| 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 | 35.7 | Very low | 41.5 | Very low | 166 Ų | 166 | 148.5 Ų | 148.5 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | 0 | 138.1 | 0 | -73.3 | 71.6 | 172.9 | 0 | 0 | 109 | W3 | M1-W3 PolarHBondContact O-N 3.13Š| |||
| 2 | S | 32.7 | Very low | 41.9 | Very low | 109 Ų | 109 | 158.4 Ų | 158.4 | 76% | 0.762 | 79% | 0.788 | S | S | * | * | trans | -85.3 | 112.3 | -166.9 | -173.4 | 0 | 0 | 0 | 0 | 111.8 | K4 | S2-K4 VanDerWaalsContact C-N 3.32Å; S2-K4 PolarHBondContact O-N 3.09Å | ||
| 3 | W | 51 | Low | 41.8 | Very low | 172 Ų | 172 | 151.1 Ų | 151.1 | 65% | 0.652 | 78% | 0.778 | S | S | * | * | trans | -69.5 | 83.8 | 173.9 | -57.1 | 85.9 | 0 | 0 | 0 | 109.8 | M1 R5 | M1-W3 PolarHBondContact O-N 3.13Å; W3-R5 PolarHBondContact O-N 3.29Å | ||
| 4 | K | 35.1 | Very low | 42.3 | Very low | 171 Ų | 171 | 149 Ų | 149 | 74% | 0.743 | 78% | 0.783 | S | S | * | * | trans | -69.2 | 106.9 | 177.5 | -101 | -172.6 | 177.8 | 176.2 | 0 | 110.2 | S2 N6 | S2-K4 VanDerWaalsContact C-N 3.32Å; S2-K4 PolarHBondContact O-N 3.09Å; K4-N6 PolarHBondContact O-N 2.9Å | ||
| 5 | R | 47.3 | Very low | 42.8 | Very low | 229 Ų | 229 | 148.3 Ų | 148.3 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | -60.9 | -1.3 | 171.8 | -166.9 | 73.9 | -175.3 | -165.7 | 3.4 | 114.5 | W3 | W3-R5 PolarHBondContact O-N 3.29Š| ||
| 6 | N | 45.9 | Very low | 42.9 | Very low | 110 Ų | 110 | 151.8 Ų | 151.8 | 59% | 0.588 | 80% | 0.797 | S | S | * | * | trans | -121 | 89.2 | -167.6 | -73.2 | 33.9 | 0 | 0 | 0 | 112.3 | K4 | K4-N6 PolarHBondContact O-N 2.9Š| ||
| 7 | Y | 46.8 | Very low | 43.2 | Very low | 218 Ų | 218 | 146.9 Ų | 146.9 | 86% | 0.855 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -114.6 | 9.7 | 156 | -85.3 | -78.4 | 0 | 0 | 0 | 112.7 | ||
| 8 | F | 43.1 | Very low | 43.3 | Very low | 206 Ų | 206 | 148.4 Ų | 148.4 | 90% | 0.904 | 80% | 0.796 | S | S | * | * | trans | -109.1 | 36.2 | 176 | -67.6 | -74.3 | 0 | 0 | 0 | 113.2 | ||||
| 9 | S | 45.6 | Very low | 43.8 | Very low | 103 Ų | 103 | 151.1 Ų | 151.1 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | trans | -113.5 | 81 | 168.9 | -59.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 10 | G | 37.2 | Very low | 44.2 | Very low | 75 Ų | 75 | 148.1 Ų | 148.1 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | -154 | 107.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 11 | G | 36.6 | Very low | 44.3 | Very low | 75 Ų | 75 | 146.6 Ų | 146.6 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | trans | 80.8 | 112.2 | 142.4 | 0 | 0 | 0 | 0 | 0 | 117.9 | G13 | G11-G13 PolarHBondContact O-N 3.17Š| ||
| 12 | R | 46.2 | Very low | 44.8 | Very low | 267 Ų | 267 | 149.9 Ų | 149.9 | 100% | 1.008 | 80% | 0.799 | S | S | * | * | trans | -54.1 | 114.2 | 155.8 | -66.4 | 173.9 | 167.1 | -170.1 | -4.8 | 109 | ||||
| 13 | G | 40.3 | Very low | 45.6 | Very low | 63 Ų | 63 | 149.5 Ų | 149.5 | 65% | 0.649 | 80% | 0.797 | S | S | * | * | trans | -161.4 | 112.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110 | G11 V15 | G11-G13 PolarHBondContact O-N 3.17Å; G13-V15 PolarHBondContact O-N 3.31Å; G13-V15 VanDerWaalsContact O-N 3.17Å | ||
| 14 | S | 48.8 | Very low | 45.5 | Very low | 122 Ų | 122 | 145.2 Ų | 145.2 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | trans | -65.4 | 99.4 | -178.6 | 47.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 15 | V | 49.2 | Very low | 46 | Very low | 138 Ų | 138 | 143.4 Ų | 143.4 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | trans | -141.7 | 47.6 | 161.6 | -68 | 0 | 0 | 0 | 0 | 110.8 | G13 G17 | G13-V15 PolarHBondContact O-N 3.31Å; G13-V15 VanDerWaalsContact O-N 3.17Å; V15-G17 PolarHBondContact O-N 3.18Å; V15-G17 VanDerWaalsContact O-N 3.13Å | ||
| 16 | Q | 45 | Very low | 46 | Very low | 204 Ų | 204 | 136.2 Ų | 136.2 | 95% | 0.953 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | 84.2 | 175.3 | -167.8 | 156.2 | 2 | 0 | 0 | 108.7 | ||
| 17 | G | 47.2 | Very low | 46.3 | Very low | 70 Ų | 70 | 137.1 Ų | 137.1 | 72% | 0.722 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -175.4 | -14.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 120.4 | V15 | V15-G17 PolarHBondContact O-N 3.18Å; V15-G17 VanDerWaalsContact O-N 3.13Å |
| 18 | M | 46.5 | Very low | 46.6 | Very low | 174 Ų | 174 | 127.1 Ų | 127.1 | 86% | 0.857 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -124.1 | 3.4 | -169.6 | -63.6 | -167.6 | 80.9 | 0 | 0 | 116.8 | ||
| 19 | F | 51.7 | Low | 47.1 | Very low | 198 Ų | 198 | 123 Ų | 123 | 87% | 0.868 | 74% | 0.741 | S | S | * | * | trans | -127.2 | 63.3 | 176.7 | -65.3 | -82 | 0 | 0 | 0 | 110.8 | P21 | F19-P21 VanDerWaalsContact O-CD 3.26Å; F19-P21 WeakPolarHBondContact O-CD 3.26Å | ||
| 20 | A | 51.7 | Low | 47.4 | Very low | 91 Ų | 91 | 123.2 Ų | 123.2 | 75% | 0.752 | 74% | 0.742 | S | S | * | * | trans | -64.8 | 115.5 | 154.6 | 0 | 0 | 0 | 0 | 0 | 106.6 | R22 | A20-R22 PolarHBondContact O-N 3.17Å; A20-R22 VanDerWaalsContact O-N 3.09Å | ||
| 21 | P | 46.8 | Very low | 48.5 | Very low | 117 Ų | 117 | 124.6 Ų | 124.6 | 76% | 0.76 | 73% | 0.727 | S | S | * | * | trans | -66.2 | 117.6 | -179.9 | 22.3 | -23 | 0 | 0 | 0 | 107.7 | F19 S23 | F19-P21 VanDerWaalsContact O-CD 3.26Å; F19-P21 WeakPolarHBondContact O-CD 3.26Å; P21-S23 PolarHBondContact O-N 2.69Å | ||
| 22 | R | 46.8 | Very low | 49.8 | Very low | 235 Ų | 235 | 124 Ų | 124 | 89% | 0.887 | 72% | 0.721 | S | S | * | * | trans | -54.1 | 130.3 | 166.6 | -60.6 | -176.1 | 81.9 | -143.9 | 5.4 | 106.9 | A20 S24 | A20-R22 PolarHBondContact O-N 3.17Å; A20-R22 VanDerWaalsContact O-N 3.09Å; R22-S24 PolarHBondContact O-N 2.78Å | ||
| 23 | S | 49.1 | Very low | 50.7 | Low | 102 Ų | 102 | 113.2 Ų | 113.2 | 71% | 0.713 | 68% | 0.683 | S | S | * | * | trans | -20 | 97.7 | 172.9 | 176.2 | 0 | 0 | 0 | 0 | 113 | P21 T25 | P21-S23 PolarHBondContact O-N 2.69Å; S23-T25 VanDerWaalsContact C-N 3.27Å; S23-T25 PolarHBondContact O-N 3.21Å | ||
| 24 | S | 48.7 | Very low | 51.9 | Low | 81 Ų | 81 | 113 Ų | 113 | 57% | 0.566 | 67% | 0.672 | S | S | * | * | trans | -94 | 45.1 | -176.6 | 63.2 | 0 | 0 | 0 | 0 | 110.8 | R22 S26 | R22-S24 PolarHBondContact O-N 2.78Å; S24-S26 PolarHBondContact O-N 3.05Å | ||
| 25 | T | 46.4 | Very low | 52.5 | Low | 134 Ų | 134 | 110.5 Ų | 110.5 | 82% | 0.822 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -71.6 | -3.7 | 179.7 | 48.9 | 0 | 0 | 0 | 0 | 113.6 | S23 | S23-T25 VanDerWaalsContact C-N 3.27Å; S23-T25 PolarHBondContact O-N 3.21Å |
| 26 | S | 47 | Very low | 53.4 | Low | 78 Ų | 78 | 108 Ų | 108 | 55% | 0.545 | 63% | 0.628 | S | S | . | * | S | Bend | trans | -119.5 | -15.3 | -178.9 | 179.1 | 0 | 0 | 0 | 0 | 115.1 | S24 R58 | S24-S26 PolarHBondContact O-N 3.05Å; S26-R58 PolarHBondContact O-NH1 3.06Å; S26-R58 PolarHBondContact O-NH2 3.43Å |
| 27 | I | 51.1 | Low | 53.8 | Low | 128 Ų | 128 | 104.7 Ų | 104.7 | 66% | 0.656 | 63% | 0.625 | S | S | * | * | trans | -104.6 | 101.9 | -176.6 | -52.6 | 175.2 | 0 | 0 | 0 | 108 | ||||
| 28 | A | 54.2 | Low | 54.9 | Low | 8 Ų | 8 | 104.8 Ų | 104.8 | 7% | 0.066 | 63% | 0.626 | C | S | . | * | trans | -51.5 | 141.4 | 167.9 | 0 | 0 | 0 | 0 | 0 | 109 | S30 W52 | A28-S30 PolarHBondContact O-N 3.33Å; A28-W52 HydrophobicContact CB-CZ2 4.19Å | ||
| 29 | P | 52.1 | Low | 55.8 | Low | 119 Ų | 119 | 100.9 Ų | 100.9 | 77% | 0.773 | 61% | 0.605 | S | S | * | * | trans | -50 | 117.4 | 179.4 | 18.4 | -30.1 | 0 | 0 | 0 | 109.8 | K31 | P29-K31 VanDerWaalsContact C-N 3.29Å; P29-K31 PolarHBondContact O-N 3.49Å | ||
| 30 | S | 52.9 | Low | 56.8 | Low | 108 Ų | 108 | 98.3 Ų | 98.3 | 76% | 0.755 | 60% | 0.6 | S | S | * | * | trans | -74.6 | 85.3 | -178.8 | 39.2 | 0 | 0 | 0 | 0 | 108.9 | A28 G32 | A28-S30 PolarHBondContact O-N 3.33Å; S30-G32 PolarHBondContact O-N 3.41Å | ||
| 31 | K | 61.3 | Low | 57.8 | Low | 104 Ų | 104 | 95.6 Ų | 95.6 | 45% | 0.452 | 58% | 0.576 | S | S | . | * | trans | -79.7 | 111.9 | 173.2 | -165.3 | 173.3 | 176.9 | -166.3 | 0 | 107.8 | P29 A78 K80 | P29-K31 VanDerWaalsContact C-N 3.29Å; P29-K31 PolarHBondContact O-N 3.49Å; K31-A78 WeakPolarHBondContact CD-O 3.36Å; K31-A78 VanDerWaalsContact CE-O 3.24Å; K31-A78 WeakPolarHBondContact CE-O 3.44Å; K31-A78 PolarHBondContact NZ-O 3.07Å; K31-K80 PolarHBondContact NZ-OXT 3.04Å | ||
| 32 | G | 62.3 | Low | 59.2 | Low | 63 Ų | 63 | 93.3 Ų | 93.3 | 65% | 0.649 | 56% | 0.562 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 146.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111 | S30 | S30-G32 PolarHBondContact O-N 3.41Š|
| 33 | L | 66.3 | Low | 60.8 | Low | 40 Ų | 40 | 90.1 Ų | 90.1 | 21% | 0.209 | 56% | 0.555 | C | S | . | * | P | Polyproline II helix | trans | -91.5 | 127.3 | 174.5 | -63.7 | 171.6 | 0 | 0 | 0 | 108.8 | N45 L48 A78 L79 | L33-N45 HydrophobicContact CB-CB 4.06Å; L33-N45 HydrophobicContact CD1-CB 3.96Å; L33-N45 WeakPolarHBondContact CD1-OD1 3.45Å; L33-L48 HydrophobicContact CD1-CB 3.95Å; L33-L48 HydrophobicContact CD1-CD1 3.79Å; L33-A78 HydrophobicContact CD2-CB 3.8Å; L33-L79 HydrophobicContact CD2-CD2 4.21Å |
| 34 | S | 65.6 | Low | 62.1 | Low | 60 Ų | 60 | 89.1 Ų | 89.1 | 42% | 0.42 | 54% | 0.541 | S | S | . | . | P | Polyproline II helix | trans | -69.8 | 146.3 | 176.7 | 52.5 | 0 | 0 | 0 | 0 | 110.9 | N45 | S34-N45 PolarHBondContact O-ND2 3.35Š|
| 35 | N | 61.4 | Low | 63.5 | Low | 68 Ų | 68 | 86.5 Ų | 86.5 | 36% | 0.364 | 52% | 0.521 | S | S | . | . | trans | -146.2 | 93.9 | 171.5 | 178.6 | 62.5 | 0 | 0 | 0 | 108.3 | S41 | N35-S41 PolarHBondContact OD1-OG 3.14Š| ||
| 36 | E | 68.1 | Low | 65.2 | Low | 85 Ų | 85 | 83.7 Ų | 83.7 | 40% | 0.397 | 51% | 0.507 | S | S | . | . | trans | -64.6 | 148.6 | 175.3 | -71.6 | 88.3 | 138.6 | 0 | 0 | 110.9 | G38 Q39 | E36-G38 PolarHBondContact O-N 3.15Å; E36-Q39 HydrophobicContact CB-CG 4.12Å; E36-Q39 WeakPolarHBondContact O-CB 3.37Å; E36-Q39 PolarHBondContact O-N 3.05Å; E36-Q39 VanDerWaalsContact O-N 3.1Å | ||
| 37 | P | 53.7 | Low | 66.9 | Low | 136 Ų | 136 | 81.9 Ų | 81.9 | 88% | 0.883 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | 125.7 | 176.3 | -24 | 33.1 | 0 | 0 | 0 | 111.3 | ||
| 38 | G | 68.7 | Low | 68.4 | Low | 72 Ų | 72 | 76.6 Ų | 76.6 | 74% | 0.742 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 94.7 | -2.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | E36 | E36-G38 PolarHBondContact O-N 3.15Š|
| 39 | Q | 67 | Low | 69.7 | Low | 91 Ų | 91 | 79.6 Ų | 79.6 | 43% | 0.425 | 48% | 0.482 | S | S | . | . | trans | -81.7 | -7.7 | -179.6 | -79.3 | -86.5 | -16.4 | 0 | 0 | 115.3 | E36 S41 | E36-Q39 HydrophobicContact CB-CG 4.12Å; E36-Q39 WeakPolarHBondContact O-CB 3.37Å; E36-Q39 PolarHBondContact O-N 3.05Å; E36-Q39 VanDerWaalsContact O-N 3.1Å; Q39-S41 WeakPolarHBondContact O-CB 3.39Å; Q39-S41 PolarHBondContact O-N 3.21Å | ||
| 40 | N | 71.4 | Confident | 71.2 | Confident | 144 Ų | 144 | 78.7 Ų | 78.7 | 77% | 0.77 | 47% | 0.474 | S | S | * | . | trans | 42.8 | 18.6 | 178.4 | -64.8 | 15.1 | 0 | 0 | 0 | 116.3 | ||||
| 41 | S | 73.4 | Confident | 72.6 | Confident | 35 Ų | 35 | 76.9 Ų | 76.9 | 25% | 0.245 | 46% | 0.455 | C | S | . | . | trans | -99.4 | 1.8 | -173.2 | 57.4 | 0 | 0 | 0 | 0 | 112.4 | N35 Q39 F43 L44 N45 | N35-S41 PolarHBondContact OD1-OG 3.14Å; Q39-S41 WeakPolarHBondContact O-CB 3.39Å; Q39-S41 PolarHBondContact O-N 3.21Å; S41-F43 PolarHBondContact O-N 2.99Å; S41-L44 WeakPolarHBondContact O-CB 3.41Å; S41-L44 PolarHBondContact O-N 3.39Å; S41-N45 PolarHBondContact O-N 3.26Å | ||
| 42 | C | 76.2 | Confident | 73.6 | Confident | 68 Ų | 68 | 73.8 Ų | 73.8 | 46% | 0.459 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -55.8 | -32.7 | 177.1 | 59.7 | 0 | 0 | 0 | 0 | 113.7 | N45 S46 | C42-N45 PolarHBondContact O-N 2.9Å; C42-S46 WeakPolarHBondContact O-CB 3.34Å; C42-S46 PolarHBondContact O-N 3.47Å; C42-S46 PolarHBondContact O-OG 3.05Å |
| 43 | F | 79.8 | Confident | 74.6 | Confident | 168 Ų | 168 | 77.9 Ų | 77.9 | 74% | 0.737 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -59.8 | -47.9 | 173.9 | 173.6 | -99.8 | 0 | 0 | 0 | 111.2 | S41 S46 A47 | S41-F43 PolarHBondContact O-N 2.99Å; F43-S46 PolarHBondContact O-N 3.4Å; F43-A47 PolarHBondContact O-N 3.32Å |
| 44 | L | 77.5 | Confident | 75.5 | Confident | 81 Ų | 81 | 80.7 Ų | 80.7 | 42% | 0.424 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.6 | -41.7 | -179.9 | -172.1 | 69.5 | 0 | 0 | 0 | 111.1 | S41 S46 A47 L48 I75 | S41-L44 WeakPolarHBondContact O-CB 3.41Å; S41-L44 PolarHBondContact O-N 3.39Å; L44-S46 VanDerWaalsContact C-N 3.33Å; L44-S46 PolarHBondContact O-N 3.37Å; L44-A47 PolarHBondContact O-N 2.92Å; L44-L48 HydrophobicContact CG-CD1 4.18Å; L44-L48 WeakPolarHBondContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CG 3.34Å; L44-L48 PolarHBondContact O-N 3.48Å; L44-I75 HydrophobicContact CD2-CD1 4.43Å |
| 45 | N | 76.7 | Confident | 76.2 | Confident | 27 Ų | 27 | 81.5 Ų | 81.5 | 14% | 0.144 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -62.7 | -41.1 | 177.8 | -68.1 | -8.9 | 0 | 0 | 0 | 111.7 | L33 S34 S41 C42 L48 Q49 | L33-N45 HydrophobicContact CB-CB 4.06Å; L33-N45 HydrophobicContact CD1-CB 3.96Å; L33-N45 WeakPolarHBondContact CD1-OD1 3.45Å; S34-N45 PolarHBondContact O-ND2 3.35Å; S41-N45 PolarHBondContact O-N 3.26Å; C42-N45 PolarHBondContact O-N 2.9Å; N45-L48 PolarHBondContact O-N 3Å; N45-Q49 WeakPolarHBondContact O-CG 3.41Å; N45-Q49 PolarHBondContact O-N 3.06Å |
| 46 | S | 82.1 | Confident | 77.4 | Confident | 75 Ų | 75 | 84.5 Ų | 84.5 | 52% | 0.524 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.6 | -42.5 | 177.9 | -55.7 | 0 | 0 | 0 | 0 | 111.7 | C42 F43 L44 L48 Q49 V50 | C42-S46 WeakPolarHBondContact O-CB 3.34Å; C42-S46 PolarHBondContact O-N 3.47Å; C42-S46 PolarHBondContact O-OG 3.05Å; F43-S46 PolarHBondContact O-N 3.4Å; L44-S46 VanDerWaalsContact C-N 3.33Å; L44-S46 PolarHBondContact O-N 3.37Å; S46-L48 VanDerWaalsContact C-N 3.35Å; S46-L48 PolarHBondContact O-N 3.22Å; S46-Q49 PolarHBondContact O-N 3.31Å; S46-V50 PolarHBondContact O-N 3.5Å |
| 47 | A | 83.3 | Confident | 78.2 | Confident | 40 Ų | 40 | 83.3 Ų | 83.3 | 33% | 0.331 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.5 | -41.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | F43 L44 V50 L51 | F43-A47 PolarHBondContact O-N 3.32Å; L44-A47 PolarHBondContact O-N 2.92Å; A47-V50 PolarHBondContact O-N 3.01Å; A47-L51 WeakPolarHBondContact O-CG 3.23Å; A47-L51 PolarHBondContact O-N 2.85Å |
| 48 | L | 82.4 | Confident | 79.6 | Confident | 16 Ų | 16 | 78.2 Ų | 78.2 | 8% | 0.084 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -65 | -38.5 | 177.9 | -78.7 | 168.5 | 0 | 0 | 0 | 113.1 | L33 L44 N45 S46 V50 L51 W52 I75 L79 | L33-L48 HydrophobicContact CD1-CB 3.95Å; L33-L48 HydrophobicContact CD1-CD1 3.79Å; L44-L48 HydrophobicContact CG-CD1 4.18Å; L44-L48 WeakPolarHBondContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CG 3.34Å; L44-L48 PolarHBondContact O-N 3.48Å; N45-L48 PolarHBondContact O-N 3Å; S46-L48 VanDerWaalsContact C-N 3.35Å; S46-L48 PolarHBondContact O-N 3.22Å; L48-V50 VanDerWaalsContact C-N 3.34Å; L48-V50 PolarHBondContact O-N 3.38Å; L48-L51 PolarHBondContact O-N 3.39Å; L48-W52 WeakPolarHBondContact O-CB 3.47Å; L48-W52 PolarHBondContact O-N 3.41Å; L48-I75 HydrophobicContact CD1-CD1 4Å; L48-I75 HydrophobicContact CD1-CG1 3.92Å; L48-I75 HydrophobicContact CD1-CG2 3.94Å; L48-I75 HydrophobicContact CD2-CD1 4.27Å; L48-I75 HydrophobicContact CD2-CG2 3.75Å; L48-L79 HydrophobicContact CD2-CD1 4.45Å |
| 49 | Q | 81.9 | Confident | 80.3 | Confident | 72 Ų | 72 | 81.9 Ų | 81.9 | 34% | 0.336 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 174.9 | -70.6 | -66.4 | -19.7 | 0 | 0 | 111.2 | N45 S46 W52 H53 | N45-Q49 WeakPolarHBondContact O-CG 3.41Å; N45-Q49 PolarHBondContact O-N 3.06Å; S46-Q49 PolarHBondContact O-N 3.31Å; Q49-W52 PolarHBondContact O-N 3.22Å; Q49-H53 PolarHBondContact O-CD2 3.25Å; Q49-H53 PolarHBondContact O-N 3.4Å |
| 50 | V | 84.2 | Confident | 81.2 | Confident | 100 Ų | 100 | 80.1 Ų | 80.1 | 61% | 0.606 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -62.9 | -46 | 176 | 175.3 | 0 | 0 | 0 | 0 | 111.4 | S46 A47 L48 W52 H53 | S46-V50 PolarHBondContact O-N 3.5Å; A47-V50 PolarHBondContact O-N 3.01Å; L48-V50 VanDerWaalsContact C-N 3.34Å; L48-V50 PolarHBondContact O-N 3.38Å; V50-W52 VanDerWaalsContact C-N 3.28Å; V50-W52 PolarHBondContact O-N 3.45Å; V50-H53 PolarHBondContact O-N 3.23Å |
| 51 | L | 81.6 | Confident | 81.8 | Confident | 69 Ų | 69 | 74.2 Ų | 74.2 | 36% | 0.361 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.5 | -34 | 178.5 | -70.4 | 172.1 | 0 | 0 | 0 | 112.3 | A47 L48 H53 L54 F57 | A47-L51 WeakPolarHBondContact O-CG 3.23Å; A47-L51 PolarHBondContact O-N 2.85Å; L48-L51 PolarHBondContact O-N 3.39Å; L51-H53 PolarHBondContact O-N 3.23Å; L51-L54 HydrophobicContact CD2-CD1 4.16Å; L51-L54 WeakPolarHBondContact O-CB 3.46Å; L51-L54 PolarHBondContact O-N 2.87Å; L51-F57 HydrophobicContact CB-CD1 4.07Å; L51-F57 HydrophobicContact CB-CD2 4.42Å; L51-F57 HydrophobicContact CB-CE1 4.08Å; L51-F57 HydrophobicContact CB-CE2 4.45Å; L51-F57 HydrophobicContact CB-CG 4.24Å; L51-F57 HydrophobicContact CB-CZ 4.28Å; L51-F57 WeakPolarHBondContact O-CB 3.36Å; L51-F57 VanDerWaalsContact O-CD1 3.27Å; L51-F57 WeakPolarHBondContact O-CD1 3.5Å |
| 52 | W | 82.6 | Confident | 82.3 | Confident | 40 Ų | 40 | 78.8 Ų | 78.8 | 15% | 0.152 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -66.6 | -25.4 | 178.5 | -163.3 | -100.6 | 0 | 0 | 0 | 113.7 | A28 L48 Q49 V50 L54 F57 R58 F61 L79 | A28-W52 HydrophobicContact CB-CZ2 4.19Å; L48-W52 WeakPolarHBondContact O-CB 3.47Å; L48-W52 PolarHBondContact O-N 3.41Å; Q49-W52 PolarHBondContact O-N 3.22Å; V50-W52 VanDerWaalsContact C-N 3.28Å; V50-W52 PolarHBondContact O-N 3.45Å; W52-L54 PolarHBondContact O-N 3.17Å; W52-F57 HydrophobicContact CE3-CD1 4.28Å; W52-F57 AromaticContact CE3-CE1 3.98Å; W52-F57 HydrophobicContact CE3-CE1 3.98Å; W52-R58 HydrophobicContact CZ2-CG 4.21Å; W52-F61 HydrophobicContact CH2-CD1 4.02Å; W52-F61 HydrophobicContact CH2-CE1 4.36Å; W52-F61 AromaticContact CZ3-CD1 3.7Å; W52-F61 HydrophobicContact CZ3-CD1 3.7Å; W52-F61 HydrophobicContact CZ3-CE1 4.05Å; W52-F61 HydrophobicContact CZ3-CG 4.11Å; W52-L79 HydrophobicContact CE3-CD1 3.91Å; W52-L79 HydrophobicContact CE3-CD2 4.41Å; W52-L79 HydrophobicContact CH2-CB 4.19Å; W52-L79 HydrophobicContact CZ3-CB 3.98Å; W52-L79 HydrophobicContact CZ3-CD1 3.76Å; W52-L79 HydrophobicContact CZ3-CD2 4.41Å; W52-L79 HydrophobicContact CZ3-CG 4.27Å |
| 53 | H | 82.1 | Confident | 82.7 | Confident | 149 Ų | 149 | 82.8 Ų | 82.8 | 69% | 0.69 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.3 | -11.7 | 173.1 | -69.9 | -62.2 | 0 | 0 | 0 | 113.4 | Q49 V50 L51 D55 | Q49-H53 PolarHBondContact O-CD2 3.25Å; Q49-H53 PolarHBondContact O-N 3.4Å; V50-H53 PolarHBondContact O-N 3.23Å; L51-H53 PolarHBondContact O-N 3.23Å; H53-D55 PolarHBondContact O-N 3.14Å |
| 54 | L | 86.3 | Confident | 82.9 | Confident | 98 Ų | 98 | 78.8 Ų | 78.8 | 51% | 0.513 | 40% | 0.395 | S | S | . | . | trans | -83.3 | 115.3 | 172.5 | -58.8 | 175.8 | 0 | 0 | 0 | 109.9 | L51 W52 I56 F57 R58 | L51-L54 HydrophobicContact CD2-CD1 4.16Å; L51-L54 WeakPolarHBondContact O-CB 3.46Å; L51-L54 PolarHBondContact O-N 2.87Å; W52-L54 PolarHBondContact O-N 3.17Å; L54-I56 PolarHBondContact O-N 2.84Å; L54-I56 VanDerWaalsContact O-N 3.15Å; L54-F57 HydrophobicContact CB-CB 4.06Å; L54-F57 WeakPolarHBondContact O-CB 3.24Å; L54-F57 PolarHBondContact O-N 3.22Å; L54-R58 PolarHBondContact O-N 3.43Å | ||
| 55 | D | 79.7 | Confident | 83.1 | Confident | 78 Ų | 78 | 80.3 Ų | 80.3 | 42% | 0.417 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.5 | -29.4 | -178.4 | -90.8 | -24.3 | 0 | 0 | 0 | 114.2 | H53 R58 R59 | H53-D55 PolarHBondContact O-N 3.14Å; D55-R58 IonicContact OD1-CZ 3.55Å; D55-R58 IonicContact OD1-NE 3.65Å; D55-R58 IonicContact OD1-NH2 2.78Å; D55-R58 PolarHBondContact OD1-NH2 2.95Å; D55-R59 WeakPolarHBondContact O-CB 3.32Å; D55-R59 WeakPolarHBondContact O-CG 3.35Å; D55-R59 PolarHBondContact O-N 3.07Å; D55-R59 VanDerWaalsContact O-N 3.14Å; D55-R59 PolarHBondContact O-NE 2.79Å |
| 56 | I | 87 | Confident | 83.4 | Confident | 131 Ų | 131 | 84.2 Ų | 84.2 | 67% | 0.672 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -67.2 | -48.6 | 175.6 | -63.4 | 168.2 | 0 | 0 | 0 | 109.5 | L54 R58 R59 S60 | L54-I56 PolarHBondContact O-N 2.84Å; L54-I56 VanDerWaalsContact O-N 3.15Å; I56-R58 PolarHBondContact O-N 3.44Å; I56-R59 PolarHBondContact O-N 3.05Å; I56-S60 WeakPolarHBondContact O-CB 3.42Å; I56-S60 PolarHBondContact O-N 3.35Å; I56-S60 PolarHBondContact O-OG 3.37Å; I56-S60 VanDerWaalsContact O-OG 3.06Å |
| 57 | F | 84.8 | Confident | 83.6 | Confident | 59 Ų | 59 | 84.4 Ų | 84.4 | 26% | 0.259 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -59.9 | -48.8 | 179.7 | -179.8 | -99.2 | 0 | 0 | 0 | 111.1 | L51 W52 L54 R59 S60 F61 | L51-F57 HydrophobicContact CB-CD1 4.07Å; L51-F57 HydrophobicContact CB-CD2 4.42Å; L51-F57 HydrophobicContact CB-CE1 4.08Å; L51-F57 HydrophobicContact CB-CE2 4.45Å; L51-F57 HydrophobicContact CB-CG 4.24Å; L51-F57 HydrophobicContact CB-CZ 4.28Å; L51-F57 WeakPolarHBondContact O-CB 3.36Å; L51-F57 VanDerWaalsContact O-CD1 3.27Å; L51-F57 WeakPolarHBondContact O-CD1 3.5Å; W52-F57 HydrophobicContact CE3-CD1 4.28Å; W52-F57 AromaticContact CE3-CE1 3.98Å; W52-F57 HydrophobicContact CE3-CE1 3.98Å; L54-F57 HydrophobicContact CB-CB 4.06Å; L54-F57 WeakPolarHBondContact O-CB 3.24Å; L54-F57 PolarHBondContact O-N 3.22Å; F57-R59 PolarHBondContact O-N 2.92Å; F57-S60 PolarHBondContact O-N 3.18Å; F57-F61 HydrophobicContact CZ-CD2 4.28Å; F57-F61 VanDerWaalsContact O-CB 3.23Å; F57-F61 WeakPolarHBondContact O-CB 3.5Å; F57-F61 PolarHBondContact O-N 3.45Å |
| 58 | R | 82.1 | Confident | 83.8 | Confident | 29 Ų | 29 | 91.7 Ų | 91.7 | 11% | 0.109 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -61.6 | -41.3 | -179.3 | -174.1 | 172.6 | 64.9 | 151.7 | -1.5 | 113.2 | S26 W52 L54 D55 I56 R62 | S26-R58 PolarHBondContact O-NH1 3.06Å; S26-R58 PolarHBondContact O-NH2 3.43Å; W52-R58 HydrophobicContact CZ2-CG 4.21Å; L54-R58 PolarHBondContact O-N 3.43Å; D55-R58 IonicContact OD1-CZ 3.55Å; D55-R58 IonicContact OD1-NE 3.65Å; D55-R58 IonicContact OD1-NH2 2.78Å; D55-R58 PolarHBondContact OD1-NH2 2.95Å; I56-R58 PolarHBondContact O-N 3.44Å; R58-R62 WeakPolarHBondContact O-CG 3.36Å; R58-R62 PolarHBondContact O-N 3.37Å |
| 59 | R | 84.8 | Confident | 83.9 | Confident | 149 Ų | 149 | 94.4 Ų | 94.4 | 56% | 0.562 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -66.7 | -49.4 | 177.5 | -80.9 | -176.2 | -90.6 | -175.9 | -10.1 | 111.4 | D55 I56 F57 F61 R62 Q63 | D55-R59 WeakPolarHBondContact O-CB 3.32Å; D55-R59 WeakPolarHBondContact O-CG 3.35Å; D55-R59 PolarHBondContact O-N 3.07Å; D55-R59 VanDerWaalsContact O-N 3.14Å; D55-R59 PolarHBondContact O-NE 2.79Å; I56-R59 PolarHBondContact O-N 3.05Å; F57-R59 PolarHBondContact O-N 2.92Å; R59-F61 VanDerWaalsContact C-N 3.31Å; R59-F61 PolarHBondContact O-N 3.05Å; R59-R62 PolarHBondContact O-N 3.02Å; R59-Q63 WeakPolarHBondContact O-CG 3.44Å; R59-Q63 PolarHBondContact O-N 3.25Å |
| 60 | S | 84.6 | Confident | 84 | Confident | 55 Ų | 55 | 99 Ų | 99 | 39% | 0.385 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.4 | -40.2 | 178.1 | -59.5 | 0 | 0 | 0 | 0 | 112 | I56 F57 R62 Q63 L64 | I56-S60 WeakPolarHBondContact O-CB 3.42Å; I56-S60 PolarHBondContact O-N 3.35Å; I56-S60 PolarHBondContact O-OG 3.37Å; I56-S60 VanDerWaalsContact O-OG 3.06Å; F57-S60 PolarHBondContact O-N 3.18Å; S60-R62 VanDerWaalsContact C-N 3.33Å; S60-R62 PolarHBondContact O-N 3.11Å; S60-Q63 PolarHBondContact O-N 3.27Å; S60-L64 WeakPolarHBondContact O-CD1 3.4Å; S60-L64 PolarHBondContact O-N 3.34Å |
| 61 | F | 85.1 | Confident | 83.7 | Confident | 20 Ų | 20 | 96.2 Ų | 96.2 | 9% | 0.088 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -62.8 | -37.5 | 178 | -167.8 | -91.4 | 0 | 0 | 0 | 112.9 | W52 F57 R59 Q63 L64 I75 F76 L79 | W52-F61 HydrophobicContact CH2-CD1 4.02Å; W52-F61 HydrophobicContact CH2-CE1 4.36Å; W52-F61 AromaticContact CZ3-CD1 3.7Å; W52-F61 HydrophobicContact CZ3-CD1 3.7Å; W52-F61 HydrophobicContact CZ3-CE1 4.05Å; W52-F61 HydrophobicContact CZ3-CG 4.11Å; F57-F61 HydrophobicContact CZ-CD2 4.28Å; F57-F61 VanDerWaalsContact O-CB 3.23Å; F57-F61 WeakPolarHBondContact O-CB 3.5Å; F57-F61 PolarHBondContact O-N 3.45Å; R59-F61 VanDerWaalsContact C-N 3.31Å; R59-F61 PolarHBondContact O-N 3.05Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; F61-L64 PolarHBondContact O-N 2.92Å; F61-I75 HydrophobicContact CE2-CG2 4.46Å; F61-F76 HydrophobicContact CD2-CE1 4.3Å; F61-F76 HydrophobicContact CD2-CZ 4.34Å; F61-F76 HydrophobicContact CE1-CD1 4.41Å; F61-F76 HydrophobicContact CE2-CD1 4.05Å; F61-F76 HydrophobicContact CE2-CD2 4.32Å; F61-F76 AromaticContact CE2-CE1 3.97Å; F61-F76 HydrophobicContact CE2-CE1 3.97Å; F61-F76 HydrophobicContact CE2-CE2 4.25Å; F61-F76 HydrophobicContact CE2-CG 4.23Å; F61-F76 HydrophobicContact CE2-CZ 4.09Å; F61-F76 AromaticContact CZ-CD1 3.88Å; F61-F76 HydrophobicContact CZ-CD1 3.88Å; F61-F76 HydrophobicContact CZ-CE1 4.18Å; F61-F76 HydrophobicContact CZ-CG 4.14Å; F61-L79 HydrophobicContact CE1-CB 3.6Å; F61-L79 HydrophobicContact CE1-CD1 4.33Å; F61-L79 HydrophobicContact CE2-CD1 4.28Å; F61-L79 HydrophobicContact CZ-CB 3.7Å; F61-L79 HydrophobicContact CZ-CD1 3.89Å; F61-L79 HydrophobicContact CZ-CG 4.37Å |
| 62 | R | 83.1 | Confident | 83.1 | Confident | 130 Ų | 130 | 98.6 Ų | 98.6 | 49% | 0.491 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.8 | -31 | 175.5 | -73.6 | 176.8 | -178.8 | 164.4 | -3.6 | 113.2 | R58 R59 S60 L64 | R58-R62 WeakPolarHBondContact O-CG 3.36Å; R58-R62 PolarHBondContact O-N 3.37Å; R59-R62 PolarHBondContact O-N 3.02Å; S60-R62 VanDerWaalsContact C-N 3.33Å; S60-R62 PolarHBondContact O-N 3.11Å; R62-L64 VanDerWaalsContact C-N 3.29Å |
| 63 | Q | 84.6 | Confident | 82.5 | Confident | 152 Ų | 152 | 101.4 Ų | 101.4 | 71% | 0.71 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -72.9 | -23.9 | 177.8 | -70.6 | 175.3 | -11.8 | 0 | 0 | 112.4 | R59 S60 F61 T65 | R59-Q63 WeakPolarHBondContact O-CG 3.44Å; R59-Q63 PolarHBondContact O-N 3.25Å; S60-Q63 PolarHBondContact O-N 3.27Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; Q63-T65 PolarHBondContact O-N 3.18Å; Q63-T65 VanDerWaalsContact O-N 3.14Å |
| 64 | L | 83.9 | Confident | 82.5 | Confident | 84 Ų | 84 | 95 Ų | 95 | 44% | 0.44 | 50% | 0.495 | S | S | . | . | trans | -72.7 | 103.8 | 172.5 | -75.9 | 146 | 0 | 0 | 0 | 110 | S60 F61 R62 F76 | S60-L64 WeakPolarHBondContact O-CD1 3.4Å; S60-L64 PolarHBondContact O-N 3.34Å; F61-L64 PolarHBondContact O-N 2.92Å; R62-L64 VanDerWaalsContact C-N 3.29Å; L64-F76 HydrophobicContact CB-CE1 3.56Å; L64-F76 HydrophobicContact CB-CZ 3.75Å; L64-F76 HydrophobicContact CD1-CZ 3.97Å; L64-F76 HydrophobicContact CD2-CZ 4.45Å; L64-F76 HydrophobicContact CG-CZ 4.25Å | ||
| 65 | T | 81.3 | Confident | 82.1 | Confident | 113 Ų | 113 | 93.2 Ų | 93.2 | 69% | 0.693 | 49% | 0.485 | S | S | * | . | trans | -92.6 | -21.1 | 179.5 | 53.5 | 0 | 0 | 0 | 0 | 113.1 | Q63 | Q63-T65 PolarHBondContact O-N 3.18Å; Q63-T65 VanDerWaalsContact O-N 3.14Å | ||
| 66 | T | 84.9 | Confident | 82.3 | Confident | 110 Ų | 110 | 91.9 Ų | 91.9 | 68% | 0.675 | 48% | 0.476 | S | S | * | . | trans | -120.7 | 141.9 | -179.5 | 62 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 67 | H | 86 | Confident | 82.1 | Confident | 78 Ų | 78 | 88.9 Ų | 88.9 | 36% | 0.361 | 47% | 0.466 | S | S | . | . | trans | -150.8 | 153.2 | 171.9 | 72.5 | -78.8 | 0 | 0 | 0 | 110 | C69 C74 F76 C77 | H67-C69 PolarHBondContact O-N 2.72Å; H67-C74 PolarHBondContact CD2-SG 3.48Å; H67-C74 PolarHBondContact NE2-SG 3.13Å; H67-F76 HydrophobicContact CB-CB 4.08Å; H67-F76 HydrophobicContact CB-CD1 3.96Å; H67-F76 HydrophobicContact CB-CD2 3.67Å; H67-F76 HydrophobicContact CB-CE1 4.29Å; H67-F76 HydrophobicContact CB-CE2 4.02Å; H67-F76 HydrophobicContact CB-CG 3.62Å; H67-F76 HydrophobicContact CB-CZ 4.3Å; H67-F76 WeakPolarHBondContact CD2-CB 3.39Å; H67-F76 AromaticContact CD2-CG 3.94Å; H67-F76 VanDerWaalsContact CG-CB 3.41Å; H67-F76 AromaticContact CG-CD2 3.97Å; H67-F76 AromaticContact CG-CG 3.53Å; H67-F76 AromaticContact ND1-CG 3.89Å; H67-C77 PolarHBondContact NE2-SG 3.01Å | ||
| 68 | K | 86.8 | Confident | 81.6 | Confident | 194 Ų | 194 | 87.3 Ų | 87.3 | 84% | 0.843 | 46% | 0.464 | S | S | * | . | trans | -83.2 | 111.2 | 168.5 | -174.3 | 178 | 179.9 | -178.9 | 0 | 108.2 | M70 | K68-M70 PolarHBondContact O-N 2.99Š| ||
| 69 | C | 85.6 | Confident | 81.1 | Confident | 72 Ų | 72 | 87.1 Ų | 87.1 | 49% | 0.486 | 47% | 0.465 | S | S | . | . | trans | -66.7 | 131.3 | 178.3 | -171.9 | 0 | 0 | 0 | 0 | 110 | H67 | H67-C69 PolarHBondContact O-N 2.72Š| ||
| 70 | M | 83.3 | Confident | 80.4 | Confident | 169 Ų | 169 | 88.1 Ų | 88.1 | 83% | 0.833 | 47% | 0.473 | S | S | * | . | trans | -103.4 | 23.5 | 178.1 | -62.5 | -169.8 | 75.4 | 0 | 0 | 112.2 | K68 | K68-M70 PolarHBondContact O-N 2.99Š| ||
| 71 | G | 77.4 | Confident | 80.2 | Confident | 42 Ų | 42 | 89.8 Ų | 89.8 | 43% | 0.433 | 48% | 0.478 | S | S | . | . | G | 310 helix | trans | 81.4 | -144.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113 | S73 C74 | G71-S73 PolarHBondContact O-N 3.24Å; G71-S73 VanDerWaalsContact O-N 3.09Å; G71-C74 WeakPolarHBondContact O-CB 3.42Å; G71-C74 PolarHBondContact O-N 3.47Å; G71-C74 VanDerWaalsContact O-N 3.13Å |
| 72 | D | 69 | Low | 79.9 | Confident | 118 Ų | 118 | 93.4 Ų | 93.4 | 63% | 0.631 | 50% | 0.498 | S | S | * | . | G | 310 helix | trans | -63.3 | -20.1 | -166.3 | -71.3 | -18.4 | 0 | 0 | 0 | 114.7 | ||
| 73 | S | 70.6 | Confident | 79.8 | Confident | 100 Ų | 100 | 91.4 Ų | 91.4 | 70% | 0.699 | 50% | 0.498 | S | S | * | . | G | 310 helix | trans | -100.2 | 18.6 | 179.6 | -51.8 | 0 | 0 | 0 | 0 | 113.8 | G71 I75 | G71-S73 PolarHBondContact O-N 3.24Å; G71-S73 VanDerWaalsContact O-N 3.09Å; S73-I75 PolarHBondContact O-N 3.47Å |
| 74 | C | 81.2 | Confident | 79.5 | Confident | 15 Ų | 15 | 87.8 Ų | 87.8 | 10% | 0.101 | 49% | 0.486 | C | S | . | . | trans | -74.2 | 112.9 | -175.1 | -169.2 | 0 | 0 | 0 | 0 | 113.1 | H67 G71 F76 C77 A78 | H67-C74 PolarHBondContact CD2-SG 3.48Å; H67-C74 PolarHBondContact NE2-SG 3.13Å; G71-C74 WeakPolarHBondContact O-CB 3.42Å; G71-C74 PolarHBondContact O-N 3.47Å; G71-C74 VanDerWaalsContact O-N 3.13Å; C74-F76 VanDerWaalsContact C-N 3.3Å; C74-F76 PolarHBondContact O-N 3.48Å; C74-C77 HydrophobicContact CB-CB 4.22Å; C74-C77 PolarHBondContact O-N 3.1Å; C74-A78 PolarHBondContact O-N 3.2Å; C74-A78 VanDerWaalsContact O-N 3.11Å | ||
| 75 | I | 79.4 | Confident | 79.2 | Confident | 59 Ų | 59 | 88.1 Ų | 88.1 | 30% | 0.303 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.4 | -35.8 | 179.3 | -60.1 | 167.4 | 0 | 0 | 0 | 112.2 | L44 L48 F61 S73 A78 L79 | L44-I75 HydrophobicContact CD2-CD1 4.43Å; L48-I75 HydrophobicContact CD1-CD1 4Å; L48-I75 HydrophobicContact CD1-CG1 3.92Å; L48-I75 HydrophobicContact CD1-CG2 3.94Å; L48-I75 HydrophobicContact CD2-CD1 4.27Å; L48-I75 HydrophobicContact CD2-CG2 3.75Å; F61-I75 HydrophobicContact CE2-CG2 4.46Å; S73-I75 PolarHBondContact O-N 3.47Å; I75-A78 PolarHBondContact O-N 3.09Å; I75-L79 HydrophobicContact CG2-CD1 3.61Å; I75-L79 HydrophobicContact CG2-CG 4.28Å; I75-L79 PolarHBondContact O-N 3.45Å |
| 76 | F | 82.9 | Confident | 79 | Confident | 50 Ų | 50 | 86.4 Ų | 86.4 | 22% | 0.219 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -62.3 | -44.5 | 176.9 | -92.8 | -84.6 | 0 | 0 | 0 | 112.9 | F61 L64 H67 C74 A78 K80 | F61-F76 HydrophobicContact CD2-CE1 4.3Å; F61-F76 HydrophobicContact CD2-CZ 4.34Å; F61-F76 HydrophobicContact CE1-CD1 4.41Å; F61-F76 HydrophobicContact CE2-CD1 4.05Å; F61-F76 HydrophobicContact CE2-CD2 4.32Å; F61-F76 AromaticContact CE2-CE1 3.97Å; F61-F76 HydrophobicContact CE2-CE1 3.97Å; F61-F76 HydrophobicContact CE2-CE2 4.25Å; F61-F76 HydrophobicContact CE2-CG 4.23Å; F61-F76 HydrophobicContact CE2-CZ 4.09Å; F61-F76 AromaticContact CZ-CD1 3.88Å; F61-F76 HydrophobicContact CZ-CD1 3.88Å; F61-F76 HydrophobicContact CZ-CE1 4.18Å; F61-F76 HydrophobicContact CZ-CG 4.14Å; L64-F76 HydrophobicContact CB-CE1 3.56Å; L64-F76 HydrophobicContact CB-CZ 3.75Å; L64-F76 HydrophobicContact CD1-CZ 3.97Å; L64-F76 HydrophobicContact CD2-CZ 4.45Å; L64-F76 HydrophobicContact CG-CZ 4.25Å; H67-F76 HydrophobicContact CB-CB 4.08Å; H67-F76 HydrophobicContact CB-CD1 3.96Å; H67-F76 HydrophobicContact CB-CD2 3.67Å; H67-F76 HydrophobicContact CB-CE1 4.29Å; H67-F76 HydrophobicContact CB-CE2 4.02Å; H67-F76 HydrophobicContact CB-CG 3.62Å; H67-F76 HydrophobicContact CB-CZ 4.3Å; H67-F76 WeakPolarHBondContact CD2-CB 3.39Å; H67-F76 AromaticContact CD2-CG 3.94Å; H67-F76 VanDerWaalsContact CG-CB 3.41Å; H67-F76 AromaticContact CG-CD2 3.97Å; H67-F76 AromaticContact CG-CG 3.53Å; H67-F76 AromaticContact ND1-CG 3.89Å; C74-F76 VanDerWaalsContact C-N 3.3Å; C74-F76 PolarHBondContact O-N 3.48Å; F76-A78 VanDerWaalsContact C-N 3.31Å; F76-K80 WeakPolarHBondContact O-CB 3.33Å; F76-K80 PolarHBondContact O-N 3.47Å |
| 77 | C | 81.9 | Confident | 78.6 | Confident | 69 Ų | 69 | 84.7 Ų | 84.7 | 47% | 0.466 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -68.8 | -31.1 | 175.1 | -63.8 | 0 | 0 | 0 | 0 | 112.3 | H67 C74 | H67-C77 PolarHBondContact NE2-SG 3.01Å; C74-C77 HydrophobicContact CB-CB 4.22Å; C74-C77 PolarHBondContact O-N 3.1Å |
| 78 | A | 75.8 | Confident | 78.1 | Confident | 25 Ų | 25 | 85.2 Ų | 85.2 | 21% | 0.207 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -72 | -43 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | K31 L33 C74 I75 F76 | K31-A78 WeakPolarHBondContact CD-O 3.36Å; K31-A78 VanDerWaalsContact CE-O 3.24Å; K31-A78 WeakPolarHBondContact CE-O 3.44Å; K31-A78 PolarHBondContact NZ-O 3.07Å; L33-A78 HydrophobicContact CD2-CB 3.8Å; C74-A78 PolarHBondContact O-N 3.2Å; C74-A78 VanDerWaalsContact O-N 3.11Å; I75-A78 PolarHBondContact O-N 3.09Å; F76-A78 VanDerWaalsContact C-N 3.31Å |
| 79 | L | 71.9 | Confident | 77.3 | Confident | 26 Ų | 26 | 76.2 Ų | 76.2 | 14% | 0.136 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -92.9 | -12.3 | -172.6 | -64.9 | 175.1 | 0 | 0 | 0 | 114.7 | L33 L48 W52 F61 I75 | L33-L79 HydrophobicContact CD2-CD2 4.21Å; L48-L79 HydrophobicContact CD2-CD1 4.45Å; W52-L79 HydrophobicContact CE3-CD1 3.91Å; W52-L79 HydrophobicContact CE3-CD2 4.41Å; W52-L79 HydrophobicContact CH2-CB 4.19Å; W52-L79 HydrophobicContact CZ3-CB 3.98Å; W52-L79 HydrophobicContact CZ3-CD1 3.76Å; W52-L79 HydrophobicContact CZ3-CD2 4.41Å; W52-L79 HydrophobicContact CZ3-CG 4.27Å; F61-L79 HydrophobicContact CE1-CB 3.6Å; F61-L79 HydrophobicContact CE1-CD1 4.33Å; F61-L79 HydrophobicContact CE2-CD1 4.28Å; F61-L79 HydrophobicContact CZ-CB 3.7Å; F61-L79 HydrophobicContact CZ-CD1 3.89Å; F61-L79 HydrophobicContact CZ-CG 4.37Å; I75-L79 HydrophobicContact CG2-CD1 3.61Å; I75-L79 HydrophobicContact CG2-CG 4.28Å; I75-L79 PolarHBondContact O-N 3.45Å |
| 80 | K | 69.1 | Low | 76.6 | Confident | 169 Ų | 169 | 76.5 Ų | 76.5 | 74% | 0.735 | 43% | 0.433 | S | S | * | . | trans | -91.9 | 0 | 168.8 | -151.1 | 178.1 | -175.4 | 92.1 | 0 | 111 | K31 F76 | K31-K80 PolarHBondContact NZ-OXT 3.04Å; F76-K80 WeakPolarHBondContact O-CB 3.33Å; F76-K80 PolarHBondContact O-N 3.47Å |
Retrieved 80 of 80 residues in 45.7 ms
(Link to these results)