N379-R382 WeakPolarHBondContact O-CB 2.99Å; N379-R382 PolarHBondContact O-N 3.16Å; N379-R382 VanDerWaalsContact O-N 3.11Å; N379-F383 PolarHBondContact O-N 3.31Å |
| 380 | R | 80.1 | Confident | 78 | Confident | 105 Ų | 105 | 92.6 Ų | 92.6 | 40% | 0.396 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -50.5 | -50.4 | -179.9 | 174.5 | -178.7 | -87.3 | -79.1 | -1.8 | 112.2 | E322 N376 R382 F383 D384 | E322-R380 IonicContact OE1-CZ 3.33Å; E322-R380 IonicContact OE1-NH1 3.28Å; E322-R380 PolarHBondContact OE1-NH1 3.32Å; E322-R380 IonicContact OE1-NH2 3.75Å; E322-R380 PolarHBondContact OE1-NH2 3.01Å; N376-R380 WeakPolarHBondContact O-CB 3.19Å; N376-R380 PolarHBondContact O-N 3Å; R380-R382 PolarHBondContact O-N 3.25Å; R380-R382 VanDerWaalsContact O-N 3.16Å; R380-F383 WeakPolarHBondContact O-CA 3.08Å; R380-F383 WeakPolarHBondContact O-CB 3.28Å; R380-F383 PolarHBondContact O-N 3.34Å; R380-D384 WeakPolarHBondContact CG-OD2 3.03Å; R380-D384 PolarHBondContact O-N 3.16Å |
| 381 | D | 81.7 | Confident | 77.3 | Confident | 131 Ų | 131 | 99 Ų | 99 | 70% | 0.701 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -57.5 | -35.6 | -177.6 | -69 | -11.3 | 0 | 0 | 0 | 112.7 | N379 R385 | N379-D381 VanDerWaalsContact C-N 3.34Å; N379-D381 PolarHBondContact O-N 2.96Å; D381-R385 WeakPolarHBondContact O-CB 3.39Å; D381-R385 PolarHBondContact O-N 3.11Å |
| 382 | R | 80.4 | Confident | 76.9 | Confident | 207 Ų | 207 | 101 Ų | 101 | 78% | 0.781 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -68.1 | -40.1 | 177.2 | -171.9 | 179.6 | -179.5 | 177.5 | 1.9 | 111.4 | N379 R380 Y386 | N379-R382 WeakPolarHBondContact O-CB 2.99Å; N379-R382 PolarHBondContact O-N 3.16Å; N379-R382 VanDerWaalsContact O-N 3.11Å; R380-R382 PolarHBondContact O-N 3.25Å; R380-R382 VanDerWaalsContact O-N 3.16Å; R382-Y386 WeakPolarHBondContact O-CB 3.49Å; R382-Y386 PolarHBondContact O-N 2.79Å |
| 383 | F | 78.5 | Confident | 76.2 | Confident | 51 Ų | 51 | 104.9 Ų | 104.9 | 22% | 0.224 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -69.1 | -41.9 | 176.3 | -86.1 | -82.6 | 0 | 0 | 0 | 112 | L374 I375 N379 R380 R385 Y386 L387 | L374-F383 HydrophobicContact CD1-CZ 4.38Å; L374-F383 HydrophobicContact CD2-CE1 4.34Å; L374-F383 HydrophobicContact CD2-CZ 3.94Å; L374-F383 HydrophobicContact CG-CE2 4.41Å; L374-F383 HydrophobicContact CG-CZ 3.76Å; L374-F383 WeakPolarHBondContact O-CE2 3.27Å; I375-F383 HydrophobicContact CD1-CD1 4.26Å; I375-F383 HydrophobicContact CD1-CG 4.42Å; I375-F383 HydrophobicContact CG1-CD1 4.13Å; I375-F383 HydrophobicContact CG1-CD2 4Å; I375-F383 HydrophobicContact CG1-CE1 4.18Å; I375-F383 HydrophobicContact CG1-CE2 4.04Å; I375-F383 HydrophobicContact CG1-CG 4.06Å; I375-F383 HydrophobicContact CG1-CZ 4.15Å; N379-F383 PolarHBondContact O-N 3.31Å; R380-F383 WeakPolarHBondContact O-CA 3.08Å; R380-F383 WeakPolarHBondContact O-CB 3.28Å; R380-F383 PolarHBondContact O-N 3.34Å; F383-R385 VanDerWaalsContact C-N 3.34Å; F383-R385 PolarHBondContact O-N 2.89Å; F383-Y386 WeakPolarHBondContact O-CB 3.44Å; F383-Y386 PolarHBondContact O-N 3.16Å; F383-Y386 VanDerWaalsContact O-N 3.15Å; F383-L387 PolarHBondContact O-N 3.48Å |
| 384 | D | 78.9 | Confident | 74.8 | Confident | 67 Ų | 67 | 110.1 Ų | 110.1 | 36% | 0.358 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.9 | -41.2 | 177.3 | -72.9 | -22.4 | 0 | 0 | 0 | 111.2 | R380 Y386 L387 Y388 | R380-D384 WeakPolarHBondContact CG-OD2 3.03Å; R380-D384 PolarHBondContact O-N 3.16Å; D384-Y386 PolarHBondContact O-N 2.83Å; D384-L387 PolarHBondContact O-N 2.78Å; D384-Y388 PolarHBondContact O-N 2.94Å |
| 385 | R | 78.7 | Confident | 73.3 | Confident | 186 Ų | 186 | 112 Ų | 112 | 70% | 0.702 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.6 | -44.4 | 171.5 | -174.1 | 173.8 | -179.1 | 176.3 | -0.3 | 111.8 | D381 F383 L387 Y388 L389 | D381-R385 WeakPolarHBondContact O-CB 3.39Å; D381-R385 PolarHBondContact O-N 3.11Å; F383-R385 VanDerWaalsContact C-N 3.34Å; F383-R385 PolarHBondContact O-N 2.89Å; R385-L387 VanDerWaalsContact C-N 3.33Å; R385-L387 PolarHBondContact O-N 2.83Å; R385-Y388 PolarHBondContact O-N 3.46Å; R385-L389 HydrophobicContact CG-CD1 4.16Å; R385-L389 WeakPolarHBondContact O-CB 3.49Å; R385-L389 VanDerWaalsContact O-CG 3.24Å; R385-L389 WeakPolarHBondContact O-CG 3.47Å; R385-L389 PolarHBondContact O-N 3.35Å; R385-L389 VanDerWaalsContact O-N 3.08Å |
| 386 | Y | 73.2 | Confident | 71.6 | Confident | 84 Ų | 84 | 113.9 Ų | 113.9 | 33% | 0.329 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60 | -42.1 | 176.7 | 178.9 | -110.4 | 0 | 0 | 0 | 112.1 | V301 R382 F383 D384 L389 L390 L395 | V301-Y386 HydrophobicContact CG1-CE1 4.02Å; V301-Y386 WeakPolarHBondContact CG1-OH 3.3Å; R382-Y386 WeakPolarHBondContact O-CB 3.49Å; R382-Y386 PolarHBondContact O-N 2.79Å; F383-Y386 WeakPolarHBondContact O-CB 3.44Å; F383-Y386 PolarHBondContact O-N 3.16Å; F383-Y386 VanDerWaalsContact O-N 3.15Å; D384-Y386 PolarHBondContact O-N 2.83Å; Y386-L389 PolarHBondContact O-N 2.82Å; Y386-L390 HydrophobicContact CD1-CD1 3.71Å; Y386-L390 HydrophobicContact CE1-CD1 3.36Å; Y386-L390 HydrophobicContact CE1-CG 4.23Å; Y386-L390 HydrophobicContact CE2-CD1 4.43Å; Y386-L390 HydrophobicContact CE2-CG 4.47Å; Y386-L390 HydrophobicContact CG-CD1 4.4Å; Y386-L390 WeakPolarHBondContact O-CG 3.34Å; Y386-L390 PolarHBondContact O-N 2.87Å; Y386-L395 HydrophobicContact CE2-CD2 4.37Å |
| 387 | L | 72.5 | Confident | 69.7 | Low | 48 Ų | 48 | 114.3 Ų | 114.3 | 25% | 0.251 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.1 | -43.3 | 174.8 | -73.2 | -173.2 | 0 | 0 | 0 | 113.7 | P300 L321 F383 D384 R385 L389 L390 K391 | P300-L387 HydrophobicContact CB-CD2 4.15Å; P300-L387 HydrophobicContact CG-CD2 3.89Å; L321-L387 HydrophobicContact CD1-CD1 3.16Å; L321-L387 HydrophobicContact CD1-CD2 3.99Å; L321-L387 HydrophobicContact CD1-CG 3.59Å; L321-L387 HydrophobicContact CD2-CD1 3.9Å; L321-L387 HydrophobicContact CD2-CD2 3.81Å; L321-L387 HydrophobicContact CD2-CG 4.29Å; L321-L387 HydrophobicContact CG-CD1 3.62Å; L321-L387 HydrophobicContact CG-CD2 4.39Å; L321-L387 HydrophobicContact CG-CG 4.34Å; F383-L387 PolarHBondContact O-N 3.48Å; D384-L387 PolarHBondContact O-N 2.78Å; R385-L387 VanDerWaalsContact C-N 3.33Å; R385-L387 PolarHBondContact O-N 2.83Å; L387-L389 PolarHBondContact O-N 3.46Å; L387-L390 HydrophobicContact CD2-CD1 4.26Å; L387-L390 PolarHBondContact O-N 2.98Å; L387-K391 WeakPolarHBondContact O-CB 3.38Å; L387-K391 PolarHBondContact O-N 3.42Å |
| 388 | Y | 75.1 | Confident | 67.8 | Low | 150 Ų | 150 | 112.1 Ų | 112.1 | 59% | 0.588 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -55.7 | -44.5 | 177 | 175.8 | -90.4 | 0 | 0 | 0 | 110.4 | D384 R385 K391 N392 | D384-Y388 PolarHBondContact O-N 2.94Å; R385-Y388 PolarHBondContact O-N 3.46Å; Y388-K391 PolarHBondContact O-N 3.28Å; Y388-N392 WeakPolarHBondContact CD2-ND2 3.37Å; Y388-N392 WeakPolarHBondContact CE1-ND2 3.37Å; Y388-N392 WeakPolarHBondContact CE2-ND2 3.44Å; Y388-N392 WeakPolarHBondContact O-CB 3.47Å; Y388-N392 PolarHBondContact O-N 3.45Å; Y388-N392 VanDerWaalsContact O-N 3.11Å; Y388-N392 PolarHBondContact O-ND2 3.01Å |
| 389 | L | 75 | Confident | 65.8 | Low | 31 Ų | 31 | 108.4 Ų | 108.4 | 16% | 0.162 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 177.9 | -71 | 174.6 | 0 | 0 | 0 | 112.1 | R385 Y386 L387 N392 K393 R394 P396 | R385-L389 HydrophobicContact CG-CD1 4.16Å; R385-L389 WeakPolarHBondContact O-CB 3.49Å; R385-L389 VanDerWaalsContact O-CG 3.24Å; R385-L389 WeakPolarHBondContact O-CG 3.47Å; R385-L389 PolarHBondContact O-N 3.35Å; R385-L389 VanDerWaalsContact O-N 3.08Å; Y386-L389 PolarHBondContact O-N 2.82Å; L387-L389 PolarHBondContact O-N 3.46Å; L389-N392 CarbonylContact O-C 3.5Å; L389-N392 PolarHBondContact O-N 3.27Å; L389-K393 PolarHBondContact O-N 3.49Å; L389-K393 VanDerWaalsContact O-N 3.13Å; L389-R394 WeakPolarHBondContact CB-O 3.46Å; L389-R394 HydrophobicContact CD2-CB 4.19Å; L389-R394 VanDerWaalsContact CD2-O 3.24Å; L389-R394 WeakPolarHBondContact CD2-O 3.4Å; L389-R394 CarbonylContact O-C 3.48Å; L389-R394 PolarHBondContact O-N 2.98Å; L389-P396 HydrophobicContact CD1-CB 4.5Å; L389-P396 HydrophobicContact CD1-CG 3.78Å |
| 390 | L | 69 | Low | 64 | Low | 46 Ų | 46 | 110.5 Ų | 110.5 | 24% | 0.241 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -62 | -47.1 | 174.5 | -75.2 | 169.3 | 0 | 0 | 0 | 113.1 | V301 Y386 L387 N392 K393 L395 | V301-L390 HydrophobicContact CG1-CD1 3.29Å; V301-L390 HydrophobicContact CG1-CD2 3.65Å; V301-L390 HydrophobicContact CG1-CG 4.11Å; Y386-L390 HydrophobicContact CD1-CD1 3.71Å; Y386-L390 HydrophobicContact CE1-CD1 3.36Å; Y386-L390 HydrophobicContact CE1-CG 4.23Å; Y386-L390 HydrophobicContact CE2-CD1 4.43Å; Y386-L390 HydrophobicContact CE2-CG 4.47Å; Y386-L390 HydrophobicContact CG-CD1 4.4Å; Y386-L390 WeakPolarHBondContact O-CG 3.34Å; Y386-L390 PolarHBondContact O-N 2.87Å; L387-L390 HydrophobicContact CD2-CD1 4.26Å; L387-L390 PolarHBondContact O-N 2.98Å; L390-N392 PolarHBondContact O-N 2.86Å; L390-K393 PolarHBondContact O-N 3.13Å; L390-L395 HydrophobicContact CD2-CD2 3.78Å; L390-L395 HydrophobicContact CD2-CG 4.47Å |
| 391 | K | 70.1 | Confident | 62.1 | Low | 181 Ų | 181 | 108.6 Ų | 108.6 | 79% | 0.787 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.2 | -35.5 | -179.6 | -171.5 | 177.9 | 179.7 | -177.5 | 0 | 111.5 | L387 Y388 | L387-K391 WeakPolarHBondContact O-CB 3.38Å; L387-K391 PolarHBondContact O-N 3.42Å; Y388-K391 PolarHBondContact O-N 3.28Å |
| 392 | N | 72.5 | Confident | 60.2 | Low | 74 Ų | 74 | 106.9 Ų | 106.9 | 40% | 0.396 | 50% | 0.504 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.8 | 11.7 | -179.2 | -64.2 | -47.9 | 0 | 0 | 0 | 113.6 | Y388 L389 L390 R394 | Y388-N392 WeakPolarHBondContact CD2-ND2 3.37Å; Y388-N392 WeakPolarHBondContact CE1-ND2 3.37Å; Y388-N392 WeakPolarHBondContact CE2-ND2 3.44Å; Y388-N392 WeakPolarHBondContact O-CB 3.47Å; Y388-N392 PolarHBondContact O-N 3.45Å; Y388-N392 VanDerWaalsContact O-N 3.11Å; Y388-N392 PolarHBondContact O-ND2 3.01Å; L389-N392 CarbonylContact O-C 3.5Å; L389-N392 PolarHBondContact O-N 3.27Å; L390-N392 PolarHBondContact O-N 2.86Å; N392-R394 PolarHBondContact O-N 3.03Å |
| 393 | K | 64 | Low | 58.1 | Low | 200 Ų | 200 | 101.8 Ų | 101.8 | 87% | 0.87 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.5 | 19.5 | -176.8 | -61.6 | -176.1 | 178.7 | 179.4 | 0 | 114.7 | L389 L390 L395 | L389-K393 PolarHBondContact O-N 3.49Å; L389-K393 VanDerWaalsContact O-N 3.13Å; L390-K393 PolarHBondContact O-N 3.13Å; K393-L395 PolarHBondContact O-N 3.48Å |
| 394 | R | 48.6 | Very low | 56.4 | Low | 185 Ų | 185 | 102.2 Ų | 102.2 | 70% | 0.698 | 51% | 0.505 | S | S | * | . | trans | -100.2 | 74 | 176 | -71.7 | -174.7 | -173.9 | -179.7 | 1.7 | 107.9 | L389 N392 | L389-R394 WeakPolarHBondContact CB-O 3.46Å; L389-R394 HydrophobicContact CD2-CB 4.19Å; L389-R394 VanDerWaalsContact CD2-O 3.24Å; L389-R394 WeakPolarHBondContact CD2-O 3.4Å; L389-R394 CarbonylContact O-C 3.48Å; L389-R394 PolarHBondContact O-N 2.98Å; N392-R394 PolarHBondContact O-N 3.03Å | ||
| 395 | L | 44.6 | Very low | 54.6 | Low | 114 Ų | 114 | 104.6 Ų | 104.6 | 60% | 0.597 | 51% | 0.514 | S | S | * | . | P | Polyproline II helix | trans | -64.7 | 128.1 | 166.8 | -78.5 | 166.1 | 0 | 0 | 0 | 107.6 | Y386 L390 K393 S397 | Y386-L395 HydrophobicContact CE2-CD2 4.37Å; L390-L395 HydrophobicContact CD2-CD2 3.78Å; L390-L395 HydrophobicContact CD2-CG 4.47Å; K393-L395 PolarHBondContact O-N 3.48Å; L395-S397 PolarHBondContact O-N 2.97Å |
| 396 | P | 39.2 | Very low | 52.8 | Low | 61 Ų | 61 | 100 Ų | 100 | 40% | 0.396 | 50% | 0.503 | S | S | . | . | P | Polyproline II helix | trans | -65.3 | 123.5 | 171.9 | 26.2 | -25.6 | 0 | 0 | 0 | 106.7 | L389 D400 | L389-P396 HydrophobicContact CD1-CB 4.5Å; L389-P396 HydrophobicContact CD1-CG 3.78Å; P396-D400 WeakPolarHBondContact CA-OD2 3.34Å; P396-D400 HydrophobicContact CB-CB 4.32Å; P396-D400 WeakPolarHBondContact CB-OD2 3.5Å |
| 397 | S | 39 | Very low | 51.4 | Low | 66 Ų | 66 | 98.9 Ų | 98.9 | 46% | 0.462 | 51% | 0.511 | S | S | . | . | P | Polyproline II helix | trans | -64 | 148.3 | 170.8 | 64.2 | 0 | 0 | 0 | 0 | 108.6 | L395 N399 D400 | L395-S397 PolarHBondContact O-N 2.97Å; S397-N399 PolarHBondContact O-N 2.72Å; S397-D400 PolarHBondContact O-N 3.23Å |
| 398 | D | 39.3 | Very low | 50 | Low | 141 Ų | 141 | 99.7 Ų | 99.7 | 75% | 0.754 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.5 | -11.3 | 178.5 | -72.1 | -40 | 0 | 0 | 0 | 113.9 | S401 | D398-S401 PolarHBondContact O-OG 3.37Š|
| 399 | N | 40.2 | Very low | 48.3 | Very low | 104 Ų | 104 | 98.1 Ų | 98.1 | 56% | 0.556 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -70.9 | -22.2 | 171.6 | -72.9 | -13.1 | 0 | 0 | 0 | 114.7 | S397 S401 L402 N403 | S397-N399 PolarHBondContact O-N 2.72Å; N399-S401 VanDerWaalsContact C-N 3.35Å; N399-L402 PolarHBondContact O-N 3.11Å; N399-N403 PolarHBondContact O-N 3.1Å; N399-N403 PolarHBondContact O-ND2 2.91Å |
| 400 | D | 43.2 | Very low | 46.6 | Very low | 88 Ų | 88 | 100.4 Ų | 100.4 | 47% | 0.471 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -73.2 | -30.2 | -179.7 | -69.4 | -27.4 | 0 | 0 | 0 | 111.7 | P396 S397 A404 | P396-D400 WeakPolarHBondContact CA-OD2 3.34Å; P396-D400 HydrophobicContact CB-CB 4.32Å; P396-D400 WeakPolarHBondContact CB-OD2 3.5Å; S397-D400 PolarHBondContact O-N 3.23Å; D400-A404 WeakPolarHBondContact O-CB 3.37Å; D400-A404 PolarHBondContact O-N 2.85Å; D400-A404 VanDerWaalsContact O-N 3.13Å |
| 401 | S | 41.4 | Very low | 45.2 | Very low | 65 Ų | 65 | 101.8 Ų | 101.8 | 46% | 0.455 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -72.5 | -33.6 | 169.6 | 29.8 | 0 | 0 | 0 | 0 | 112.9 | D398 N399 A404 Q405 | D398-S401 PolarHBondContact O-OG 3.37Å; N399-S401 VanDerWaalsContact C-N 3.35Å; S401-A404 PolarHBondContact O-N 2.9Å; S401-Q405 WeakPolarHBondContact O-CB 3.42Å; S401-Q405 WeakPolarHBondContact O-CG 3.49Å; S401-Q405 PolarHBondContact O-N 2.92Å |
| 402 | L | 40.6 | Very low | 43.6 | Very low | 96 Ų | 96 | 101 Ų | 101 | 50% | 0.503 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -69.4 | -41.3 | 176.6 | -131.9 | 92.2 | 0 | 0 | 0 | 110.8 | N399 Q405 L406 | N399-L402 PolarHBondContact O-N 3.11Å; L402-Q405 PolarHBondContact O-N 2.91Å; L402-L406 HydrophobicContact CD2-CD1 4.36Å; L402-L406 VanDerWaalsContact O-CB 3.29Å; L402-L406 WeakPolarHBondContact O-CB 3.29Å; L402-L406 WeakPolarHBondContact O-CD1 3.36Å; L402-L406 VanDerWaalsContact O-CG 3.24Å; L402-L406 WeakPolarHBondContact O-CG 3.27Å; L402-L406 PolarHBondContact O-N 2.96Å |
| 403 | N | 37.3 | Very low | 41.8 | Very low | 99 Ų | 99 | 105.6 Ų | 105.6 | 53% | 0.529 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -69.2 | -32.3 | 176.4 | -73.2 | -22.6 | 0 | 0 | 0 | 112.6 | N399 A407 | N399-N403 PolarHBondContact O-N 3.1Å; N399-N403 PolarHBondContact O-ND2 2.91Å; N403-A407 WeakPolarHBondContact O-CB 3.41Å; N403-A407 PolarHBondContact O-N 2.92Å |
| 404 | A | 42 | Very low | 40.4 | Very low | 61 Ų | 61 | 100 Ų | 100 | 50% | 0.504 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -70.9 | -37 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | D400 S401 S408 | D400-A404 WeakPolarHBondContact O-CB 3.37Å; D400-A404 PolarHBondContact O-N 2.85Å; D400-A404 VanDerWaalsContact O-N 3.13Å; S401-A404 PolarHBondContact O-N 2.9Å; A404-S408 PolarHBondContact O-N 2.64Å; A404-S408 VanDerWaalsContact O-N 3.1Å; A404-S408 PolarHBondContact O-OG 3.24Å; A404-S408 VanDerWaalsContact O-OG 3.11Å |
| 405 | Q | 41.4 | Very low | 39.7 | Very low | 117 Ų | 117 | 96.8 Ų | 96.8 | 55% | 0.547 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -73.2 | -36.4 | 174.7 | -74.8 | -178.5 | -44.5 | 0 | 0 | 112.4 | S401 L402 S408 Q409 | S401-Q405 WeakPolarHBondContact O-CB 3.42Å; S401-Q405 WeakPolarHBondContact O-CG 3.49Å; S401-Q405 PolarHBondContact O-N 2.92Å; L402-Q405 PolarHBondContact O-N 2.91Å; Q405-S408 WeakPolarHBondContact CA-OG 3.4Å; Q405-S408 PolarHBondContact O-N 3.32Å; Q405-S408 PolarHBondContact O-OG 3.44Å; Q405-Q409 WeakPolarHBondContact O-CB 3.24Å; Q405-Q409 VanDerWaalsContact O-CG 3.27Å; Q405-Q409 WeakPolarHBondContact O-CG 3.36Å; Q405-Q409 PolarHBondContact O-N 2.9Å |
| 406 | L | 41.2 | Very low | 39.1 | Very low | 88 Ų | 88 | 98 Ų | 98 | 46% | 0.461 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.5 | -36.6 | 173 | -75.9 | 162.1 | 0 | 0 | 0 | 111.8 | L402 Q409 S410 | L402-L406 HydrophobicContact CD2-CD1 4.36Å; L402-L406 VanDerWaalsContact O-CB 3.29Å; L402-L406 WeakPolarHBondContact O-CB 3.29Å; L402-L406 WeakPolarHBondContact O-CD1 3.36Å; L402-L406 VanDerWaalsContact O-CG 3.24Å; L402-L406 WeakPolarHBondContact O-CG 3.27Å; L402-L406 PolarHBondContact O-N 2.96Å; L406-Q409 PolarHBondContact O-N 2.59Å; L406-S410 WeakPolarHBondContact O-CB 3.17Å; L406-S410 PolarHBondContact O-N 3.46Å; L406-S410 PolarHBondContact O-OG 3.45Å |
| 407 | A | 42.2 | Very low | 38.8 | Very low | 61 Ų | 61 | 103 Ų | 103 | 50% | 0.504 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -70.4 | -31.1 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | N403 A411 | N403-A407 WeakPolarHBondContact O-CB 3.41Å; N403-A407 PolarHBondContact O-N 2.92Å; A407-A411 PolarHBondContact O-N 3.29Å |
| 408 | S | 43.2 | Very low | 38.4 | Very low | 65 Ų | 65 | 104.3 Ų | 104.3 | 46% | 0.455 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -77.8 | -31.7 | 172.2 | 53.5 | 0 | 0 | 0 | 0 | 113.1 | A404 Q405 | A404-S408 PolarHBondContact O-N 2.64Å; A404-S408 VanDerWaalsContact O-N 3.1Å; A404-S408 PolarHBondContact O-OG 3.24Å; A404-S408 VanDerWaalsContact O-OG 3.11Å; Q405-S408 WeakPolarHBondContact CA-OG 3.4Å; Q405-S408 PolarHBondContact O-N 3.32Å; Q405-S408 PolarHBondContact O-OG 3.44Å |
| 409 | Q | 41.4 | Very low | 38 | Very low | 117 Ų | 117 | 103.3 Ų | 103.3 | 55% | 0.547 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -78.1 | -33.3 | 177.4 | -75.2 | 175.7 | -4.3 | 0 | 0 | 112.6 | Q405 L406 A411 E412 E413 | Q405-Q409 WeakPolarHBondContact O-CB 3.24Å; Q405-Q409 VanDerWaalsContact O-CG 3.27Å; Q405-Q409 WeakPolarHBondContact O-CG 3.36Å; Q405-Q409 PolarHBondContact O-N 2.9Å; L406-Q409 PolarHBondContact O-N 2.59Å; Q409-A411 VanDerWaalsContact C-N 3.29Å; Q409-A411 PolarHBondContact O-N 3.49Å; Q409-E412 PolarHBondContact O-N 3.48Å; Q409-E413 PolarHBondContact O-N 3.36Å |
| 410 | S | 38.8 | Very low | 37.6 | Very low | 79 Ų | 79 | 102.9 Ų | 102.9 | 55% | 0.552 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -11.8 | 174.7 | 47.9 | 0 | 0 | 0 | 0 | 114.1 | L406 | L406-S410 WeakPolarHBondContact O-CB 3.17Å; L406-S410 PolarHBondContact O-N 3.46Å; L406-S410 PolarHBondContact O-OG 3.45Å |
| 411 | A | 38.8 | Very low | 37.2 | Very low | 75 Ų | 75 | 107.3 Ų | 107.3 | 62% | 0.62 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -17.5 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | A407 Q409 | A407-A411 PolarHBondContact O-N 3.29Å; Q409-A411 VanDerWaalsContact C-N 3.29Å; Q409-A411 PolarHBondContact O-N 3.49Å |
| 412 | E | 36.6 | Very low | 36.9 | Very low | 164 Ų | 164 | 109.4 Ų | 109.4 | 77% | 0.766 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.9 | -10.3 | 179 | -75 | -176.5 | 156.3 | 0 | 0 | 113.7 | Q409 | Q409-E412 PolarHBondContact O-N 3.48Š|
| 413 | E | 34.2 | Very low | 36.9 | Very low | 171 Ų | 171 | 110.2 Ų | 110.2 | 80% | 0.799 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -99 | 7 | 177.6 | -76.9 | -176.6 | 157.5 | 0 | 0 | 114.6 | Q409 T415 | Q409-E413 PolarHBondContact O-N 3.36Å; E413-T415 VanDerWaalsContact C-N 3.3Å; E413-T415 PolarHBondContact O-N 3.34Å |
| 414 | A | 35.5 | Very low | 37 | Very low | 84 Ų | 84 | 113.1 Ų | 113.1 | 69% | 0.694 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -86.6 | 13.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 415 | T | 34.8 | Very low | 37.3 | Very low | 117 Ų | 117 | 114.9 Ų | 114.9 | 72% | 0.718 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -133.8 | 70.1 | 178.9 | 55.5 | 0 | 0 | 0 | 0 | 111.6 | E413 | E413-T415 VanDerWaalsContact C-N 3.3Å; E413-T415 PolarHBondContact O-N 3.34Å |
| 416 | D | 32 | Very low | 37.1 | Very low | 138 Ų | 138 | 118 Ų | 118 | 74% | 0.738 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -176.4 | 127.8 | 139.9 | -104.2 | -33.3 | 0 | 0 | 0 | 112.4 | ||
| 417 | Q | 32.4 | Very low | 36.9 | Very low | 168 Ų | 168 | 117.5 Ų | 117.5 | 79% | 0.785 | 70% | 0.7 | S | S | * | * | trans | 66.7 | 98.5 | 148.5 | -65.6 | 163.1 | 13.3 | 0 | 0 | 118.2 | ||||
| 418 | A | 31.1 | Very low | 36.7 | Very low | 93 Ų | 93 | 121.4 Ų | 121.4 | 77% | 0.769 | 72% | 0.717 | S | S | * | * | 73.7 | 115.5 | 79 | 0 | 0 | 0 | 0 | 0 | 115 | |||||
| 419 | C | 30.1 | Very low | 36.4 | Very low | 120 Ų | 120 | 122.5 Ų | 122.5 | 81% | 0.811 | 73% | 0.725 | S | S | * | * | trans | 124.1 | 105.8 | 145.2 | -78.7 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 420 | C | 31 | Very low | 36.1 | Very low | 95 Ų | 95 | 121.9 Ų | 121.9 | 64% | 0.642 | 73% | 0.733 | S | S | * | * | 94.9 | 106.2 | 122.8 | -71.3 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 421 | H | 35.8 | Very low | 36 | Very low | 180 Ų | 180 | 124 Ų | 124 | 83% | 0.833 | 74% | 0.743 | S | S | * | * | trans | 97 | 97.8 | 140.2 | -59.3 | -57.2 | 0 | 0 | 0 | 120.3 | ||||
| 422 | S | 35.4 | Very low | 35.9 | Very low | 110 Ų | 110 | 125.9 Ų | 125.9 | 77% | 0.769 | 75% | 0.749 | S | S | * | * | trans | -62.6 | -174.2 | 153.2 | -18.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 423 | P | 40.2 | Very low | 36.1 | Very low | 113 Ų | 113 | 123.7 Ų | 123.7 | 73% | 0.734 | 75% | 0.749 | S | S | * | * | cis | -141.2 | 154.6 | -0.1 | 27 | -2.1 | 0 | 0 | 0 | 118.2 | ||||
| 424 | L | 38.2 | Very low | 36.3 | Very low | 160 Ų | 160 | 122.3 Ų | 122.3 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | 26 | 172.9 | 125.7 | -78.1 | 158.4 | 0 | 0 | 0 | 122.2 | |||||
| 425 | P | 48.8 | Very low | 36.1 | Very low | 97 Ų | 97 | 125.3 Ų | 125.3 | 63% | 0.63 | 76% | 0.756 | S | S | * | * | cis | -144.1 | -162.1 | -17.7 | 28.5 | -2.5 | 0 | 0 | 0 | 115.1 | ||||
| 426 | E | 37.3 | Very low | 36.2 | Very low | 184 Ų | 184 | 128.7 Ų | 128.7 | 86% | 0.86 | 76% | 0.764 | S | S | * | * | trans | 105.3 | 133.1 | 155.4 | -63.9 | -172.4 | 175.9 | 0 | 0 | 115.7 | ||||
| 427 | A | 37.5 | Very low | 36.2 | Very low | 77 Ų | 77 | 126.8 Ų | 126.8 | 64% | 0.636 | 76% | 0.761 | S | S | * | * | cis | -174.3 | 147.1 | 7.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 428 | V | 38.4 | Very low | 36.3 | Very low | 143 Ų | 143 | 127 Ų | 127 | 87% | 0.867 | 76% | 0.762 | S | S | * | * | trans | 71.3 | 132.5 | 132.8 | 174.6 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 429 | S | 36.1 | Very low | 36.4 | Very low | 88 Ų | 88 | 128 Ų | 128 | 62% | 0.615 | 76% | 0.758 | S | S | * | * | cis | 173.8 | 130.9 | 9.1 | 147.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 430 | S | 34.7 | Very low | 36.4 | Very low | 104 Ų | 104 | 129.8 Ų | 129.8 | 73% | 0.727 | 76% | 0.759 | S | S | * | * | trans | 60 | 148 | 131.6 | 84.7 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 431 | V | 36.9 | Very low | 36.8 | Very low | 124 Ų | 124 | 131.1 Ų | 131.1 | 75% | 0.752 | 76% | 0.763 | S | S | * | * | cis | -155.9 | 160.1 | 25.4 | 168.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 432 | P | 37.5 | Very low | 36.7 | Very low | 114 Ų | 114 | 128 Ų | 128 | 74% | 0.74 | 76% | 0.759 | S | S | * | * | trans | -108.7 | -154.2 | -173.9 | 41.9 | -26.5 | 0 | 0 | 0 | 113.7 | ||||
| 433 | P | 40.8 | Very low | 36.8 | Very low | 118 Ų | 118 | 129 Ų | 129 | 77% | 0.766 | 76% | 0.76 | S | S | * | * | -110.9 | 172.4 | -107.9 | 34.9 | -15.3 | 0 | 0 | 0 | 114.6 | |||||
| 434 | V | 37.1 | Very low | 36.4 | Very low | 141 Ų | 141 | 132.6 Ų | 132.6 | 86% | 0.855 | 77% | 0.767 | S | S | * | * | trans | -136 | 133.1 | 169.7 | -177.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 435 | D | 31.3 | Very low | 36.5 | Very low | 147 Ų | 147 | 131.7 Ų | 131.7 | 79% | 0.786 | 77% | 0.768 | S | S | * | * | trans | -48 | 152.6 | 169.1 | -90 | -44.8 | 0 | 0 | 0 | 113.7 | ||||
| 436 | E | 38.1 | Very low | 36 | Very low | 189 Ų | 189 | 135.9 Ų | 135.9 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | -164.1 | 127.7 | 129.6 | -107.6 | 166.2 | -158.4 | 0 | 0 | 111.7 | |||||
| 437 | S | 32.1 | Very low | 35.7 | Very low | 98 Ų | 98 | 132.4 Ų | 132.4 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | -53.2 | 152.1 | 164.2 | 43.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 438 | E | 34 | Very low | 35.6 | Very low | 173 Ų | 173 | 140.5 Ų | 140.5 | 81% | 0.808 | 81% | 0.805 | S | S | * | * | 171 | 128.4 | 114.8 | -95.7 | -166.4 | 179.9 | 0 | 0 | 115.5 | |||||
| 439 | T | 33.8 | Very low | 35.5 | Very low | 112 Ų | 112 | 140.4 Ų | 140.4 | 69% | 0.687 | 80% | 0.802 | S | S | * | * | 76.2 | 117.3 | 128.4 | -33.8 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 440 | I | 29.7 | Very low | 35.4 | Very low | 159 Ų | 159 | 143.1 Ų | 143.1 | 82% | 0.815 | 81% | 0.812 | S | S | * | * | trans | -86.5 | 137.8 | 169.4 | -66.1 | 165.7 | 0 | 0 | 0 | 109.4 | ||||
| 441 | V | 38.3 | Very low | 35.5 | Very low | 123 Ų | 123 | 145.3 Ų | 145.3 | 75% | 0.745 | 82% | 0.817 | S | S | * | * | trans | -129.8 | 127.9 | 163.5 | -176.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 442 | P | 34.8 | Very low | 35.4 | Very low | 114 Ų | 114 | 146.5 Ų | 146.5 | 74% | 0.74 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -95.4 | 139.5 | 169.1 | 34.4 | -25.9 | 0 | 0 | 0 | 111 | ||
| 443 | V | 37.7 | Very low | 35.2 | Very low | 131 Ų | 131 | 148.6 Ų | 148.6 | 79% | 0.794 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 125.3 | 175.6 | 172.5 | 0 | 0 | 0 | 0 | 109.5 | V445 | V443-V445 HydrophobicContact CG1-CG2 4.46Š|
| 444 | E | 30.9 | Very low | 34.9 | Very low | 188 Ų | 188 | 150.6 Ų | 150.6 | 88% | 0.879 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 138.8 | 165.7 | -69.3 | 175.8 | 141.5 | 0 | 0 | 111 | ||
| 445 | V | 41.2 | Very low | 34.7 | Very low | 141 Ų | 141 | 151.3 Ų | 151.3 | 86% | 0.855 | 83% | 0.828 | S | S | * | * | trans | -138.4 | 128.4 | 155.9 | -176.2 | 0 | 0 | 0 | 0 | 109.5 | V443 | V443-V445 HydrophobicContact CG1-CG2 4.46Š| ||
| 446 | E | 38.1 | Very low | 35 | Very low | 185 Ų | 185 | 151.6 Ų | 151.6 | 86% | 0.864 | 83% | 0.831 | S | S | * | * | trans | -66.3 | 161 | -172.3 | -66.2 | 170 | 133.2 | 0 | 0 | 115.5 | ||||
| 447 | S | 30.7 | Very low | 34.7 | Very low | 112 Ų | 112 | 148.5 Ų | 148.5 | 78% | 0.783 | 83% | 0.827 | S | S | * | * | trans | -64.2 | 139.7 | 174.7 | 50.4 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 448 | I | 35.2 | Very low | 35 | Very low | 246 Ų | 246 | 153.1 Ų | 153.1 | 100% | 1.262 | 84% | 0.839 | S | S | * | * | trans | -133 | 0 | 139 | -64.4 | -178.1 | 0 | 0 | 0 | 107.8 |
Retrieved 448 of 448 residues in 344.4 ms
(Link to these results)