| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33.6 | Very low | 40.8 | Very low | 237 Ų | 237 | 153 Ų | 153 | 100% | 1.167 | 71% | 0.713 | S | S | * | * | 0 | 82.8 | 0 | -171.4 | 167.2 | 161.2 | 0 | 0 | 108.5 | |||||
| 2 | F | 30.4 | Very low | 41.3 | Very low | 210 Ų | 210 | 149.3 Ų | 149.3 | 92% | 0.921 | 70% | 0.7 | S | S | * | * | trans | -117.7 | 130.3 | -180 | -77.2 | -80.2 | 0 | 0 | 0 | 109.3 | S4 | F2-S4 PolarHBondContact O-N 3.16Š| ||
| 3 | K | 35.4 | Very low | 41.5 | Very low | 205 Ų | 205 | 146.5 Ų | 146.5 | 89% | 0.891 | 69% | 0.692 | S | S | * | * | trans | -67.2 | 115.6 | -168.3 | -94.5 | 171 | 172.2 | 169.3 | 0 | 112 | K5 | K3-K5 PolarHBondContact O-N 2.82Š| ||
| 4 | S | 42.6 | Very low | 41.2 | Very low | 73 Ų | 73 | 140.3 Ų | 140.3 | 51% | 0.51 | 68% | 0.677 | S | S | . | * | trans | -65.8 | 97.5 | 163 | 158.1 | 0 | 0 | 0 | 0 | 111 | F2 | F2-S4 PolarHBondContact O-N 3.16Š| ||
| 5 | K | 40.2 | Very low | 40.9 | Very low | 177 Ų | 177 | 139.7 Ų | 139.7 | 77% | 0.77 | 67% | 0.673 | S | S | * | * | trans | -136.8 | 46.7 | 168.1 | -85.2 | -165.3 | 174.6 | -171.6 | 0 | 111.5 | K3 | K3-K5 PolarHBondContact O-N 2.82Š| ||
| 6 | D | 49.1 | Very low | 40.7 | Very low | 85 Ų | 85 | 137.4 Ų | 137.4 | 46% | 0.455 | 66% | 0.661 | S | S | . | * | trans | -103.5 | 115.4 | 170.4 | -151.3 | -25.4 | 0 | 0 | 0 | 109.5 | E8 R9 R10 | D6-E8 VanDerWaalsContact C-N 3.29Å; D6-E8 PolarHBondContact O-N 3.03Å; D6-R9 HydrophobicContact CB-CB 4.1Å; D6-R9 PolarHBondContact O-N 3.26Å; D6-R10 PolarHBondContact O-N 3.41Å | ||
| 7 | P | 45.8 | Very low | 40.2 | Very low | 94 Ų | 94 | 135.2 Ų | 135.2 | 61% | 0.61 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -64.5 | -29.2 | -179 | 23.3 | -31.6 | 0 | 0 | 0 | 113.2 | R9 R10 H11 | P7-R9 VanDerWaalsContact C-N 3.34Å; P7-R9 PolarHBondContact O-N 3.15Å; P7-R10 PolarHBondContact O-N 3.42Å; P7-H11 PolarHBondContact O-N 3.39Å |
| 8 | E | 46 | Very low | 39.5 | Very low | 149 Ų | 149 | 137.7 Ų | 137.7 | 70% | 0.696 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -65.6 | -39.1 | 175.9 | -69.3 | -174.5 | 170.7 | 0 | 0 | 111.6 | D6 R10 H11 I12 | D6-E8 VanDerWaalsContact C-N 3.29Å; D6-E8 PolarHBondContact O-N 3.03Å; E8-R10 VanDerWaalsContact C-N 3.26Å; E8-R10 PolarHBondContact O-N 3.15Å; E8-H11 PolarHBondContact O-N 3.27Å; E8-I12 PolarHBondContact O-N 3.38Å |
| 9 | R | 45.1 | Very low | 39 | Very low | 161 Ų | 161 | 134.7 Ų | 134.7 | 61% | 0.608 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -68.2 | -24.7 | 179 | -150.6 | 176.1 | -166.5 | -120.1 | 2.8 | 112.9 | D6 P7 L13 | D6-R9 HydrophobicContact CB-CB 4.1Å; D6-R9 PolarHBondContact O-N 3.26Å; P7-R9 VanDerWaalsContact C-N 3.34Å; P7-R9 PolarHBondContact O-N 3.15Å; R9-L13 WeakPolarHBondContact O-CD1 3.42Å; R9-L13 WeakPolarHBondContact O-CG 3.33Å; R9-L13 PolarHBondContact O-N 3.31Å |
| 10 | R | 40.8 | Very low | 38.7 | Very low | 161 Ų | 161 | 135.9 Ų | 135.9 | 61% | 0.608 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -74.2 | -35 | 174.2 | -74.2 | -176.2 | 178.1 | 177 | -2.1 | 112.3 | D6 P7 E8 L13 A14 | D6-R10 PolarHBondContact O-N 3.41Å; P7-R10 PolarHBondContact O-N 3.42Å; E8-R10 VanDerWaalsContact C-N 3.26Å; E8-R10 PolarHBondContact O-N 3.15Å; R10-L13 PolarHBondContact O-N 2.85Å; R10-A14 WeakPolarHBondContact O-CB 3.42Å; R10-A14 PolarHBondContact O-N 3.39Å |
| 11 | H | 40.2 | Very low | 38.3 | Very low | 131 Ų | 131 | 134.4 Ų | 134.4 | 61% | 0.606 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -65.6 | -43.6 | 175.5 | -112 | -85.5 | 0 | 0 | 0 | 111.1 | P7 E8 L13 A14 E15 | P7-H11 PolarHBondContact O-N 3.39Å; E8-H11 PolarHBondContact O-N 3.27Å; H11-L13 VanDerWaalsContact C-N 3.34Å; H11-L13 PolarHBondContact O-N 3.2Å; H11-A14 PolarHBondContact O-N 3.48Å; H11-E15 WeakPolarHBondContact O-CB 3.42Å; H11-E15 PolarHBondContact O-N 3.31Å |
| 12 | I | 46.8 | Very low | 38.1 | Very low | 109 Ų | 109 | 130.9 Ų | 130.9 | 56% | 0.559 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -61.4 | -40.7 | 177.1 | -60.7 | 169.9 | 0 | 0 | 0 | 111.7 | E8 H16 | E8-I12 PolarHBondContact O-N 3.38Å; I12-H16 WeakPolarHBondContact O-CB 2.93Å; I12-H16 PolarHBondContact O-N 3.03Å |
| 13 | L | 43.4 | Very low | 38.3 | Very low | 113 Ų | 113 | 127.2 Ų | 127.2 | 59% | 0.592 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -75.5 | -32.1 | 177.9 | -71.5 | 167.7 | 0 | 0 | 0 | 113.3 | R9 R10 H11 | R9-L13 WeakPolarHBondContact O-CD1 3.42Å; R9-L13 WeakPolarHBondContact O-CG 3.33Å; R9-L13 PolarHBondContact O-N 3.31Å; R10-L13 PolarHBondContact O-N 2.85Å; H11-L13 VanDerWaalsContact C-N 3.34Å; H11-L13 PolarHBondContact O-N 3.2Å |
| 14 | A | 37.5 | Very low | 38.1 | Very low | 59 Ų | 59 | 120.1 Ų | 120.1 | 49% | 0.488 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -79.9 | -34 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | R10 H11 S17 | R10-A14 WeakPolarHBondContact O-CB 3.42Å; R10-A14 PolarHBondContact O-N 3.39Å; H11-A14 PolarHBondContact O-N 3.48Å; A14-S17 PolarHBondContact O-N 3.4Å |
| 15 | E | 36.2 | Very low | 37.8 | Very low | 131 Ų | 131 | 122.7 Ų | 122.7 | 61% | 0.612 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -72.7 | -35.3 | 173.4 | -82.3 | -177.6 | 141.5 | 0 | 0 | 112.3 | H11 S17 K18 A19 | H11-E15 WeakPolarHBondContact O-CB 3.42Å; H11-E15 PolarHBondContact O-N 3.31Å; E15-S17 PolarHBondContact O-N 3.05Å; E15-S17 VanDerWaalsContact O-N 3.14Å; E15-K18 PolarHBondContact O-N 3.24Å; E15-K18 VanDerWaalsContact O-N 3.09Å; E15-A19 PolarHBondContact O-N 3.19Å; E15-A19 VanDerWaalsContact O-N 3.08Å |
| 16 | H | 37.6 | Very low | 37.7 | Very low | 104 Ų | 104 | 119.4 Ų | 119.4 | 48% | 0.481 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -58.1 | -26.9 | 172.1 | -115.8 | -90.3 | 0 | 0 | 0 | 113.1 | I12 | I12-H16 WeakPolarHBondContact O-CB 2.93Å; I12-H16 PolarHBondContact O-N 3.03Å |
| 17 | S | 33.2 | Very low | 37.1 | Very low | 100 Ų | 100 | 119 Ų | 119 | 70% | 0.699 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -17.7 | 178.9 | 177.5 | 0 | 0 | 0 | 0 | 114.2 | A14 E15 | A14-S17 PolarHBondContact O-N 3.4Å; E15-S17 PolarHBondContact O-N 3.05Å; E15-S17 VanDerWaalsContact O-N 3.14Å |
| 18 | K | 28 | Very low | 36.5 | Very low | 179 Ų | 179 | 120.1 Ų | 120.1 | 78% | 0.778 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.4 | -14 | -173.9 | -80.3 | -175.1 | 176.5 | -178.8 | 0 | 114.7 | E15 | E15-K18 PolarHBondContact O-N 3.24Å; E15-K18 VanDerWaalsContact O-N 3.09Å |
| 19 | A | 28.9 | Very low | 36.3 | Very low | 81 Ų | 81 | 119.2 Ų | 119.2 | 67% | 0.669 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -86 | -6.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115 | E15 | E15-A19 PolarHBondContact O-N 3.19Å; E15-A19 VanDerWaalsContact O-N 3.08Å |
| 20 | Y | 33.8 | Very low | 36 | Very low | 159 Ų | 159 | 119.2 Ų | 119.2 | 62% | 0.624 | 66% | 0.656 | S | S | * | * | trans | -110.6 | 51.7 | -176 | -73.2 | -80.8 | 0 | 0 | 0 | 114 | ||||
| 21 | S | 30.6 | Very low | 35.7 | Very low | 105 Ų | 105 | 117.9 Ų | 117.9 | 73% | 0.734 | 66% | 0.656 | S | S | * | * | trans | -128.4 | 73.2 | 165.8 | 54.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 22 | L | 28.8 | Very low | 35.7 | Very low | 163 Ų | 163 | 115.7 Ų | 115.7 | 85% | 0.853 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -133.8 | 143.8 | 154 | -87.2 | 166.7 | 0 | 0 | 0 | 108.5 | G24 | L22-G24 PolarHBondContact O-N 2.95Š|
| 23 | P | 33.7 | Very low | 35.3 | Very low | 132 Ų | 132 | 118.2 Ų | 118.2 | 86% | 0.857 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -81.9 | 104.9 | -164.6 | 32.2 | -31.7 | 0 | 0 | 0 | 110.8 | ||
| 24 | G | 31.9 | Very low | 34.9 | Very low | 57 Ų | 57 | 121.9 Ų | 121.9 | 59% | 0.588 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -176.8 | 112 | 171.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | L22 V26 | L22-G24 PolarHBondContact O-N 2.95Å; G24-V26 PolarHBondContact O-N 3.23Å |
| 25 | S | 37 | Very low | 34.8 | Very low | 126 Ų | 126 | 125 Ų | 125 | 88% | 0.881 | 68% | 0.678 | S | S | * | * | trans | -54.5 | 94.7 | -172.4 | 50.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 26 | V | 37 | Very low | 35 | Very low | 109 Ų | 109 | 122.1 Ų | 122.1 | 66% | 0.661 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -89 | 126.1 | 159.1 | -176.9 | 0 | 0 | 0 | 0 | 106.3 | G24 | G24-V26 PolarHBondContact O-N 3.23Š|
| 27 | P | 36.8 | Very low | 35.5 | Very low | 77 Ų | 77 | 122.2 Ų | 122.2 | 50% | 0.5 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -60.6 | 144.5 | -178.7 | -14 | 25.9 | 0 | 0 | 0 | 110.4 | H29 L32 | P27-H29 PolarHBondContact O-N 3.05Å; P27-L32 HydrophobicContact CB-CD1 3.92Å; P27-L32 HydrophobicContact CG-CD1 4.28Å |
| 28 | N | 33.9 | Very low | 36 | Very low | 117 Ų | 117 | 122.4 Ų | 122.4 | 63% | 0.626 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -56 | 137.9 | 178.5 | -97.5 | -27.1 | 0 | 0 | 0 | 110.9 | E30 E31 L32 | N28-E30 PolarHBondContact O-N 3.48Å; N28-E31 PolarHBondContact O-N 3.26Å; N28-L32 PolarHBondContact O-N 3.35Å |
| 29 | H | 41.3 | Very low | 37.2 | Very low | 129 Ų | 129 | 120.8 Ų | 120.8 | 60% | 0.597 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -55.5 | -24.2 | 178.5 | -116.1 | -75.5 | 0 | 0 | 0 | 113.4 | P27 | P27-H29 PolarHBondContact O-N 3.05Å |
| 30 | E | 39.3 | Very low | 38.5 | Very low | 161 Ų | 161 | 121.4 Ų | 121.4 | 75% | 0.752 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -77.3 | -23.9 | 174.5 | -72.1 | -176 | 144.7 | 0 | 0 | 113.7 | N28 | N28-E30 PolarHBondContact O-N 3.48Å |
| 31 | E | 34.6 | Very low | 39.6 | Very low | 134 Ų | 134 | 118.1 Ų | 118.1 | 63% | 0.626 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -83.7 | -32.9 | 176.5 | -74.6 | -173.4 | 138 | 0 | 0 | 112.3 | N28 Q33 K34 | N28-E31 PolarHBondContact O-N 3.26Å; E31-Q33 VanDerWaalsContact C-N 3.28Å; E31-Q33 PolarHBondContact O-N 3.13Å; E31-K34 PolarHBondContact O-N 3.33Å |
| 32 | L | 39.3 | Very low | 41 | Very low | 85 Ų | 85 | 120.2 Ų | 120.2 | 45% | 0.445 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -70.7 | -20.5 | 175.2 | -86.1 | 134.9 | 0 | 0 | 0 | 113.8 | P27 N28 K34 | P27-L32 HydrophobicContact CB-CD1 3.92Å; P27-L32 HydrophobicContact CG-CD1 4.28Å; N28-L32 PolarHBondContact O-N 3.35Å; L32-K34 VanDerWaalsContact C-N 3.34Å |
| 33 | Q | 37.8 | Very low | 42.5 | Very low | 161 Ų | 161 | 115.6 Ų | 115.6 | 75% | 0.752 | 64% | 0.635 | S | S | * | * | G | 310 helix | trans | -79.6 | -17.4 | 179.3 | -147.8 | 172.3 | 24 | 0 | 0 | 112.9 | E31 D35 | E31-Q33 VanDerWaalsContact C-N 3.28Å; E31-Q33 PolarHBondContact O-N 3.13Å; Q33-D35 VanDerWaalsContact C-N 3.31Å; Q33-D35 PolarHBondContact O-N 3.15Å |
| 34 | K | 36.6 | Very low | 43.8 | Very low | 190 Ų | 190 | 111.7 Ų | 111.7 | 83% | 0.826 | 61% | 0.607 | S | S | * | * | G | 310 helix | trans | -73.4 | -17.6 | 179.8 | -94.2 | 178.8 | 176 | 173.1 | 0 | 114.3 | E31 L32 | E31-K34 PolarHBondContact O-N 3.33Å; L32-K34 VanDerWaalsContact C-N 3.34Å |
| 35 | D | 34 | Very low | 45.1 | Very low | 126 Ų | 126 | 111.9 Ų | 111.9 | 67% | 0.674 | 60% | 0.599 | S | S | * | * | G | 310 helix | trans | -97.5 | 2.7 | -169 | -148.5 | 28.8 | 0 | 0 | 0 | 114.2 | Q33 T37 | Q33-D35 VanDerWaalsContact C-N 3.31Å; Q33-D35 PolarHBondContact O-N 3.15Å; D35-T37 PolarHBondContact O-N 3.01Å; D35-T37 PolarHBondContact O-OG1 3.48Å |
| 36 | G | 42 | Very low | 46.3 | Very low | 70 Ų | 70 | 112.5 Ų | 112.5 | 72% | 0.722 | 59% | 0.586 | S | S | * | * | S | Bend | trans | 62.9 | 3.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 37 | T | 46.6 | Very low | 47.7 | Very low | 105 Ų | 105 | 107.9 Ų | 107.9 | 64% | 0.644 | 56% | 0.559 | S | S | * | * | trans | -90.5 | -9.8 | -175.5 | 35 | 0 | 0 | 0 | 0 | 113.5 | D35 | D35-T37 PolarHBondContact O-N 3.01Å; D35-T37 PolarHBondContact O-OG1 3.48Å | ||
| 38 | F | 45 | Very low | 49.3 | Very low | 105 Ų | 105 | 109.7 Ų | 109.7 | 46% | 0.461 | 56% | 0.561 | S | S | . | * | trans | -107.6 | 95.7 | -178.4 | -159.3 | -93.1 | 0 | 0 | 0 | 112.1 | ||||
| 39 | K | 52.3 | Low | 51.2 | Low | 145 Ų | 145 | 109.8 Ų | 109.8 | 63% | 0.63 | 56% | 0.558 | S | S | * | * | trans | -84.9 | 110.4 | 169.1 | -69.5 | -177.3 | -178.8 | 176.5 | 0 | 109.4 | D43 | K39-D43 WeakPolarHBondContact CA-OD2 3.37Å; K39-D43 HydrophobicContact CB-CB 4Å; K39-D43 HydrophobicContact CG-CB 4.24Å | ||
| 40 | H | 55.5 | Low | 52.8 | Low | 94 Ų | 94 | 108 Ų | 108 | 44% | 0.435 | 55% | 0.553 | S | S | . | * | trans | -64.2 | 156.5 | 168.8 | 77.4 | -69.6 | 0 | 0 | 0 | 110 | H42 D43 | H40-H42 WeakPolarHBondContact NE2-CB 3.39Å; H40-H42 PolarHBondContact O-N 3.16Å; H40-D43 VanDerWaalsContact CE1-CA 3.46Å; H40-D43 WeakPolarHBondContact CE1-CA 3.47Å; H40-D43 PolarHBondContact CE1-N 3.45Å; H40-D43 IonicContact CE1-OD1 2.91Å; H40-D43 PolarHBondContact CE1-OD1 3.25Å; H40-D43 WeakPolarHBondContact ND1-CB 3.47Å; H40-D43 VanDerWaalsContact ND1-CG 3.3Å; H40-D43 IonicContact ND1-OD1 3.85Å; H40-D43 PolarHBondContact ND1-OD1 3.43Å; H40-D43 IonicContact ND1-OD2 3.02Å; H40-D43 WeakPolarHBondContact O-CB 3.43Å; H40-D43 PolarHBondContact O-N 3.43Å | ||
| 41 | C | 57.5 | Low | 54.5 | Low | 90 Ų | 90 | 102.2 Ų | 102.2 | 61% | 0.608 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -3.7 | -172.8 | -56.8 | 0 | 0 | 0 | 0 | 115.5 | ||
| 42 | H | 61.1 | Low | 56.7 | Low | 149 Ų | 149 | 100.4 Ų | 100.4 | 69% | 0.69 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.9 | 18.4 | 175.3 | -56.8 | -63.6 | 0 | 0 | 0 | 114.4 | H40 N44 | H40-H42 WeakPolarHBondContact NE2-CB 3.39Å; H40-H42 PolarHBondContact O-N 3.16Å; H42-N44 PolarHBondContact O-N 2.82Å |
| 43 | D | 58.8 | Low | 58.8 | Low | 66 Ų | 66 | 100 Ų | 100 | 35% | 0.353 | 52% | 0.517 | S | S | . | . | trans | -73 | 15 | -176.3 | -132.8 | 9.8 | 0 | 0 | 0 | 115.1 | K39 H40 S45 | K39-D43 WeakPolarHBondContact CA-OD2 3.37Å; K39-D43 HydrophobicContact CB-CB 4Å; K39-D43 HydrophobicContact CG-CB 4.24Å; H40-D43 VanDerWaalsContact CE1-CA 3.46Å; H40-D43 WeakPolarHBondContact CE1-CA 3.47Å; H40-D43 PolarHBondContact CE1-N 3.45Å; H40-D43 IonicContact CE1-OD1 2.91Å; H40-D43 PolarHBondContact CE1-OD1 3.25Å; H40-D43 WeakPolarHBondContact ND1-CB 3.47Å; H40-D43 VanDerWaalsContact ND1-CG 3.3Å; H40-D43 IonicContact ND1-OD1 3.85Å; H40-D43 PolarHBondContact ND1-OD1 3.43Å; H40-D43 IonicContact ND1-OD2 3.02Å; H40-D43 WeakPolarHBondContact O-CB 3.43Å; H40-D43 PolarHBondContact O-N 3.43Å; D43-S45 PolarHBondContact O-N 3.39Å | ||
| 44 | N | 61.4 | Low | 60.8 | Low | 50 Ų | 50 | 95 Ų | 95 | 27% | 0.267 | 49% | 0.493 | S | S | . | . | trans | -86.1 | 29.6 | 177.7 | -136 | 11.1 | 0 | 0 | 0 | 112.2 | H42 F46 A47 Q48 F348 | H42-N44 PolarHBondContact O-N 2.82Å; N44-F46 PolarHBondContact O-N 3.34Å; N44-A47 HydrophobicContact CB-CB 4.45Å; N44-A47 WeakPolarHBondContact O-CB 3.41Å; N44-A47 PolarHBondContact O-N 3.29Å; N44-Q48 PolarHBondContact O-N 3.01Å; N44-F348 PolarHBondContact ND2-O 2.91Å | ||
| 45 | S | 59.6 | Low | 63 | Low | 60 Ų | 60 | 87.8 Ų | 87.8 | 42% | 0.42 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -54.8 | -36.5 | -178.2 | 56.6 | 0 | 0 | 0 | 0 | 112.8 | D43 Q48 Q49 | D43-S45 PolarHBondContact O-N 3.39Å; S45-Q48 PolarHBondContact O-N 2.94Å; S45-Q49 WeakPolarHBondContact O-CB 3.36Å; S45-Q49 PolarHBondContact O-N 3.46Å |
| 46 | F | 62.9 | Low | 65.5 | Low | 139 Ų | 139 | 88.8 Ų | 88.8 | 61% | 0.61 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -61.1 | -43.9 | 173.6 | -66.5 | -73.6 | 0 | 0 | 0 | 112.5 | N44 Q48 Q49 D50 | N44-F46 PolarHBondContact O-N 3.34Å; F46-Q48 VanDerWaalsContact C-N 3.29Å; F46-Q48 PolarHBondContact O-N 2.85Å; F46-Q49 PolarHBondContact O-N 3.43Å; F46-D50 WeakPolarHBondContact O-CB 3.48Å; F46-D50 PolarHBondContact O-N 3.14Å |
| 47 | A | 66.3 | Low | 67.7 | Low | 13 Ų | 13 | 88.5 Ų | 88.5 | 11% | 0.107 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -66.6 | -32.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | N44 R51 | N44-A47 HydrophobicContact CB-CB 4.45Å; N44-A47 WeakPolarHBondContact O-CB 3.41Å; N44-A47 PolarHBondContact O-N 3.29Å; A47-R51 WeakPolarHBondContact O-CD 3.42Å; A47-R51 WeakPolarHBondContact O-CG 3.06Å; A47-R51 PolarHBondContact O-N 2.87Å |
| 48 | Q | 70.3 | Confident | 69.6 | Low | 114 Ų | 114 | 83.7 Ų | 83.7 | 53% | 0.533 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -70.7 | -43.5 | 173.4 | -175.7 | 173.2 | -22.2 | 0 | 0 | 111.7 | N44 S45 F46 R51 E52 | N44-Q48 PolarHBondContact O-N 3.01Å; S45-Q48 PolarHBondContact O-N 2.94Å; F46-Q48 VanDerWaalsContact C-N 3.29Å; F46-Q48 PolarHBondContact O-N 2.85Å; Q48-R51 PolarHBondContact O-N 3.19Å; Q48-E52 PolarHBondContact O-N 2.94Å |
| 49 | Q | 72.7 | Confident | 71.7 | Confident | 119 Ų | 119 | 81.2 Ų | 81.2 | 56% | 0.556 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -66.2 | -39.3 | 179 | -170.3 | 173.5 | 6.9 | 0 | 0 | 112.7 | S45 F46 R51 E52 T53 | S45-Q49 WeakPolarHBondContact O-CB 3.36Å; S45-Q49 PolarHBondContact O-N 3.46Å; F46-Q49 PolarHBondContact O-N 3.43Å; Q49-R51 VanDerWaalsContact C-N 3.34Å; Q49-E52 PolarHBondContact O-N 3.39Å; Q49-T53 PolarHBondContact O-N 3.1Å; Q49-T53 PolarHBondContact O-OG1 3.08Å |
| 50 | D | 74.9 | Confident | 73.5 | Confident | 93 Ų | 93 | 83.6 Ų | 83.6 | 50% | 0.497 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.4 | -45.5 | 174.3 | -71.6 | -17.8 | 0 | 0 | 0 | 110.5 | F46 E52 T53 E54 | F46-D50 WeakPolarHBondContact O-CB 3.48Å; F46-D50 PolarHBondContact O-N 3.14Å; D50-E52 PolarHBondContact O-N 2.82Å; D50-T53 WeakPolarHBondContact O-CB 3.2Å; D50-T53 PolarHBondContact O-N 2.73Å; D50-T53 VanDerWaalsContact O-N 3.15Å; D50-E54 WeakPolarHBondContact O-CG 3.48Å; D50-E54 PolarHBondContact O-N 3.26Å |
| 51 | R | 75.5 | Confident | 75.1 | Confident | 39 Ų | 39 | 82.7 Ų | 82.7 | 15% | 0.147 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 177.5 | -73.8 | 169.7 | -179.3 | 162.3 | 2.7 | 113 | A47 Q48 Q49 T53 E54 K55 N315 | A47-R51 WeakPolarHBondContact O-CD 3.42Å; A47-R51 WeakPolarHBondContact O-CG 3.06Å; A47-R51 PolarHBondContact O-N 2.87Å; Q48-R51 PolarHBondContact O-N 3.19Å; Q49-R51 VanDerWaalsContact C-N 3.34Å; R51-T53 VanDerWaalsContact C-N 3.25Å; R51-T53 PolarHBondContact O-N 3.01Å; R51-E54 PolarHBondContact O-N 3.47Å; R51-K55 VanDerWaalsContact O-CB 3.25Å; R51-K55 WeakPolarHBondContact O-CB 3.48Å; R51-K55 PolarHBondContact O-N 2.74Å; R51-N315 PolarHBondContact NH2-O 3.09Å |
| 52 | E | 80.8 | Confident | 76.7 | Confident | 96 Ų | 96 | 78.4 Ų | 78.4 | 45% | 0.449 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.7 | -37.7 | 175.2 | -74.6 | -173.3 | -172.8 | 0 | 0 | 111.7 | Q48 Q49 D50 K56 | Q48-E52 PolarHBondContact O-N 2.94Å; Q49-E52 PolarHBondContact O-N 3.39Å; D50-E52 PolarHBondContact O-N 2.82Å; E52-K56 WeakPolarHBondContact O-CG 3.26Å; E52-K56 PolarHBondContact O-N 3.14Å |
| 53 | T | 83 | Confident | 78.2 | Confident | 76 Ų | 76 | 78 Ų | 78 | 47% | 0.466 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -68.2 | -48.5 | 177.2 | -55 | 0 | 0 | 0 | 0 | 111 | Q49 D50 R51 K55 K56 V57 | Q49-T53 PolarHBondContact O-N 3.1Å; Q49-T53 PolarHBondContact O-OG1 3.08Å; D50-T53 WeakPolarHBondContact O-CB 3.2Å; D50-T53 PolarHBondContact O-N 2.73Å; D50-T53 VanDerWaalsContact O-N 3.15Å; R51-T53 VanDerWaalsContact C-N 3.25Å; R51-T53 PolarHBondContact O-N 3.01Å; T53-K55 VanDerWaalsContact C-N 3.26Å; T53-K55 PolarHBondContact O-N 3.13Å; T53-K56 PolarHBondContact O-N 2.88Å; T53-V57 WeakPolarHBondContact O-CG2 3.3Å; T53-V57 PolarHBondContact O-N 3.09Å |
| 54 | E | 80.9 | Confident | 79.9 | Confident | 57 Ų | 57 | 77.5 Ų | 77.5 | 27% | 0.266 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -54.9 | -43.3 | 174.3 | -74.2 | 172 | 179.4 | 0 | 0 | 111.5 | D50 R51 V57 A58 Q212 | D50-E54 WeakPolarHBondContact O-CG 3.48Å; D50-E54 PolarHBondContact O-N 3.26Å; R51-E54 PolarHBondContact O-N 3.47Å; E54-V57 PolarHBondContact O-N 3.28Å; E54-A58 VanDerWaalsContact O-CB 3.28Å; E54-A58 WeakPolarHBondContact O-CB 3.29Å; E54-A58 PolarHBondContact O-N 2.84Å; E54-Q212 WeakPolarHBondContact OE1-CG 3.3Å; E54-Q212 PolarHBondContact OE1-NE2 3.15Å |
| 55 | K | 82.5 | Confident | 81.3 | Confident | 38 Ų | 38 | 75.1 Ų | 75.1 | 17% | 0.165 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 178.2 | -175.2 | 169.6 | -175.6 | 158.7 | 0 | 113.3 | R51 T53 V57 A58 S59 L109 S112 S113 E128 | R51-K55 VanDerWaalsContact O-CB 3.25Å; R51-K55 WeakPolarHBondContact O-CB 3.48Å; R51-K55 PolarHBondContact O-N 2.74Å; T53-K55 VanDerWaalsContact C-N 3.26Å; T53-K55 PolarHBondContact O-N 3.13Å; K55-V57 VanDerWaalsContact C-N 3.33Å; K55-A58 WeakPolarHBondContact O-CB 3.38Å; K55-A58 PolarHBondContact O-N 3.49Å; K55-S59 WeakPolarHBondContact O-CB 3.21Å; K55-S59 PolarHBondContact O-N 2.67Å; K55-L109 WeakPolarHBondContact CE-O 3.45Å; K55-L109 HydrophobicContact CG-CD2 4.43Å; K55-L109 PolarHBondContact NZ-O 3.37Å; K55-S112 PolarHBondContact NZ-O 3.31Å; K55-S112 VanDerWaalsContact NZ-O 3.13Å; K55-S112 PolarHBondContact NZ-OG 3.2Å; K55-S113 VanDerWaalsContact NZ-CA 3.26Å; K55-E128 IonicContact NZ-OE1 3.76Å |
| 56 | K | 86.8 | Confident | 82.9 | Confident | 146 Ų | 146 | 72.8 Ų | 72.8 | 64% | 0.635 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -62.9 | -42.3 | 174.2 | -74.9 | 172.4 | -174.5 | 172.1 | 0 | 111.2 | E52 T53 S59 R60 | E52-K56 WeakPolarHBondContact O-CG 3.26Å; E52-K56 PolarHBondContact O-N 3.14Å; T53-K56 PolarHBondContact O-N 2.88Å; K56-S59 PolarHBondContact O-N 3.2Å; K56-R60 WeakPolarHBondContact O-CB 3.27Å; K56-R60 PolarHBondContact O-N 3.34Å |
| 57 | V | 87.3 | Confident | 84.4 | Confident | 64 Ų | 64 | 69.5 Ų | 69.5 | 39% | 0.388 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63 | -47 | 175.7 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | T53 E54 K55 R60 R61 | T53-V57 WeakPolarHBondContact O-CG2 3.3Å; T53-V57 PolarHBondContact O-N 3.09Å; E54-V57 PolarHBondContact O-N 3.28Å; K55-V57 VanDerWaalsContact C-N 3.33Å; V57-R60 PolarHBondContact O-N 3.31Å; V57-R61 WeakPolarHBondContact O-CG 3.4Å; V57-R61 PolarHBondContact O-N 3.06Å |
| 58 | A | 86.1 | Confident | 85.7 | Confident | 5 Ų | 5 | 70.4 Ų | 70.4 | 4% | 0.041 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -56.4 | -50 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | E54 K55 R60 R61 L62 L109 N215 V218 | E54-A58 VanDerWaalsContact O-CB 3.28Å; E54-A58 WeakPolarHBondContact O-CB 3.29Å; E54-A58 PolarHBondContact O-N 2.84Å; K55-A58 WeakPolarHBondContact O-CB 3.38Å; K55-A58 PolarHBondContact O-N 3.49Å; A58-R60 PolarHBondContact O-N 3.41Å; A58-R61 PolarHBondContact O-N 3.43Å; A58-L62 PolarHBondContact O-N 2.95Å; A58-L109 HydrophobicContact CB-CD1 4.3Å; A58-N215 WeakPolarHBondContact CB-ND2 3.34Å; A58-V218 HydrophobicContact CB-CG2 3.37Å |
| 59 | S | 89.8 | Confident | 86.7 | Confident | 52 Ų | 52 | 65 Ų | 65 | 36% | 0.364 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -60.2 | -45.4 | 178.6 | -179.2 | 0 | 0 | 0 | 0 | 111.6 | K55 K56 R61 L62 Y63 | K55-S59 WeakPolarHBondContact O-CB 3.21Å; K55-S59 PolarHBondContact O-N 2.67Å; K56-S59 PolarHBondContact O-N 3.2Å; S59-R61 PolarHBondContact O-N 3.42Å; S59-L62 PolarHBondContact O-N 2.92Å; S59-Y63 WeakPolarHBondContact O-CB 3.33Å; S59-Y63 PolarHBondContact O-N 3.26Å |
| 60 | R | 90.7 | Very high | 87.7 | Confident | 195 Ų | 195 | 62.8 Ų | 62.8 | 74% | 0.736 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -61 | -43.3 | 177.2 | -174.7 | 178.6 | 176.4 | -170.5 | -1.1 | 112.1 | K56 V57 A58 Y63 V64 | K56-R60 WeakPolarHBondContact O-CB 3.27Å; K56-R60 PolarHBondContact O-N 3.34Å; V57-R60 PolarHBondContact O-N 3.31Å; A58-R60 PolarHBondContact O-N 3.41Å; R60-Y63 PolarHBondContact O-N 3.38Å; R60-V64 VanDerWaalsContact O-CG2 3.31Å; R60-V64 WeakPolarHBondContact O-CG2 3.42Å; R60-V64 PolarHBondContact O-N 3.11Å |
| 61 | R | 89.2 | Confident | 88.6 | Confident | 75 Ų | 75 | 63.9 Ų | 63.9 | 28% | 0.283 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.9 | -48.9 | 178.9 | -72.8 | 179 | -176.5 | 172.6 | 3 | 111.8 | V57 A58 S59 Y63 V64 V65 L184 | V57-R61 WeakPolarHBondContact O-CG 3.4Å; V57-R61 PolarHBondContact O-N 3.06Å; A58-R61 PolarHBondContact O-N 3.43Å; S59-R61 PolarHBondContact O-N 3.42Å; R61-Y63 VanDerWaalsContact C-N 3.29Å; R61-Y63 PolarHBondContact O-N 3.24Å; R61-V64 PolarHBondContact O-N 3.4Å; R61-V65 WeakPolarHBondContact O-CG2 3.49Å; R61-V65 PolarHBondContact O-N 3.01Å; R61-L184 HydrophobicContact CB-CD1 4.29Å |
| 62 | L | 90.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 65.1 Ų | 65.1 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -60.6 | -40.6 | 177.5 | -75.6 | 167.9 | 0 | 0 | 0 | 111.6 | A58 S59 V64 V65 S66 F102 L106 L109 L184 V218 A221 | A58-L62 PolarHBondContact O-N 2.95Å; S59-L62 PolarHBondContact O-N 2.92Å; L62-V64 PolarHBondContact O-N 3Å; L62-V65 PolarHBondContact O-N 2.86Å; L62-S66 WeakPolarHBondContact O-CB 3.38Å; L62-S66 PolarHBondContact O-N 3.05Å; L62-S66 PolarHBondContact O-OG 2.92Å; L62-F102 HydrophobicContact CD2-CD1 4.43Å; L62-L106 HydrophobicContact CB-CD2 3.61Å; L62-L106 HydrophobicContact CB-CG 3.89Å; L62-L106 HydrophobicContact CD1-CD2 4.5Å; L62-L109 HydrophobicContact CD1-CD1 3.4Å; L62-L109 VanDerWaalsContact CD1-CD1 3.4Å; L62-L184 HydrophobicContact CD2-CD1 4.45Å; L62-V218 HydrophobicContact CD1-CG2 4.19Å; L62-A221 HydrophobicContact CD2-CB 3.53Å |
| 63 | Y | 93.6 | Very high | 89.8 | Confident | 141 Ų | 141 | 61.4 Ų | 61.4 | 55% | 0.553 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -61.4 | -43.8 | 176.1 | -174 | -103.3 | 0 | 0 | 0 | 112.5 | S59 R60 R61 S66 I67 | S59-Y63 WeakPolarHBondContact O-CB 3.33Å; S59-Y63 PolarHBondContact O-N 3.26Å; R60-Y63 PolarHBondContact O-N 3.38Å; R61-Y63 VanDerWaalsContact C-N 3.29Å; R61-Y63 PolarHBondContact O-N 3.24Å; Y63-S66 PolarHBondContact O-N 3.1Å; Y63-I67 HydrophobicContact CD1-CD1 3.79Å; Y63-I67 HydrophobicContact CE1-CD1 3.3Å; Y63-I67 HydrophobicContact CE1-CG1 4.37Å; Y63-I67 HydrophobicContact CE2-CD1 4.46Å; Y63-I67 WeakPolarHBondContact O-CG1 3.41Å; Y63-I67 PolarHBondContact O-N 3.36Å; Y63-I67 VanDerWaalsContact O-N 3.08Å |
| 64 | V | 92.6 | Very high | 90.2 | Very high | 56 Ų | 56 | 62.3 Ų | 62.3 | 34% | 0.339 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63 | -46.1 | 175.8 | 173.5 | 0 | 0 | 0 | 0 | 111 | R60 R61 L62 S66 I67 I68 T183 | R60-V64 VanDerWaalsContact O-CG2 3.31Å; R60-V64 WeakPolarHBondContact O-CG2 3.42Å; R60-V64 PolarHBondContact O-N 3.11Å; R61-V64 PolarHBondContact O-N 3.4Å; L62-V64 PolarHBondContact O-N 3Å; V64-S66 PolarHBondContact O-N 3.43Å; V64-I67 PolarHBondContact O-N 2.76Å; V64-I68 HydrophobicContact CG1-CD1 3.77Å; V64-I68 HydrophobicContact CG1-CG1 4.44Å; V64-I68 WeakPolarHBondContact O-CG1 3.22Å; V64-I68 PolarHBondContact O-N 2.79Å; V64-T183 HydrophobicContact CB-CG2 4.27Å; V64-T183 HydrophobicContact CG1-CG2 3.77Å |
| 65 | V | 91.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 177.8 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | R61 L62 I67 I68 C69 F102 M180 T183 L184 | R61-V65 WeakPolarHBondContact O-CG2 3.49Å; R61-V65 PolarHBondContact O-N 3.01Å; L62-V65 PolarHBondContact O-N 2.86Å; V65-I67 VanDerWaalsContact C-N 3.34Å; V65-I67 PolarHBondContact O-N 3.35Å; V65-I68 PolarHBondContact O-N 2.86Å; V65-C69 VanDerWaalsContact O-CB 3.32Å; V65-C69 WeakPolarHBondContact O-CB 3.36Å; V65-C69 PolarHBondContact O-N 2.95Å; V65-F102 HydrophobicContact CG1-CD1 4.41Å; V65-F102 HydrophobicContact CG1-CD2 3.91Å; V65-F102 HydrophobicContact CG1-CE1 4.15Å; V65-F102 HydrophobicContact CG1-CE2 3.61Å; V65-F102 HydrophobicContact CG1-CG 4.33Å; V65-F102 HydrophobicContact CG1-CZ 3.76Å; V65-M180 HydrophobicContact CG1-CB 4.2Å; V65-M180 HydrophobicContact CG1-CG 4.08Å; V65-M180 HydrophobicContact CG1-SD 3.99Å; V65-T183 HydrophobicContact CG2-CG2 3.68Å; V65-L184 HydrophobicContact CG2-CB 4.43Å |
| 66 | S | 93.8 | Very high | 90.8 | Very high | 11 Ų | 11 | 60.7 Ų | 60.7 | 8% | 0.077 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.2 | -40.7 | 175.5 | -61.2 | 0 | 0 | 0 | 0 | 112.7 | L62 Y63 V64 L70 F102 | L62-S66 WeakPolarHBondContact O-CB 3.38Å; L62-S66 PolarHBondContact O-N 3.05Å; L62-S66 PolarHBondContact O-OG 2.92Å; Y63-S66 PolarHBondContact O-N 3.1Å; V64-S66 PolarHBondContact O-N 3.43Å; S66-L70 VanDerWaalsContact O-CB 3.31Å; S66-L70 WeakPolarHBondContact O-CB 3.28Å; S66-L70 PolarHBondContact O-N 3.46Å; S66-F102 VanDerWaalsContact OG-CB 3.25Å; S66-F102 WeakPolarHBondContact OG-CB 3.47Å |
| 67 | I | 94.6 | Very high | 90.9 | Very high | 70 Ų | 70 | 57.2 Ų | 57.2 | 36% | 0.359 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -65.6 | -45.7 | 176 | -70.5 | 171.1 | 0 | 0 | 0 | 110.8 | Y63 V64 V65 C69 L70 L71 | Y63-I67 HydrophobicContact CD1-CD1 3.79Å; Y63-I67 HydrophobicContact CE1-CD1 3.3Å; Y63-I67 HydrophobicContact CE1-CG1 4.37Å; Y63-I67 HydrophobicContact CE2-CD1 4.46Å; Y63-I67 WeakPolarHBondContact O-CG1 3.41Å; Y63-I67 PolarHBondContact O-N 3.36Å; Y63-I67 VanDerWaalsContact O-N 3.08Å; V64-I67 PolarHBondContact O-N 2.76Å; V65-I67 VanDerWaalsContact C-N 3.34Å; V65-I67 PolarHBondContact O-N 3.35Å; I67-C69 PolarHBondContact O-N 3.25Å; I67-L70 PolarHBondContact O-N 3.25Å; I67-L71 HydrophobicContact CG2-CD1 4.08Å; I67-L71 HydrophobicContact CG2-CG 4.44Å; I67-L71 WeakPolarHBondContact O-CG 3.16Å; I67-L71 PolarHBondContact O-N 2.97Å |
| 68 | I | 91.9 | Very high | 90.9 | Very high | 32 Ų | 32 | 56.5 Ų | 56.5 | 16% | 0.164 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.2 | -49.3 | 178.7 | -69.3 | 168.8 | 0 | 0 | 0 | 110.1 | V64 V65 L70 L71 F72 I179 M180 | V64-I68 HydrophobicContact CG1-CD1 3.77Å; V64-I68 HydrophobicContact CG1-CG1 4.44Å; V64-I68 WeakPolarHBondContact O-CG1 3.22Å; V64-I68 PolarHBondContact O-N 2.79Å; V65-I68 PolarHBondContact O-N 2.86Å; I68-L70 VanDerWaalsContact C-N 3.33Å; I68-L70 PolarHBondContact O-N 2.87Å; I68-L71 PolarHBondContact O-N 3.48Å; I68-F72 HydrophobicContact CG2-CD2 3.68Å; I68-F72 HydrophobicContact CG2-CE2 3.62Å; I68-F72 VanDerWaalsContact O-CD2 3.31Å; I68-F72 WeakPolarHBondContact O-CD2 3.34Å; I68-F72 PolarHBondContact O-N 3.43Å; I68-I179 HydrophobicContact CD1-CG2 4.12Å; I68-I179 HydrophobicContact CG2-CG2 4.21Å; I68-M180 HydrophobicContact CG2-CG 4.02Å |
| 69 | C | 92.8 | Very high | 90.7 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -57.7 | -43.9 | 177.2 | -172 | 0 | 0 | 0 | 0 | 112 | V65 I67 L71 F72 M73 L95 F102 M180 | V65-C69 VanDerWaalsContact O-CB 3.32Å; V65-C69 WeakPolarHBondContact O-CB 3.36Å; V65-C69 PolarHBondContact O-N 2.95Å; I67-C69 PolarHBondContact O-N 3.25Å; C69-L71 PolarHBondContact O-N 3.5Å; C69-F72 PolarHBondContact O-N 3.04Å; C69-M73 VanDerWaalsContact O-CB 3.3Å; C69-M73 WeakPolarHBondContact O-CB 3.38Å; C69-M73 PolarHBondContact O-N 3.43Å; C69-L95 PolarHBondContact SG-O 2.98Å; C69-L95 VanDerWaalsContact SG-O 3.38Å; C69-F102 HydrophobicContact CB-CD2 4.32Å; C69-F102 HydrophobicContact CB-CE2 4.13Å; C69-M180 HydrophobicContact CB-SD 3.86Å |
| 70 | L | 93.9 | Very high | 90.4 | Very high | 72 Ų | 72 | 55.4 Ų | 55.4 | 38% | 0.377 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.7 | -41.4 | 177.5 | 177.6 | 61.4 | 0 | 0 | 0 | 112.2 | S66 I67 I68 M73 I74 L99 | S66-L70 VanDerWaalsContact O-CB 3.31Å; S66-L70 WeakPolarHBondContact O-CB 3.28Å; S66-L70 PolarHBondContact O-N 3.46Å; I67-L70 PolarHBondContact O-N 3.25Å; I68-L70 VanDerWaalsContact C-N 3.33Å; I68-L70 PolarHBondContact O-N 2.87Å; L70-M73 HydrophobicContact CD1-CE 3.46Å; L70-M73 VanDerWaalsContact CD1-CE 3.46Å; L70-M73 PolarHBondContact O-N 3Å; L70-I74 HydrophobicContact CD1-CD1 4.02Å; L70-I74 HydrophobicContact CD1-CG1 4.34Å; L70-I74 HydrophobicContact CG-CD1 4.08Å; L70-I74 VanDerWaalsContact O-CG1 3.29Å; L70-I74 WeakPolarHBondContact O-CG1 3.44Å; L70-I74 PolarHBondContact O-N 2.77Å; L70-L99 HydrophobicContact CB-CD2 4.46Å; L70-L99 HydrophobicContact CD1-CD2 4.07Å |
| 71 | L | 92.8 | Very high | 90 | Very high | 117 Ų | 117 | 55.2 Ų | 55.2 | 61% | 0.613 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -65.9 | -43.9 | 178.2 | -70.3 | 173.6 | 0 | 0 | 0 | 111.9 | I67 I68 C69 I74 G75 | I67-L71 HydrophobicContact CG2-CD1 4.08Å; I67-L71 HydrophobicContact CG2-CG 4.44Å; I67-L71 WeakPolarHBondContact O-CG 3.16Å; I67-L71 PolarHBondContact O-N 2.97Å; I68-L71 PolarHBondContact O-N 3.48Å; C69-L71 PolarHBondContact O-N 3.5Å; L71-I74 PolarHBondContact O-N 2.88Å; L71-G75 PolarHBondContact O-N 2.95Å |
| 72 | F | 90.7 | Very high | 89.7 | Confident | 64 Ų | 64 | 58.7 Ų | 58.7 | 28% | 0.281 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.5 | -44.9 | 175.3 | -82.1 | -67.3 | 0 | 0 | 0 | 111.7 | I68 C69 I74 G75 E76 L95 A176 I179 | I68-F72 HydrophobicContact CG2-CD2 3.68Å; I68-F72 HydrophobicContact CG2-CE2 3.62Å; I68-F72 VanDerWaalsContact O-CD2 3.31Å; I68-F72 WeakPolarHBondContact O-CD2 3.34Å; I68-F72 PolarHBondContact O-N 3.43Å; C69-F72 PolarHBondContact O-N 3.04Å; F72-I74 VanDerWaalsContact C-N 3.34Å; F72-I74 PolarHBondContact O-N 2.89Å; F72-G75 WeakPolarHBondContact O-CA 3.22Å; F72-G75 PolarHBondContact O-N 2.69Å; F72-G75 VanDerWaalsContact O-N 3.08Å; F72-E76 PolarHBondContact O-N 2.88Å; F72-L95 HydrophobicContact CB-CD1 4.09Å; F72-A176 HydrophobicContact CB-CB 4.49Å; F72-A176 HydrophobicContact CD1-CB 3.85Å; F72-A176 HydrophobicContact CD2-CB 3.66Å; F72-A176 HydrophobicContact CE1-CB 3.9Å; F72-A176 HydrophobicContact CE2-CB 3.7Å; F72-A176 HydrophobicContact CG-CB 3.75Å; F72-A176 HydrophobicContact CZ-CB 3.83Å; F72-I179 HydrophobicContact CE2-CD1 4.38Å; F72-I179 HydrophobicContact CZ-CD1 4.09Å |
| 73 | M | 91.5 | Very high | 89.2 | Confident | 19 Ų | 19 | 62 Ų | 62 | 9% | 0.094 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58 | -44.8 | 177.1 | -176.4 | -175.2 | 61.5 | 0 | 0 | 111.9 | C69 L70 G75 E76 I77 L95 L96 L99 | C69-M73 VanDerWaalsContact O-CB 3.3Å; C69-M73 WeakPolarHBondContact O-CB 3.38Å; C69-M73 PolarHBondContact O-N 3.43Å; L70-M73 HydrophobicContact CD1-CE 3.46Å; L70-M73 VanDerWaalsContact CD1-CE 3.46Å; L70-M73 PolarHBondContact O-N 3Å; M73-G75 VanDerWaalsContact C-N 3.33Å; M73-G75 PolarHBondContact O-N 2.85Å; M73-E76 PolarHBondContact O-N 3.49Å; M73-I77 HydrophobicContact CG-CD1 3.88Å; M73-I77 WeakPolarHBondContact O-CB 3.44Å; M73-I77 VanDerWaalsContact O-CG1 3.23Å; M73-I77 WeakPolarHBondContact O-CG1 3.26Å; M73-I77 PolarHBondContact O-N 3.37Å; M73-L95 HydrophobicContact CB-CB 4.02Å; M73-L95 HydrophobicContact CB-CD1 4.18Å; M73-L95 HydrophobicContact CG-CB 4.23Å; M73-L96 HydrophobicContact SD-CB 3.93Å; M73-L96 HydrophobicContact SD-CD1 4.01Å; M73-L99 HydrophobicContact CE-CD2 3.75Å; M73-L99 HydrophobicContact SD-CD2 4.42Å |
| 74 | I | 91.4 | Very high | 88.4 | Confident | 95 Ų | 95 | 58.6 Ų | 58.6 | 49% | 0.487 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -63.1 | -41.9 | 176.2 | -68.3 | 166 | 0 | 0 | 0 | 110.9 | L70 L71 F72 A78 | L70-I74 HydrophobicContact CD1-CD1 4.02Å; L70-I74 HydrophobicContact CD1-CG1 4.34Å; L70-I74 HydrophobicContact CG-CD1 4.08Å; L70-I74 VanDerWaalsContact O-CG1 3.29Å; L70-I74 WeakPolarHBondContact O-CG1 3.44Å; L70-I74 PolarHBondContact O-N 2.77Å; L71-I74 PolarHBondContact O-N 2.88Å; F72-I74 VanDerWaalsContact C-N 3.34Å; F72-I74 PolarHBondContact O-N 2.89Å; I74-A78 WeakPolarHBondContact O-CB 3.44Å; I74-A78 PolarHBondContact O-N 2.74Å |
| 75 | G | 88.3 | Confident | 87.6 | Confident | 44 Ų | 44 | 56.8 Ų | 56.8 | 45% | 0.454 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L71 F72 M73 A78 G79 | L71-G75 PolarHBondContact O-N 2.95Å; F72-G75 WeakPolarHBondContact O-CA 3.22Å; F72-G75 PolarHBondContact O-N 2.69Å; F72-G75 VanDerWaalsContact O-N 3.08Å; M73-G75 VanDerWaalsContact C-N 3.33Å; M73-G75 PolarHBondContact O-N 2.85Å; G75-A78 PolarHBondContact O-N 3.14Å; G75-G79 PolarHBondContact O-N 2.86Å |
| 76 | E | 87.7 | Confident | 86.7 | Confident | 17 Ų | 17 | 63.5 Ų | 63.5 | 8% | 0.079 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -70.1 | -41.1 | 178.1 | -75.7 | -178.7 | -169 | 0 | 0 | 112.6 | F72 M73 A78 G79 G80 V88 A92 L95 | F72-E76 PolarHBondContact O-N 2.88Å; M73-E76 PolarHBondContact O-N 3.49Å; E76-A78 VanDerWaalsContact C-N 3.33Å; E76-A78 PolarHBondContact O-N 3.06Å; E76-G79 PolarHBondContact O-N 3.03Å; E76-G80 PolarHBondContact O-N 2.96Å; E76-V88 HydrophobicContact CB-CG1 4.26Å; E76-V88 VanDerWaalsContact O-CG1 3.24Å; E76-V88 WeakPolarHBondContact O-CG1 3.48Å; E76-A92 HydrophobicContact CB-CB 4.24Å; E76-A92 PolarHBondContact OE2-N 3.43Å; E76-L95 HydrophobicContact CG-CD1 4.45Å; E76-L95 WeakPolarHBondContact OE2-CD1 3.42Å |
| 77 | I | 88.4 | Confident | 85.7 | Confident | 73 Ų | 73 | 65.1 Ų | 65.1 | 37% | 0.374 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -60.8 | -45.4 | 174.5 | -69.1 | 169.8 | 0 | 0 | 0 | 110.3 | M73 Y81 A92 | M73-I77 HydrophobicContact CG-CD1 3.88Å; M73-I77 WeakPolarHBondContact O-CB 3.44Å; M73-I77 VanDerWaalsContact O-CG1 3.23Å; M73-I77 WeakPolarHBondContact O-CG1 3.26Å; M73-I77 PolarHBondContact O-N 3.37Å; I77-Y81 WeakPolarHBondContact O-CB 3.38Å; I77-Y81 PolarHBondContact O-N 2.97Å; I77-A92 HydrophobicContact CD1-CB 4.49Å; I77-A92 HydrophobicContact CG1-CB 3.65Å |
| 78 | A | 86.8 | Confident | 84.9 | Confident | 48 Ų | 48 | 62.3 Ų | 62.3 | 40% | 0.397 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -64.7 | -45.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | I74 G75 E76 Y81 L82 | I74-A78 WeakPolarHBondContact O-CB 3.44Å; I74-A78 PolarHBondContact O-N 2.74Å; G75-A78 PolarHBondContact O-N 3.14Å; E76-A78 VanDerWaalsContact C-N 3.33Å; E76-A78 PolarHBondContact O-N 3.06Å; A78-Y81 PolarHBondContact O-N 2.99Å; A78-L82 WeakPolarHBondContact O-CB 3.45Å; A78-L82 VanDerWaalsContact O-CG 3.24Å; A78-L82 WeakPolarHBondContact O-CG 3.41Å; A78-L82 PolarHBondContact O-N 3.45Å |
| 79 | G | 81.9 | Confident | 84.2 | Confident | 34 Ų | 34 | 64.8 Ų | 64.8 | 35% | 0.351 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | G75 E76 L82 A83 | G75-G79 PolarHBondContact O-N 2.86Å; E76-G79 PolarHBondContact O-N 3.03Å; G79-L82 PolarHBondContact O-N 3.33Å; G79-A83 WeakPolarHBondContact O-CB 3.44Å; G79-A83 PolarHBondContact O-N 3.11Å |
| 80 | G | 83.2 | Confident | 83.5 | Confident | 1 Ų | 1 | 67.9 Ų | 67.9 | 1% | 0.01 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E76 A83 G84 S85 | E76-G80 PolarHBondContact O-N 2.96Å; G80-A83 PolarHBondContact O-N 2.79Å; G80-G84 WeakPolarHBondContact O-CA 3.39Å; G80-G84 PolarHBondContact O-N 3.07Å; G80-S85 PolarHBondContact O-N 3.14Å; G80-S85 VanDerWaalsContact O-N 3.08Å |
| 81 | Y | 83.2 | Confident | 82.9 | Confident | 191 Ų | 191 | 66.1 Ų | 66.1 | 75% | 0.749 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -64.7 | -44.9 | 174.7 | -176.6 | -98.7 | 0 | 0 | 0 | 112.2 | I77 A78 G84 | I77-Y81 WeakPolarHBondContact O-CB 3.38Å; I77-Y81 PolarHBondContact O-N 2.97Å; A78-Y81 PolarHBondContact O-N 2.99Å; Y81-G84 PolarHBondContact O-N 3.32Å |
| 82 | L | 82.9 | Confident | 82.5 | Confident | 148 Ų | 148 | 60.7 Ų | 60.7 | 78% | 0.775 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -67.7 | -34.8 | 178.7 | -69.3 | 173.1 | 0 | 0 | 0 | 112.7 | A78 G79 | A78-L82 WeakPolarHBondContact O-CB 3.45Å; A78-L82 VanDerWaalsContact O-CG 3.24Å; A78-L82 WeakPolarHBondContact O-CG 3.41Å; A78-L82 PolarHBondContact O-N 3.45Å; G79-L82 PolarHBondContact O-N 3.33Å |
| 83 | A | 78.9 | Confident | 82.2 | Confident | 68 Ų | 68 | 60.2 Ų | 60.2 | 56% | 0.562 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -83.4 | -11.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | G79 G80 S85 | G79-A83 WeakPolarHBondContact O-CB 3.44Å; G79-A83 PolarHBondContact O-N 3.11Å; G80-A83 PolarHBondContact O-N 2.79Å; A83-S85 PolarHBondContact O-N 3.08Å |
| 84 | G | 76.9 | Confident | 81.9 | Confident | 71 Ų | 71 | 61.2 Ų | 61.2 | 73% | 0.732 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.1 | 25.1 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | G80 Y81 | G80-G84 WeakPolarHBondContact O-CA 3.39Å; G80-G84 PolarHBondContact O-N 3.07Å; Y81-G84 PolarHBondContact O-N 3.32Å |
| 85 | S | 76.3 | Confident | 81.8 | Confident | 18 Ų | 18 | 57 Ų | 57 | 13% | 0.126 | 36% | 0.356 | C | S | . | . | trans | -100 | 116.9 | -169.7 | -179.6 | 0 | 0 | 0 | 0 | 112.2 | G80 A83 A87 V88 M89 V165 | G80-S85 PolarHBondContact O-N 3.14Å; G80-S85 VanDerWaalsContact O-N 3.08Å; A83-S85 PolarHBondContact O-N 3.08Å; S85-A87 PolarHBondContact O-N 3.09Å; S85-A87 PolarHBondContact OG-N 3.08Å; S85-V88 PolarHBondContact O-N 3.44Å; S85-M89 PolarHBondContact O-N 2.83Å; S85-V165 WeakPolarHBondContact OG-CG1 3.36Å | ||
| 86 | L | 73.6 | Confident | 81.9 | Confident | 141 Ų | 141 | 59.6 Ų | 59.6 | 74% | 0.738 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -64.1 | -30.2 | 175.1 | -170.7 | 66.1 | 0 | 0 | 0 | 112.2 | M89 T90 | L86-M89 WeakPolarHBondContact O-CB 3.45Å; L86-M89 PolarHBondContact O-N 3.23Å; L86-T90 PolarHBondContact O-N 3.39Å; L86-T90 VanDerWaalsContact O-N 3.09Å; L86-T90 PolarHBondContact O-OG1 3.34Å |
| 87 | A | 72.3 | Confident | 82 | Confident | 45 Ų | 45 | 60.5 Ų | 60.5 | 37% | 0.372 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -65.9 | -38.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S85 M89 T90 D91 | S85-A87 PolarHBondContact O-N 3.09Å; S85-A87 PolarHBondContact OG-N 3.08Å; A87-M89 VanDerWaalsContact C-N 3.32Å; A87-T90 PolarHBondContact O-N 2.95Å; A87-T90 PolarHBondContact O-OG1 3.45Å; A87-D91 PolarHBondContact O-N 3.42Å |
| 88 | V | 77.4 | Confident | 82.1 | Confident | 11 Ų | 11 | 57.2 Ų | 57.2 | 7% | 0.067 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -67.9 | -37.3 | 175.1 | -171.7 | 0 | 0 | 0 | 0 | 110.2 | E76 S85 T90 D91 A92 V165 T169 | E76-V88 HydrophobicContact CB-CG1 4.26Å; E76-V88 VanDerWaalsContact O-CG1 3.24Å; E76-V88 WeakPolarHBondContact O-CG1 3.48Å; S85-V88 PolarHBondContact O-N 3.44Å; V88-T90 VanDerWaalsContact C-N 3.35Å; V88-T90 PolarHBondContact O-N 3.23Å; V88-D91 PolarHBondContact O-N 3.17Å; V88-A92 PolarHBondContact O-N 2.85Å; V88-V165 HydrophobicContact CG2-CG1 3.98Å; V88-T169 HydrophobicContact CB-CG2 4.24Å; V88-T169 HydrophobicContact CG1-CG2 4.31Å; V88-T169 HydrophobicContact CG2-CG2 3.49Å; V88-T169 VanDerWaalsContact CG2-CG2 3.49Å |
| 89 | M | 76.9 | Confident | 82.4 | Confident | 83 Ų | 83 | 56.3 Ų | 56.3 | 41% | 0.409 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -67 | -33.8 | 179.8 | -67.9 | -64.9 | -62.3 | 0 | 0 | 112.9 | S85 L86 A87 A93 | S85-M89 PolarHBondContact O-N 2.83Å; L86-M89 WeakPolarHBondContact O-CB 3.45Å; L86-M89 PolarHBondContact O-N 3.23Å; A87-M89 VanDerWaalsContact C-N 3.32Å; M89-A93 PolarHBondContact O-N 3.16Å; M89-A93 VanDerWaalsContact O-N 3.15Å |
| 90 | T | 78.4 | Confident | 82.9 | Confident | 65 Ų | 65 | 56.8 Ų | 56.8 | 40% | 0.399 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -69.2 | -34 | 173.9 | 49.3 | 0 | 0 | 0 | 0 | 112.5 | L86 A87 V88 A93 H94 | L86-T90 PolarHBondContact O-N 3.39Å; L86-T90 VanDerWaalsContact O-N 3.09Å; L86-T90 PolarHBondContact O-OG1 3.34Å; A87-T90 PolarHBondContact O-N 2.95Å; A87-T90 PolarHBondContact O-OG1 3.45Å; V88-T90 VanDerWaalsContact C-N 3.35Å; V88-T90 PolarHBondContact O-N 3.23Å; T90-A93 WeakPolarHBondContact O-CB 3.39Å; T90-A93 PolarHBondContact O-N 3.31Å; T90-H94 PolarHBondContact O-CD2 2.84Å; T90-H94 VanDerWaalsContact O-CD2 3.31Å; T90-H94 PolarHBondContact O-N 2.8Å |
| 91 | D | 81.3 | Confident | 83.3 | Confident | 35 Ų | 35 | 56.8 Ų | 56.8 | 19% | 0.187 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -68 | -42.9 | 175.5 | -156.3 | 29.4 | 0 | 0 | 0 | 111 | A87 V88 A93 H94 L95 | A87-D91 PolarHBondContact O-N 3.42Å; V88-D91 PolarHBondContact O-N 3.17Å; D91-A93 PolarHBondContact O-N 3.24Å; D91-H94 WeakPolarHBondContact O-CA 3.28Å; D91-H94 VanDerWaalsContact O-CB 3.31Å; D91-H94 WeakPolarHBondContact O-CB 3.4Å; D91-H94 PolarHBondContact O-N 3.44Å; D91-L95 PolarHBondContact O-N 3.42Å; D91-L95 VanDerWaalsContact O-N 3.08Å |
| 92 | A | 84.6 | Confident | 83.7 | Confident | 4 Ų | 4 | 47.7 Ų | 47.7 | 3% | 0.033 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.9 | -33.3 | 173 | 0 | 0 | 0 | 0 | 0 | 113.2 | E76 I77 V88 H94 L95 L96 | E76-A92 HydrophobicContact CB-CB 4.24Å; E76-A92 PolarHBondContact OE2-N 3.43Å; I77-A92 HydrophobicContact CD1-CB 4.49Å; I77-A92 HydrophobicContact CG1-CB 3.65Å; V88-A92 PolarHBondContact O-N 2.85Å; A92-H94 VanDerWaalsContact C-N 3.34Å; A92-L95 PolarHBondContact O-N 3.44Å; A92-L96 PolarHBondContact O-N 2.87Å |
| 93 | A | 84.4 | Confident | 84.2 | Confident | 53 Ų | 53 | 44.4 Ų | 44.4 | 44% | 0.438 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -68.1 | -32.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | M89 T90 D91 L96 T97 | M89-A93 PolarHBondContact O-N 3.16Å; M89-A93 VanDerWaalsContact O-N 3.15Å; T90-A93 WeakPolarHBondContact O-CB 3.39Å; T90-A93 PolarHBondContact O-N 3.31Å; D91-A93 PolarHBondContact O-N 3.24Å; A93-L96 WeakPolarHBondContact O-CB 3.42Å; A93-L96 PolarHBondContact O-N 3.19Å; A93-T97 PolarHBondContact O-N 3.19Å |
| 94 | H | 84.3 | Confident | 84.8 | Confident | 41 Ų | 41 | 43 Ų | 43 | 19% | 0.19 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.4 | -49.5 | 170.3 | -80.4 | -67.6 | 0 | 0 | 0 | 111.4 | T90 D91 A92 L96 T97 D98 L146 | T90-H94 PolarHBondContact O-CD2 2.84Å; T90-H94 VanDerWaalsContact O-CD2 3.31Å; T90-H94 PolarHBondContact O-N 2.8Å; D91-H94 WeakPolarHBondContact O-CA 3.28Å; D91-H94 VanDerWaalsContact O-CB 3.31Å; D91-H94 WeakPolarHBondContact O-CB 3.4Å; D91-H94 PolarHBondContact O-N 3.44Å; A92-H94 VanDerWaalsContact C-N 3.34Å; H94-L96 PolarHBondContact O-N 3.43Å; H94-L96 VanDerWaalsContact O-N 3.14Å; H94-T97 WeakPolarHBondContact O-CA 3.22Å; H94-T97 PolarHBondContact O-N 3.39Å; H94-T97 PolarHBondContact O-OG1 2.92Å; H94-D98 VanDerWaalsContact O-CG 3.31Å; H94-D98 PolarHBondContact O-N 3.4Å; H94-L146 VanDerWaalsContact CE1-CD2 3.49Å; H94-L146 WeakPolarHBondContact CE1-CD2 3.41Å; H94-L146 VanDerWaalsContact NE2-CD2 3.29Å; H94-L146 WeakPolarHBondContact NE2-CD2 3.31Å |
| 95 | L | 89.4 | Confident | 85.6 | Confident | 6 Ų | 6 | 39.7 Ų | 39.7 | 3% | 0.031 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -58.2 | -31.5 | 177.3 | -66.7 | -176.8 | 0 | 0 | 0 | 113 | C69 F72 M73 E76 D91 A92 D98 L99 | C69-L95 PolarHBondContact SG-O 2.98Å; C69-L95 VanDerWaalsContact SG-O 3.38Å; F72-L95 HydrophobicContact CB-CD1 4.09Å; M73-L95 HydrophobicContact CB-CB 4.02Å; M73-L95 HydrophobicContact CB-CD1 4.18Å; M73-L95 HydrophobicContact CG-CB 4.23Å; E76-L95 HydrophobicContact CG-CD1 4.45Å; E76-L95 WeakPolarHBondContact OE2-CD1 3.42Å; D91-L95 PolarHBondContact O-N 3.42Å; D91-L95 VanDerWaalsContact O-N 3.08Å; A92-L95 PolarHBondContact O-N 3.44Å; L95-D98 PolarHBondContact O-N 3.16Å; L95-L99 WeakPolarHBondContact O-CB 3.44Å; L95-L99 PolarHBondContact O-N 3.14Å |
| 96 | L | 90.5 | Very high | 86.3 | Confident | 98 Ų | 98 | 40.5 Ų | 40.5 | 51% | 0.513 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64 | -42.4 | 173 | 178.4 | 63.7 | 0 | 0 | 0 | 112 | M73 A92 A93 H94 D98 L99 A100 | M73-L96 HydrophobicContact SD-CB 3.93Å; M73-L96 HydrophobicContact SD-CD1 4.01Å; A92-L96 PolarHBondContact O-N 2.87Å; A93-L96 WeakPolarHBondContact O-CB 3.42Å; A93-L96 PolarHBondContact O-N 3.19Å; H94-L96 PolarHBondContact O-N 3.43Å; H94-L96 VanDerWaalsContact O-N 3.14Å; L96-D98 VanDerWaalsContact C-N 3.28Å; L96-D98 PolarHBondContact O-N 3.2Å; L96-L99 PolarHBondContact O-N 2.81Å; L96-A100 WeakPolarHBondContact O-CB 3.48Å; L96-A100 PolarHBondContact O-N 2.98Å |
| 97 | T | 89.7 | Confident | 87.3 | Confident | 37 Ų | 37 | 39.6 Ų | 39.6 | 23% | 0.227 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -67.5 | -30.9 | 177 | 59.1 | 0 | 0 | 0 | 0 | 112.4 | A93 H94 S101 V142 | A93-T97 PolarHBondContact O-N 3.19Å; H94-T97 WeakPolarHBondContact O-CA 3.22Å; H94-T97 PolarHBondContact O-N 3.39Å; H94-T97 PolarHBondContact O-OG1 2.92Å; T97-S101 PolarHBondContact O-N 3.3Å; T97-S101 PolarHBondContact O-OG 3.38Å; T97-V142 HydrophobicContact CG2-CG2 3.87Å |
| 98 | D | 90.4 | Very high | 88.3 | Confident | 4 Ų | 4 | 37.6 Ų | 37.6 | 2% | 0.021 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -69.9 | -48 | 175.4 | -54.2 | -18.8 | 0 | 0 | 0 | 110.3 | H94 L95 L96 A100 S101 F102 H224 | H94-D98 VanDerWaalsContact O-CG 3.31Å; H94-D98 PolarHBondContact O-N 3.4Å; L95-D98 PolarHBondContact O-N 3.16Å; L96-D98 VanDerWaalsContact C-N 3.28Å; L96-D98 PolarHBondContact O-N 3.2Å; D98-A100 VanDerWaalsContact C-N 3.29Å; D98-A100 PolarHBondContact O-N 2.73Å; D98-S101 WeakPolarHBondContact O-CB 3.47Å; D98-S101 PolarHBondContact O-N 3.4Å; D98-F102 HydrophobicContact CB-CE2 3.98Å; D98-F102 HydrophobicContact CB-CZ 4.23Å; D98-F102 WeakPolarHBondContact O-CD2 3.49Å; D98-F102 WeakPolarHBondContact O-CG 3.48Å; D98-F102 PolarHBondContact O-N 2.77Å; D98-H224 IonicContact OD1-CD2 3.16Å; D98-H224 IonicContact OD1-CE1 3.85Å; D98-H224 IonicContact OD1-NE2 3.49Å; D98-H224 PolarHBondContact OD1-NE2 3.35Å |
| 99 | L | 93 | Very high | 89 | Confident | 28 Ų | 28 | 37.2 Ų | 37.2 | 15% | 0.147 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -56.6 | -45.1 | 174.5 | -178.9 | 61.7 | 0 | 0 | 0 | 111.2 | L70 M73 L95 L96 S101 F102 V103 | L70-L99 HydrophobicContact CB-CD2 4.46Å; L70-L99 HydrophobicContact CD1-CD2 4.07Å; M73-L99 HydrophobicContact CE-CD2 3.75Å; M73-L99 HydrophobicContact SD-CD2 4.42Å; L95-L99 WeakPolarHBondContact O-CB 3.44Å; L95-L99 PolarHBondContact O-N 3.14Å; L96-L99 PolarHBondContact O-N 2.81Å; L99-S101 VanDerWaalsContact C-N 3.31Å; L99-S101 PolarHBondContact O-N 3.34Å; L99-F102 PolarHBondContact O-N 2.7Å; L99-V103 HydrophobicContact CD1-CG2 4.38Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.45Å; L99-V103 PolarHBondContact O-N 3.16Å |
| 100 | A | 92.5 | Very high | 89.7 | Confident | 44 Ų | 44 | 40 Ų | 40 | 36% | 0.364 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -58.7 | -43 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L96 D98 F102 V103 I104 | L96-A100 WeakPolarHBondContact O-CB 3.48Å; L96-A100 PolarHBondContact O-N 2.98Å; D98-A100 VanDerWaalsContact C-N 3.29Å; D98-A100 PolarHBondContact O-N 2.73Å; A100-F102 PolarHBondContact O-N 3.25Å; A100-V103 PolarHBondContact O-N 3.17Å; A100-I104 WeakPolarHBondContact O-CD1 3.46Å; A100-I104 VanDerWaalsContact O-CG1 3.25Å; A100-I104 WeakPolarHBondContact O-CG1 3.41Å; A100-I104 PolarHBondContact O-N 3.4Å |
| 101 | S | 91.4 | Very high | 90.4 | Very high | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.007 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.3 | -37.7 | 178.2 | -62.4 | 0 | 0 | 0 | 0 | 112.8 | T97 D98 L99 S105 | T97-S101 PolarHBondContact O-N 3.3Å; T97-S101 PolarHBondContact O-OG 3.38Å; D98-S101 WeakPolarHBondContact O-CB 3.47Å; D98-S101 PolarHBondContact O-N 3.4Å; L99-S101 VanDerWaalsContact C-N 3.31Å; L99-S101 PolarHBondContact O-N 3.34Å; S101-S105 PolarHBondContact O-N 3.13Å; S101-S105 PolarHBondContact O-OG 3.39Å |
| 102 | F | 92.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -69.3 | -39.1 | 173.4 | -55.1 | -38.9 | 0 | 0 | 0 | 112.6 | L62 V65 S66 C69 D98 L99 A100 S105 L106 M180 A221 V225 | L62-F102 HydrophobicContact CD2-CD1 4.43Å; V65-F102 HydrophobicContact CG1-CD1 4.41Å; V65-F102 HydrophobicContact CG1-CD2 3.91Å; V65-F102 HydrophobicContact CG1-CE1 4.15Å; V65-F102 HydrophobicContact CG1-CE2 3.61Å; V65-F102 HydrophobicContact CG1-CG 4.33Å; V65-F102 HydrophobicContact CG1-CZ 3.76Å; S66-F102 VanDerWaalsContact OG-CB 3.25Å; S66-F102 WeakPolarHBondContact OG-CB 3.47Å; C69-F102 HydrophobicContact CB-CD2 4.32Å; C69-F102 HydrophobicContact CB-CE2 4.13Å; D98-F102 HydrophobicContact CB-CE2 3.98Å; D98-F102 HydrophobicContact CB-CZ 4.23Å; D98-F102 WeakPolarHBondContact O-CD2 3.49Å; D98-F102 WeakPolarHBondContact O-CG 3.48Å; D98-F102 PolarHBondContact O-N 2.77Å; L99-F102 PolarHBondContact O-N 2.7Å; A100-F102 PolarHBondContact O-N 3.25Å; F102-S105 WeakPolarHBondContact O-CB 3.34Å; F102-S105 PolarHBondContact O-N 3.38Å; F102-L106 PolarHBondContact O-N 3.47Å; F102-M180 HydrophobicContact CE2-SD 4.16Å; F102-A221 HydrophobicContact CD1-CB 4.07Å; F102-A221 HydrophobicContact CE1-CB 4.21Å; F102-V225 HydrophobicContact CE1-CG2 3.59Å; F102-V225 HydrophobicContact CZ-CG2 3.39Å |
| 103 | V | 93.3 | Very high | 90.9 | Very high | 79 Ų | 79 | 39.8 Ų | 39.8 | 48% | 0.479 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -63.8 | -42.8 | 175.6 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | L99 A100 S105 L106 F107 | L99-V103 HydrophobicContact CD1-CG2 4.38Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.45Å; L99-V103 PolarHBondContact O-N 3.16Å; A100-V103 PolarHBondContact O-N 3.17Å; V103-S105 VanDerWaalsContact C-N 3.3Å; V103-S105 PolarHBondContact O-N 3.41Å; V103-L106 PolarHBondContact O-N 3.41Å; V103-F107 WeakPolarHBondContact O-CB 3.15Å; V103-F107 PolarHBondContact O-N 2.9Å |
| 104 | I | 93.1 | Very high | 91.1 | Very high | 40 Ų | 40 | 41.1 Ų | 41.1 | 21% | 0.205 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -57.4 | -45.3 | 172.3 | -71.5 | 161.7 | 0 | 0 | 0 | 110.4 | A100 F107 S108 L134 | A100-I104 WeakPolarHBondContact O-CD1 3.46Å; A100-I104 VanDerWaalsContact O-CG1 3.25Å; A100-I104 WeakPolarHBondContact O-CG1 3.41Å; A100-I104 PolarHBondContact O-N 3.4Å; I104-F107 PolarHBondContact O-N 2.92Å; I104-S108 WeakPolarHBondContact O-CB 3.49Å; I104-S108 PolarHBondContact O-N 3.25Å; I104-L134 HydrophobicContact CD1-CD2 3.83Å; I104-L134 HydrophobicContact CD1-CG 4.08Å; I104-L134 HydrophobicContact CG1-CD2 4.12Å; I104-L134 HydrophobicContact CG2-CB 4.29Å; I104-L134 HydrophobicContact CG2-CD2 3.9Å; I104-L134 HydrophobicContact CG2-CG 4.31Å |
| 105 | S | 92 | Very high | 91.3 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.9 | -44.9 | 178.2 | -66 | 0 | 0 | 0 | 0 | 112.3 | S101 F102 V103 S108 L109 | S101-S105 PolarHBondContact O-N 3.13Å; S101-S105 PolarHBondContact O-OG 3.39Å; F102-S105 WeakPolarHBondContact O-CB 3.34Å; F102-S105 PolarHBondContact O-N 3.38Å; V103-S105 VanDerWaalsContact C-N 3.3Å; V103-S105 PolarHBondContact O-N 3.41Å; S105-S108 PolarHBondContact O-N 2.83Å; S105-S108 PolarHBondContact O-OG 3.29Å; S105-L109 WeakPolarHBondContact O-CG 3.39Å; S105-L109 PolarHBondContact O-N 3.27Å |
| 106 | L | 92.8 | Very high | 91.2 | Very high | 36 Ų | 36 | 48.2 Ų | 48.2 | 19% | 0.188 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.5 | -44.3 | 175.1 | -78.2 | 170.3 | 0 | 0 | 0 | 112.1 | L62 F102 V103 S108 L109 W110 | L62-L106 HydrophobicContact CB-CD2 3.61Å; L62-L106 HydrophobicContact CB-CG 3.89Å; L62-L106 HydrophobicContact CD1-CD2 4.5Å; F102-L106 PolarHBondContact O-N 3.47Å; V103-L106 PolarHBondContact O-N 3.41Å; L106-S108 VanDerWaalsContact C-N 3.33Å; L106-S108 PolarHBondContact O-N 2.91Å; L106-L109 PolarHBondContact O-N 2.92Å; L106-W110 WeakPolarHBondContact O-CB 3.46Å; L106-W110 PolarHBondContact O-N 2.89Å |
| 107 | F | 94.1 | Very high | 91.2 | Very high | 121 Ų | 121 | 46.5 Ų | 46.5 | 53% | 0.531 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 177 | 179.9 | -105.5 | 0 | 0 | 0 | 111.3 | V103 I104 L109 W110 L111 | V103-F107 WeakPolarHBondContact O-CB 3.15Å; V103-F107 PolarHBondContact O-N 2.9Å; I104-F107 PolarHBondContact O-N 2.92Å; F107-L109 PolarHBondContact O-N 2.99Å; F107-W110 HydrophobicContact CD2-CE3 4.08Å; F107-W110 HydrophobicContact CD2-CZ3 4.39Å; F107-W110 AromaticContact CE2-CE3 3.9Å; F107-W110 HydrophobicContact CE2-CE3 3.9Å; F107-W110 AromaticContact CE2-CZ3 3.77Å; F107-W110 HydrophobicContact CE2-CZ3 3.77Å; F107-W110 HydrophobicContact CZ-CZ3 4.47Å; F107-W110 PolarHBondContact O-N 3.25Å; F107-L111 HydrophobicContact CE1-CD2 4.29Å; F107-L111 WeakPolarHBondContact O-CB 3.28Å; F107-L111 PolarHBondContact O-N 3.03Å |
| 108 | S | 93.6 | Very high | 91.2 | Very high | 4 Ų | 4 | 54 Ų | 54 | 3% | 0.028 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.7 | -42.6 | 176.7 | 78 | 0 | 0 | 0 | 0 | 112.4 | I104 S105 L106 L111 S112 A127 S217 | I104-S108 WeakPolarHBondContact O-CB 3.49Å; I104-S108 PolarHBondContact O-N 3.25Å; S105-S108 PolarHBondContact O-N 2.83Å; S105-S108 PolarHBondContact O-OG 3.29Å; L106-S108 VanDerWaalsContact C-N 3.33Å; L106-S108 PolarHBondContact O-N 2.91Å; S108-L111 PolarHBondContact O-N 3.19Å; S108-S112 PolarHBondContact O-N 2.83Å; S108-S112 PolarHBondContact O-OG 3.44Å; S108-A127 WeakPolarHBondContact CB-O 3.33Å; S108-S217 PolarHBondContact OG-OG 3Å |
| 109 | L | 91 | Very high | 91.2 | Very high | 3 Ų | 3 | 65.1 Ų | 65.1 | 2% | 0.016 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -67.5 | -40.2 | 176.6 | -75.4 | 173 | 0 | 0 | 0 | 112.1 | K55 A58 L62 S105 L106 F107 L111 S112 S113 E128 | K55-L109 WeakPolarHBondContact CE-O 3.45Å; K55-L109 HydrophobicContact CG-CD2 4.43Å; K55-L109 PolarHBondContact NZ-O 3.37Å; A58-L109 HydrophobicContact CB-CD1 4.3Å; L62-L109 HydrophobicContact CD1-CD1 3.4Å; L62-L109 VanDerWaalsContact CD1-CD1 3.4Å; S105-L109 WeakPolarHBondContact O-CG 3.39Å; S105-L109 PolarHBondContact O-N 3.27Å; L106-L109 PolarHBondContact O-N 2.92Å; F107-L109 PolarHBondContact O-N 2.99Å; L109-L111 VanDerWaalsContact C-N 3.34Å; L109-S112 WeakPolarHBondContact CA-OG 3.16Å; L109-S112 PolarHBondContact O-OG 3.35Å; L109-S113 PolarHBondContact O-N 2.9Å; L109-E128 HydrophobicContact CD2-CG 4.14Å |
| 110 | W | 92.2 | Very high | 91.1 | Very high | 140 Ų | 140 | 67 Ų | 67 | 53% | 0.53 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.8 | -44.8 | 173.9 | 173.5 | 81.6 | 0 | 0 | 0 | 110.6 | L106 F107 S112 S113 K114 | L106-W110 WeakPolarHBondContact O-CB 3.46Å; L106-W110 PolarHBondContact O-N 2.89Å; F107-W110 HydrophobicContact CD2-CE3 4.08Å; F107-W110 HydrophobicContact CD2-CZ3 4.39Å; F107-W110 AromaticContact CE2-CE3 3.9Å; F107-W110 HydrophobicContact CE2-CE3 3.9Å; F107-W110 AromaticContact CE2-CZ3 3.77Å; F107-W110 HydrophobicContact CE2-CZ3 3.77Å; F107-W110 HydrophobicContact CZ-CZ3 4.47Å; F107-W110 PolarHBondContact O-N 3.25Å; W110-S112 PolarHBondContact O-N 3.31Å; W110-S113 WeakPolarHBondContact O-CB 3.44Å; W110-S113 PolarHBondContact O-N 3.2Å; W110-S113 PolarHBondContact O-OG 3Å; W110-K114 VanDerWaalsContact CZ3-CE 3.49Å |
| 111 | L | 92.4 | Very high | 90.9 | Very high | 28 Ų | 28 | 69.4 Ų | 69.4 | 15% | 0.147 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.3 | -43.4 | -179.8 | -170.7 | 56.6 | 0 | 0 | 0 | 111.3 | F107 S108 L109 S113 K114 W124 A127 | F107-L111 HydrophobicContact CE1-CD2 4.29Å; F107-L111 WeakPolarHBondContact O-CB 3.28Å; F107-L111 PolarHBondContact O-N 3.03Å; S108-L111 PolarHBondContact O-N 3.19Å; L109-L111 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 2.73Å; L111-S113 VanDerWaalsContact O-N 3.14Å; L111-K114 HydrophobicContact CD1-CD 4Å; L111-K114 WeakPolarHBondContact O-CB 3.42Å; L111-K114 WeakPolarHBondContact O-CG 3.37Å; L111-K114 PolarHBondContact O-N 3.32Å; L111-W124 HydrophobicContact CD1-CD2 3.88Å; L111-W124 HydrophobicContact CD1-CE3 3.55Å; L111-W124 HydrophobicContact CD1-CH2 4.27Å; L111-W124 HydrophobicContact CD1-CZ3 3.76Å; L111-W124 HydrophobicContact CD2-CE3 3.73Å; L111-W124 HydrophobicContact CD2-CZ3 3.81Å; L111-W124 HydrophobicContact CG-CD2 4.08Å; L111-W124 HydrophobicContact CG-CE3 3.47Å; L111-W124 VanDerWaalsContact CG-CE3 3.47Å; L111-W124 HydrophobicContact CG-CZ3 3.96Å; L111-W124 WeakPolarHBondContact O-CB 3.43Å; L111-A127 HydrophobicContact CB-CB 4.04Å; L111-A127 HydrophobicContact CD2-CB 3.83Å; L111-A127 HydrophobicContact CG-CB 3.9Å |
| 112 | S | 90 | Very high | 90.7 | Very high | 2 Ų | 2 | 74.6 Ų | 74.6 | 1% | 0.014 | 37% | 0.373 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69 | -7.4 | 176 | 68.3 | 0 | 0 | 0 | 0 | 114.1 | K55 S108 L109 W110 W124 E128 | K55-S112 PolarHBondContact NZ-O 3.31Å; K55-S112 VanDerWaalsContact NZ-O 3.13Å; K55-S112 PolarHBondContact NZ-OG 3.2Å; S108-S112 PolarHBondContact O-N 2.83Å; S108-S112 PolarHBondContact O-OG 3.44Å; L109-S112 WeakPolarHBondContact CA-OG 3.16Å; L109-S112 PolarHBondContact O-OG 3.35Å; W110-S112 PolarHBondContact O-N 3.31Å; S112-W124 WeakPolarHBondContact CA-O 3.41Å; S112-W124 WeakPolarHBondContact CB-O 3.48Å; S112-E128 WeakPolarHBondContact CB-OE1 3.39Å; S112-E128 VanDerWaalsContact OG-CG 3.28Å; S112-E128 WeakPolarHBondContact OG-CG 3.35Å; S112-E128 PolarHBondContact OG-OE1 2.92Å |
| 113 | S | 87.3 | Confident | 90.6 | Very high | 71 Ų | 71 | 75.2 Ų | 75.2 | 50% | 0.497 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | -9 | 175.9 | 76 | 0 | 0 | 0 | 0 | 113 | K55 L109 W110 L111 | K55-S113 VanDerWaalsContact NZ-CA 3.26Å; L109-S113 PolarHBondContact O-N 2.9Å; W110-S113 WeakPolarHBondContact O-CB 3.44Å; W110-S113 PolarHBondContact O-N 3.2Å; W110-S113 PolarHBondContact O-OG 3Å; L111-S113 PolarHBondContact O-N 2.73Å; L111-S113 VanDerWaalsContact O-N 3.14Å |
| 114 | K | 89.1 | Confident | 90.6 | Very high | 81 Ų | 81 | 75.6 Ų | 75.6 | 35% | 0.352 | 37% | 0.373 | S | S | . | . | S | Bend | trans | -67.6 | 148.2 | -179.5 | -68.9 | -163 | -179.3 | -169.6 | 0 | 111.5 | W110 L111 W124 | W110-K114 VanDerWaalsContact CZ3-CE 3.49Å; L111-K114 HydrophobicContact CD1-CD 4Å; L111-K114 WeakPolarHBondContact O-CB 3.42Å; L111-K114 WeakPolarHBondContact O-CG 3.37Å; L111-K114 PolarHBondContact O-N 3.32Å; K114-W124 HydrophobicContact CB-CG 4.27Å |
| 115 | P | 86.6 | Confident | 90.4 | Very high | 105 Ų | 105 | 76.8 Ų | 76.8 | 68% | 0.682 | 38% | 0.376 | S | S | * | . | P | Polyproline II helix | trans | -62.2 | 155.5 | 176.1 | 27.6 | -35.3 | 0 | 0 | 0 | 111.5 | ||
| 116 | V | 88.3 | Confident | 90.4 | Very high | 90 Ų | 90 | 80.3 Ų | 80.3 | 55% | 0.545 | 39% | 0.389 | S | S | . | . | P | Polyproline II helix | trans | -61 | 149.7 | 174.2 | -59.2 | 0 | 0 | 0 | 0 | 111 | ||
| 117 | T | 89.8 | Confident | 90.4 | Very high | 63 Ų | 63 | 79.1 Ų | 79.1 | 39% | 0.387 | 38% | 0.384 | S | S | . | . | trans | -131 | 164.7 | 178.8 | 64.8 | 0 | 0 | 0 | 0 | 109.6 | R119 L120 S121 | T117-R119 PolarHBondContact O-N 3.39Å; T117-L120 PolarHBondContact N-O 2.97Å; T117-L120 CarbonylContact O-C 2.99Å; T117-L120 PolarHBondContact O-N 3.28Å; T117-L120 VanDerWaalsContact O-N 3.15Å; T117-L120 PolarHBondContact OG1-N 3.21Å; T117-S121 WeakPolarHBondContact O-CA 3.2Å; T117-S121 PolarHBondContact O-N 3.27Å | ||
| 118 | Q | 89.5 | Confident | 90.3 | Very high | 193 Ų | 193 | 74 Ų | 74 | 90% | 0.902 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -62.8 | -31 | 178.6 | -70.5 | 179.6 | -18.9 | 0 | 0 | 113.3 | ||
| 119 | R | 90.9 | Very high | 90.2 | Very high | 239 Ų | 239 | 73.8 Ų | 73.8 | 90% | 0.902 | 36% | 0.361 | S | S | * | . | S | Bend | trans | -76.5 | -30.1 | 175.7 | -67.4 | -174.7 | 179.9 | -178.8 | -0.5 | 112.9 | T117 | T117-R119 PolarHBondContact O-N 3.39Š|
| 120 | L | 90.6 | Very high | 90.4 | Very high | 68 Ų | 68 | 78.2 Ų | 78.2 | 36% | 0.356 | 38% | 0.384 | S | S | . | . | S | Bend | trans | -123.8 | 77.6 | 179.4 | -62.3 | 173 | 0 | 0 | 0 | 108.3 | T117 Y122 G123 W124 | T117-L120 PolarHBondContact N-O 2.97Å; T117-L120 CarbonylContact O-C 2.99Å; T117-L120 PolarHBondContact O-N 3.28Å; T117-L120 VanDerWaalsContact O-N 3.15Å; T117-L120 PolarHBondContact OG1-N 3.21Å; L120-Y122 VanDerWaalsContact C-N 3.32Å; L120-Y122 PolarHBondContact O-N 2.89Å; L120-G123 WeakPolarHBondContact O-CA 3.45Å; L120-G123 PolarHBondContact O-N 3.22Å; L120-W124 HydrophobicContact CD1-CD2 3.61Å; L120-W124 HydrophobicContact CD1-CE3 3.96Å; L120-W124 HydrophobicContact CD1-CG 4.21Å; L120-W124 HydrophobicContact CD1-CH2 3.86Å; L120-W124 HydrophobicContact CD1-CZ2 3.48Å; L120-W124 VanDerWaalsContact CD1-CZ2 3.48Å; L120-W124 HydrophobicContact CD1-CZ3 4.08Å |
| 121 | S | 89 | Confident | 90.4 | Very high | 93 Ų | 93 | 71.9 Ų | 71.9 | 65% | 0.65 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -35.2 | -170.9 | -40.8 | 0 | 0 | 0 | 0 | 112.6 | T117 G123 | T117-S121 WeakPolarHBondContact O-CA 3.2Å; T117-S121 PolarHBondContact O-N 3.27Å; S121-G123 VanDerWaalsContact C-N 3.27Å |
| 122 | Y | 87.3 | Confident | 90.4 | Very high | 110 Ų | 110 | 70.6 Ų | 70.6 | 43% | 0.431 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | -6.9 | 170.4 | -72.9 | -66.4 | 0 | 0 | 0 | 113.3 | L120 Y125 L312 | L120-Y122 VanDerWaalsContact C-N 3.32Å; L120-Y122 PolarHBondContact O-N 2.89Å; Y122-Y125 WeakPolarHBondContact O-CD2 3.42Å; Y122-Y125 WeakPolarHBondContact O-CE2 3.36Å; Y122-L312 HydrophobicContact CD1-CD1 3.95Å; Y122-L312 HydrophobicContact CD2-CD2 4.49Å; Y122-L312 HydrophobicContact CG-CD1 4.25Å; Y122-L312 HydrophobicContact CG-CD2 4.17Å |
| 123 | G | 91 | Very high | 90.6 | Very high | 14 Ų | 14 | 71.6 Ų | 71.6 | 14% | 0.144 | 36% | 0.36 | C | S | . | . | trans | 85.7 | -169 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | L120 S121 Y125 | L120-G123 WeakPolarHBondContact O-CA 3.45Å; L120-G123 PolarHBondContact O-N 3.22Å; S121-G123 VanDerWaalsContact C-N 3.27Å; G123-Y125 VanDerWaalsContact C-N 3.32Å; G123-Y125 PolarHBondContact O-N 2.91Å | ||
| 124 | W | 91.6 | Very high | 90.9 | Very high | 87 Ų | 87 | 72.6 Ų | 72.6 | 33% | 0.33 | 36% | 0.36 | S | S | . | . | S | Bend | trans | -91.1 | 16.6 | -172.2 | -70.5 | 87.1 | 0 | 0 | 0 | 113.8 | L111 S112 K114 L120 R126 A127 | L111-W124 HydrophobicContact CD1-CD2 3.88Å; L111-W124 HydrophobicContact CD1-CE3 3.55Å; L111-W124 HydrophobicContact CD1-CH2 4.27Å; L111-W124 HydrophobicContact CD1-CZ3 3.76Å; L111-W124 HydrophobicContact CD2-CE3 3.73Å; L111-W124 HydrophobicContact CD2-CZ3 3.81Å; L111-W124 HydrophobicContact CG-CD2 4.08Å; L111-W124 HydrophobicContact CG-CE3 3.47Å; L111-W124 VanDerWaalsContact CG-CE3 3.47Å; L111-W124 HydrophobicContact CG-CZ3 3.96Å; L111-W124 WeakPolarHBondContact O-CB 3.43Å; S112-W124 WeakPolarHBondContact CA-O 3.41Å; S112-W124 WeakPolarHBondContact CB-O 3.48Å; K114-W124 HydrophobicContact CB-CG 4.27Å; L120-W124 HydrophobicContact CD1-CD2 3.61Å; L120-W124 HydrophobicContact CD1-CE3 3.96Å; L120-W124 HydrophobicContact CD1-CG 4.21Å; L120-W124 HydrophobicContact CD1-CH2 3.86Å; L120-W124 HydrophobicContact CD1-CZ2 3.48Å; L120-W124 VanDerWaalsContact CD1-CZ2 3.48Å; L120-W124 HydrophobicContact CD1-CZ3 4.08Å; W124-R126 VanDerWaalsContact C-N 3.32Å; W124-R126 PolarHBondContact O-N 3.35Å; W124-A127 WeakPolarHBondContact O-CB 3.47Å; W124-A127 PolarHBondContact O-N 3.47Å |
| 125 | Y | 89.1 | Confident | 91 | Very high | 65 Ų | 65 | 68.8 Ų | 68.8 | 26% | 0.255 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -39.1 | -172.3 | -59.4 | -61.1 | 0 | 0 | 0 | 113.6 | Y122 G123 A127 E128 L312 T313 H349 | Y122-Y125 WeakPolarHBondContact O-CD2 3.42Å; Y122-Y125 WeakPolarHBondContact O-CE2 3.36Å; G123-Y125 VanDerWaalsContact C-N 3.32Å; G123-Y125 PolarHBondContact O-N 2.91Å; Y125-A127 PolarHBondContact O-N 3.43Å; Y125-A127 VanDerWaalsContact O-N 3.09Å; Y125-E128 PolarHBondContact O-N 3.29Å; Y125-L312 HydrophobicContact CD2-CD1 4.39Å; Y125-T313 WeakPolarHBondContact O-CG2 3.3Å; Y125-H349 AromaticContact CE2-NE2 3.63Å |
| 126 | R | 92.2 | Very high | 91.2 | Very high | 73 Ų | 73 | 63.9 Ų | 63.9 | 28% | 0.275 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -13.5 | 176.9 | -74.2 | -174.1 | 176.1 | 173.3 | 4.6 | 113.8 | W124 E128 I129 L130 E280 L312 | W124-R126 VanDerWaalsContact C-N 3.32Å; W124-R126 PolarHBondContact O-N 3.35Å; R126-E128 PolarHBondContact O-N 2.92Å; R126-I129 WeakPolarHBondContact O-CB 3.33Å; R126-I129 PolarHBondContact O-N 3.42Å; R126-I129 VanDerWaalsContact O-N 3.08Å; R126-L130 PolarHBondContact O-N 3Å; R126-E280 IonicContact CZ-OE1 3.98Å; R126-E280 IonicContact NH1-OE1 3.66Å; R126-E280 PolarHBondContact NH1-OE1 3.32Å; R126-E280 VanDerWaalsContact NH1-OE1 3.16Å; R126-E280 IonicContact NH2-OE1 2.74Å; R126-E280 PolarHBondContact NH2-OE1 3.43Å; R126-L312 VanDerWaalsContact CG-O 3.32Å; R126-L312 WeakPolarHBondContact CG-O 3.5Å |
| 127 | A | 92.6 | Very high | 91.5 | Very high | 12 Ų | 12 | 63.6 Ų | 63.6 | 10% | 0.099 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.6 | -32.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S108 L111 W124 Y125 I129 L130 G131 | S108-A127 WeakPolarHBondContact CB-O 3.33Å; L111-A127 HydrophobicContact CB-CB 4.04Å; L111-A127 HydrophobicContact CD2-CB 3.83Å; L111-A127 HydrophobicContact CG-CB 3.9Å; W124-A127 WeakPolarHBondContact O-CB 3.47Å; W124-A127 PolarHBondContact O-N 3.47Å; Y125-A127 PolarHBondContact O-N 3.43Å; Y125-A127 VanDerWaalsContact O-N 3.09Å; A127-I129 VanDerWaalsContact C-N 3.33Å; A127-L130 PolarHBondContact O-N 3.32Å; A127-G131 PolarHBondContact O-N 2.89Å |
| 128 | E | 91.6 | Very high | 91.5 | Very high | 13 Ų | 13 | 61.9 Ų | 61.9 | 6% | 0.061 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.7 | -40.5 | 175 | -67.3 | 179.7 | -168.3 | 0 | 0 | 111.9 | K55 L109 S112 Y125 R126 G131 A132 S217 | K55-E128 IonicContact NZ-OE1 3.76Å; L109-E128 HydrophobicContact CD2-CG 4.14Å; S112-E128 WeakPolarHBondContact CB-OE1 3.39Å; S112-E128 VanDerWaalsContact OG-CG 3.28Å; S112-E128 WeakPolarHBondContact OG-CG 3.35Å; S112-E128 PolarHBondContact OG-OE1 2.92Å; Y125-E128 PolarHBondContact O-N 3.29Å; R126-E128 PolarHBondContact O-N 2.92Å; E128-G131 PolarHBondContact O-N 3.03Å; E128-A132 VanDerWaalsContact O-CB 3.32Å; E128-A132 WeakPolarHBondContact O-CB 2.93Å; E128-A132 PolarHBondContact O-N 2.69Å; E128-S217 PolarHBondContact O-OG 3.35Å |
| 129 | I | 92.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -68.3 | -42.8 | 179.7 | -53.7 | -58.6 | 0 | 0 | 0 | 110.1 | R126 A127 A132 L133 A216 I274 V277 L278 M314 | R126-I129 WeakPolarHBondContact O-CB 3.33Å; R126-I129 PolarHBondContact O-N 3.42Å; R126-I129 VanDerWaalsContact O-N 3.08Å; A127-I129 VanDerWaalsContact C-N 3.33Å; I129-A132 PolarHBondContact O-N 3.1Å; I129-L133 WeakPolarHBondContact O-CB 2.96Å; I129-L133 PolarHBondContact O-N 2.96Å; I129-A216 HydrophobicContact CD1-CB 3.64Å; I129-I274 HydrophobicContact CG2-CB 4.44Å; I129-I274 HydrophobicContact CG2-CG2 3.69Å; I129-V277 HydrophobicContact CD1-CG1 4.16Å; I129-V277 HydrophobicContact CG1-CG1 3.95Å; I129-V277 HydrophobicContact CG2-CB 4.41Å; I129-V277 HydrophobicContact CG2-CG1 4.31Å; I129-L278 HydrophobicContact CB-CD2 4.49Å; I129-L278 HydrophobicContact CG2-CD1 4.41Å; I129-L278 HydrophobicContact CG2-CD2 3.83Å; I129-L278 HydrophobicContact CG2-CG 3.83Å; I129-M314 HydrophobicContact CD1-CG 4.48Å; I129-M314 HydrophobicContact CD1-SD 4.25Å |
| 130 | L | 93.8 | Very high | 91.6 | Very high | 96 Ų | 96 | 45.9 Ų | 45.9 | 50% | 0.503 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -66 | -39.7 | 175.6 | -66.1 | 174.8 | 0 | 0 | 0 | 112.5 | R126 A127 L133 L134 L278 | R126-L130 PolarHBondContact O-N 3Å; A127-L130 PolarHBondContact O-N 3.32Å; L130-L133 WeakPolarHBondContact O-CB 3.49Å; L130-L133 PolarHBondContact O-N 2.81Å; L130-L134 PolarHBondContact O-N 3Å; L130-L278 HydrophobicContact CD2-CD1 4.47Å; L130-L278 HydrophobicContact CD2-CD2 4.1Å |
| 131 | G | 93.4 | Very high | 91.7 | Very high | 7 Ų | 7 | 48.1 Ų | 48.1 | 7% | 0.072 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.4 | -46.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | A127 E128 L133 L134 S135 | A127-G131 PolarHBondContact O-N 2.89Å; E128-G131 PolarHBondContact O-N 3.03Å; G131-L133 VanDerWaalsContact C-N 3.33Å; G131-L133 PolarHBondContact O-N 3.09Å; G131-L134 PolarHBondContact O-N 3.48Å; G131-S135 PolarHBondContact O-N 2.9Å; G131-S135 PolarHBondContact O-OG 3.33Å |
| 132 | A | 91.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.4 | -41.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | E128 I129 S135 V136 A216 A220 I274 | E128-A132 VanDerWaalsContact O-CB 3.32Å; E128-A132 WeakPolarHBondContact O-CB 2.93Å; E128-A132 PolarHBondContact O-N 2.69Å; I129-A132 PolarHBondContact O-N 3.1Å; A132-S135 PolarHBondContact O-N 3.44Å; A132-V136 WeakPolarHBondContact O-CG2 3.44Å; A132-V136 PolarHBondContact O-N 3.08Å; A132-A216 HydrophobicContact CB-CB 4.25Å; A132-A220 HydrophobicContact CB-CB 3.76Å; A132-I274 HydrophobicContact CB-CD1 3.74Å |
| 133 | L | 94.1 | Very high | 91.9 | Very high | 24 Ų | 24 | 39.8 Ų | 39.8 | 13% | 0.126 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -59.7 | -47 | 175.3 | -178.5 | 64.4 | 0 | 0 | 0 | 111.4 | I129 L130 G131 S135 V136 F137 M271 I274 L278 | I129-L133 WeakPolarHBondContact O-CB 2.96Å; I129-L133 PolarHBondContact O-N 2.96Å; L130-L133 WeakPolarHBondContact O-CB 3.49Å; L130-L133 PolarHBondContact O-N 2.81Å; G131-L133 VanDerWaalsContact C-N 3.33Å; G131-L133 PolarHBondContact O-N 3.09Å; L133-S135 PolarHBondContact O-N 3.06Å; L133-V136 PolarHBondContact O-N 3.27Å; L133-F137 HydrophobicContact CD1-CD2 4.15Å; L133-F137 HydrophobicContact CD1-CE2 3.56Å; L133-F137 HydrophobicContact CD1-CZ 4.06Å; L133-F137 HydrophobicContact CD2-CE2 4.02Å; L133-F137 HydrophobicContact CG-CD2 3.92Å; L133-F137 HydrophobicContact CG-CE2 3.53Å; L133-F137 HydrophobicContact CG-CZ 4.49Å; L133-F137 VanDerWaalsContact O-CD2 3.26Å; L133-F137 WeakPolarHBondContact O-CD2 3.49Å; L133-F137 PolarHBondContact O-N 3.09Å; L133-M271 HydrophobicContact CD1-CE 3.84Å; L133-M271 HydrophobicContact CD1-SD 3.26Å; L133-M271 WeakPolarHBondContact CD1-SD 3.38Å; L133-I274 HydrophobicContact CB-CG2 3.89Å; L133-I274 HydrophobicContact CD1-CG2 3.99Å; L133-I274 HydrophobicContact CG-CG2 4.42Å; L133-L278 HydrophobicContact CD2-CD1 3.96Å |
| 134 | L | 93.2 | Very high | 91.9 | Very high | 92 Ų | 92 | 41 Ų | 41 | 48% | 0.482 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -61.6 | -43.2 | 178 | -177.4 | 61.9 | 0 | 0 | 0 | 111.6 | I104 L130 G131 V136 F137 T138 | I104-L134 HydrophobicContact CD1-CD2 3.83Å; I104-L134 HydrophobicContact CD1-CG 4.08Å; I104-L134 HydrophobicContact CG1-CD2 4.12Å; I104-L134 HydrophobicContact CG2-CB 4.29Å; I104-L134 HydrophobicContact CG2-CD2 3.9Å; I104-L134 HydrophobicContact CG2-CG 4.31Å; L130-L134 PolarHBondContact O-N 3Å; G131-L134 PolarHBondContact O-N 3.48Å; L134-V136 PolarHBondContact O-N 3.26Å; L134-F137 PolarHBondContact O-N 3.44Å; L134-T138 PolarHBondContact O-N 2.86Å; L134-T138 PolarHBondContact O-OG1 3.29Å |
| 135 | S | 91.8 | Very high | 91.9 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.2 | -43.4 | 175.2 | -62.8 | 0 | 0 | 0 | 0 | 112.4 | G131 A132 L133 F137 T138 I139 | G131-S135 PolarHBondContact O-N 2.9Å; G131-S135 PolarHBondContact O-OG 3.33Å; A132-S135 PolarHBondContact O-N 3.44Å; L133-S135 PolarHBondContact O-N 3.06Å; S135-F137 VanDerWaalsContact C-N 3.32Å; S135-F137 PolarHBondContact O-N 2.9Å; S135-T138 WeakPolarHBondContact O-CB 3.36Å; S135-T138 PolarHBondContact O-N 3.44Å; S135-I139 WeakPolarHBondContact O-CG1 3.37Å; S135-I139 PolarHBondContact O-N 3.42Å; S135-I139 VanDerWaalsContact O-N 3.09Å |
| 136 | V | 91.9 | Very high | 91.8 | Very high | 2 Ų | 2 | 38.5 Ų | 38.5 | 1% | 0.012 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.2 | -39 | 176.6 | 175.6 | 0 | 0 | 0 | 0 | 111.5 | A132 L133 L134 T138 I139 W140 I270 M271 I274 | A132-V136 WeakPolarHBondContact O-CG2 3.44Å; A132-V136 PolarHBondContact O-N 3.08Å; L133-V136 PolarHBondContact O-N 3.27Å; L134-V136 PolarHBondContact O-N 3.26Å; V136-T138 VanDerWaalsContact C-N 3.35Å; V136-I139 WeakPolarHBondContact O-CB 3.39Å; V136-I139 PolarHBondContact O-N 3.49Å; V136-W140 PolarHBondContact O-N 3.21Å; V136-W140 VanDerWaalsContact O-N 3.11Å; V136-I270 HydrophobicContact CG2-CG2 4.27Å; V136-M271 HydrophobicContact CB-CE 4.28Å; V136-M271 HydrophobicContact CG1-CB 4.5Å; V136-M271 HydrophobicContact CG1-CE 3.66Å; V136-I274 HydrophobicContact CG2-CD1 4.43Å |
| 137 | F | 93.5 | Very high | 91.8 | Very high | 85 Ų | 85 | 37 Ų | 37 | 37% | 0.373 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -64.1 | -38.9 | 174 | -76.9 | -53.4 | 0 | 0 | 0 | 112.7 | L133 L134 S135 I139 W140 I141 M271 | L133-F137 HydrophobicContact CD1-CD2 4.15Å; L133-F137 HydrophobicContact CD1-CE2 3.56Å; L133-F137 HydrophobicContact CD1-CZ 4.06Å; L133-F137 HydrophobicContact CD2-CE2 4.02Å; L133-F137 HydrophobicContact CG-CD2 3.92Å; L133-F137 HydrophobicContact CG-CE2 3.53Å; L133-F137 HydrophobicContact CG-CZ 4.49Å; L133-F137 VanDerWaalsContact O-CD2 3.26Å; L133-F137 WeakPolarHBondContact O-CD2 3.49Å; L133-F137 PolarHBondContact O-N 3.09Å; L134-F137 PolarHBondContact O-N 3.44Å; S135-F137 VanDerWaalsContact C-N 3.32Å; S135-F137 PolarHBondContact O-N 2.9Å; F137-I139 VanDerWaalsContact C-N 3.3Å; F137-I139 PolarHBondContact O-N 3.3Å; F137-W140 HydrophobicContact CD1-CE3 4.33Å; F137-W140 HydrophobicContact CE1-CE3 4.41Å; F137-W140 HydrophobicContact CE1-CZ3 4.46Å; F137-W140 PolarHBondContact O-N 3.28Å; F137-I141 WeakPolarHBondContact O-CG1 3.26Å; F137-I141 PolarHBondContact O-N 3.15Å; F137-M271 HydrophobicContact CD1-CE 3.98Å; F137-M271 HydrophobicContact CE1-CE 3.6Å; F137-M271 HydrophobicContact CE2-CE 4.33Å; F137-M271 HydrophobicContact CG-CE 4.47Å; F137-M271 HydrophobicContact CZ-CE 3.8Å |
| 138 | T | 90.6 | Very high | 91.8 | Very high | 27 Ų | 27 | 43.6 Ų | 43.6 | 17% | 0.166 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -57.5 | -44.8 | 173.1 | -56.4 | 0 | 0 | 0 | 0 | 111 | L134 S135 V136 W140 I141 V142 | L134-T138 PolarHBondContact O-N 2.86Å; L134-T138 PolarHBondContact O-OG1 3.29Å; S135-T138 WeakPolarHBondContact O-CB 3.36Å; S135-T138 PolarHBondContact O-N 3.44Å; V136-T138 VanDerWaalsContact C-N 3.35Å; T138-W140 VanDerWaalsContact C-N 3.32Å; T138-W140 PolarHBondContact O-N 3.25Å; T138-I141 PolarHBondContact O-N 3.24Å; T138-V142 HydrophobicContact CG2-CG2 4.38Å; T138-V142 WeakPolarHBondContact O-CG2 3.38Å; T138-V142 PolarHBondContact O-N 3.29Å |
| 139 | I | 89.8 | Confident | 91.6 | Very high | 14 Ų | 14 | 45.7 Ų | 45.7 | 7% | 0.072 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -57.1 | -46.3 | 175.8 | -63.5 | 168.2 | 0 | 0 | 0 | 111 | S135 V136 F137 I141 V142 T143 H224 V263 T267 | S135-I139 WeakPolarHBondContact O-CG1 3.37Å; S135-I139 PolarHBondContact O-N 3.42Å; S135-I139 VanDerWaalsContact O-N 3.09Å; V136-I139 WeakPolarHBondContact O-CB 3.39Å; V136-I139 PolarHBondContact O-N 3.49Å; F137-I139 VanDerWaalsContact C-N 3.3Å; F137-I139 PolarHBondContact O-N 3.3Å; I139-I141 PolarHBondContact O-N 3.34Å; I139-V142 PolarHBondContact O-N 3.49Å; I139-T143 VanDerWaalsContact O-CB 3.27Å; I139-T143 WeakPolarHBondContact O-CB 3.26Å; I139-T143 PolarHBondContact O-N 3.44Å; I139-T143 PolarHBondContact O-OG1 2.85Å; I139-H224 HydrophobicContact CD1-CB 3.91Å; I139-H224 HydrophobicContact CG1-CB 4.49Å; I139-H224 WeakPolarHBondContact CG1-ND1 3.46Å; I139-V263 HydrophobicContact CG2-CG1 3.36Å; I139-T267 HydrophobicContact CD1-CG2 4.06Å; I139-T267 HydrophobicContact CG2-CG2 4.1Å |
| 140 | W | 92.8 | Very high | 91.4 | Very high | 81 Ų | 81 | 45.8 Ų | 45.8 | 31% | 0.307 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -65.4 | -38.6 | -179.3 | -72.6 | 10.7 | 0 | 0 | 0 | 112.5 | V136 F137 T138 G144 L264 T267 M271 | V136-W140 PolarHBondContact O-N 3.21Å; V136-W140 VanDerWaalsContact O-N 3.11Å; F137-W140 HydrophobicContact CD1-CE3 4.33Å; F137-W140 HydrophobicContact CE1-CE3 4.41Å; F137-W140 HydrophobicContact CE1-CZ3 4.46Å; F137-W140 PolarHBondContact O-N 3.28Å; T138-W140 VanDerWaalsContact C-N 3.32Å; T138-W140 PolarHBondContact O-N 3.25Å; W140-G144 PolarHBondContact O-N 3.33Å; W140-L264 HydrophobicContact CD2-CD2 4.47Å; W140-L264 HydrophobicContact CG-CD2 4.18Å; W140-T267 PolarHBondContact NE1-OG1 3.2Å; W140-M271 HydrophobicContact CH2-CE 3.98Å; W140-M271 HydrophobicContact CH2-CG 4.24Å; W140-M271 HydrophobicContact CZ2-CB 4.41Å; W140-M271 HydrophobicContact CZ2-CE 4.14Å; W140-M271 HydrophobicContact CZ2-CG 4.43Å; W140-M271 HydrophobicContact CZ3-CE 4.19Å |
| 141 | I | 92.6 | Very high | 91.3 | Very high | 115 Ų | 115 | 44.3 Ų | 44.3 | 59% | 0.59 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -63.6 | -50.6 | 175.6 | -68.4 | 166.8 | 0 | 0 | 0 | 110 | F137 T138 I139 T143 G144 V145 | F137-I141 WeakPolarHBondContact O-CG1 3.26Å; F137-I141 PolarHBondContact O-N 3.15Å; T138-I141 PolarHBondContact O-N 3.24Å; I139-I141 PolarHBondContact O-N 3.34Å; I141-T143 PolarHBondContact O-N 2.78Å; I141-G144 PolarHBondContact O-N 3.15Å; I141-V145 WeakPolarHBondContact O-CG2 3.32Å; I141-V145 PolarHBondContact O-N 2.87Å |
| 142 | V | 88.9 | Confident | 91.1 | Very high | 22 Ų | 22 | 47.8 Ų | 47.8 | 13% | 0.133 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61 | -44.7 | 179.2 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | T97 T138 I139 G144 V145 L146 | T97-V142 HydrophobicContact CG2-CG2 3.87Å; T138-V142 HydrophobicContact CG2-CG2 4.38Å; T138-V142 WeakPolarHBondContact O-CG2 3.38Å; T138-V142 PolarHBondContact O-N 3.29Å; I139-V142 PolarHBondContact O-N 3.49Å; V142-G144 VanDerWaalsContact C-N 3.33Å; V142-G144 PolarHBondContact O-N 3.48Å; V142-V145 PolarHBondContact O-N 3.06Å; V142-L146 HydrophobicContact CG1-CD1 4.3Å; V142-L146 WeakPolarHBondContact O-CG 3.36Å; V142-L146 PolarHBondContact O-N 3.4Å |
| 143 | T | 90.3 | Very high | 90.8 | Very high | 6 Ų | 6 | 51.8 Ų | 51.8 | 4% | 0.037 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.3 | -43.2 | 175.8 | -56 | 0 | 0 | 0 | 0 | 111.1 | I139 I141 V145 L146 V147 L264 | I139-T143 VanDerWaalsContact O-CB 3.27Å; I139-T143 WeakPolarHBondContact O-CB 3.26Å; I139-T143 PolarHBondContact O-N 3.44Å; I139-T143 PolarHBondContact O-OG1 2.85Å; I141-T143 PolarHBondContact O-N 2.78Å; T143-V145 PolarHBondContact O-N 3.3Å; T143-L146 PolarHBondContact O-N 3.42Å; T143-V147 HydrophobicContact CG2-CG2 4.46Å; T143-V147 VanDerWaalsContact O-CG2 3.3Å; T143-V147 WeakPolarHBondContact O-CG2 3.14Å; T143-V147 PolarHBondContact O-N 2.98Å; T143-L264 HydrophobicContact CG2-CG 4.44Å |
| 144 | G | 92.6 | Very high | 90.5 | Very high | 41 Ų | 41 | 54.2 Ų | 54.2 | 42% | 0.423 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62 | -41.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | W140 I141 V142 V147 Y148 | W140-G144 PolarHBondContact O-N 3.33Å; I141-G144 PolarHBondContact O-N 3.15Å; V142-G144 VanDerWaalsContact C-N 3.33Å; V142-G144 PolarHBondContact O-N 3.48Å; G144-V147 PolarHBondContact O-N 2.85Å; G144-Y148 WeakPolarHBondContact O-CB 3.26Å; G144-Y148 PolarHBondContact O-N 3.41Å |
| 145 | V | 90.1 | Very high | 90.4 | Very high | 79 Ų | 79 | 54.7 Ų | 54.7 | 48% | 0.479 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.7 | -45.1 | 174.4 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | I141 V142 T143 V147 Y148 L149 | I141-V145 WeakPolarHBondContact O-CG2 3.32Å; I141-V145 PolarHBondContact O-N 2.87Å; V142-V145 PolarHBondContact O-N 3.06Å; T143-V145 PolarHBondContact O-N 3.3Å; V145-V147 PolarHBondContact O-N 3.15Å; V145-Y148 WeakPolarHBondContact O-CB 3.48Å; V145-Y148 PolarHBondContact O-N 2.9Å; V145-L149 HydrophobicContact CG1-CD1 4.07Å; V145-L149 HydrophobicContact CG1-CG 4.4Å; V145-L149 WeakPolarHBondContact O-CG 3.49Å; V145-L149 PolarHBondContact O-N 3.35Å |
| 146 | L | 87.5 | Confident | 90.1 | Very high | 19 Ų | 19 | 60.7 Ų | 60.7 | 10% | 0.099 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 177.5 | -76.7 | 173.8 | 0 | 0 | 0 | 113.1 | H94 V142 T143 Y148 L149 A150 Q231 T256 | H94-L146 VanDerWaalsContact CE1-CD2 3.49Å; H94-L146 WeakPolarHBondContact CE1-CD2 3.41Å; H94-L146 VanDerWaalsContact NE2-CD2 3.29Å; H94-L146 WeakPolarHBondContact NE2-CD2 3.31Å; V142-L146 HydrophobicContact CG1-CD1 4.3Å; V142-L146 WeakPolarHBondContact O-CG 3.36Å; V142-L146 PolarHBondContact O-N 3.4Å; T143-L146 PolarHBondContact O-N 3.42Å; L146-Y148 VanDerWaalsContact C-N 3.32Å; L146-L149 PolarHBondContact O-N 3.26Å; L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.43Å; L146-Q231 VanDerWaalsContact CD1-CD 3.48Å; L146-Q231 VanDerWaalsContact CD1-OE1 3.3Å; L146-T256 HydrophobicContact CB-CG2 4.2Å |
| 147 | V | 92.1 | Very high | 89.2 | Confident | 42 Ų | 42 | 65 Ų | 65 | 26% | 0.255 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.8 | -43.6 | 175.6 | 169.3 | 0 | 0 | 0 | 0 | 110.5 | T143 G144 V145 A150 V151 F257 S260 | T143-V147 HydrophobicContact CG2-CG2 4.46Å; T143-V147 VanDerWaalsContact O-CG2 3.3Å; T143-V147 WeakPolarHBondContact O-CG2 3.14Å; T143-V147 PolarHBondContact O-N 2.98Å; G144-V147 PolarHBondContact O-N 2.85Å; V145-V147 PolarHBondContact O-N 3.15Å; V147-A150 PolarHBondContact O-N 3.26Å; V147-V151 WeakPolarHBondContact O-CG2 3.48Å; V147-V151 PolarHBondContact O-N 3.01Å; V147-F257 HydrophobicContact CG1-CD1 4.21Å; V147-F257 HydrophobicContact CG1-CE1 3.79Å; V147-S260 VanDerWaalsContact CG2-OG 3.24Å; V147-S260 WeakPolarHBondContact CG2-OG 3.42Å |
| 148 | Y | 92.3 | Very high | 87.9 | Confident | 150 Ų | 150 | 68.2 Ų | 68.2 | 59% | 0.588 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -59.4 | -48.3 | 175.5 | 173.8 | -91.5 | 0 | 0 | 0 | 111.7 | G144 V145 L146 A150 V151 E152 | G144-Y148 WeakPolarHBondContact O-CB 3.26Å; G144-Y148 PolarHBondContact O-N 3.41Å; V145-Y148 WeakPolarHBondContact O-CB 3.48Å; V145-Y148 PolarHBondContact O-N 2.9Å; L146-Y148 VanDerWaalsContact C-N 3.32Å; Y148-A150 VanDerWaalsContact C-N 3.31Å; Y148-A150 PolarHBondContact O-N 2.82Å; Y148-V151 WeakPolarHBondContact O-CB 3.28Å; Y148-V151 PolarHBondContact O-N 3.05Å; Y148-E152 PolarHBondContact O-N 3.28Å |
| 149 | L | 88.2 | Confident | 86.9 | Confident | 58 Ų | 58 | 68.8 Ų | 68.8 | 30% | 0.304 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.9 | -36.5 | 177 | -67.7 | 174.8 | 0 | 0 | 0 | 112.1 | V145 L146 E152 R153 | V145-L149 HydrophobicContact CG1-CD1 4.07Å; V145-L149 HydrophobicContact CG1-CG 4.4Å; V145-L149 WeakPolarHBondContact O-CG 3.49Å; V145-L149 PolarHBondContact O-N 3.35Å; L146-L149 PolarHBondContact O-N 3.26Å; L149-E152 PolarHBondContact O-N 2.87Å; L149-R153 VanDerWaalsContact O-CG 3.32Å; L149-R153 WeakPolarHBondContact O-CG 3.41Å; L149-R153 PolarHBondContact O-N 3.04Å |
| 150 | A | 88.1 | Confident | 85.7 | Confident | 1 Ų | 1 | 77.7 Ų | 77.7 | 1% | 0.008 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | L146 V147 Y148 R153 I154 P253 T256 F257 | L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.43Å; V147-A150 PolarHBondContact O-N 3.26Å; Y148-A150 VanDerWaalsContact C-N 3.31Å; Y148-A150 PolarHBondContact O-N 2.82Å; A150-R153 PolarHBondContact O-N 2.9Å; A150-I154 WeakPolarHBondContact O-CG1 3.34Å; A150-I154 PolarHBondContact O-N 2.96Å; A150-P253 HydrophobicContact CB-CB 4.29Å; A150-T256 HydrophobicContact CB-CG2 3.96Å; A150-F257 HydrophobicContact CB-CE2 4.22Å; A150-F257 HydrophobicContact CB-CZ 4.22Å |
| 151 | V | 91.4 | Very high | 84.5 | Confident | 66 Ų | 66 | 76.2 Ų | 76.2 | 40% | 0.4 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 172.4 | 173.6 | 0 | 0 | 0 | 0 | 110.4 | V147 Y148 R153 I154 V155 F257 | V147-V151 WeakPolarHBondContact O-CG2 3.48Å; V147-V151 PolarHBondContact O-N 3.01Å; Y148-V151 WeakPolarHBondContact O-CB 3.28Å; Y148-V151 PolarHBondContact O-N 3.05Å; V151-R153 VanDerWaalsContact C-N 3.32Å; V151-R153 PolarHBondContact O-N 3.05Å; V151-I154 PolarHBondContact O-N 3.17Å; V151-I154 VanDerWaalsContact O-N 3.13Å; V151-V155 HydrophobicContact CG1-CG2 4.19Å; V151-V155 WeakPolarHBondContact O-CG2 3.28Å; V151-V155 PolarHBondContact O-N 3.47Å; V151-F257 HydrophobicContact CG2-CE1 3.95Å; V151-F257 HydrophobicContact CG2-CZ 3.6Å |
| 152 | E | 88.9 | Confident | 83.7 | Confident | 79 Ų | 79 | 77.2 Ų | 77.2 | 37% | 0.369 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.2 | -41.9 | 179.7 | -170.6 | 176 | -141.4 | 0 | 0 | 112 | Y148 L149 I154 V155 H156 | Y148-E152 PolarHBondContact O-N 3.28Å; L149-E152 PolarHBondContact O-N 2.87Å; E152-I154 VanDerWaalsContact C-N 3.34Å; E152-I154 PolarHBondContact O-N 3.39Å; E152-V155 PolarHBondContact O-N 2.92Å; E152-H156 WeakPolarHBondContact CG-ND1 2.88Å; E152-H156 PolarHBondContact O-N 3.29Å; E152-H156 PolarHBondContact O-ND1 2.91Å; E152-H156 VanDerWaalsContact O-ND1 3.09Å |
| 153 | R | 85.9 | Confident | 83.1 | Confident | 85 Ų | 85 | 76.7 Ų | 76.7 | 32% | 0.321 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.2 | -40.7 | 174.2 | -73.9 | 173.2 | -170.6 | 167.7 | 6.4 | 112.5 | L149 A150 V151 D157 Y159 D252 P253 | L149-R153 VanDerWaalsContact O-CG 3.32Å; L149-R153 WeakPolarHBondContact O-CG 3.41Å; L149-R153 PolarHBondContact O-N 3.04Å; A150-R153 PolarHBondContact O-N 2.9Å; V151-R153 VanDerWaalsContact C-N 3.32Å; V151-R153 PolarHBondContact O-N 3.05Å; R153-D157 PolarHBondContact O-N 3.41Å; R153-Y159 HydrophobicContact CB-CD1 4.18Å; R153-Y159 HydrophobicContact CB-CE1 3.94Å; R153-Y159 HydrophobicContact CG-CD1 4.39Å; R153-Y159 WeakPolarHBondContact O-CE1 3.25Å; R153-D252 IonicContact CZ-OD2 2.97Å; R153-D252 IonicContact NH1-OD1 2.68Å; R153-D252 IonicContact NH1-OD2 2.76Å; R153-D252 PolarHBondContact NH1-OD2 3.3Å; R153-P253 HydrophobicContact CB-CG 4.18Å |
| 154 | I | 88.4 | Confident | 82.8 | Confident | 74 Ų | 74 | 82.3 Ų | 82.3 | 38% | 0.379 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -69.6 | -40.9 | 178.4 | -66.3 | 179.2 | 0 | 0 | 0 | 111.6 | A150 V151 E152 I250 P253 F257 | A150-I154 WeakPolarHBondContact O-CG1 3.34Å; A150-I154 PolarHBondContact O-N 2.96Å; V151-I154 PolarHBondContact O-N 3.17Å; V151-I154 VanDerWaalsContact O-N 3.13Å; E152-I154 VanDerWaalsContact C-N 3.34Å; E152-I154 PolarHBondContact O-N 3.39Å; I154-I250 HydrophobicContact CD1-CD1 4.07Å; I154-I250 HydrophobicContact CG1-CD1 3.7Å; I154-P253 HydrophobicContact CD1-CB 3.71Å; I154-P253 HydrophobicContact CD1-CG 4.5Å; I154-P253 HydrophobicContact CG1-CB 3.7Å; I154-P253 HydrophobicContact CG1-CG 3.96Å; I154-F257 HydrophobicContact CD1-CE2 3.74Å; I154-F257 HydrophobicContact CD1-CZ 4.47Å |
| 155 | V | 90.8 | Very high | 82.3 | Confident | 102 Ų | 102 | 81.9 Ų | 81.9 | 62% | 0.618 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -76 | -42.1 | -173.1 | 172.9 | 0 | 0 | 0 | 0 | 112 | V151 E152 | V151-V155 HydrophobicContact CG1-CG2 4.19Å; V151-V155 WeakPolarHBondContact O-CG2 3.28Å; V151-V155 PolarHBondContact O-N 3.47Å; E152-V155 PolarHBondContact O-N 2.92Å |
| 156 | H | 85.3 | Confident | 82 | Confident | 127 Ų | 127 | 79 Ų | 79 | 59% | 0.588 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -89.2 | -21.2 | -173.8 | -64.6 | 95.6 | 0 | 0 | 0 | 113.7 | E152 D158 | E152-H156 WeakPolarHBondContact CG-ND1 2.88Å; E152-H156 PolarHBondContact O-N 3.29Å; E152-H156 PolarHBondContact O-ND1 2.91Å; E152-H156 VanDerWaalsContact O-ND1 3.09Å; H156-D158 PolarHBondContact O-N 3.15Å |
| 157 | D | 74.1 | Confident | 82 | Confident | 93 Ų | 93 | 80.5 Ų | 80.5 | 50% | 0.497 | 40% | 0.398 | S | S | . | . | trans | 51.1 | 2.1 | 178.6 | -156.4 | 46.2 | 0 | 0 | 0 | 117.3 | R153 Y159 K249 | R153-D157 PolarHBondContact O-N 3.41Å; D157-Y159 PolarHBondContact O-N 3.26Å; D157-K249 PolarHBondContact O-NZ 3.18Å; D157-K249 WeakPolarHBondContact OD1-CE 3.47Å; D157-K249 IonicContact OD1-NZ 3.2Å; D157-K249 PolarHBondContact OD1-NZ 3.14Å; D157-K249 IonicContact OD2-NZ 3.16Å; D157-K249 PolarHBondContact OD2-NZ 3.05Å | ||
| 158 | D | 66.2 | Low | 81.8 | Confident | 151 Ų | 151 | 84.1 Ų | 84.1 | 81% | 0.807 | 42% | 0.415 | S | S | * | . | trans | -95.1 | 64.3 | -177.8 | -174.3 | 14.2 | 0 | 0 | 0 | 111.5 | H156 | H156-D158 PolarHBondContact O-N 3.15Š| ||
| 159 | Y | 68.7 | Low | 81.4 | Confident | 40 Ų | 40 | 78 Ų | 78 | 16% | 0.157 | 39% | 0.393 | C | S | . | . | trans | -136.9 | 121.1 | 172.4 | 68.8 | -80.6 | 0 | 0 | 0 | 110.9 | R153 D157 I161 K249 | R153-Y159 HydrophobicContact CB-CD1 4.18Å; R153-Y159 HydrophobicContact CB-CE1 3.94Å; R153-Y159 HydrophobicContact CG-CD1 4.39Å; R153-Y159 WeakPolarHBondContact O-CE1 3.25Å; D157-Y159 PolarHBondContact O-N 3.26Å; Y159-I161 HydrophobicContact CD2-CD1 3.71Å; Y159-I161 HydrophobicContact CD2-CG1 3.5Å; Y159-I161 VanDerWaalsContact CD2-CG1 3.5Å; Y159-I161 HydrophobicContact CE2-CD1 3.43Å; Y159-I161 VanDerWaalsContact CE2-CD1 3.43Å; Y159-I161 HydrophobicContact CE2-CG1 3.72Å; Y159-K249 HydrophobicContact CE1-CD 4.28Å; Y159-K249 HydrophobicContact CE2-CB 4.1Å; Y159-K249 HydrophobicContact CE2-CD 4.4Å; Y159-K249 PolarHBondContact OH-O 3.32Å | ||
| 160 | E | 64 | Low | 81.4 | Confident | 200 Ų | 200 | 75.3 Ų | 75.3 | 94% | 0.935 | 38% | 0.379 | S | S | * | . | trans | -93 | 118.1 | 167.8 | -66.2 | -154.8 | 162.1 | 0 | 0 | 109 | ||||
| 161 | I | 68.4 | Low | 81.5 | Confident | 50 Ų | 50 | 76.4 Ų | 76.4 | 26% | 0.256 | 39% | 0.39 | S | S | . | . | trans | -95 | 116.8 | 173.7 | -59.2 | -172.5 | 0 | 0 | 0 | 108.1 | Y159 G163 M166 I242 | Y159-I161 HydrophobicContact CD2-CD1 3.71Å; Y159-I161 HydrophobicContact CD2-CG1 3.5Å; Y159-I161 VanDerWaalsContact CD2-CG1 3.5Å; Y159-I161 HydrophobicContact CE2-CD1 3.43Å; Y159-I161 VanDerWaalsContact CE2-CD1 3.43Å; Y159-I161 HydrophobicContact CE2-CG1 3.72Å; I161-G163 VanDerWaalsContact C-N 3.31Å; I161-G163 PolarHBondContact O-N 3.07Å; I161-M166 HydrophobicContact CD1-SD 4.26Å; I161-M166 HydrophobicContact CG2-CB 4.03Å; I161-M166 HydrophobicContact CG2-CG 4.33Å; I161-M166 HydrophobicContact CG2-SD 3.47Å; I161-M166 WeakPolarHBondContact CG2-SD 3.35Å; I161-I242 HydrophobicContact CB-CG2 4.49Å; I161-I242 HydrophobicContact CD1-CD1 3.9Å; I161-I242 HydrophobicContact CG2-CG2 4.41Å | ||
| 162 | E | 74.8 | Confident | 81.4 | Confident | 136 Ų | 136 | 76.3 Ų | 76.3 | 64% | 0.636 | 39% | 0.392 | S | S | * | . | trans | -73 | 90.3 | 166 | -167.3 | 161.7 | -142.6 | 0 | 0 | 109.4 | H164 V165 M166 | E162-H164 PolarHBondContact O-N 2.89Å; E162-V165 HydrophobicContact CB-CB 4.49Å; E162-V165 HydrophobicContact CB-CG2 4.38Å; E162-V165 HydrophobicContact CG-CG2 4Å; E162-V165 PolarHBondContact O-N 3.5Å; E162-V165 WeakPolarHBondContact OE2-CG2 3.39Å; E162-M166 PolarHBondContact O-N 3.33Å; E162-M166 VanDerWaalsContact O-N 3.12Å | ||
| 163 | G | 76.6 | Confident | 81.3 | Confident | 11 Ų | 11 | 72.8 Ų | 72.8 | 11% | 0.113 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -55.6 | -29 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | I161 L167 | I161-G163 VanDerWaalsContact C-N 3.31Å; I161-G163 PolarHBondContact O-N 3.07Å; G163-L167 VanDerWaalsContact O-CB 3.24Å; G163-L167 WeakPolarHBondContact O-CB 3.4Å; G163-L167 PolarHBondContact O-N 3.29Å |
| 164 | H | 84.1 | Confident | 81.6 | Confident | 125 Ų | 125 | 69.5 Ų | 69.5 | 58% | 0.579 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -63.5 | -47.9 | 174 | -77.5 | -85.6 | 0 | 0 | 0 | 112.7 | E162 L167 I168 F243 | E162-H164 PolarHBondContact O-N 2.89Å; H164-L167 PolarHBondContact O-N 3Å; H164-I168 WeakPolarHBondContact O-CG1 3.48Å; H164-I168 PolarHBondContact O-N 3.48Å; H164-F243 AromaticContact CE1-CE2 3.4Å; H164-F243 VanDerWaalsContact CE1-CE2 3.4Å; H164-F243 WeakPolarHBondContact CE1-CE2 3.43Å; H164-F243 AromaticContact CE1-CZ 3.92Å; H164-F243 AromaticContact ND1-CE2 3.56Å; H164-F243 AromaticContact NE2-CE2 3.74Å |
| 165 | V | 82 | Confident | 81.8 | Confident | 31 Ų | 31 | 69.7 Ų | 69.7 | 19% | 0.188 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -68.4 | -45.2 | -179.2 | 178.2 | 0 | 0 | 0 | 0 | 109.7 | S85 V88 E162 L167 I168 T169 | S85-V165 WeakPolarHBondContact OG-CG1 3.36Å; V88-V165 HydrophobicContact CG2-CG1 3.98Å; E162-V165 HydrophobicContact CB-CB 4.49Å; E162-V165 HydrophobicContact CB-CG2 4.38Å; E162-V165 HydrophobicContact CG-CG2 4Å; E162-V165 PolarHBondContact O-N 3.5Å; E162-V165 WeakPolarHBondContact OE2-CG2 3.39Å; V165-L167 VanDerWaalsContact C-N 3.3Å; V165-L167 PolarHBondContact O-N 2.85Å; V165-I168 PolarHBondContact O-N 2.58Å; V165-T169 HydrophobicContact CG1-CG2 4.17Å; V165-T169 WeakPolarHBondContact O-CG2 3.38Å; V165-T169 PolarHBondContact O-N 3.27Å; V165-T169 PolarHBondContact O-OG1 3.13Å; V165-T169 VanDerWaalsContact O-OG1 3.13Å |
| 166 | M | 83.9 | Confident | 81.7 | Confident | 18 Ų | 18 | 64.9 Ų | 64.9 | 9% | 0.089 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -59.8 | -37.7 | 177.8 | -169.7 | -172 | 177.6 | 0 | 0 | 112.6 | I161 E162 T169 S170 V235 A239 I242 D252 | I161-M166 HydrophobicContact CD1-SD 4.26Å; I161-M166 HydrophobicContact CG2-CB 4.03Å; I161-M166 HydrophobicContact CG2-CG 4.33Å; I161-M166 HydrophobicContact CG2-SD 3.47Å; I161-M166 WeakPolarHBondContact CG2-SD 3.35Å; E162-M166 PolarHBondContact O-N 3.33Å; E162-M166 VanDerWaalsContact O-N 3.12Å; M166-T169 WeakPolarHBondContact CA-OG1 3.28Å; M166-T169 PolarHBondContact O-OG1 3.49Å; M166-S170 VanDerWaalsContact O-CB 3.24Å; M166-S170 WeakPolarHBondContact O-CB 3.44Å; M166-S170 PolarHBondContact O-N 2.99Å; M166-S170 PolarHBondContact O-OG 3.3Å; M166-V235 HydrophobicContact CE-CG1 3.63Å; M166-A239 HydrophobicContact CB-CB 4.34Å; M166-A239 HydrophobicContact CE-CB 4.23Å; M166-A239 HydrophobicContact CG-CB 3.83Å; M166-A239 HydrophobicContact SD-CB 3.97Å; M166-I242 HydrophobicContact CE-CD1 4.46Å; M166-I242 HydrophobicContact SD-CD1 4.19Å; M166-D252 HydrophobicContact CE-CB 4.4Å; M166-D252 WeakPolarHBondContact CE-OD1 3.41Å |
| 167 | L | 87.9 | Confident | 82 | Confident | 51 Ų | 51 | 59.2 Ų | 59.2 | 27% | 0.267 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -66.9 | -42.8 | 177.8 | -174.9 | 69.4 | 0 | 0 | 0 | 111.9 | G163 H164 V165 S170 G171 L236 A239 I240 F243 | G163-L167 VanDerWaalsContact O-CB 3.24Å; G163-L167 WeakPolarHBondContact O-CB 3.4Å; G163-L167 PolarHBondContact O-N 3.29Å; H164-L167 PolarHBondContact O-N 3Å; V165-L167 VanDerWaalsContact C-N 3.3Å; V165-L167 PolarHBondContact O-N 2.85Å; L167-S170 PolarHBondContact O-OG 3.41Å; L167-G171 PolarHBondContact O-N 2.88Å; L167-G171 VanDerWaalsContact O-N 3.08Å; L167-L236 HydrophobicContact CD1-CD1 3.96Å; L167-A239 HydrophobicContact CB-CB 4.43Å; L167-A239 HydrophobicContact CD1-CB 4.26Å; L167-I240 HydrophobicContact CD1-CG1 3.62Å; L167-F243 HydrophobicContact CD2-CD2 4.24Å; L167-F243 HydrophobicContact CD2-CG 4.39Å |
| 168 | I | 87.4 | Confident | 82.9 | Confident | 118 Ų | 118 | 58.2 Ų | 58.2 | 61% | 0.605 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -67.7 | -47.6 | 178.9 | -66.5 | 170.6 | 0 | 0 | 0 | 110.4 | H164 V165 G171 C172 | H164-I168 WeakPolarHBondContact O-CG1 3.48Å; H164-I168 PolarHBondContact O-N 3.48Å; V165-I168 PolarHBondContact O-N 2.58Å; I168-G171 PolarHBondContact O-N 2.71Å; I168-C172 PolarHBondContact O-N 3.48Å; I168-C172 PolarHBondContact O-SG 3.03Å |
| 169 | T | 85 | Confident | 84.2 | Confident | 21 Ų | 21 | 54.2 Ų | 54.2 | 13% | 0.129 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -64.6 | -49.8 | -177.8 | 55.7 | 0 | 0 | 0 | 0 | 111.6 | V88 V165 M166 G171 C172 A173 | V88-T169 HydrophobicContact CB-CG2 4.24Å; V88-T169 HydrophobicContact CG1-CG2 4.31Å; V88-T169 HydrophobicContact CG2-CG2 3.49Å; V88-T169 VanDerWaalsContact CG2-CG2 3.49Å; V165-T169 HydrophobicContact CG1-CG2 4.17Å; V165-T169 WeakPolarHBondContact O-CG2 3.38Å; V165-T169 PolarHBondContact O-N 3.27Å; V165-T169 PolarHBondContact O-OG1 3.13Å; V165-T169 VanDerWaalsContact O-OG1 3.13Å; M166-T169 WeakPolarHBondContact CA-OG1 3.28Å; M166-T169 PolarHBondContact O-OG1 3.49Å; T169-G171 VanDerWaalsContact C-N 3.26Å; T169-G171 PolarHBondContact O-N 2.72Å; T169-C172 WeakPolarHBondContact O-CB 3.01Å; T169-C172 PolarHBondContact O-N 2.83Å; T169-C172 VanDerWaalsContact O-N 3.09Å; T169-A173 PolarHBondContact O-N 2.65Å |
| 170 | S | 87.3 | Confident | 85.2 | Confident | 2 Ų | 2 | 52.3 Ų | 52.3 | 1% | 0.014 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.1 | -33.9 | 177.4 | 60.3 | 0 | 0 | 0 | 0 | 112.7 | M166 L167 A173 V174 L236 | M166-S170 VanDerWaalsContact O-CB 3.24Å; M166-S170 WeakPolarHBondContact O-CB 3.44Å; M166-S170 PolarHBondContact O-N 2.99Å; M166-S170 PolarHBondContact O-OG 3.3Å; L167-S170 PolarHBondContact O-OG 3.41Å; S170-A173 PolarHBondContact O-N 3.43Å; S170-V174 VanDerWaalsContact O-CG2 3.31Å; S170-V174 WeakPolarHBondContact O-CG2 3.27Å; S170-V174 PolarHBondContact O-N 3.11Å; S170-L236 WeakPolarHBondContact OG-CA 3.14Å; S170-L236 WeakPolarHBondContact OG-CD1 3.48Å |
| 171 | G | 90.9 | Very high | 86.5 | Confident | 24 Ų | 24 | 43.3 Ų | 43.3 | 25% | 0.247 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.2 | -46.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L167 I168 T169 V174 V175 | L167-G171 PolarHBondContact O-N 2.88Å; L167-G171 VanDerWaalsContact O-N 3.08Å; I168-G171 PolarHBondContact O-N 2.71Å; T169-G171 VanDerWaalsContact C-N 3.26Å; T169-G171 PolarHBondContact O-N 2.72Å; G171-V174 PolarHBondContact O-N 3.4Å; G171-V175 WeakPolarHBondContact O-CG2 3.13Å; G171-V175 PolarHBondContact O-N 3.18Å; G171-V175 VanDerWaalsContact O-N 3.14Å |
| 172 | C | 88.1 | Confident | 87.5 | Confident | 64 Ų | 64 | 46.8 Ų | 46.8 | 43% | 0.432 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -61.4 | -44.9 | 174.7 | -72.2 | 0 | 0 | 0 | 0 | 112 | I168 T169 V174 V175 A176 | I168-C172 PolarHBondContact O-N 3.48Å; I168-C172 PolarHBondContact O-SG 3.03Å; T169-C172 WeakPolarHBondContact O-CB 3.01Å; T169-C172 PolarHBondContact O-N 2.83Å; T169-C172 VanDerWaalsContact O-N 3.09Å; C172-V174 PolarHBondContact O-N 3.48Å; C172-V175 PolarHBondContact O-N 3.43Å; C172-A176 PolarHBondContact O-N 3.43Å |
| 173 | A | 88.1 | Confident | 88.2 | Confident | 5 Ų | 5 | 42.4 Ų | 42.4 | 4% | 0.041 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60 | -44.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | T169 S170 V175 A176 N177 | T169-A173 PolarHBondContact O-N 2.65Å; S170-A173 PolarHBondContact O-N 3.43Å; A173-V175 VanDerWaalsContact C-N 3.35Å; A173-V175 PolarHBondContact O-N 3.35Å; A173-A176 PolarHBondContact O-N 3.26Å; A173-N177 WeakPolarHBondContact O-CB 3.24Å; A173-N177 PolarHBondContact O-N 3.09Å; A173-N177 PolarHBondContact O-ND2 3.45Å |
| 174 | V | 91.6 | Very high | 88.5 | Confident | 16 Ų | 16 | 41.9 Ų | 41.9 | 10% | 0.097 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.2 | -45.2 | 175.1 | 169 | 0 | 0 | 0 | 0 | 111 | S170 G171 C172 N177 I178 L229 S232 V233 L236 | S170-V174 VanDerWaalsContact O-CG2 3.31Å; S170-V174 WeakPolarHBondContact O-CG2 3.27Å; S170-V174 PolarHBondContact O-N 3.11Å; G171-V174 PolarHBondContact O-N 3.4Å; C172-V174 PolarHBondContact O-N 3.48Å; V174-N177 PolarHBondContact O-N 3.28Å; V174-I178 HydrophobicContact CG1-CD1 3.74Å; V174-I178 HydrophobicContact CG1-CG1 4.38Å; V174-I178 WeakPolarHBondContact O-CB 3.32Å; V174-I178 VanDerWaalsContact O-CG1 3.23Å; V174-I178 WeakPolarHBondContact O-CG1 3.49Å; V174-I178 PolarHBondContact O-N 3.02Å; V174-L229 HydrophobicContact CG1-CD1 4.35Å; V174-S232 VanDerWaalsContact CG2-C 3.4Å; V174-S232 WeakPolarHBondContact CG2-O 3.45Å; V174-V233 HydrophobicContact CG1-CG2 4.17Å; V174-V233 HydrophobicContact CG2-CG2 3.93Å; V174-L236 HydrophobicContact CB-CD2 4.43Å; V174-L236 HydrophobicContact CG2-CB 4.15Å; V174-L236 HydrophobicContact CG2-CD2 3.93Å |
| 175 | V | 91.9 | Very high | 88.3 | Confident | 79 Ų | 79 | 39.9 Ų | 39.9 | 48% | 0.479 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -62.4 | -45.5 | 178.1 | 172 | 0 | 0 | 0 | 0 | 111.3 | G171 C172 A173 I178 I179 | G171-V175 WeakPolarHBondContact O-CG2 3.13Å; G171-V175 PolarHBondContact O-N 3.18Å; G171-V175 VanDerWaalsContact O-N 3.14Å; C172-V175 PolarHBondContact O-N 3.43Å; A173-V175 VanDerWaalsContact C-N 3.35Å; A173-V175 PolarHBondContact O-N 3.35Å; V175-I178 PolarHBondContact O-N 3.39Å; V175-I179 HydrophobicContact CG1-CD1 3.97Å; V175-I179 WeakPolarHBondContact O-CG1 3.4Å; V175-I179 PolarHBondContact O-N 2.87Å |
| 176 | A | 89.7 | Confident | 87.4 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.4 | -48 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | F72 C172 A173 I178 I179 M180 | F72-A176 HydrophobicContact CB-CB 4.49Å; F72-A176 HydrophobicContact CD1-CB 3.85Å; F72-A176 HydrophobicContact CD2-CB 3.66Å; F72-A176 HydrophobicContact CE1-CB 3.9Å; F72-A176 HydrophobicContact CE2-CB 3.7Å; F72-A176 HydrophobicContact CG-CB 3.75Å; F72-A176 HydrophobicContact CZ-CB 3.83Å; C172-A176 PolarHBondContact O-N 3.43Å; A173-A176 PolarHBondContact O-N 3.26Å; A176-I178 PolarHBondContact O-N 2.91Å; A176-I179 PolarHBondContact O-N 2.98Å; A176-M180 WeakPolarHBondContact O-CG 3.44Å; A176-M180 PolarHBondContact O-N 3.22Å |
| 177 | N | 91.8 | Very high | 85.3 | Confident | 8 Ų | 8 | 46.3 Ų | 46.3 | 4% | 0.043 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.4 | -35.3 | 178.9 | -77.7 | -34.7 | 0 | 0 | 0 | 112.9 | A173 V174 M180 A181 D228 L229 S232 | A173-N177 WeakPolarHBondContact O-CB 3.24Å; A173-N177 PolarHBondContact O-N 3.09Å; A173-N177 PolarHBondContact O-ND2 3.45Å; V174-N177 PolarHBondContact O-N 3.28Å; N177-M180 PolarHBondContact O-N 2.98Å; N177-M180 WeakPolarHBondContact OD1-CE 3.12Å; N177-A181 WeakPolarHBondContact O-CB 3.36Å; N177-A181 PolarHBondContact O-N 3.49Å; N177-D228 PolarHBondContact ND2-O 3.17Å; N177-L229 HydrophobicContact CB-CB 3.95Å; N177-L229 HydrophobicContact CB-CD1 3.75Å; N177-L229 HydrophobicContact CB-CG 4.45Å; N177-S232 PolarHBondContact ND2-OG 3.02Å |
| 178 | I | 93.1 | Very high | 83.1 | Confident | 72 Ų | 72 | 46.8 Ų | 46.8 | 37% | 0.369 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.8 | -46.5 | 172.1 | -71.7 | 168.5 | 0 | 0 | 0 | 110.5 | V174 V175 A176 M180 A181 L182 L229 | V174-I178 HydrophobicContact CG1-CD1 3.74Å; V174-I178 HydrophobicContact CG1-CG1 4.38Å; V174-I178 WeakPolarHBondContact O-CB 3.32Å; V174-I178 VanDerWaalsContact O-CG1 3.23Å; V174-I178 WeakPolarHBondContact O-CG1 3.49Å; V174-I178 PolarHBondContact O-N 3.02Å; V175-I178 PolarHBondContact O-N 3.39Å; A176-I178 PolarHBondContact O-N 2.91Å; I178-M180 VanDerWaalsContact C-N 3.33Å; I178-M180 PolarHBondContact O-N 3.23Å; I178-A181 PolarHBondContact O-N 3.26Å; I178-L182 HydrophobicContact CG2-CD1 3.78Å; I178-L182 HydrophobicContact CG2-CG 4.24Å; I178-L182 WeakPolarHBondContact O-CB 3.34Å; I178-L182 VanDerWaalsContact O-CG 3.26Å; I178-L182 WeakPolarHBondContact O-CG 3.11Å; I178-L182 PolarHBondContact O-N 3.45Å; I178-L229 HydrophobicContact CG1-CD1 3.63Å; I178-L229 HydrophobicContact CG1-CD2 4.26Å |
| 179 | I | 92.1 | Very high | 80.5 | Confident | 67 Ų | 67 | 50.6 Ų | 50.6 | 34% | 0.344 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.9 | -44.4 | 178.9 | -67.6 | 165.9 | 0 | 0 | 0 | 110.5 | I68 F72 V175 A176 T183 | I68-I179 HydrophobicContact CD1-CG2 4.12Å; I68-I179 HydrophobicContact CG2-CG2 4.21Å; F72-I179 HydrophobicContact CE2-CD1 4.38Å; F72-I179 HydrophobicContact CZ-CD1 4.09Å; V175-I179 HydrophobicContact CG1-CD1 3.97Å; V175-I179 WeakPolarHBondContact O-CG1 3.4Å; V175-I179 PolarHBondContact O-N 2.87Å; A176-I179 PolarHBondContact O-N 2.98Å; I179-T183 WeakPolarHBondContact O-CB 3.43Å; I179-T183 PolarHBondContact O-N 3.48Å; I179-T183 PolarHBondContact O-OG1 2.93Å |
| 180 | M | 90.8 | Very high | 77.9 | Confident | 1 Ų | 1 | 52.9 Ų | 52.9 | 1% | 0.005 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.5 | -45.1 | 176.5 | -68.9 | -166.6 | -68.2 | 0 | 0 | 111.7 | V65 I68 C69 F102 A176 N177 I178 L182 T183 L184 V225 | V65-M180 HydrophobicContact CG1-CB 4.2Å; V65-M180 HydrophobicContact CG1-CG 4.08Å; V65-M180 HydrophobicContact CG1-SD 3.99Å; I68-M180 HydrophobicContact CG2-CG 4.02Å; C69-M180 HydrophobicContact CB-SD 3.86Å; F102-M180 HydrophobicContact CE2-SD 4.16Å; A176-M180 WeakPolarHBondContact O-CG 3.44Å; A176-M180 PolarHBondContact O-N 3.22Å; N177-M180 PolarHBondContact O-N 2.98Å; N177-M180 WeakPolarHBondContact OD1-CE 3.12Å; I178-M180 VanDerWaalsContact C-N 3.33Å; I178-M180 PolarHBondContact O-N 3.23Å; M180-L182 PolarHBondContact O-N 3.25Å; M180-T183 PolarHBondContact O-N 3.49Å; M180-L184 WeakPolarHBondContact O-CB 3.32Å; M180-L184 PolarHBondContact O-N 3.43Å; M180-V225 HydrophobicContact CB-CG1 3.84Å; M180-V225 HydrophobicContact CB-CG2 4.43Å |
| 181 | A | 90.9 | Very high | 75.3 | Confident | 10 Ų | 10 | 60.8 Ų | 60.8 | 8% | 0.083 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | N177 I178 T183 L184 H185 V225 M226 L229 | N177-A181 WeakPolarHBondContact O-CB 3.36Å; N177-A181 PolarHBondContact O-N 3.49Å; I178-A181 PolarHBondContact O-N 3.26Å; A181-T183 VanDerWaalsContact C-N 3.34Å; A181-T183 PolarHBondContact O-N 2.96Å; A181-L184 PolarHBondContact O-N 3.28Å; A181-H185 WeakPolarHBondContact O-CB 3.38Å; A181-H185 PolarHBondContact O-N 2.96Å; A181-V225 HydrophobicContact CB-CG1 3.91Å; A181-M226 HydrophobicContact CB-CE 3.58Å; A181-M226 HydrophobicContact CB-SD 4.5Å; A181-L229 HydrophobicContact CB-CD2 4.48Å |
| 182 | L | 90.4 | Very high | 72.5 | Confident | 124 Ų | 124 | 65.2 Ų | 65.2 | 65% | 0.649 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -65.8 | -35.4 | 177.5 | -70 | 174.7 | 0 | 0 | 0 | 112.5 | I178 M180 L184 | I178-L182 HydrophobicContact CG2-CD1 3.78Å; I178-L182 HydrophobicContact CG2-CG 4.24Å; I178-L182 WeakPolarHBondContact O-CB 3.34Å; I178-L182 VanDerWaalsContact O-CG 3.26Å; I178-L182 WeakPolarHBondContact O-CG 3.11Å; I178-L182 PolarHBondContact O-N 3.45Å; M180-L182 PolarHBondContact O-N 3.25Å; L182-L184 VanDerWaalsContact C-N 3.33Å |
| 183 | T | 88.5 | Confident | 70.1 | Confident | 43 Ų | 43 | 70.4 Ų | 70.4 | 26% | 0.264 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -67.8 | -36.3 | 176.9 | -58.5 | 0 | 0 | 0 | 0 | 111.7 | V64 V65 I179 M180 A181 | V64-T183 HydrophobicContact CB-CG2 4.27Å; V64-T183 HydrophobicContact CG1-CG2 3.77Å; V65-T183 HydrophobicContact CG2-CG2 3.68Å; I179-T183 WeakPolarHBondContact O-CB 3.43Å; I179-T183 PolarHBondContact O-N 3.48Å; I179-T183 PolarHBondContact O-OG1 2.93Å; M180-T183 PolarHBondContact O-N 3.49Å; A181-T183 VanDerWaalsContact C-N 3.34Å; A181-T183 PolarHBondContact O-N 2.96Å |
| 184 | L | 83.3 | Confident | 67.7 | Low | 0 Ų | 0 | 74.2 Ų | 74.2 | 0% | 0 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -88.5 | -19.3 | -178.8 | -160.1 | 53.4 | 0 | 0 | 0 | 112.9 | R61 L62 V65 M180 A181 L182 Q186 V218 A221 F222 V225 | R61-L184 HydrophobicContact CB-CD1 4.29Å; L62-L184 HydrophobicContact CD2-CD1 4.45Å; V65-L184 HydrophobicContact CG2-CB 4.43Å; M180-L184 WeakPolarHBondContact O-CB 3.32Å; M180-L184 PolarHBondContact O-N 3.43Å; A181-L184 PolarHBondContact O-N 3.28Å; L182-L184 VanDerWaalsContact C-N 3.33Å; L184-Q186 PolarHBondContact O-N 3.19Å; L184-V218 HydrophobicContact CD1-CG1 3.93Å; L184-A221 HydrophobicContact CD2-CB 3.99Å; L184-F222 HydrophobicContact CB-CD2 4.31Å; L184-F222 VanDerWaalsContact CD2-CA 3.44Å; L184-F222 HydrophobicContact CD2-CB 3.94Å; L184-F222 HydrophobicContact CG-CB 4.12Å; L184-F222 HydrophobicContact CG-CD2 4.25Å; L184-V225 HydrophobicContact CD2-CG2 4.25Å |
| 185 | H | 79.4 | Confident | 64.7 | Low | 83 Ų | 83 | 77.1 Ų | 77.1 | 38% | 0.384 | 48% | 0.479 | S | S | . | . | trans | -53.9 | 127.5 | 177.9 | -176.5 | -90.5 | 0 | 0 | 0 | 110.7 | A181 S187 | A181-H185 WeakPolarHBondContact O-CB 3.38Å; A181-H185 PolarHBondContact O-N 2.96Å; H185-S187 PolarHBondContact O-N 2.88Å | ||
| 186 | Q | 62.9 | Low | 62.3 | Low | 77 Ų | 77 | 82 Ų | 82 | 36% | 0.36 | 50% | 0.501 | S | S | . | . | trans | -82.5 | 102.5 | 179 | -66.2 | 168.3 | 19.8 | 0 | 0 | 108.1 | L184 G188 | L184-Q186 PolarHBondContact O-N 3.19Å; Q186-G188 PolarHBondContact O-N 3.48Å | ||
| 187 | S | 41.1 | Very low | 59.6 | Low | 107 Ų | 107 | 86.9 Ų | 86.9 | 75% | 0.748 | 54% | 0.542 | S | S | * | . | trans | -70.3 | 66.2 | 162.6 | -57.2 | 0 | 0 | 0 | 0 | 109.9 | H185 | H185-S187 PolarHBondContact O-N 2.88Š| ||
| 188 | G | 40.3 | Very low | 56.8 | Low | 61 Ų | 61 | 91.6 Ų | 91.6 | 63% | 0.629 | 58% | 0.575 | S | S | * | * | trans | -109.6 | 101.2 | 162.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | Q186 G190 | Q186-G188 PolarHBondContact O-N 3.48Å; G188-G190 PolarHBondContact O-N 3.29Å | ||
| 189 | H | 34.2 | Very low | 54.1 | Low | 198 Ų | 198 | 97.3 Ų | 97.3 | 92% | 0.917 | 60% | 0.6 | S | S | * | * | trans | -51 | 128.1 | 180 | -72.9 | -66.4 | 0 | 0 | 0 | 113.1 | ||||
| 190 | G | 29.1 | Very low | 51.1 | Low | 69 Ų | 69 | 97 Ų | 97 | 71% | 0.711 | 61% | 0.614 | S | S | * | * | trans | 141.7 | 64.6 | 155.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | G188 S192 | G188-G190 PolarHBondContact O-N 3.29Å; G190-S192 PolarHBondContact O-N 3.46Å | ||
| 191 | H | 33.8 | Very low | 48.4 | Very low | 168 Ų | 168 | 106 Ų | 106 | 78% | 0.778 | 66% | 0.655 | S | S | * | * | trans | -76.4 | 102.6 | 156.9 | -66 | -72.5 | 0 | 0 | 0 | 108.4 | ||||
| 192 | S | 30.8 | Very low | 45.7 | Very low | 117 Ų | 117 | 109.6 Ų | 109.6 | 82% | 0.818 | 68% | 0.68 | S | S | * | * | trans | -100 | 105 | 157.1 | 61.8 | 0 | 0 | 0 | 0 | 107.9 | G190 | G190-S192 PolarHBondContact O-N 3.46Š| ||
| 193 | H | 39.6 | Very low | 43 | Very low | 173 Ų | 173 | 112.2 Ų | 112.2 | 80% | 0.801 | 69% | 0.689 | S | S | * | * | trans | -58.1 | 146.8 | 165.7 | -72.7 | -92.8 | 0 | 0 | 0 | 110.2 | ||||
| 194 | G | 36 | Very low | 40.1 | Very low | 85 Ų | 85 | 114.9 Ų | 114.9 | 88% | 0.876 | 71% | 0.709 | S | S | * | * | trans | -60.2 | 146.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 195 | G | 30.1 | Very low | 37.8 | Very low | 78 Ų | 78 | 121.3 Ų | 121.3 | 80% | 0.804 | 75% | 0.751 | S | S | * | * | trans | 177.8 | 128.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 196 | L | 40.5 | Very low | 35.4 | Very low | 181 Ų | 181 | 126.5 Ų | 126.5 | 95% | 0.948 | 77% | 0.772 | S | S | * | * | trans | -48.8 | 154.8 | -179 | -68.2 | 138.5 | 0 | 0 | 0 | 116.1 | ||||
| 197 | A | 32.9 | Very low | 34.2 | Very low | 102 Ų | 102 | 134.2 Ų | 134.2 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | 100.9 | 126.6 | 148.8 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 198 | S | 33.1 | Very low | 33.7 | Very low | 107 Ų | 107 | 132 Ų | 132 | 75% | 0.748 | 79% | 0.793 | S | S | * | * | trans | 94.9 | 113.9 | 135.9 | -166.5 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 199 | H | 35.5 | Very low | 33.6 | Very low | 192 Ų | 192 | 139.1 Ų | 139.1 | 89% | 0.889 | 81% | 0.806 | S | S | * | * | trans | 27.5 | 135.6 | 141.4 | -73.7 | -64.9 | 0 | 0 | 0 | 123.7 | ||||
| 200 | G | 30.7 | Very low | 34.3 | Very low | 62 Ų | 62 | 135.4 Ų | 135.4 | 64% | 0.639 | 78% | 0.784 | S | S | * | * | 122.1 | 109.5 | 123.1 | 0 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 201 | H | 33.3 | Very low | 34.9 | Very low | 189 Ų | 189 | 137.1 Ų | 137.1 | 88% | 0.875 | 79% | 0.791 | S | S | * | * | trans | 58 | 117.2 | 145.8 | -58.5 | -69.1 | 0 | 0 | 0 | 124.7 | ||||
| 202 | S | 34.5 | Very low | 35.8 | Very low | 86 Ų | 86 | 132.7 Ų | 132.7 | 60% | 0.601 | 77% | 0.771 | S | S | * | * | trans | 11 | 122.4 | 143 | 58.7 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 203 | H | 33 | Very low | 37.2 | Very low | 179 Ų | 179 | 130.3 Ų | 130.3 | 83% | 0.829 | 75% | 0.747 | S | S | * | * | 167.1 | 154.4 | 100.6 | -88.8 | -69.3 | 0 | 0 | 0 | 111.3 | |||||
| 204 | S | 28.9 | Very low | 38.5 | Very low | 99 Ų | 99 | 123 Ų | 123 | 69% | 0.692 | 72% | 0.717 | S | S | * | * | trans | 79.3 | 119.7 | -177.4 | -60.2 | 0 | 0 | 0 | 0 | 116.5 | K206 | S204-K206 PolarHBondContact O-N 3.25Š| ||
| 205 | P | 33.4 | Very low | 40.5 | Very low | 135 Ų | 135 | 120 Ų | 120 | 88% | 0.877 | 68% | 0.681 | S | S | * | * | trans | -75.1 | 83.4 | 169.7 | 32.6 | -30.1 | 0 | 0 | 0 | 107.8 | R207 | P205-R207 PolarHBondContact O-N 2.95Å; P205-R207 VanDerWaalsContact O-N 3.14Å | ||
| 206 | K | 30.5 | Very low | 42.9 | Very low | 192 Ų | 192 | 116.5 Ų | 116.5 | 84% | 0.835 | 64% | 0.644 | S | S | * | * | trans | -59.5 | 118.2 | 156.2 | -71.8 | -172.4 | 179 | 178.1 | 0 | 105.3 | S204 G208 | S204-K206 PolarHBondContact O-N 3.25Å; K206-G208 VanDerWaalsContact C-N 3.28Å; K206-G208 PolarHBondContact O-N 3.18Å | ||
| 207 | R | 36.1 | Very low | 45 | Very low | 238 Ų | 238 | 107.9 Ų | 107.9 | 90% | 0.898 | 60% | 0.599 | S | S | * | * | trans | -44.7 | 99.5 | 165.1 | -102.1 | 176.8 | 153.9 | -176.5 | -7 | 106.7 | P205 K209 | P205-R207 PolarHBondContact O-N 2.95Å; P205-R207 VanDerWaalsContact O-N 3.14Å; R207-K209 PolarHBondContact O-N 2.98Å | ||
| 208 | G | 32.6 | Very low | 47.4 | Very low | 62 Ų | 62 | 103.2 Ų | 103.2 | 64% | 0.639 | 56% | 0.56 | S | S | * | * | trans | -56.7 | 126.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 106.7 | K206 R210 | K206-G208 VanDerWaalsContact C-N 3.28Å; K206-G208 PolarHBondContact O-N 3.18Å; G208-R210 PolarHBondContact O-N 3.39Å | ||
| 209 | K | 36.8 | Very low | 49.8 | Very low | 210 Ų | 210 | 100.3 Ų | 100.3 | 91% | 0.913 | 53% | 0.532 | S | S | * | . | trans | -59.5 | 99.8 | 167 | -74.6 | -174.4 | 176.8 | -178.3 | 0 | 105.5 | R207 A211 | R207-K209 PolarHBondContact O-N 2.98Å; K209-A211 PolarHBondContact O-N 3.24Å | ||
| 210 | R | 49.2 | Very low | 52.2 | Low | 119 Ų | 119 | 91.3 Ų | 91.3 | 45% | 0.449 | 49% | 0.491 | S | S | . | . | trans | -55.8 | 124.2 | 176.8 | -74 | 177.6 | 171.1 | 179.4 | -5.5 | 106.2 | G208 Q212 S344 | G208-R210 PolarHBondContact O-N 3.39Å; R210-Q212 VanDerWaalsContact C-N 3.26Å; R210-Q212 PolarHBondContact O-N 3.02Å; R210-S344 PolarHBondContact NH2-O 3.46Å | ||
| 211 | A | 42 | Very low | 54.8 | Low | 105 Ų | 105 | 88.4 Ų | 88.4 | 87% | 0.868 | 46% | 0.461 | S | S | * | . | trans | -66 | 92.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | K209 | K209-A211 PolarHBondContact O-N 3.24Š| ||
| 212 | Q | 53.1 | Low | 57.4 | Low | 76 Ų | 76 | 82 Ų | 82 | 36% | 0.355 | 43% | 0.431 | S | S | . | . | P | Polyproline II helix | trans | -81 | 121.5 | -175.7 | -157.4 | 99.1 | -25.1 | 0 | 0 | 108.2 | E54 R210 | E54-Q212 WeakPolarHBondContact OE1-CG 3.3Å; E54-Q212 PolarHBondContact OE1-NE2 3.15Å; R210-Q212 VanDerWaalsContact C-N 3.26Å; R210-Q212 PolarHBondContact O-N 3.02Å |
| 213 | Q | 60.4 | Low | 59.8 | Low | 67 Ų | 67 | 79.3 Ų | 79.3 | 31% | 0.313 | 41% | 0.411 | S | S | . | . | P | Polyproline II helix | trans | -71.5 | 146.6 | 174.9 | -68 | -177.5 | -9.7 | 0 | 0 | 109.3 | S284 N315 | Q213-S284 PolarHBondContact NE2-OG 3.01Å; Q213-S284 VanDerWaalsContact NE2-OG 3.11Å; Q213-N315 WeakPolarHBondContact CB-OD1 3.41Å; Q213-N315 PolarHBondContact O-ND2 2.98Å; Q213-N315 PolarHBondContact O-OD1 3.21Å |
| 214 | A | 65.3 | Low | 62.4 | Low | 20 Ų | 20 | 71 Ų | 71 | 17% | 0.165 | 37% | 0.372 | C | S | . | . | P | Polyproline II helix | trans | -66.2 | 153.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A216 R219 | A214-A216 PolarHBondContact O-N 3.47Å; A214-R219 HydrophobicContact CB-CB 4.4Å |
| 215 | N | 78.8 | Confident | 65.3 | Low | 22 Ų | 22 | 66.3 Ų | 66.3 | 12% | 0.118 | 34% | 0.339 | C | S | . | . | P | Polyproline II helix | trans | -51.9 | 136.9 | 170.6 | -68 | -12.9 | 0 | 0 | 0 | 110.8 | A58 S217 V218 R219 | A58-N215 WeakPolarHBondContact CB-ND2 3.34Å; N215-S217 VanDerWaalsContact C-N 3.31Å; N215-S217 PolarHBondContact O-N 2.81Å; N215-V218 HydrophobicContact CB-CB 4.3Å; N215-V218 HydrophobicContact CB-CG2 4.07Å; N215-V218 PolarHBondContact O-N 3.31Å; N215-R219 PolarHBondContact O-N 2.83Å |
| 216 | A | 80.5 | Confident | 68 | Low | 3 Ų | 3 | 62.3 Ų | 62.3 | 3% | 0.025 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -55.5 | -45.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I129 A132 A214 V218 R219 A220 M314 | I129-A216 HydrophobicContact CD1-CB 3.64Å; A132-A216 HydrophobicContact CB-CB 4.25Å; A214-A216 PolarHBondContact O-N 3.47Å; A216-V218 VanDerWaalsContact C-N 3.33Å; A216-V218 PolarHBondContact O-N 3.02Å; A216-R219 PolarHBondContact O-N 3.18Å; A216-A220 WeakPolarHBondContact O-CB 3.5Å; A216-A220 PolarHBondContact O-N 3.41Å; A216-M314 HydrophobicContact CB-CG 3.89Å |
| 217 | S | 83.8 | Confident | 70.7 | Confident | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.2 | -38.6 | 178.7 | -45 | 0 | 0 | 0 | 0 | 112.4 | S108 E128 N215 A221 | S108-S217 PolarHBondContact OG-OG 3Å; E128-S217 PolarHBondContact O-OG 3.35Å; N215-S217 VanDerWaalsContact C-N 3.31Å; N215-S217 PolarHBondContact O-N 2.81Å; S217-A221 WeakPolarHBondContact O-CB 3.4Å; S217-A221 PolarHBondContact O-N 3.01Å |
| 218 | V | 83.4 | Confident | 73.2 | Confident | 5 Ų | 5 | 43.2 Ų | 43.2 | 3% | 0.03 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -71.3 | -40.7 | 177.1 | 176.5 | 0 | 0 | 0 | 0 | 110.9 | A58 L62 L184 N215 A216 A221 F222 | A58-V218 HydrophobicContact CB-CG2 3.37Å; L62-V218 HydrophobicContact CD1-CG2 4.19Å; L184-V218 HydrophobicContact CD1-CG1 3.93Å; N215-V218 HydrophobicContact CB-CB 4.3Å; N215-V218 HydrophobicContact CB-CG2 4.07Å; N215-V218 PolarHBondContact O-N 3.31Å; A216-V218 VanDerWaalsContact C-N 3.33Å; A216-V218 PolarHBondContact O-N 3.02Å; V218-A221 PolarHBondContact O-N 3.34Å; V218-F222 VanDerWaalsContact O-CB 3.28Å; V218-F222 WeakPolarHBondContact O-CB 3.34Å; V218-F222 PolarHBondContact O-N 2.98Å |
| 219 | R | 84.3 | Confident | 75.9 | Confident | 45 Ų | 45 | 41.6 Ų | 41.6 | 17% | 0.17 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.6 | -42.8 | 177.2 | -170.7 | 176.2 | 71.7 | 164.9 | 9.5 | 111.2 | A214 N215 A216 F222 V223 D273 M314 | A214-R219 HydrophobicContact CB-CB 4.4Å; N215-R219 PolarHBondContact O-N 2.83Å; A216-R219 PolarHBondContact O-N 3.18Å; R219-F222 PolarHBondContact O-N 3.33Å; R219-V223 WeakPolarHBondContact O-CG2 3.27Å; R219-V223 PolarHBondContact O-N 2.98Å; R219-D273 IonicContact CZ-OD2 2.94Å; R219-D273 IonicContact NH1-OD2 3.27Å; R219-D273 IonicContact NH2-OD2 2.74Å; R219-M314 VanDerWaalsContact CZ-CE 3.47Å; R219-M314 VanDerWaalsContact NH1-CE 3.3Å |
| 220 | A | 85.5 | Confident | 78.4 | Confident | 3 Ų | 3 | 35.3 Ų | 35.3 | 3% | 0.025 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.3 | -49.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | A132 A216 F222 V223 H224 | A132-A220 HydrophobicContact CB-CB 3.76Å; A216-A220 WeakPolarHBondContact O-CB 3.5Å; A216-A220 PolarHBondContact O-N 3.41Å; A220-F222 VanDerWaalsContact C-N 3.28Å; A220-F222 PolarHBondContact O-N 3.42Å; A220-V223 PolarHBondContact O-N 3.27Å; A220-H224 WeakPolarHBondContact O-CB 3.35Å; A220-H224 PolarHBondContact O-N 3.5Å |
| 221 | A | 86.4 | Confident | 80.3 | Confident | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.008 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.1 | -35.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113 | L62 F102 L184 S217 V218 H224 V225 | L62-A221 HydrophobicContact CD2-CB 3.53Å; F102-A221 HydrophobicContact CD1-CB 4.07Å; F102-A221 HydrophobicContact CE1-CB 4.21Å; L184-A221 HydrophobicContact CD2-CB 3.99Å; S217-A221 WeakPolarHBondContact O-CB 3.4Å; S217-A221 PolarHBondContact O-N 3.01Å; V218-A221 PolarHBondContact O-N 3.34Å; A221-H224 WeakPolarHBondContact O-CB 3.21Å; A221-H224 PolarHBondContact O-N 2.91Å; A221-V225 WeakPolarHBondContact O-CG2 3.39Å; A221-V225 PolarHBondContact O-N 2.96Å |
| 222 | F | 86.7 | Confident | 82.6 | Confident | 55 Ų | 55 | 26.5 Ų | 26.5 | 24% | 0.241 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -66.8 | -44.8 | 176.9 | 175.9 | -101.4 | 0 | 0 | 0 | 111.5 | L184 V218 R219 A220 H224 V225 M226 | L184-F222 HydrophobicContact CB-CD2 4.31Å; L184-F222 VanDerWaalsContact CD2-CA 3.44Å; L184-F222 HydrophobicContact CD2-CB 3.94Å; L184-F222 HydrophobicContact CG-CB 4.12Å; L184-F222 HydrophobicContact CG-CD2 4.25Å; V218-F222 VanDerWaalsContact O-CB 3.28Å; V218-F222 WeakPolarHBondContact O-CB 3.34Å; V218-F222 PolarHBondContact O-N 2.98Å; R219-F222 PolarHBondContact O-N 3.33Å; A220-F222 VanDerWaalsContact C-N 3.28Å; A220-F222 PolarHBondContact O-N 3.42Å; F222-H224 VanDerWaalsContact C-N 3.31Å; F222-V225 PolarHBondContact O-N 2.89Å; F222-M226 HydrophobicContact CD1-CG 4.14Å; F222-M226 HydrophobicContact CD2-CG 4.24Å; F222-M226 HydrophobicContact CE1-CG 3.73Å; F222-M226 HydrophobicContact CE1-SD 4.3Å; F222-M226 HydrophobicContact CE2-CG 3.83Å; F222-M226 HydrophobicContact CE2-SD 3.97Å; F222-M226 HydrophobicContact CG-CG 4.39Å; F222-M226 HydrophobicContact CZ-CG 3.56Å; F222-M226 HydrophobicContact CZ-SD 3.64Å; F222-M226 WeakPolarHBondContact O-CB 3.38Å; F222-M226 WeakPolarHBondContact O-CG 3.28Å; F222-M226 PolarHBondContact O-N 3.03Å |
| 223 | V | 86.1 | Confident | 84.4 | Confident | 30 Ų | 30 | 25.6 Ų | 25.6 | 18% | 0.182 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -70.3 | -33.3 | 178.7 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | R219 A220 M226 G227 T267 I270 | R219-V223 WeakPolarHBondContact O-CG2 3.27Å; R219-V223 PolarHBondContact O-N 2.98Å; A220-V223 PolarHBondContact O-N 3.27Å; V223-M226 PolarHBondContact O-N 2.82Å; V223-G227 PolarHBondContact O-N 2.86Å; V223-T267 HydrophobicContact CG1-CG2 4.26Å; V223-I270 HydrophobicContact CB-CD1 3.57Å; V223-I270 HydrophobicContact CG1-CD1 3.49Å; V223-I270 VanDerWaalsContact CG1-CD1 3.49Å; V223-I270 HydrophobicContact CG2-CD1 3.49Å; V223-I270 VanDerWaalsContact CG2-CD1 3.49Å |
| 224 | H | 87.7 | Confident | 85.8 | Confident | 4 Ų | 4 | 23.4 Ų | 23.4 | 2% | 0.019 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -54 | -61 | 168.4 | -171.4 | 97.2 | 0 | 0 | 0 | 110.7 | D98 I139 A220 A221 F222 M226 G227 D228 | D98-H224 IonicContact OD1-CD2 3.16Å; D98-H224 IonicContact OD1-CE1 3.85Å; D98-H224 IonicContact OD1-NE2 3.49Å; D98-H224 PolarHBondContact OD1-NE2 3.35Å; I139-H224 HydrophobicContact CD1-CB 3.91Å; I139-H224 HydrophobicContact CG1-CB 4.49Å; I139-H224 WeakPolarHBondContact CG1-ND1 3.46Å; A220-H224 WeakPolarHBondContact O-CB 3.35Å; A220-H224 PolarHBondContact O-N 3.5Å; A221-H224 WeakPolarHBondContact O-CB 3.21Å; A221-H224 PolarHBondContact O-N 2.91Å; F222-H224 VanDerWaalsContact C-N 3.31Å; H224-M226 PolarHBondContact O-N 3.4Å; H224-G227 WeakPolarHBondContact O-CA 3.37Å; H224-G227 PolarHBondContact O-N 3Å; H224-D228 IonicContact CD2-OD2 3.97Å; H224-D228 PolarHBondContact CD2-OD2 2.81Å; H224-D228 IonicContact NE2-OD1 3.74Å; H224-D228 IonicContact NE2-OD2 3.63Å; H224-D228 PolarHBondContact NE2-OD2 3.22Å; H224-D228 PolarHBondContact O-N 2.9Å |
| 225 | V | 89.6 | Confident | 86.9 | Confident | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -57.8 | -36.6 | 179.2 | 172.8 | 0 | 0 | 0 | 0 | 112.5 | F102 M180 A181 L184 A221 F222 D228 L229 | F102-V225 HydrophobicContact CE1-CG2 3.59Å; F102-V225 HydrophobicContact CZ-CG2 3.39Å; M180-V225 HydrophobicContact CB-CG1 3.84Å; M180-V225 HydrophobicContact CB-CG2 4.43Å; A181-V225 HydrophobicContact CB-CG1 3.91Å; L184-V225 HydrophobicContact CD2-CG2 4.25Å; A221-V225 WeakPolarHBondContact O-CG2 3.39Å; A221-V225 PolarHBondContact O-N 2.96Å; F222-V225 PolarHBondContact O-N 2.89Å; V225-D228 PolarHBondContact O-N 3.37Å; V225-L229 WeakPolarHBondContact O-CB 3.5Å; V225-L229 PolarHBondContact O-N 3.19Å |
| 226 | M | 88.9 | Confident | 87.5 | Confident | 51 Ų | 51 | 25.1 Ų | 25.1 | 25% | 0.251 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -71.7 | -33.8 | 177.7 | -67.2 | -84.9 | 61.1 | 0 | 0 | 112.9 | A181 F222 V223 H224 L229 L230 | A181-M226 HydrophobicContact CB-CE 3.58Å; A181-M226 HydrophobicContact CB-SD 4.5Å; F222-M226 HydrophobicContact CD1-CG 4.14Å; F222-M226 HydrophobicContact CD2-CG 4.24Å; F222-M226 HydrophobicContact CE1-CG 3.73Å; F222-M226 HydrophobicContact CE1-SD 4.3Å; F222-M226 HydrophobicContact CE2-CG 3.83Å; F222-M226 HydrophobicContact CE2-SD 3.97Å; F222-M226 HydrophobicContact CG-CG 4.39Å; F222-M226 HydrophobicContact CZ-CG 3.56Å; F222-M226 HydrophobicContact CZ-SD 3.64Å; F222-M226 WeakPolarHBondContact O-CB 3.38Å; F222-M226 WeakPolarHBondContact O-CG 3.28Å; F222-M226 PolarHBondContact O-N 3.03Å; V223-M226 PolarHBondContact O-N 2.82Å; H224-M226 PolarHBondContact O-N 3.4Å; M226-L229 HydrophobicContact CE-CB 3.85Å; M226-L229 HydrophobicContact CE-CD2 3.32Å; M226-L229 HydrophobicContact CE-CG 4.18Å; M226-L230 VanDerWaalsContact O-CG 3.31Å; M226-L230 WeakPolarHBondContact O-CG 3.37Å; M226-L230 PolarHBondContact O-N 3.34Å; M226-L230 VanDerWaalsContact O-N 3.15Å |
| 227 | G | 87.8 | Confident | 88.1 | Confident | 10 Ų | 10 | 28.3 Ų | 28.3 | 10% | 0.103 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -55.8 | -59.3 | 164.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | V223 H224 L229 L230 Q231 F259 | V223-G227 PolarHBondContact O-N 2.86Å; H224-G227 WeakPolarHBondContact O-CA 3.37Å; H224-G227 PolarHBondContact O-N 3Å; G227-L229 VanDerWaalsContact C-N 3.26Å; G227-L229 PolarHBondContact O-N 3.39Å; G227-L230 PolarHBondContact O-N 3.34Å; G227-Q231 PolarHBondContact O-N 3.02Å; G227-F259 WeakPolarHBondContact O-CZ 3.4Å |
| 228 | D | 88 | Confident | 88.4 | Confident | 19 Ų | 19 | 28.3 Ų | 28.3 | 10% | 0.102 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.2 | -35.4 | -175.5 | -52 | -31.5 | 0 | 0 | 0 | 112.8 | N177 H224 V225 Q231 S232 | N177-D228 PolarHBondContact ND2-O 3.17Å; H224-D228 IonicContact CD2-OD2 3.97Å; H224-D228 PolarHBondContact CD2-OD2 2.81Å; H224-D228 IonicContact NE2-OD1 3.74Å; H224-D228 IonicContact NE2-OD2 3.63Å; H224-D228 PolarHBondContact NE2-OD2 3.22Å; H224-D228 PolarHBondContact O-N 2.9Å; V225-D228 PolarHBondContact O-N 3.37Å; D228-Q231 WeakPolarHBondContact O-CB 3.47Å; D228-Q231 PolarHBondContact O-N 3.29Å; D228-S232 WeakPolarHBondContact O-CB 3.2Å; D228-S232 PolarHBondContact O-N 2.88Å; D228-S232 PolarHBondContact O-OG 2.89Å |
| 229 | L | 90.6 | Very high | 88.6 | Confident | 28 Ų | 28 | 28 Ų | 28 | 15% | 0.147 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.1 | -50.3 | 173.2 | 179.5 | 58.3 | 0 | 0 | 0 | 111.7 | V174 N177 I178 A181 V225 M226 G227 Q231 S232 V233 | V174-L229 HydrophobicContact CG1-CD1 4.35Å; N177-L229 HydrophobicContact CB-CB 3.95Å; N177-L229 HydrophobicContact CB-CD1 3.75Å; N177-L229 HydrophobicContact CB-CG 4.45Å; I178-L229 HydrophobicContact CG1-CD1 3.63Å; I178-L229 HydrophobicContact CG1-CD2 4.26Å; A181-L229 HydrophobicContact CB-CD2 4.48Å; V225-L229 WeakPolarHBondContact O-CB 3.5Å; V225-L229 PolarHBondContact O-N 3.19Å; M226-L229 HydrophobicContact CE-CB 3.85Å; M226-L229 HydrophobicContact CE-CD2 3.32Å; M226-L229 HydrophobicContact CE-CG 4.18Å; G227-L229 VanDerWaalsContact C-N 3.26Å; G227-L229 PolarHBondContact O-N 3.39Å; L229-Q231 PolarHBondContact O-N 3.48Å; L229-S232 WeakPolarHBondContact CA-OG 3.42Å; L229-S232 PolarHBondContact O-N 3.48Å; L229-S232 PolarHBondContact O-OG 3.38Å; L229-V233 HydrophobicContact CD1-CG2 4.21Å; L229-V233 WeakPolarHBondContact O-CB 3.46Å; L229-V233 VanDerWaalsContact O-CG2 3.27Å; L229-V233 WeakPolarHBondContact O-CG2 3.33Å; L229-V233 PolarHBondContact O-N 3.05Å |
| 230 | L | 89.5 | Confident | 89 | Confident | 78 Ų | 78 | 29.4 Ų | 29.4 | 41% | 0.408 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -64.8 | -34.4 | 179.2 | -71.8 | 173.8 | 0 | 0 | 0 | 111.2 | M226 G227 S234 F259 L262 | M226-L230 VanDerWaalsContact O-CG 3.31Å; M226-L230 WeakPolarHBondContact O-CG 3.37Å; M226-L230 PolarHBondContact O-N 3.34Å; M226-L230 VanDerWaalsContact O-N 3.15Å; G227-L230 PolarHBondContact O-N 3.34Å; L230-S234 WeakPolarHBondContact O-CB 3.34Å; L230-S234 PolarHBondContact O-N 3.28Å; L230-F259 HydrophobicContact CB-CD2 3.75Å; L230-F259 HydrophobicContact CB-CE2 3.11Å; L230-F259 HydrophobicContact CB-CZ 3.89Å; L230-F259 HydrophobicContact CD1-CE2 4.16Å; L230-F259 HydrophobicContact CG-CE2 4.28Å; L230-L262 HydrophobicContact CD1-CD1 4.38Å; L230-L262 HydrophobicContact CD1-CD2 3.61Å |
| 231 | Q | 88 | Confident | 89.3 | Confident | 30 Ų | 30 | 32.4 Ų | 32.4 | 14% | 0.14 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.5 | -53.4 | 173.3 | -162.5 | 174.1 | -57 | 0 | 0 | 111.5 | L146 G227 D228 L229 V233 S234 V235 F259 | L146-Q231 VanDerWaalsContact CD1-CD 3.48Å; L146-Q231 VanDerWaalsContact CD1-OE1 3.3Å; G227-Q231 PolarHBondContact O-N 3.02Å; D228-Q231 WeakPolarHBondContact O-CB 3.47Å; D228-Q231 PolarHBondContact O-N 3.29Å; L229-Q231 PolarHBondContact O-N 3.48Å; Q231-V233 VanDerWaalsContact C-N 3.27Å; Q231-V233 PolarHBondContact O-N 3Å; Q231-S234 WeakPolarHBondContact O-CA 3.49Å; Q231-S234 WeakPolarHBondContact O-CB 3.33Å; Q231-S234 PolarHBondContact O-N 2.95Å; Q231-V235 WeakPolarHBondContact O-CG2 3.37Å; Q231-V235 PolarHBondContact O-N 3.02Å; Q231-F259 HydrophobicContact CB-CD1 3.67Å; Q231-F259 HydrophobicContact CB-CE1 3.23Å; Q231-F259 HydrophobicContact CB-CG 4.45Å; Q231-F259 HydrophobicContact CB-CZ 3.75Å; Q231-F259 HydrophobicContact CG-CD1 3.63Å; Q231-F259 HydrophobicContact CG-CE1 3.59Å |
| 232 | S | 89.9 | Confident | 89.3 | Confident | 9 Ų | 9 | 32.7 Ų | 32.7 | 6% | 0.063 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.7 | -36.3 | -178.9 | 51 | 0 | 0 | 0 | 0 | 111.7 | V174 N177 D228 L229 V235 L236 | V174-S232 VanDerWaalsContact CG2-C 3.4Å; V174-S232 WeakPolarHBondContact CG2-O 3.45Å; N177-S232 PolarHBondContact ND2-OG 3.02Å; D228-S232 WeakPolarHBondContact O-CB 3.2Å; D228-S232 PolarHBondContact O-N 2.88Å; D228-S232 PolarHBondContact O-OG 2.89Å; L229-S232 WeakPolarHBondContact CA-OG 3.42Å; L229-S232 PolarHBondContact O-N 3.48Å; L229-S232 PolarHBondContact O-OG 3.38Å; S232-V235 PolarHBondContact O-N 3.39Å; S232-L236 WeakPolarHBondContact O-CB 3.21Å; S232-L236 PolarHBondContact O-N 2.74Å |
| 233 | V | 91.7 | Very high | 89.4 | Confident | 58 Ų | 58 | 33.6 Ų | 33.6 | 35% | 0.352 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -63.4 | -41.8 | 171.1 | 170.8 | 0 | 0 | 0 | 0 | 111.3 | V174 L229 Q231 V235 L236 V237 | V174-V233 HydrophobicContact CG1-CG2 4.17Å; V174-V233 HydrophobicContact CG2-CG2 3.93Å; L229-V233 HydrophobicContact CD1-CG2 4.21Å; L229-V233 WeakPolarHBondContact O-CB 3.46Å; L229-V233 VanDerWaalsContact O-CG2 3.27Å; L229-V233 WeakPolarHBondContact O-CG2 3.33Å; L229-V233 PolarHBondContact O-N 3.05Å; Q231-V233 VanDerWaalsContact C-N 3.27Å; Q231-V233 PolarHBondContact O-N 3Å; V233-V235 PolarHBondContact O-N 3.36Å; V233-L236 PolarHBondContact O-N 3.34Å; V233-V237 HydrophobicContact CG1-CG2 4.46Å; V233-V237 WeakPolarHBondContact O-CG2 3.41Å; V233-V237 PolarHBondContact O-N 3.26Å |
| 234 | S | 89.9 | Confident | 89.6 | Confident | 21 Ų | 21 | 39.4 Ų | 39.4 | 15% | 0.147 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.1 | -44 | 177.2 | -161.3 | 0 | 0 | 0 | 0 | 112.1 | L230 Q231 V237 S238 C255 | L230-S234 WeakPolarHBondContact O-CB 3.34Å; L230-S234 PolarHBondContact O-N 3.28Å; Q231-S234 WeakPolarHBondContact O-CA 3.49Å; Q231-S234 WeakPolarHBondContact O-CB 3.33Å; Q231-S234 PolarHBondContact O-N 2.95Å; S234-V237 PolarHBondContact O-N 3.02Å; S234-S238 PolarHBondContact O-N 2.91Å; S234-S238 PolarHBondContact O-OG 2.96Å; S234-C255 WeakPolarHBondContact OG-CB 3.32Å; S234-C255 PolarHBondContact OG-O 3.33Å; S234-C255 VanDerWaalsContact OG-O 3.07Å |
| 235 | V | 88.5 | Confident | 89.7 | Confident | 38 Ų | 38 | 45.1 Ų | 45.1 | 23% | 0.23 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.4 | -40.8 | 175.5 | 179.1 | 0 | 0 | 0 | 0 | 110.8 | M166 Q231 S232 V233 S238 A239 | M166-V235 HydrophobicContact CE-CG1 3.63Å; Q231-V235 WeakPolarHBondContact O-CG2 3.37Å; Q231-V235 PolarHBondContact O-N 3.02Å; S232-V235 PolarHBondContact O-N 3.39Å; V233-V235 PolarHBondContact O-N 3.36Å; V235-S238 WeakPolarHBondContact O-CB 3.27Å; V235-S238 PolarHBondContact O-N 3.02Å; V235-A239 WeakPolarHBondContact O-CB 3.26Å; V235-A239 PolarHBondContact O-N 2.85Å |
| 236 | L | 91.8 | Very high | 89.5 | Confident | 40 Ų | 40 | 49.6 Ų | 49.6 | 21% | 0.209 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.7 | -43.1 | 176.3 | 177.9 | 62.5 | 0 | 0 | 0 | 112.3 | L167 S170 V174 S232 V233 S238 A239 I240 | L167-L236 HydrophobicContact CD1-CD1 3.96Å; S170-L236 WeakPolarHBondContact OG-CA 3.14Å; S170-L236 WeakPolarHBondContact OG-CD1 3.48Å; V174-L236 HydrophobicContact CB-CD2 4.43Å; V174-L236 HydrophobicContact CG2-CB 4.15Å; V174-L236 HydrophobicContact CG2-CD2 3.93Å; S232-L236 WeakPolarHBondContact O-CB 3.21Å; S232-L236 PolarHBondContact O-N 2.74Å; V233-L236 PolarHBondContact O-N 3.34Å; L236-S238 VanDerWaalsContact C-N 3.31Å; L236-S238 PolarHBondContact O-N 3.31Å; L236-A239 PolarHBondContact O-N 2.69Å; L236-I240 HydrophobicContact CD1-CD1 4.35Å; L236-I240 HydrophobicContact CG-CD1 4.2Å; L236-I240 WeakPolarHBondContact O-CG1 2.91Å; L236-I240 PolarHBondContact O-N 3.35Å |
| 237 | V | 91.9 | Very high | 89.3 | Confident | 69 Ų | 69 | 55.4 Ų | 55.4 | 42% | 0.418 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61 | -43.5 | 174.8 | 170.2 | 0 | 0 | 0 | 0 | 110.5 | V233 S234 I240 I241 | V233-V237 HydrophobicContact CG1-CG2 4.46Å; V233-V237 WeakPolarHBondContact O-CG2 3.41Å; V233-V237 PolarHBondContact O-N 3.26Å; S234-V237 PolarHBondContact O-N 3.02Å; V237-I240 PolarHBondContact O-N 3.07Å; V237-I241 HydrophobicContact CG1-CD1 4.11Å; V237-I241 WeakPolarHBondContact O-CG1 3.41Å; V237-I241 PolarHBondContact O-N 3.32Å; V237-I241 VanDerWaalsContact O-N 3.11Å |
| 238 | S | 89.4 | Confident | 89.3 | Confident | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.9 | -44.1 | 175.8 | -56 | 0 | 0 | 0 | 0 | 111.7 | S234 V235 L236 I240 I241 I242 C255 | S234-S238 PolarHBondContact O-N 2.91Å; S234-S238 PolarHBondContact O-OG 2.96Å; V235-S238 WeakPolarHBondContact O-CB 3.27Å; V235-S238 PolarHBondContact O-N 3.02Å; L236-S238 VanDerWaalsContact C-N 3.31Å; L236-S238 PolarHBondContact O-N 3.31Å; S238-I240 PolarHBondContact O-N 3.24Å; S238-I241 PolarHBondContact O-N 2.77Å; S238-I242 WeakPolarHBondContact O-CD1 3.5Å; S238-I242 VanDerWaalsContact O-CG1 3.27Å; S238-I242 WeakPolarHBondContact O-CG1 3.42Å; S238-I242 PolarHBondContact O-N 3.02Å; S238-C255 WeakPolarHBondContact OG-CB 3.33Å; S238-C255 PolarHBondContact OG-SG 3.34Å |
| 239 | A | 89.1 | Confident | 89.1 | Confident | 0 Ų | 0 | 63.2 Ų | 63.2 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60.8 | -42.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | M166 L167 V235 L236 I242 F243 | M166-A239 HydrophobicContact CB-CB 4.34Å; M166-A239 HydrophobicContact CE-CB 4.23Å; M166-A239 HydrophobicContact CG-CB 3.83Å; M166-A239 HydrophobicContact SD-CB 3.97Å; L167-A239 HydrophobicContact CB-CB 4.43Å; L167-A239 HydrophobicContact CD1-CB 4.26Å; V235-A239 WeakPolarHBondContact O-CB 3.26Å; V235-A239 PolarHBondContact O-N 2.85Å; L236-A239 PolarHBondContact O-N 2.69Å; A239-I242 PolarHBondContact O-N 2.87Å; A239-F243 WeakPolarHBondContact O-CB 3.49Å; A239-F243 PolarHBondContact O-N 3.48Å |
| 240 | I | 91.9 | Very high | 88.9 | Confident | 73 Ų | 73 | 65.5 Ų | 65.5 | 37% | 0.374 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 175.4 | -69.5 | 162.6 | 0 | 0 | 0 | 111.1 | L167 L236 V237 S238 F243 F244 | L167-I240 HydrophobicContact CD1-CG1 3.62Å; L236-I240 HydrophobicContact CD1-CD1 4.35Å; L236-I240 HydrophobicContact CG-CD1 4.2Å; L236-I240 WeakPolarHBondContact O-CG1 2.91Å; L236-I240 PolarHBondContact O-N 3.35Å; V237-I240 PolarHBondContact O-N 3.07Å; S238-I240 PolarHBondContact O-N 3.24Å; I240-F243 PolarHBondContact O-N 2.84Å; I240-F244 HydrophobicContact CG2-CD2 4.01Å; I240-F244 HydrophobicContact CG2-CE2 4.06Å; I240-F244 VanDerWaalsContact O-CD2 3.32Å; I240-F244 WeakPolarHBondContact O-CD2 3.44Å; I240-F244 PolarHBondContact O-N 2.61Å |
| 241 | I | 90.9 | Very high | 88.9 | Confident | 67 Ų | 67 | 62.4 Ų | 62.4 | 34% | 0.344 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62 | -48.9 | 178.5 | -67.8 | 166.9 | 0 | 0 | 0 | 110.4 | V237 S238 F243 F244 K245 A251 | V237-I241 HydrophobicContact CG1-CD1 4.11Å; V237-I241 WeakPolarHBondContact O-CG1 3.41Å; V237-I241 PolarHBondContact O-N 3.32Å; V237-I241 VanDerWaalsContact O-N 3.11Å; S238-I241 PolarHBondContact O-N 2.77Å; I241-F243 VanDerWaalsContact C-N 3.31Å; I241-F243 PolarHBondContact O-N 2.87Å; I241-F244 PolarHBondContact O-N 2.95Å; I241-K245 PolarHBondContact O-N 3.43Å; I241-A251 HydrophobicContact CB-CB 4.44Å; I241-A251 HydrophobicContact CD1-CB 4.28Å; I241-A251 HydrophobicContact CG2-CB 4.04Å |
| 242 | I | 87.8 | Confident | 88.8 | Confident | 7 Ų | 7 | 61.1 Ų | 61.1 | 4% | 0.036 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64 | -37.8 | -179.6 | -66.6 | 164.1 | 0 | 0 | 0 | 110.9 | I161 M166 S238 A239 K245 P246 D252 | I161-I242 HydrophobicContact CB-CG2 4.49Å; I161-I242 HydrophobicContact CD1-CD1 3.9Å; I161-I242 HydrophobicContact CG2-CG2 4.41Å; M166-I242 HydrophobicContact CE-CD1 4.46Å; M166-I242 HydrophobicContact SD-CD1 4.19Å; S238-I242 WeakPolarHBondContact O-CD1 3.5Å; S238-I242 VanDerWaalsContact O-CG1 3.27Å; S238-I242 WeakPolarHBondContact O-CG1 3.42Å; S238-I242 PolarHBondContact O-N 3.02Å; A239-I242 PolarHBondContact O-N 2.87Å; I242-K245 CarbonylContact O-C 3.32Å; I242-K245 VanDerWaalsContact O-C 3.32Å; I242-K245 PolarHBondContact O-N 3.37Å; I242-P246 VanDerWaalsContact O-CA 3.3Å; I242-P246 WeakPolarHBondContact O-CA 3.39Å; I242-P246 WeakPolarHBondContact O-CD 3.4Å; I242-P246 WeakPolarHBondContact O-CG 3.29Å; I242-P246 VanDerWaalsContact O-N 3.09Å; I242-D252 HydrophobicContact CD1-CB 4.14Å |
| 243 | F | 88.7 | Confident | 88.8 | Confident | 74 Ų | 74 | 60.7 Ų | 60.7 | 33% | 0.325 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61 | -45.9 | 178.3 | -177.2 | -94.2 | 0 | 0 | 0 | 112.7 | H164 L167 A239 I240 I241 | H164-F243 AromaticContact CE1-CE2 3.4Å; H164-F243 VanDerWaalsContact CE1-CE2 3.4Å; H164-F243 WeakPolarHBondContact CE1-CE2 3.43Å; H164-F243 AromaticContact CE1-CZ 3.92Å; H164-F243 AromaticContact ND1-CE2 3.56Å; H164-F243 AromaticContact NE2-CE2 3.74Å; L167-F243 HydrophobicContact CD2-CD2 4.24Å; L167-F243 HydrophobicContact CD2-CG 4.39Å; A239-F243 WeakPolarHBondContact O-CB 3.49Å; A239-F243 PolarHBondContact O-N 3.48Å; I240-F243 PolarHBondContact O-N 2.84Å; I241-F243 VanDerWaalsContact C-N 3.31Å; I241-F243 PolarHBondContact O-N 2.87Å |
| 244 | F | 90.2 | Very high | 88.8 | Confident | 151 Ų | 151 | 62 Ų | 62 | 66% | 0.662 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -82.4 | -28.4 | 178.9 | -74.3 | -69.5 | 0 | 0 | 0 | 113.3 | I240 I241 | I240-F244 HydrophobicContact CG2-CD2 4.01Å; I240-F244 HydrophobicContact CG2-CE2 4.06Å; I240-F244 VanDerWaalsContact O-CD2 3.32Å; I240-F244 WeakPolarHBondContact O-CD2 3.44Å; I240-F244 PolarHBondContact O-N 2.61Å; I241-F244 PolarHBondContact O-N 2.95Å |
| 245 | K | 90.2 | Very high | 88.8 | Confident | 124 Ų | 124 | 62 Ų | 62 | 54% | 0.539 | 31% | 0.306 | S | S | . | . | trans | -141.9 | 83.7 | -177 | -63.2 | -70.8 | -174.8 | 174.8 | 0 | 110.8 | I241 I242 E247 Y248 | I241-K245 PolarHBondContact O-N 3.43Å; I242-K245 CarbonylContact O-C 3.32Å; I242-K245 VanDerWaalsContact O-C 3.32Å; I242-K245 PolarHBondContact O-N 3.37Å; K245-E247 PolarHBondContact O-N 2.93Å; K245-Y248 HydrophobicContact CB-CD2 3.55Å; K245-Y248 HydrophobicContact CB-CE2 4.05Å; K245-Y248 HydrophobicContact CG-CD2 4.3Å; K245-Y248 HydrophobicContact CG-CE2 4.35Å; K245-Y248 PolarHBondContact O-N 3.46Å | ||
| 246 | P | 84.8 | Confident | 88.9 | Confident | 94 Ų | 94 | 61 Ų | 61 | 61% | 0.61 | 30% | 0.301 | S | S | * | . | G | 310 helix | trans | -57.1 | -24.4 | -178.4 | -27.2 | 35.3 | 0 | 0 | 0 | 114.5 | I242 Y248 K249 | I242-P246 VanDerWaalsContact O-CA 3.3Å; I242-P246 WeakPolarHBondContact O-CA 3.39Å; I242-P246 WeakPolarHBondContact O-CD 3.4Å; I242-P246 WeakPolarHBondContact O-CG 3.29Å; I242-P246 VanDerWaalsContact O-N 3.09Å; P246-Y248 PolarHBondContact O-N 3.34Å; P246-K249 PolarHBondContact O-N 2.9Å |
| 247 | E | 85.4 | Confident | 88.9 | Confident | 174 Ų | 174 | 62.3 Ų | 62.3 | 81% | 0.813 | 31% | 0.305 | S | S | * | . | G | 310 helix | trans | -61.3 | -23.5 | 176.2 | -62.7 | 173.5 | -169.1 | 0 | 0 | 113.4 | K245 K249 | K245-E247 PolarHBondContact O-N 2.93Å; E247-K249 VanDerWaalsContact C-N 3.31Å; E247-K249 PolarHBondContact O-N 3.48Å |
| 248 | Y | 87.5 | Confident | 88.9 | Confident | 135 Ų | 135 | 64.5 Ų | 64.5 | 53% | 0.529 | 31% | 0.314 | S | S | . | . | G | 310 helix | trans | -93.3 | 39.5 | 179.5 | -65.5 | -91.7 | 0 | 0 | 0 | 112.8 | K245 P246 I250 A251 | K245-Y248 HydrophobicContact CB-CD2 3.55Å; K245-Y248 HydrophobicContact CB-CE2 4.05Å; K245-Y248 HydrophobicContact CG-CD2 4.3Å; K245-Y248 HydrophobicContact CG-CE2 4.35Å; K245-Y248 PolarHBondContact O-N 3.46Å; P246-Y248 PolarHBondContact O-N 3.34Å; Y248-I250 PolarHBondContact O-N 2.84Å; Y248-A251 VanDerWaalsContact O-CB 3.27Å; Y248-A251 WeakPolarHBondContact O-CB 3.33Å; Y248-A251 PolarHBondContact O-N 3.32Å |
| 249 | K | 83.9 | Confident | 88.8 | Confident | 58 Ų | 58 | 65.2 Ų | 65.2 | 25% | 0.252 | 32% | 0.317 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56 | -22.7 | 176.2 | 63.7 | 176.7 | 176.2 | 170.3 | 0 | 114.2 | D157 Y159 P246 E247 A251 | D157-K249 PolarHBondContact O-NZ 3.18Å; D157-K249 WeakPolarHBondContact OD1-CE 3.47Å; D157-K249 IonicContact OD1-NZ 3.2Å; D157-K249 PolarHBondContact OD1-NZ 3.14Å; D157-K249 IonicContact OD2-NZ 3.16Å; D157-K249 PolarHBondContact OD2-NZ 3.05Å; Y159-K249 HydrophobicContact CE1-CD 4.28Å; Y159-K249 HydrophobicContact CE2-CB 4.1Å; Y159-K249 HydrophobicContact CE2-CD 4.4Å; Y159-K249 PolarHBondContact OH-O 3.32Å; P246-K249 PolarHBondContact O-N 2.9Å; E247-K249 VanDerWaalsContact C-N 3.31Å; E247-K249 PolarHBondContact O-N 3.48Å; K249-A251 PolarHBondContact O-N 3.45Å |
| 250 | I | 86.9 | Confident | 88.9 | Confident | 75 Ų | 75 | 65.5 Ų | 65.5 | 39% | 0.385 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -15.6 | 175.7 | -161.9 | 63 | 0 | 0 | 0 | 113.8 | I154 Y248 D252 P253 I254 | I154-I250 HydrophobicContact CD1-CD1 4.07Å; I154-I250 HydrophobicContact CG1-CD1 3.7Å; Y248-I250 PolarHBondContact O-N 2.84Å; I250-D252 VanDerWaalsContact C-N 3.27Å; I250-D252 PolarHBondContact O-N 3.25Å; I250-P253 WeakPolarHBondContact O-CD 3.36Å; I250-I254 HydrophobicContact CG1-CD1 4.07Å; I250-I254 HydrophobicContact CG1-CG1 4.41Å; I250-I254 HydrophobicContact CG2-CD1 4.25Å; I250-I254 WeakPolarHBondContact O-CG1 3.37Å; I250-I254 PolarHBondContact O-N 3.39Å |
| 251 | A | 87.6 | Confident | 88.9 | Confident | 13 Ų | 13 | 67 Ų | 67 | 11% | 0.107 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -58.6 | -39.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I241 Y248 K249 I254 C255 | I241-A251 HydrophobicContact CB-CB 4.44Å; I241-A251 HydrophobicContact CD1-CB 4.28Å; I241-A251 HydrophobicContact CG2-CB 4.04Å; Y248-A251 VanDerWaalsContact O-CB 3.27Å; Y248-A251 WeakPolarHBondContact O-CB 3.33Å; Y248-A251 PolarHBondContact O-N 3.32Å; K249-A251 PolarHBondContact O-N 3.45Å; A251-I254 PolarHBondContact O-N 3.13Å; A251-C255 VanDerWaalsContact O-CB 3.26Å; A251-C255 WeakPolarHBondContact O-CB 3.47Å; A251-C255 PolarHBondContact O-N 3.21Å |
| 252 | D | 87.7 | Confident | 88.9 | Confident | 4 Ų | 4 | 67.3 Ų | 67.3 | 2% | 0.021 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.7 | -50.3 | -177.7 | 171.5 | 77.4 | 0 | 0 | 0 | 113.3 | R153 M166 I242 I250 I254 C255 T256 | R153-D252 IonicContact CZ-OD2 2.97Å; R153-D252 IonicContact NH1-OD1 2.68Å; R153-D252 IonicContact NH1-OD2 2.76Å; R153-D252 PolarHBondContact NH1-OD2 3.3Å; M166-D252 HydrophobicContact CE-CB 4.4Å; M166-D252 WeakPolarHBondContact CE-OD1 3.41Å; I242-D252 HydrophobicContact CD1-CB 4.14Å; I250-D252 VanDerWaalsContact C-N 3.27Å; I250-D252 PolarHBondContact O-N 3.25Å; D252-I254 PolarHBondContact O-N 3.48Å; D252-C255 PolarHBondContact O-N 3.4Å; D252-T256 PolarHBondContact O-N 2.91Å; D252-T256 PolarHBondContact O-OG1 2.95Å |
| 253 | P | 89.4 | Confident | 89 | Confident | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -57.9 | -43.5 | 171.1 | -29.2 | 34.8 | 0 | 0 | 0 | 114.1 | A150 R153 I154 I250 C255 T256 F257 | A150-P253 HydrophobicContact CB-CB 4.29Å; R153-P253 HydrophobicContact CB-CG 4.18Å; I154-P253 HydrophobicContact CD1-CB 3.71Å; I154-P253 HydrophobicContact CD1-CG 4.5Å; I154-P253 HydrophobicContact CG1-CB 3.7Å; I154-P253 HydrophobicContact CG1-CG 3.96Å; I250-P253 WeakPolarHBondContact O-CD 3.36Å; P253-C255 PolarHBondContact O-N 2.85Å; P253-T256 WeakPolarHBondContact O-CB 3.42Å; P253-T256 PolarHBondContact O-N 2.94Å; P253-T256 VanDerWaalsContact O-N 3.17Å; P253-F257 HydrophobicContact CB-CE2 4.39Å; P253-F257 WeakPolarHBondContact O-CD2 3.46Å; P253-F257 PolarHBondContact O-N 2.94Å |
| 254 | I | 91.4 | Very high | 89.1 | Confident | 84 Ų | 84 | 67.2 Ų | 67.2 | 43% | 0.431 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -60.9 | -47.2 | 179.6 | -67 | 168.6 | 0 | 0 | 0 | 110.6 | I250 A251 D252 T256 F257 L258 | I250-I254 HydrophobicContact CG1-CD1 4.07Å; I250-I254 HydrophobicContact CG1-CG1 4.41Å; I250-I254 HydrophobicContact CG2-CD1 4.25Å; I250-I254 WeakPolarHBondContact O-CG1 3.37Å; I250-I254 PolarHBondContact O-N 3.39Å; A251-I254 PolarHBondContact O-N 3.13Å; D252-I254 PolarHBondContact O-N 3.48Å; I254-T256 VanDerWaalsContact C-N 3.28Å; I254-T256 PolarHBondContact O-N 3.24Å; I254-F257 PolarHBondContact O-N 2.97Å; I254-L258 HydrophobicContact CG2-CD1 4.08Å; I254-L258 WeakPolarHBondContact O-CG 3.41Å; I254-L258 PolarHBondContact O-N 3.09Å |
| 255 | C | 89.9 | Confident | 89.1 | Confident | 22 Ų | 22 | 63.8 Ų | 63.8 | 15% | 0.149 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -59.4 | -38.2 | 175.6 | -87.4 | 0 | 0 | 0 | 0 | 112.3 | S234 S238 A251 D252 P253 F259 | S234-C255 WeakPolarHBondContact OG-CB 3.32Å; S234-C255 PolarHBondContact OG-O 3.33Å; S234-C255 VanDerWaalsContact OG-O 3.07Å; S238-C255 WeakPolarHBondContact OG-CB 3.33Å; S238-C255 PolarHBondContact OG-SG 3.34Å; A251-C255 VanDerWaalsContact O-CB 3.26Å; A251-C255 WeakPolarHBondContact O-CB 3.47Å; A251-C255 PolarHBondContact O-N 3.21Å; D252-C255 PolarHBondContact O-N 3.4Å; P253-C255 PolarHBondContact O-N 2.85Å; C255-F259 VanDerWaalsContact O-CB 3.28Å; C255-F259 WeakPolarHBondContact O-CB 3.36Å; C255-F259 PolarHBondContact O-N 3.32Å; C255-F259 VanDerWaalsContact O-N 3.15Å |
| 256 | T | 89.9 | Confident | 89 | Confident | 18 Ų | 18 | 60.6 Ų | 60.6 | 11% | 0.11 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.7 | -44.8 | 175.8 | -57.1 | 0 | 0 | 0 | 0 | 112 | L146 A150 D252 P253 I254 F259 S260 | L146-T256 HydrophobicContact CB-CG2 4.2Å; A150-T256 HydrophobicContact CB-CG2 3.96Å; D252-T256 PolarHBondContact O-N 2.91Å; D252-T256 PolarHBondContact O-OG1 2.95Å; P253-T256 WeakPolarHBondContact O-CB 3.42Å; P253-T256 PolarHBondContact O-N 2.94Å; P253-T256 VanDerWaalsContact O-N 3.17Å; I254-T256 VanDerWaalsContact C-N 3.28Å; I254-T256 PolarHBondContact O-N 3.24Å; T256-F259 PolarHBondContact O-N 3.01Å; T256-S260 WeakPolarHBondContact O-CB 3.26Å; T256-S260 PolarHBondContact O-N 2.9Å; T256-S260 PolarHBondContact O-OG 3.19Å |
| 257 | F | 92.8 | Very high | 89.2 | Confident | 67 Ų | 67 | 56.2 Ų | 56.2 | 29% | 0.294 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64.2 | -48.9 | 177.6 | -73.3 | -67.8 | 0 | 0 | 0 | 112.9 | V147 A150 V151 I154 P253 I254 F259 S260 I261 | V147-F257 HydrophobicContact CG1-CD1 4.21Å; V147-F257 HydrophobicContact CG1-CE1 3.79Å; A150-F257 HydrophobicContact CB-CE2 4.22Å; A150-F257 HydrophobicContact CB-CZ 4.22Å; V151-F257 HydrophobicContact CG2-CE1 3.95Å; V151-F257 HydrophobicContact CG2-CZ 3.6Å; I154-F257 HydrophobicContact CD1-CE2 3.74Å; I154-F257 HydrophobicContact CD1-CZ 4.47Å; P253-F257 HydrophobicContact CB-CE2 4.39Å; P253-F257 WeakPolarHBondContact O-CD2 3.46Å; P253-F257 PolarHBondContact O-N 2.94Å; I254-F257 PolarHBondContact O-N 2.97Å; F257-F259 PolarHBondContact O-N 2.93Å; F257-S260 PolarHBondContact O-N 3.04Å; F257-I261 WeakPolarHBondContact O-CG1 3.32Å; F257-I261 PolarHBondContact O-N 2.89Å; F257-I261 VanDerWaalsContact O-N 3.09Å |
| 258 | L | 91.8 | Very high | 89.4 | Confident | 115 Ų | 115 | 54 Ų | 54 | 60% | 0.602 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -56.5 | -44.1 | 179.4 | -73.9 | 174.4 | 0 | 0 | 0 | 110.9 | I254 L262 | I254-L258 HydrophobicContact CG2-CD1 4.08Å; I254-L258 WeakPolarHBondContact O-CG 3.41Å; I254-L258 PolarHBondContact O-N 3.09Å; L258-L262 PolarHBondContact O-N 3.02Å |
| 259 | F | 87.4 | Confident | 89.4 | Confident | 15 Ų | 15 | 51.1 Ų | 51.1 | 7% | 0.066 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -71.4 | -40.4 | -179.8 | 178.1 | -103 | 0 | 0 | 0 | 113 | G227 L230 Q231 C255 T256 F257 I261 L262 V263 | G227-F259 WeakPolarHBondContact O-CZ 3.4Å; L230-F259 HydrophobicContact CB-CD2 3.75Å; L230-F259 HydrophobicContact CB-CE2 3.11Å; L230-F259 HydrophobicContact CB-CZ 3.89Å; L230-F259 HydrophobicContact CD1-CE2 4.16Å; L230-F259 HydrophobicContact CG-CE2 4.28Å; Q231-F259 HydrophobicContact CB-CD1 3.67Å; Q231-F259 HydrophobicContact CB-CE1 3.23Å; Q231-F259 HydrophobicContact CB-CG 4.45Å; Q231-F259 HydrophobicContact CB-CZ 3.75Å; Q231-F259 HydrophobicContact CG-CD1 3.63Å; Q231-F259 HydrophobicContact CG-CE1 3.59Å; C255-F259 VanDerWaalsContact O-CB 3.28Å; C255-F259 WeakPolarHBondContact O-CB 3.36Å; C255-F259 PolarHBondContact O-N 3.32Å; C255-F259 VanDerWaalsContact O-N 3.15Å; T256-F259 PolarHBondContact O-N 3.01Å; F257-F259 PolarHBondContact O-N 2.93Å; F259-I261 PolarHBondContact O-N 3.4Å; F259-L262 HydrophobicContact CE2-CD2 4.33Å; F259-L262 WeakPolarHBondContact O-CA 3.34Å; F259-L262 WeakPolarHBondContact O-CB 3.23Å; F259-L262 PolarHBondContact O-N 3.45Å; F259-V263 HydrophobicContact CD1-CG2 3.99Å; F259-V263 HydrophobicContact CD2-CG2 4.39Å; F259-V263 HydrophobicContact CE1-CG2 3.17Å; F259-V263 HydrophobicContact CE2-CG2 3.58Å; F259-V263 HydrophobicContact CZ-CB 4.42Å; F259-V263 HydrophobicContact CZ-CG2 2.93Å; F259-V263 PolarHBondContact O-N 2.84Å |
| 260 | S | 90.9 | Very high | 89.5 | Confident | 5 Ų | 5 | 49 Ų | 49 | 4% | 0.035 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -57.2 | -40 | 175.9 | -61.8 | 0 | 0 | 0 | 0 | 111.8 | V147 T256 F257 V263 L264 | V147-S260 VanDerWaalsContact CG2-OG 3.24Å; V147-S260 WeakPolarHBondContact CG2-OG 3.42Å; T256-S260 WeakPolarHBondContact O-CB 3.26Å; T256-S260 PolarHBondContact O-N 2.9Å; T256-S260 PolarHBondContact O-OG 3.19Å; F257-S260 PolarHBondContact O-N 3.04Å; S260-V263 PolarHBondContact O-N 3.44Å; S260-L264 WeakPolarHBondContact O-CB 3.48Å; S260-L264 VanDerWaalsContact O-CG 3.26Å; S260-L264 WeakPolarHBondContact O-CG 3.41Å; S260-L264 PolarHBondContact O-N 3.03Å |
| 261 | I | 92.4 | Very high | 89.7 | Confident | 105 Ų | 105 | 45.9 Ų | 45.9 | 54% | 0.538 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.7 | -45.6 | 173.9 | -67.2 | 167.2 | 0 | 0 | 0 | 110.8 | F257 F259 V263 L264 C265 | F257-I261 WeakPolarHBondContact O-CG1 3.32Å; F257-I261 PolarHBondContact O-N 2.89Å; F257-I261 VanDerWaalsContact O-N 3.09Å; F259-I261 PolarHBondContact O-N 3.4Å; I261-V263 PolarHBondContact O-N 2.75Å; I261-L264 PolarHBondContact O-N 3.29Å; I261-C265 WeakPolarHBondContact O-CB 3.44Å; I261-C265 PolarHBondContact O-N 3.47Å; I261-C265 PolarHBondContact O-SG 3.48Å |
| 262 | L | 90.4 | Very high | 89.9 | Confident | 74 Ų | 74 | 52.4 Ų | 52.4 | 39% | 0.387 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.1 | -45.2 | 178.5 | -170.6 | 161 | 0 | 0 | 0 | 111.7 | L230 L258 F259 C265 T266 | L230-L262 HydrophobicContact CD1-CD1 4.38Å; L230-L262 HydrophobicContact CD1-CD2 3.61Å; L258-L262 PolarHBondContact O-N 3.02Å; F259-L262 HydrophobicContact CE2-CD2 4.33Å; F259-L262 WeakPolarHBondContact O-CA 3.34Å; F259-L262 WeakPolarHBondContact O-CB 3.23Å; F259-L262 PolarHBondContact O-N 3.45Å; L262-C265 PolarHBondContact O-N 2.95Å; L262-T266 HydrophobicContact CD2-CG2 3.99Å; L262-T266 WeakPolarHBondContact O-CG2 3.48Å; L262-T266 PolarHBondContact O-N 3.34Å; L262-T266 PolarHBondContact O-OG1 3.44Å; L262-T266 VanDerWaalsContact O-OG1 3.1Å |
| 263 | V | 89.1 | Confident | 89.8 | Confident | 4 Ų | 4 | 53.9 Ų | 53.9 | 2% | 0.024 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.6 | -47.7 | 176.4 | 174.3 | 0 | 0 | 0 | 0 | 111.3 | I139 F259 S260 I261 C265 T266 T267 | I139-V263 HydrophobicContact CG2-CG1 3.36Å; F259-V263 HydrophobicContact CD1-CG2 3.99Å; F259-V263 HydrophobicContact CD2-CG2 4.39Å; F259-V263 HydrophobicContact CE1-CG2 3.17Å; F259-V263 HydrophobicContact CE2-CG2 3.58Å; F259-V263 HydrophobicContact CZ-CB 4.42Å; F259-V263 HydrophobicContact CZ-CG2 2.93Å; F259-V263 PolarHBondContact O-N 2.84Å; S260-V263 PolarHBondContact O-N 3.44Å; I261-V263 PolarHBondContact O-N 2.75Å; V263-C265 VanDerWaalsContact C-N 3.33Å; V263-C265 PolarHBondContact O-N 2.86Å; V263-T266 PolarHBondContact O-N 3.4Å; V263-T266 PolarHBondContact O-OG1 2.93Å; V263-T267 HydrophobicContact CG1-CG2 4.08Å; V263-T267 WeakPolarHBondContact O-CB 3.48Å; V263-T267 WeakPolarHBondContact O-CG2 3.27Å; V263-T267 PolarHBondContact O-N 3.44Å; V263-T267 PolarHBondContact O-OG1 3.24Å |
| 264 | L | 91.3 | Very high | 89.9 | Confident | 74 Ų | 74 | 54 Ų | 54 | 39% | 0.387 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 179.4 | -70 | 173.2 | 0 | 0 | 0 | 111 | W140 T143 S260 I261 T267 F268 | W140-L264 HydrophobicContact CD2-CD2 4.47Å; W140-L264 HydrophobicContact CG-CD2 4.18Å; T143-L264 HydrophobicContact CG2-CG 4.44Å; S260-L264 WeakPolarHBondContact O-CB 3.48Å; S260-L264 VanDerWaalsContact O-CG 3.26Å; S260-L264 WeakPolarHBondContact O-CG 3.41Å; S260-L264 PolarHBondContact O-N 3.03Å; I261-L264 PolarHBondContact O-N 3.29Å; L264-T267 PolarHBondContact O-OG1 3.11Å; L264-F268 WeakPolarHBondContact O-CB 3.39Å; L264-F268 PolarHBondContact O-N 3.4Å |
| 265 | C | 91.1 | Very high | 89.9 | Confident | 79 Ų | 79 | 53.4 Ų | 53.4 | 53% | 0.534 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -61.3 | -47.2 | 176.2 | -72 | 0 | 0 | 0 | 0 | 112.6 | I261 L262 V263 | I261-C265 WeakPolarHBondContact O-CB 3.44Å; I261-C265 PolarHBondContact O-N 3.47Å; I261-C265 PolarHBondContact O-SG 3.48Å; L262-C265 PolarHBondContact O-N 2.95Å; V263-C265 VanDerWaalsContact C-N 3.33Å; V263-C265 PolarHBondContact O-N 2.86Å |
| 266 | T | 86.9 | Confident | 90 | Very high | 58 Ų | 58 | 55.5 Ų | 55.5 | 36% | 0.356 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -68.3 | -45.2 | -178.4 | 53.9 | 0 | 0 | 0 | 0 | 111.6 | L262 V263 F268 T269 | L262-T266 HydrophobicContact CD2-CG2 3.99Å; L262-T266 WeakPolarHBondContact O-CG2 3.48Å; L262-T266 PolarHBondContact O-N 3.34Å; L262-T266 PolarHBondContact O-OG1 3.44Å; L262-T266 VanDerWaalsContact O-OG1 3.1Å; V263-T266 PolarHBondContact O-N 3.4Å; V263-T266 PolarHBondContact O-OG1 2.93Å; T266-F268 PolarHBondContact O-N 3.43Å; T266-T269 PolarHBondContact O-N 3.22Å; T266-T269 PolarHBondContact O-OG1 2.96Å |
| 267 | T | 88.9 | Confident | 90 | Very high | 1 Ų | 1 | 54.9 Ų | 54.9 | 1% | 0.006 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -70.1 | -30 | 179.7 | 56.2 | 0 | 0 | 0 | 0 | 113.4 | I139 W140 V223 V263 L264 T269 I270 M271 | I139-T267 HydrophobicContact CD1-CG2 4.06Å; I139-T267 HydrophobicContact CG2-CG2 4.1Å; W140-T267 PolarHBondContact NE1-OG1 3.2Å; V223-T267 HydrophobicContact CG1-CG2 4.26Å; V263-T267 HydrophobicContact CG1-CG2 4.08Å; V263-T267 WeakPolarHBondContact O-CB 3.48Å; V263-T267 WeakPolarHBondContact O-CG2 3.27Å; V263-T267 PolarHBondContact O-N 3.44Å; V263-T267 PolarHBondContact O-OG1 3.24Å; L264-T267 PolarHBondContact O-OG1 3.11Å; T267-T269 VanDerWaalsContact C-N 3.28Å; T267-T269 PolarHBondContact O-N 3.44Å; T267-I270 PolarHBondContact O-N 3.29Å; T267-I270 VanDerWaalsContact O-N 3.13Å; T267-M271 WeakPolarHBondContact O-CB 3.39Å; T267-M271 PolarHBondContact O-N 2.91Å |
| 268 | F | 90.8 | Very high | 90 | Very high | 129 Ų | 129 | 54.1 Ų | 54.1 | 57% | 0.566 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -58.8 | -39.3 | 175.1 | -178.7 | -99.9 | 0 | 0 | 0 | 112.4 | L264 T266 I270 M271 R272 | L264-F268 WeakPolarHBondContact O-CB 3.39Å; L264-F268 PolarHBondContact O-N 3.4Å; T266-F268 PolarHBondContact O-N 3.43Å; F268-I270 VanDerWaalsContact C-N 3.29Å; F268-I270 PolarHBondContact O-N 2.81Å; F268-M271 PolarHBondContact O-N 3.42Å; F268-R272 PolarHBondContact O-N 3.03Å |
| 269 | T | 86.8 | Confident | 90.2 | Very high | 73 Ų | 73 | 55.5 Ų | 55.5 | 45% | 0.448 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.9 | -38.3 | 177 | 67.4 | 0 | 0 | 0 | 0 | 112.3 | T266 T267 D273 | T266-T269 PolarHBondContact O-N 3.22Å; T266-T269 PolarHBondContact O-OG1 2.96Å; T267-T269 VanDerWaalsContact C-N 3.28Å; T267-T269 PolarHBondContact O-N 3.44Å; T269-D273 PolarHBondContact O-N 3.37Å |
| 270 | I | 86.7 | Confident | 90.5 | Very high | 13 Ų | 13 | 59.9 Ų | 59.9 | 7% | 0.067 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -73.9 | -43 | 179.6 | -60.7 | 167.3 | 0 | 0 | 0 | 110.5 | V136 V223 T267 F268 R272 D273 I274 | V136-I270 HydrophobicContact CG2-CG2 4.27Å; V223-I270 HydrophobicContact CB-CD1 3.57Å; V223-I270 HydrophobicContact CG1-CD1 3.49Å; V223-I270 VanDerWaalsContact CG1-CD1 3.49Å; V223-I270 HydrophobicContact CG2-CD1 3.49Å; V223-I270 VanDerWaalsContact CG2-CD1 3.49Å; T267-I270 PolarHBondContact O-N 3.29Å; T267-I270 VanDerWaalsContact O-N 3.13Å; F268-I270 VanDerWaalsContact C-N 3.29Å; F268-I270 PolarHBondContact O-N 2.81Å; I270-R272 VanDerWaalsContact C-N 3.28Å; I270-R272 PolarHBondContact O-N 3.48Å; I270-D273 PolarHBondContact O-N 3.46Å; I270-I274 HydrophobicContact CG2-CD1 3.75Å; I270-I274 HydrophobicContact CG2-CG1 4.29Å; I270-I274 WeakPolarHBondContact O-CG1 3.49Å; I270-I274 PolarHBondContact O-N 3.24Å |
| 271 | M | 90.9 | Very high | 90.4 | Very high | 10 Ų | 10 | 60.7 Ų | 60.7 | 5% | 0.049 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -54.2 | -48.5 | 174.8 | -179.7 | 63.9 | 84.1 | 0 | 0 | 110.2 | L133 V136 F137 W140 T267 F268 D273 I274 L275 | L133-M271 HydrophobicContact CD1-CE 3.84Å; L133-M271 HydrophobicContact CD1-SD 3.26Å; L133-M271 WeakPolarHBondContact CD1-SD 3.38Å; V136-M271 HydrophobicContact CB-CE 4.28Å; V136-M271 HydrophobicContact CG1-CB 4.5Å; V136-M271 HydrophobicContact CG1-CE 3.66Å; F137-M271 HydrophobicContact CD1-CE 3.98Å; F137-M271 HydrophobicContact CE1-CE 3.6Å; F137-M271 HydrophobicContact CE2-CE 4.33Å; F137-M271 HydrophobicContact CG-CE 4.47Å; F137-M271 HydrophobicContact CZ-CE 3.8Å; W140-M271 HydrophobicContact CH2-CE 3.98Å; W140-M271 HydrophobicContact CH2-CG 4.24Å; W140-M271 HydrophobicContact CZ2-CB 4.41Å; W140-M271 HydrophobicContact CZ2-CE 4.14Å; W140-M271 HydrophobicContact CZ2-CG 4.43Å; W140-M271 HydrophobicContact CZ3-CE 4.19Å; T267-M271 WeakPolarHBondContact O-CB 3.39Å; T267-M271 PolarHBondContact O-N 2.91Å; F268-M271 PolarHBondContact O-N 3.42Å; M271-D273 PolarHBondContact O-N 2.98Å; M271-I274 PolarHBondContact O-N 3.32Å; M271-L275 HydrophobicContact CG-CD1 3.95Å; M271-L275 HydrophobicContact CG-CG 4.37Å; M271-L275 WeakPolarHBondContact O-CB 3.36Å; M271-L275 VanDerWaalsContact O-CG 3.28Å; M271-L275 WeakPolarHBondContact O-CG 3.43Å; M271-L275 PolarHBondContact O-N 2.86Å; M271-L275 HydrophobicContact SD-CD1 4.21Å; M271-L275 HydrophobicContact SD-CG 4.18Å |
| 272 | R | 90.7 | Very high | 90.3 | Very high | 151 Ų | 151 | 58 Ų | 58 | 57% | 0.57 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -56.7 | -47 | 176.7 | -175 | -162.8 | 66 | 172.4 | -0.6 | 112 | F268 I270 L275 L276 | F268-R272 PolarHBondContact O-N 3.03Å; I270-R272 VanDerWaalsContact C-N 3.28Å; I270-R272 PolarHBondContact O-N 3.48Å; R272-L275 PolarHBondContact O-N 3.29Å; R272-L276 WeakPolarHBondContact O-CB 3.42Å; R272-L276 PolarHBondContact O-N 3.22Å |
| 273 | D | 87.6 | Confident | 90 | Very high | 35 Ų | 35 | 55.3 Ų | 55.3 | 19% | 0.187 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.8 | -41.4 | 179.2 | -71.2 | 2 | 0 | 0 | 0 | 112.2 | R219 T269 I270 M271 L276 V277 M314 | R219-D273 IonicContact CZ-OD2 2.94Å; R219-D273 IonicContact NH1-OD2 3.27Å; R219-D273 IonicContact NH2-OD2 2.74Å; T269-D273 PolarHBondContact O-N 3.37Å; I270-D273 PolarHBondContact O-N 3.46Å; M271-D273 PolarHBondContact O-N 2.98Å; D273-L276 PolarHBondContact O-N 3.33Å; D273-V277 WeakPolarHBondContact O-CG2 3.43Å; D273-V277 PolarHBondContact O-N 2.89Å; D273-V277 VanDerWaalsContact O-N 3.16Å; D273-M314 HydrophobicContact CB-CE 4.3Å |
| 274 | I | 90.1 | Very high | 89.3 | Confident | 1 Ų | 1 | 59.4 Ų | 59.4 | 1% | 0.005 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.2 | -47.5 | 177.1 | -73.4 | 172.9 | 0 | 0 | 0 | 110.5 | I129 A132 L133 V136 I270 M271 L276 V277 L278 | I129-I274 HydrophobicContact CG2-CB 4.44Å; I129-I274 HydrophobicContact CG2-CG2 3.69Å; A132-I274 HydrophobicContact CB-CD1 3.74Å; L133-I274 HydrophobicContact CB-CG2 3.89Å; L133-I274 HydrophobicContact CD1-CG2 3.99Å; L133-I274 HydrophobicContact CG-CG2 4.42Å; V136-I274 HydrophobicContact CG2-CD1 4.43Å; I270-I274 HydrophobicContact CG2-CD1 3.75Å; I270-I274 HydrophobicContact CG2-CG1 4.29Å; I270-I274 WeakPolarHBondContact O-CG1 3.49Å; I270-I274 PolarHBondContact O-N 3.24Å; M271-I274 PolarHBondContact O-N 3.32Å; I274-L276 VanDerWaalsContact C-N 3.28Å; I274-L276 PolarHBondContact O-N 3.4Å; I274-V277 PolarHBondContact O-N 2.92Å; I274-L278 HydrophobicContact CG2-CD1 4.26Å; I274-L278 WeakPolarHBondContact O-CG 3.31Å; I274-L278 PolarHBondContact O-N 3.43Å |
| 275 | L | 92.8 | Very high | 88.5 | Confident | 73 Ų | 73 | 59 Ų | 59 | 38% | 0.382 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.2 | -38.7 | 178 | -70.1 | 175.7 | 0 | 0 | 0 | 111.2 | M271 R272 V277 L278 M279 | M271-L275 HydrophobicContact CG-CD1 3.95Å; M271-L275 HydrophobicContact CG-CG 4.37Å; M271-L275 WeakPolarHBondContact O-CB 3.36Å; M271-L275 VanDerWaalsContact O-CG 3.28Å; M271-L275 WeakPolarHBondContact O-CG 3.43Å; M271-L275 PolarHBondContact O-N 2.86Å; M271-L275 HydrophobicContact SD-CD1 4.21Å; M271-L275 HydrophobicContact SD-CG 4.18Å; R272-L275 PolarHBondContact O-N 3.29Å; L275-V277 VanDerWaalsContact C-N 3.32Å; L275-V277 PolarHBondContact O-N 2.99Å; L275-L278 PolarHBondContact O-N 3.48Å; L275-L278 VanDerWaalsContact O-N 3.17Å; L275-M279 HydrophobicContact CB-CE 4.39Å; L275-M279 WeakPolarHBondContact O-CB 2.98Å; L275-M279 VanDerWaalsContact O-CG 3.28Å; L275-M279 WeakPolarHBondContact O-CG 3.42Å; L275-M279 PolarHBondContact O-N 2.95Å |
| 276 | L | 91.1 | Very high | 88.2 | Confident | 65 Ų | 65 | 56 Ų | 56 | 34% | 0.34 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.1 | -40.7 | 175.8 | -171.1 | 147.5 | 0 | 0 | 0 | 111.8 | R272 D273 I274 M279 E280 G281 T282 | R272-L276 WeakPolarHBondContact O-CB 3.42Å; R272-L276 PolarHBondContact O-N 3.22Å; D273-L276 PolarHBondContact O-N 3.33Å; I274-L276 VanDerWaalsContact C-N 3.28Å; I274-L276 PolarHBondContact O-N 3.4Å; L276-M279 PolarHBondContact O-N 3.44Å; L276-E280 PolarHBondContact O-N 3.43Å; L276-G281 WeakPolarHBondContact O-CA 3.48Å; L276-G281 PolarHBondContact O-N 3.44Å; L276-T282 WeakPolarHBondContact CD2-O 3.41Å |
| 277 | V | 90.5 | Very high | 88.2 | Confident | 5 Ų | 5 | 60.7 Ų | 60.7 | 3% | 0.03 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -65 | -40.7 | 174 | 175.5 | 0 | 0 | 0 | 0 | 111.7 | I129 D273 I274 L275 M279 E280 A311 M314 | I129-V277 HydrophobicContact CD1-CG1 4.16Å; I129-V277 HydrophobicContact CG1-CG1 3.95Å; I129-V277 HydrophobicContact CG2-CB 4.41Å; I129-V277 HydrophobicContact CG2-CG1 4.31Å; D273-V277 WeakPolarHBondContact O-CG2 3.43Å; D273-V277 PolarHBondContact O-N 2.89Å; D273-V277 VanDerWaalsContact O-N 3.16Å; I274-V277 PolarHBondContact O-N 2.92Å; L275-V277 VanDerWaalsContact C-N 3.32Å; L275-V277 PolarHBondContact O-N 2.99Å; V277-M279 VanDerWaalsContact C-N 3.34Å; V277-E280 PolarHBondContact O-N 3.04Å; V277-A311 HydrophobicContact CG1-CB 4.17Å; V277-A311 HydrophobicContact CG2-CB 4.15Å; V277-M314 HydrophobicContact CG2-SD 3.97Å |
| 278 | L | 92.9 | Very high | 88.3 | Confident | 52 Ų | 52 | 63 Ų | 63 | 27% | 0.272 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -68.1 | -33.6 | 178.5 | -69.1 | 176.2 | 0 | 0 | 0 | 112.9 | I129 L130 L133 I274 L275 E280 | I129-L278 HydrophobicContact CB-CD2 4.49Å; I129-L278 HydrophobicContact CG2-CD1 4.41Å; I129-L278 HydrophobicContact CG2-CD2 3.83Å; I129-L278 HydrophobicContact CG2-CG 3.83Å; L130-L278 HydrophobicContact CD2-CD1 4.47Å; L130-L278 HydrophobicContact CD2-CD2 4.1Å; L133-L278 HydrophobicContact CD2-CD1 3.96Å; I274-L278 HydrophobicContact CG2-CD1 4.26Å; I274-L278 WeakPolarHBondContact O-CG 3.31Å; I274-L278 PolarHBondContact O-N 3.43Å; L275-L278 PolarHBondContact O-N 3.48Å; L275-L278 VanDerWaalsContact O-N 3.17Å; L278-E280 PolarHBondContact O-N 2.99Å |
| 279 | M | 94.3 | Very high | 88.3 | Confident | 144 Ų | 144 | 59.4 Ų | 59.4 | 71% | 0.709 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82 | 11.1 | 175.3 | -66 | -173 | -59.2 | 0 | 0 | 113.2 | L275 L276 V277 G281 | L275-M279 HydrophobicContact CB-CE 4.39Å; L275-M279 WeakPolarHBondContact O-CB 2.98Å; L275-M279 VanDerWaalsContact O-CG 3.28Å; L275-M279 WeakPolarHBondContact O-CG 3.42Å; L275-M279 PolarHBondContact O-N 2.95Å; L276-M279 PolarHBondContact O-N 3.44Å; V277-M279 VanDerWaalsContact C-N 3.34Å; M279-G281 PolarHBondContact O-N 3.23Å |
| 280 | E | 93.6 | Very high | 88.5 | Confident | 107 Ų | 107 | 59.8 Ų | 59.8 | 50% | 0.5 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60.9 | 28.3 | 179 | -43.2 | -158.6 | 135.4 | 0 | 0 | 113.6 | R126 L276 V277 L278 W310 | R126-E280 IonicContact CZ-OE1 3.98Å; R126-E280 IonicContact NH1-OE1 3.66Å; R126-E280 PolarHBondContact NH1-OE1 3.32Å; R126-E280 VanDerWaalsContact NH1-OE1 3.16Å; R126-E280 IonicContact NH2-OE1 2.74Å; R126-E280 PolarHBondContact NH2-OE1 3.43Å; L276-E280 PolarHBondContact O-N 3.43Å; V277-E280 PolarHBondContact O-N 3.04Å; L278-E280 PolarHBondContact O-N 2.99Å; E280-W310 HydrophobicContact CB-CB 3.92Å; E280-W310 HydrophobicContact CB-CG 4.46Å; E280-W310 WeakPolarHBondContact O-CB 3.33Å |
| 281 | G | 90.4 | Very high | 88.7 | Confident | 21 Ų | 21 | 59.2 Ų | 59.2 | 22% | 0.216 | 32% | 0.315 | C | S | . | . | P | Polyproline II helix | trans | -69.4 | 157.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L276 M279 | L276-G281 WeakPolarHBondContact O-CA 3.48Å; L276-G281 PolarHBondContact O-N 3.44Å; M279-G281 PolarHBondContact O-N 3.23Å |
| 282 | T | 88.9 | Confident | 88.8 | Confident | 50 Ų | 50 | 62.2 Ų | 62.2 | 31% | 0.307 | 33% | 0.326 | S | S | . | . | P | Polyproline II helix | trans | -68.6 | 128.3 | 178.4 | -55.6 | 0 | 0 | 0 | 0 | 110.9 | L276 V286 I309 | L276-T282 WeakPolarHBondContact CD2-O 3.41Å; T282-V286 WeakPolarHBondContact CG2-O 3.19Å; T282-I309 WeakPolarHBondContact CA-O 3.33Å; T282-I309 HydrophobicContact CG2-CB 4.14Å; T282-I309 HydrophobicContact CG2-CG2 3.98Å; T282-I309 PolarHBondContact OG1-O 3Å |
| 283 | P | 83.9 | Confident | 88.9 | Confident | 16 Ų | 16 | 59.1 Ų | 59.1 | 10% | 0.104 | 32% | 0.321 | C | S | . | . | P | Polyproline II helix | trans | -64.9 | 147.8 | -176.7 | 24.1 | -31.2 | 0 | 0 | 0 | 112.3 | G285 V286 A311 A317 | P283-G285 PolarHBondContact O-N 3.03Å; P283-V286 HydrophobicContact CG-CB 4.17Å; P283-V286 HydrophobicContact CG-CG2 4.12Å; P283-V286 PolarHBondContact O-N 3.19Å; P283-V286 VanDerWaalsContact O-O 3.1Å; P283-A311 HydrophobicContact CB-CB 4.12Å; P283-A311 HydrophobicContact CG-CB 4.34Å; P283-A317 HydrophobicContact CG-CB 3.93Å |
| 284 | S | 75.1 | Confident | 89 | Confident | 90 Ų | 90 | 63.8 Ų | 63.8 | 63% | 0.629 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -16.9 | -175 | 52 | 0 | 0 | 0 | 0 | 115.5 | Q213 | Q213-S284 PolarHBondContact NE2-OG 3.01Å; Q213-S284 VanDerWaalsContact NE2-OG 3.11Å |
| 285 | G | 75.8 | Confident | 89.1 | Confident | 65 Ų | 65 | 63.8 Ų | 63.8 | 67% | 0.67 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | -2.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | P283 | P283-G285 PolarHBondContact O-N 3.03Š|
| 286 | V | 83 | Confident | 89.2 | Confident | 16 Ų | 16 | 62.9 Ų | 62.9 | 10% | 0.097 | 33% | 0.331 | C | S | . | . | S | Bend | trans | -129.8 | 118.8 | -178.1 | -177.2 | 0 | 0 | 0 | 0 | 108.7 | T282 P283 V291 I309 A317 Y346 F348 | T282-V286 WeakPolarHBondContact CG2-O 3.19Å; P283-V286 HydrophobicContact CG-CB 4.17Å; P283-V286 HydrophobicContact CG-CG2 4.12Å; P283-V286 PolarHBondContact O-N 3.19Å; P283-V286 VanDerWaalsContact O-O 3.1Å; V286-V291 HydrophobicContact CG1-CG2 3.38Å; V286-I309 HydrophobicContact CG1-CD1 4.45Å; V286-I309 HydrophobicContact CG1-CG2 4.2Å; V286-A317 HydrophobicContact CG2-CB 4.5Å; V286-Y346 HydrophobicContact CG1-CD1 4.24Å; V286-Y346 HydrophobicContact CG1-CE1 4.32Å; V286-Y346 HydrophobicContact CG2-CD1 4.14Å; V286-F348 HydrophobicContact CG1-CZ 4.14Å |
| 287 | R | 87.8 | Confident | 89.3 | Confident | 158 Ų | 158 | 63.6 Ų | 63.6 | 60% | 0.596 | 35% | 0.346 | S | S | * | . | trans | -90.5 | 129.9 | 175.7 | -67.7 | -173 | -62 | 166.7 | -0.3 | 110.1 | S289 E290 V291 | R287-S289 PolarHBondContact O-N 3.26Å; R287-E290 HydrophobicContact CB-CB 3.93Å; R287-E290 IonicContact CZ-OE2 3.63Å; R287-E290 VanDerWaalsContact CZ-OE2 3.27Å; R287-E290 IonicContact NE-OE2 3.63Å; R287-E290 PolarHBondContact NE-OE2 2.68Å; R287-E290 IonicContact NH2-OE2 2.73Å; R287-E290 PolarHBondContact NH2-OE2 3.31Å; R287-E290 PolarHBondContact O-N 3.14Å; R287-V291 PolarHBondContact O-N 3.46Å; R287-V291 VanDerWaalsContact O-N 3.11Å | ||
| 288 | Y | 90.8 | Very high | 89.3 | Confident | 49 Ų | 49 | 63.9 Ų | 63.9 | 19% | 0.192 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -52.6 | -51.9 | 178.8 | 179.5 | -87.5 | 0 | 0 | 0 | 112.4 | E290 V291 R292 L307 I309 P371 | Y288-E290 VanDerWaalsContact C-N 3.35Å; Y288-E290 PolarHBondContact O-N 3.07Å; Y288-V291 PolarHBondContact O-N 3.06Å; Y288-R292 WeakPolarHBondContact O-CB 3.45Å; Y288-R292 PolarHBondContact O-N 2.96Å; Y288-L307 HydrophobicContact CD2-CD2 4.18Å; Y288-L307 HydrophobicContact CD2-CG 4.39Å; Y288-L307 HydrophobicContact CE1-CD2 4.37Å; Y288-L307 HydrophobicContact CE2-CB 4.04Å; Y288-L307 HydrophobicContact CE2-CD2 3.73Å; Y288-L307 HydrophobicContact CE2-CG 3.75Å; Y288-L307 WeakPolarHBondContact CE2-O 3.34Å; Y288-I309 HydrophobicContact CD2-CD1 4.34Å; Y288-P371 HydrophobicContact CD1-CG 4.45Å; Y288-P371 HydrophobicContact CD2-CG 4.49Å; Y288-P371 HydrophobicContact CE1-CG 3.88Å; Y288-P371 HydrophobicContact CE2-CG 3.89Å; Y288-P371 WeakPolarHBondContact OH-CD 3.25Å |
| 289 | S | 90.6 | Very high | 89.2 | Confident | 54 Ų | 54 | 67.8 Ų | 67.8 | 38% | 0.378 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.6 | -42.5 | -179.7 | 50.2 | 0 | 0 | 0 | 0 | 112.4 | R287 V291 R292 D293 | R287-S289 PolarHBondContact O-N 3.26Å; S289-V291 PolarHBondContact O-N 2.68Å; S289-R292 PolarHBondContact O-N 2.89Å; S289-D293 WeakPolarHBondContact O-CB 3.48Å; S289-D293 PolarHBondContact O-N 3.34Å |
| 290 | E | 90.5 | Very high | 89 | Confident | 81 Ų | 81 | 62 Ų | 62 | 38% | 0.379 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.8 | -37.9 | -178.8 | -162.5 | -177.2 | 159.7 | 0 | 0 | 112.6 | R287 Y288 R294 Y346 | R287-E290 HydrophobicContact CB-CB 3.93Å; R287-E290 IonicContact CZ-OE2 3.63Å; R287-E290 VanDerWaalsContact CZ-OE2 3.27Å; R287-E290 IonicContact NE-OE2 3.63Å; R287-E290 PolarHBondContact NE-OE2 2.68Å; R287-E290 IonicContact NH2-OE2 2.73Å; R287-E290 PolarHBondContact NH2-OE2 3.31Å; R287-E290 PolarHBondContact O-N 3.14Å; Y288-E290 VanDerWaalsContact C-N 3.35Å; Y288-E290 PolarHBondContact O-N 3.07Å; E290-R294 VanDerWaalsContact O-CB 3.26Å; E290-R294 WeakPolarHBondContact O-CB 2.99Å; E290-R294 PolarHBondContact O-N 2.94Å; E290-R294 VanDerWaalsContact O-N 3.15Å; E290-Y346 WeakPolarHBondContact CG-OH 3.31Å |
| 291 | V | 91.3 | Very high | 88.9 | Confident | 1 Ų | 1 | 57.8 Ų | 57.8 | 1% | 0.006 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -67.6 | -45.7 | 173.9 | 174.7 | 0 | 0 | 0 | 0 | 110.6 | V286 R287 Y288 S289 R294 L295 I309 L319 Y346 F348 | V286-V291 HydrophobicContact CG1-CG2 3.38Å; R287-V291 PolarHBondContact O-N 3.46Å; R287-V291 VanDerWaalsContact O-N 3.11Å; Y288-V291 PolarHBondContact O-N 3.06Å; S289-V291 PolarHBondContact O-N 2.68Å; V291-R294 PolarHBondContact O-N 3.45Å; V291-L295 HydrophobicContact CG1-CD1 3.97Å; V291-L295 WeakPolarHBondContact O-CG 3.47Å; V291-L295 PolarHBondContact O-N 3.48Å; V291-I309 HydrophobicContact CB-CD1 3.79Å; V291-I309 HydrophobicContact CG1-CD1 3.83Å; V291-I309 HydrophobicContact CG2-CD1 3.93Å; V291-L319 HydrophobicContact CG1-CD1 3.53Å; V291-Y346 HydrophobicContact CG2-CD2 4.23Å; V291-Y346 HydrophobicContact CG2-CE1 4.2Å; V291-Y346 HydrophobicContact CG2-CE2 3.7Å; V291-F348 HydrophobicContact CG2-CZ 4.24Å |
| 292 | R | 92.8 | Very high | 89 | Confident | 72 Ų | 72 | 61.7 Ų | 61.7 | 27% | 0.272 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -58.5 | -51.5 | 177.9 | 176.6 | 177.4 | 171.3 | -95.1 | 0.9 | 111.7 | Y288 S289 R294 L295 L296 L307 N370 | Y288-R292 WeakPolarHBondContact O-CB 3.45Å; Y288-R292 PolarHBondContact O-N 2.96Å; S289-R292 PolarHBondContact O-N 2.89Å; R292-R294 PolarHBondContact O-N 2.93Å; R292-L295 PolarHBondContact O-N 3.38Å; R292-L295 VanDerWaalsContact O-N 3.13Å; R292-L296 HydrophobicContact CG-CD1 4.02Å; R292-L296 WeakPolarHBondContact O-CG 3.43Å; R292-L296 PolarHBondContact O-N 3.04Å; R292-L307 HydrophobicContact CB-CD2 3.82Å; R292-N370 PolarHBondContact NE-OD1 3.01Å |
| 293 | D | 92.4 | Very high | 89.1 | Confident | 86 Ų | 86 | 60.7 Ų | 60.7 | 46% | 0.46 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64 | -34.1 | -177.5 | -63.4 | -17.8 | 0 | 0 | 0 | 111.1 | S289 L296 A297 | S289-D293 WeakPolarHBondContact O-CB 3.48Å; S289-D293 PolarHBondContact O-N 3.34Å; D293-L296 PolarHBondContact O-N 3.41Å; D293-A297 WeakPolarHBondContact O-CB 3.46Å; D293-A297 PolarHBondContact O-N 3.35Å |
| 294 | R | 91.3 | Very high | 89.5 | Confident | 133 Ų | 133 | 60.4 Ų | 60.4 | 50% | 0.502 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -67.5 | -40 | 174.2 | -165.1 | 114 | 179.1 | 141 | 1.9 | 112.7 | E290 V291 R292 A297 S345 | E290-R294 VanDerWaalsContact O-CB 3.26Å; E290-R294 WeakPolarHBondContact O-CB 2.99Å; E290-R294 PolarHBondContact O-N 2.94Å; E290-R294 VanDerWaalsContact O-N 3.15Å; V291-R294 PolarHBondContact O-N 3.45Å; R292-R294 PolarHBondContact O-N 2.93Å; R294-A297 PolarHBondContact O-N 3.3Å; R294-S345 PolarHBondContact NE-OG 2.94Å |
| 295 | L | 92.4 | Very high | 90.3 | Very high | 1 Ų | 1 | 56.7 Ų | 56.7 | 1% | 0.005 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69.1 | -37.9 | 176.4 | -69.1 | 169.1 | 0 | 0 | 0 | 111.4 | V291 R292 A297 V298 V304 L307 M338 | V291-L295 HydrophobicContact CG1-CD1 3.97Å; V291-L295 WeakPolarHBondContact O-CG 3.47Å; V291-L295 PolarHBondContact O-N 3.48Å; R292-L295 PolarHBondContact O-N 3.38Å; R292-L295 VanDerWaalsContact O-N 3.13Å; L295-A297 VanDerWaalsContact C-N 3.27Å; L295-A297 PolarHBondContact O-N 2.92Å; L295-V298 PolarHBondContact O-N 3.5Å; L295-V304 HydrophobicContact CB-CG2 3.82Å; L295-V304 HydrophobicContact CD1-CG1 4.41Å; L295-L307 HydrophobicContact CD1-CD1 4.39Å; L295-M338 HydrophobicContact CB-CE 3.67Å; L295-M338 HydrophobicContact CD2-CB 4.06Å; L295-M338 HydrophobicContact CD2-CE 3.38Å; L295-M338 HydrophobicContact CD2-CG 4.37Å; L295-M338 HydrophobicContact CG-CE 4.04Å |
| 296 | L | 93.1 | Very high | 91.1 | Very high | 55 Ų | 55 | 56.1 Ų | 56.1 | 29% | 0.288 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -67.1 | -26.8 | 174 | -73 | 172.2 | 0 | 0 | 0 | 113.2 | R292 D293 V298 V301 V304 | R292-L296 HydrophobicContact CG-CD1 4.02Å; R292-L296 WeakPolarHBondContact O-CG 3.43Å; R292-L296 PolarHBondContact O-N 3.04Å; D293-L296 PolarHBondContact O-N 3.41Å; L296-V298 PolarHBondContact O-N 2.9Å; L296-V301 HydrophobicContact CD2-CG1 4.31Å; L296-V304 HydrophobicContact CD2-CB 4.19Å; L296-V304 HydrophobicContact CD2-CG2 3.72Å; L296-V304 HydrophobicContact CG-CB 4.4Å; L296-V304 HydrophobicContact CG-CG2 3.91Å |
| 297 | A | 93.2 | Very high | 91.6 | Very high | 80 Ų | 80 | 55.8 Ų | 55.8 | 66% | 0.661 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -6.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | D293 R294 L295 | D293-A297 WeakPolarHBondContact O-CB 3.46Å; D293-A297 PolarHBondContact O-N 3.35Å; R294-A297 PolarHBondContact O-N 3.3Å; L295-A297 VanDerWaalsContact C-N 3.27Å; L295-A297 PolarHBondContact O-N 2.92Å |
| 298 | V | 91 | Very high | 91.8 | Very high | 11 Ų | 11 | 52.9 Ų | 52.9 | 7% | 0.067 | 28% | 0.279 | C | S | . | . | S | Bend | trans | -77.4 | 128.9 | 175.3 | 177.4 | 0 | 0 | 0 | 0 | 109.5 | L295 L296 G300 V301 I334 E337 M338 | L295-V298 PolarHBondContact O-N 3.5Å; L296-V298 PolarHBondContact O-N 2.9Å; V298-G300 PolarHBondContact O-N 2.84Å; V298-V301 HydrophobicContact CB-CG2 3.99Å; V298-V301 HydrophobicContact CG1-CG2 4.3Å; V298-V301 WeakPolarHBondContact O-CB 3.25Å; V298-V301 PolarHBondContact O-N 3.27Å; V298-V301 VanDerWaalsContact O-N 3.16Å; V298-I334 HydrophobicContact CG1-CG2 4.34Å; V298-E337 HydrophobicContact CG1-CB 4.32Å; V298-E337 HydrophobicContact CG1-CG 4.02Å; V298-M338 HydrophobicContact CB-CG 4.13Å; V298-M338 HydrophobicContact CG1-CG 4.02Å; V298-M338 HydrophobicContact CG2-CG 3.94Å |
| 299 | D | 90.8 | Very high | 92 | Very high | 133 Ų | 133 | 50.9 Ų | 50.9 | 71% | 0.711 | 27% | 0.271 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | 132 | -177.7 | -72.9 | -32.9 | 0 | 0 | 0 | 111.2 | I334 | D299-I334 WeakPolarHBondContact O-CD1 3.29Š|
| 300 | G | 89.8 | Confident | 92.1 | Very high | 24 Ų | 24 | 50.1 Ų | 50.1 | 25% | 0.247 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 91.4 | -8.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | V298 I325 D326 | V298-G300 PolarHBondContact O-N 2.84Å; G300-I325 WeakPolarHBondContact O-CA 3.3Å; G300-D326 PolarHBondContact O-N 2.99Å |
| 301 | V | 93 | Very high | 92.1 | Very high | 17 Ų | 17 | 46.2 Ų | 46.2 | 10% | 0.103 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -79.8 | 127.3 | 169.8 | 178 | 0 | 0 | 0 | 0 | 110.1 | L296 V298 V304 I323 I334 M338 | L296-V301 HydrophobicContact CD2-CG1 4.31Å; V298-V301 HydrophobicContact CB-CG2 3.99Å; V298-V301 HydrophobicContact CG1-CG2 4.3Å; V298-V301 WeakPolarHBondContact O-CB 3.25Å; V298-V301 PolarHBondContact O-N 3.27Å; V298-V301 VanDerWaalsContact O-N 3.16Å; V301-V304 HydrophobicContact CG1-CG2 4.06Å; V301-I323 HydrophobicContact CB-CG2 4.41Å; V301-I323 HydrophobicContact CG1-CG2 3.76Å; V301-I323 HydrophobicContact CG2-CG2 3.91Å; V301-I334 HydrophobicContact CG2-CG2 3.9Å; V301-M338 HydrophobicContact CG2-CE 3.97Å; V301-M338 HydrophobicContact CG2-SD 3.79Å |
| 302 | K | 91.7 | Very high | 91.9 | Very high | 104 Ų | 104 | 46.4 Ų | 46.4 | 45% | 0.452 | 24% | 0.243 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.8 | -38.6 | 178 | -60.6 | -64.2 | -177.1 | 175.1 | 0 | 112.4 | A324 D326 | K302-A324 PolarHBondContact N-O 2.97Å; K302-D326 WeakPolarHBondContact CE-OD2 3.32Å; K302-D326 IonicContact NZ-OD2 2.82Å; K302-D326 PolarHBondContact NZ-OD2 2.76Å |
| 303 | A | 91 | Very high | 91.6 | Very high | 28 Ų | 28 | 43.4 Ų | 43.4 | 23% | 0.231 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.1 | 149.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | A324 L361 | A303-A324 HydrophobicContact CB-CB 4.13Å; A303-A324 PolarHBondContact N-O 2.95Å; A303-A324 PolarHBondContact O-N 3.31Å; A303-L361 HydrophobicContact CB-CD1 4.28Å; A303-L361 HydrophobicContact CB-CD2 4.49Å |
| 304 | V | 92.8 | Very high | 91 | Very high | 10 Ų | 10 | 40.2 Ų | 40.2 | 6% | 0.061 | 22% | 0.215 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 125.2 | 168.2 | 176.4 | 0 | 0 | 0 | 0 | 107.1 | L295 L296 V301 L307 I323 | L295-V304 HydrophobicContact CB-CG2 3.82Å; L295-V304 HydrophobicContact CD1-CG1 4.41Å; L296-V304 HydrophobicContact CD2-CB 4.19Å; L296-V304 HydrophobicContact CD2-CG2 3.72Å; L296-V304 HydrophobicContact CG-CB 4.4Å; L296-V304 HydrophobicContact CG-CG2 3.91Å; V301-V304 HydrophobicContact CG1-CG2 4.06Å; V304-L307 HydrophobicContact CG1-CB 4.26Å; V304-L307 HydrophobicContact CG1-CD2 4.49Å; V304-I323 HydrophobicContact CB-CD1 4.07Å; V304-I323 HydrophobicContact CG1-CD1 3.8Å; V304-I323 HydrophobicContact CG2-CD1 3.56Å |
| 305 | H | 91.5 | Very high | 90.3 | Very high | 13 Ų | 13 | 35 Ų | 35 | 6% | 0.06 | 20% | 0.197 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 169.1 | 178.1 | 57.4 | 91.5 | 0 | 0 | 0 | 110.6 | L307 H322 E356 C368 | H305-L307 PolarHBondContact O-N 2.77Å; H305-L307 VanDerWaalsContact O-N 3.08Å; H305-H322 WeakPolarHBondContact CE1-CB 3.48Å; H305-H322 PolarHBondContact N-O 3.49Å; H305-H322 WeakPolarHBondContact O-CB 3.47Å; H305-H322 PolarHBondContact O-N 2.89Å; H305-H322 VanDerWaalsContact O-O 3.08Å; H305-E356 IonicContact CE1-OE2 3.1Å; H305-E356 PolarHBondContact CE1-OE2 3.14Å; H305-E356 IonicContact NE2-OE2 3.39Å; H305-E356 PolarHBondContact NE2-OE2 3.18Å; H305-C368 HydrophobicContact CB-CB 4.04Å |
| 306 | N | 91.6 | Very high | 89.8 | Confident | 53 Ų | 53 | 35.6 Ų | 35.6 | 28% | 0.283 | 20% | 0.2 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | 50.2 | 36.8 | -176.7 | -155.4 | 31.6 | 0 | 0 | 0 | 112.6 | H308 H322 | N306-H308 PolarHBondContact O-CD2 3.47Å; N306-H308 VanDerWaalsContact O-CD2 3.26Å; N306-H308 PolarHBondContact O-N 3.45Å; N306-H308 PolarHBondContact OD1-NE2 2.85Å; N306-H322 HydrophobicContact CB-CB 4.3Å; N306-H322 PolarHBondContact ND2-NE2 3.2Å; N306-H322 VanDerWaalsContact ND2-NE2 3.1Å |
| 307 | L | 93.3 | Very high | 89.6 | Confident | 9 Ų | 9 | 33.3 Ų | 33.3 | 5% | 0.047 | 19% | 0.189 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -76.8 | 115.8 | 179.8 | 172.8 | 64.1 | 0 | 0 | 0 | 108.4 | Y288 R292 L295 V304 H305 I309 L319 A321 | Y288-L307 HydrophobicContact CD2-CD2 4.18Å; Y288-L307 HydrophobicContact CD2-CG 4.39Å; Y288-L307 HydrophobicContact CE1-CD2 4.37Å; Y288-L307 HydrophobicContact CE2-CB 4.04Å; Y288-L307 HydrophobicContact CE2-CD2 3.73Å; Y288-L307 HydrophobicContact CE2-CG 3.75Å; Y288-L307 WeakPolarHBondContact CE2-O 3.34Å; R292-L307 HydrophobicContact CB-CD2 3.82Å; L295-L307 HydrophobicContact CD1-CD1 4.39Å; V304-L307 HydrophobicContact CG1-CB 4.26Å; V304-L307 HydrophobicContact CG1-CD2 4.49Å; H305-L307 PolarHBondContact O-N 2.77Å; H305-L307 VanDerWaalsContact O-N 3.08Å; L307-I309 HydrophobicContact CD1-CD1 4.15Å; L307-I309 HydrophobicContact CD1-CG1 3.92Å; L307-I309 HydrophobicContact CD2-CD1 4.22Å; L307-I309 HydrophobicContact CG-CD1 4.22Å; L307-I309 HydrophobicContact CG-CG1 4.19Å; L307-L319 HydrophobicContact CD1-CD1 4.07Å; L307-L319 HydrophobicContact CD1-CD2 4.26Å; L307-L319 HydrophobicContact CD1-CG 4.03Å; L307-A321 HydrophobicContact CB-CB 4.5Å; L307-A321 HydrophobicContact CD1-CB 3.73Å |
| 308 | H | 93.9 | Very high | 89.5 | Confident | 97 Ų | 97 | 29.5 Ų | 29.5 | 45% | 0.449 | 16% | 0.158 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -115.8 | 127.8 | 173.8 | -65 | -75.7 | 0 | 0 | 0 | 109.6 | N306 W310 L319 S320 | N306-H308 PolarHBondContact O-CD2 3.47Å; N306-H308 VanDerWaalsContact O-CD2 3.26Å; N306-H308 PolarHBondContact O-N 3.45Å; N306-H308 PolarHBondContact OD1-NE2 2.85Å; H308-W310 HydrophobicContact CB-CE3 4.09Å; H308-W310 HydrophobicContact CB-CZ3 3.99Å; H308-L319 WeakPolarHBondContact O-CA 3.31Å; H308-S320 PolarHBondContact N-O 3.46Å; H308-S320 PolarHBondContact O-N 2.64Å |
| 309 | I | 93.4 | Very high | 89.6 | Confident | 7 Ų | 7 | 29 Ų | 29 | 4% | 0.036 | 16% | 0.155 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.2 | 116 | 175.7 | -53.9 | 168.6 | 0 | 0 | 0 | 107.3 | T282 V286 Y288 V291 L307 V318 L319 F348 | T282-I309 WeakPolarHBondContact CA-O 3.33Å; T282-I309 HydrophobicContact CG2-CB 4.14Å; T282-I309 HydrophobicContact CG2-CG2 3.98Å; T282-I309 PolarHBondContact OG1-O 3Å; V286-I309 HydrophobicContact CG1-CD1 4.45Å; V286-I309 HydrophobicContact CG1-CG2 4.2Å; Y288-I309 HydrophobicContact CD2-CD1 4.34Å; V291-I309 HydrophobicContact CB-CD1 3.79Å; V291-I309 HydrophobicContact CG1-CD1 3.83Å; V291-I309 HydrophobicContact CG2-CD1 3.93Å; L307-I309 HydrophobicContact CD1-CD1 4.15Å; L307-I309 HydrophobicContact CD1-CG1 3.92Å; L307-I309 HydrophobicContact CD2-CD1 4.22Å; L307-I309 HydrophobicContact CG-CD1 4.22Å; L307-I309 HydrophobicContact CG-CG1 4.19Å; I309-V318 WeakPolarHBondContact CA-O 3.4Å; I309-L319 HydrophobicContact CG1-CD1 4.22Å; I309-L319 HydrophobicContact CG1-CG 4.3Å; I309-F348 HydrophobicContact CG2-CE1 4.05Å |
| 310 | W | 93.8 | Very high | 89.8 | Confident | 37 Ų | 37 | 24.2 Ų | 24.2 | 14% | 0.14 | 13% | 0.131 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -134.1 | 171.1 | -180 | 71.4 | 98.9 | 0 | 0 | 0 | 111.3 | E280 H308 A317 V318 | E280-W310 HydrophobicContact CB-CB 3.92Å; E280-W310 HydrophobicContact CB-CG 4.46Å; E280-W310 WeakPolarHBondContact O-CB 3.33Å; H308-W310 HydrophobicContact CB-CE3 4.09Å; H308-W310 HydrophobicContact CB-CZ3 3.99Å; W310-A317 CarbonylContact O-C 3.53Å; W310-A317 WeakPolarHBondContact O-CA 3.31Å; W310-V318 HydrophobicContact CD2-CB 4.02Å; W310-V318 HydrophobicContact CD2-CG1 4.37Å; W310-V318 HydrophobicContact CE3-CB 4.47Å; W310-V318 HydrophobicContact CH2-CB 4.21Å; W310-V318 HydrophobicContact CH2-CG1 3.49Å; W310-V318 VanDerWaalsContact CH2-CG1 3.49Å; W310-V318 HydrophobicContact CZ2-CB 3.73Å; W310-V318 HydrophobicContact CZ2-CG1 3.25Å; W310-V318 HydrophobicContact CZ3-CG1 4.13Å; W310-V318 PolarHBondContact N-O 3.08Å; W310-V318 VanDerWaalsContact N-O 3.08Å; W310-V318 PolarHBondContact O-N 3.31Å |
| 311 | A | 89.9 | Confident | 90.1 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.12 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.9 | 138.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | V277 P283 Q316 | V277-A311 HydrophobicContact CG1-CB 4.17Å; V277-A311 HydrophobicContact CG2-CB 4.15Å; P283-A311 HydrophobicContact CB-CB 4.12Å; P283-A311 HydrophobicContact CG-CB 4.34Å; A311-Q316 WeakPolarHBondContact CA-O 3.43Å |
| 312 | L | 87.8 | Confident | 90.1 | Very high | 5 Ų | 5 | 23.7 Ų | 23.7 | 3% | 0.026 | 12% | 0.121 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -85.9 | -37 | 165.8 | -64.7 | 175.6 | 0 | 0 | 0 | 110.9 | Y122 Y125 R126 Q316 V318 | Y122-L312 HydrophobicContact CD1-CD1 3.95Å; Y122-L312 HydrophobicContact CD2-CD2 4.49Å; Y122-L312 HydrophobicContact CG-CD1 4.25Å; Y122-L312 HydrophobicContact CG-CD2 4.17Å; Y125-L312 HydrophobicContact CD2-CD1 4.39Å; R126-L312 VanDerWaalsContact CG-O 3.32Å; R126-L312 WeakPolarHBondContact CG-O 3.5Å; L312-Q316 HydrophobicContact CB-CB 4.07Å; L312-Q316 PolarHBondContact N-O 3.29Å; L312-V318 HydrophobicContact CD1-CG2 3.73Å; L312-V318 HydrophobicContact CG-CG2 3.81Å |
| 313 | T | 86.2 | Confident | 90.2 | Very high | 9 Ų | 9 | 18.7 Ų | 18.7 | 6% | 0.055 | 10% | 0.1 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.6 | 175.9 | 172.6 | 61.6 | 0 | 0 | 0 | 0 | 108.4 | Y125 N315 Q316 | Y125-T313 WeakPolarHBondContact O-CG2 3.3Å; T313-N315 PolarHBondContact O-N 3.34Å; T313-Q316 PolarHBondContact O-N 3Å; T313-Q316 VanDerWaalsContact O-N 3.14Å; T313-Q316 WeakPolarHBondContact OG1-CB 3.24Å; T313-Q316 WeakPolarHBondContact OG1-CG 3.19Å; T313-Q316 PolarHBondContact OG1-OE1 3.48Å |
| 314 | M | 79.4 | Confident | 90.3 | Very high | 19 Ų | 19 | 17.4 Ų | 17.4 | 9% | 0.094 | 9% | 0.089 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -53.4 | -27.2 | -179.7 | -49 | -55.4 | -68.4 | 0 | 0 | 113.8 | I129 A216 R219 D273 V277 | I129-M314 HydrophobicContact CD1-CG 4.48Å; I129-M314 HydrophobicContact CD1-SD 4.25Å; A216-M314 HydrophobicContact CB-CG 3.89Å; R219-M314 VanDerWaalsContact CZ-CE 3.47Å; R219-M314 VanDerWaalsContact NH1-CE 3.3Å; D273-M314 HydrophobicContact CB-CE 4.3Å; V277-M314 HydrophobicContact CG2-SD 3.97Å |
| 315 | N | 76.4 | Confident | 90.4 | Very high | 23 Ų | 23 | 17 Ų | 17 | 12% | 0.123 | 9% | 0.086 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -115 | 5.5 | -175.4 | -66.6 | -21.7 | 0 | 0 | 0 | 114.3 | R51 Q213 T313 | R51-N315 PolarHBondContact NH2-O 3.09Å; Q213-N315 WeakPolarHBondContact CB-OD1 3.41Å; Q213-N315 PolarHBondContact O-ND2 2.98Å; Q213-N315 PolarHBondContact O-OD1 3.21Å; T313-N315 PolarHBondContact O-N 3.34Å |
| 316 | Q | 81.9 | Confident | 90.2 | Very high | 13 Ų | 13 | 18.3 Ų | 18.3 | 6% | 0.061 | 9% | 0.094 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.4 | 85.7 | -177.1 | -69.9 | 174.9 | -57.3 | 0 | 0 | 110 | A311 L312 T313 H349 | A311-Q316 WeakPolarHBondContact CA-O 3.43Å; L312-Q316 HydrophobicContact CB-CB 4.07Å; L312-Q316 PolarHBondContact N-O 3.29Å; T313-Q316 PolarHBondContact O-N 3Å; T313-Q316 VanDerWaalsContact O-N 3.14Å; T313-Q316 WeakPolarHBondContact OG1-CB 3.24Å; T313-Q316 WeakPolarHBondContact OG1-CG 3.19Å; T313-Q316 PolarHBondContact OG1-OE1 3.48Å; Q316-H349 HydrophobicContact CB-CB 4.2Å; Q316-H349 HydrophobicContact CG-CB 4.5Å; Q316-H349 PolarHBondContact NE2-CD2 3.38Å; Q316-H349 VanDerWaalsContact NE2-CD2 3.29Å |
| 317 | A | 88.6 | Confident | 89.9 | Confident | 8 Ų | 8 | 20.1 Ų | 20.1 | 7% | 0.066 | 10% | 0.103 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.4 | 145 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | P283 V286 W310 F348 H349 | P283-A317 HydrophobicContact CG-CB 3.93Å; V286-A317 HydrophobicContact CG2-CB 4.5Å; W310-A317 CarbonylContact O-C 3.53Å; W310-A317 WeakPolarHBondContact O-CA 3.31Å; A317-F348 HydrophobicContact CB-CD1 3.63Å; A317-F348 HydrophobicContact CB-CE1 3.86Å; A317-F348 CarbonylContact O-C 3.56Å; A317-F348 WeakPolarHBondContact O-CA 3.47Å; A317-H349 WeakPolarHBondContact O-CB 3.24Å; A317-H349 PolarHBondContact O-N 3.22Å |
| 318 | V | 91.5 | Very high | 89.6 | Confident | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 14% | 0.135 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 143.8 | 171.4 | -178.1 | 0 | 0 | 0 | 0 | 108.1 | I309 W310 L312 H349 S350 | I309-V318 WeakPolarHBondContact CA-O 3.4Å; W310-V318 HydrophobicContact CD2-CB 4.02Å; W310-V318 HydrophobicContact CD2-CG1 4.37Å; W310-V318 HydrophobicContact CE3-CB 4.47Å; W310-V318 HydrophobicContact CH2-CB 4.21Å; W310-V318 HydrophobicContact CH2-CG1 3.49Å; W310-V318 VanDerWaalsContact CH2-CG1 3.49Å; W310-V318 HydrophobicContact CZ2-CB 3.73Å; W310-V318 HydrophobicContact CZ2-CG1 3.25Å; W310-V318 HydrophobicContact CZ3-CG1 4.13Å; W310-V318 PolarHBondContact N-O 3.08Å; W310-V318 VanDerWaalsContact N-O 3.08Å; W310-V318 PolarHBondContact O-N 3.31Å; L312-V318 HydrophobicContact CD1-CG2 3.73Å; L312-V318 HydrophobicContact CG-CG2 3.81Å; V318-H349 HydrophobicContact CG2-CB 4.44Å; V318-S350 WeakPolarHBondContact CA-O 3.44Å |
| 319 | L | 93.7 | Very high | 89.3 | Confident | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 13% | 0.126 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 135.7 | 178.9 | -174.2 | 151 | 0 | 0 | 0 | 110.2 | V291 L307 H308 I309 A321 F348 S350 I351 T352 | V291-L319 HydrophobicContact CG1-CD1 3.53Å; L307-L319 HydrophobicContact CD1-CD1 4.07Å; L307-L319 HydrophobicContact CD1-CD2 4.26Å; L307-L319 HydrophobicContact CD1-CG 4.03Å; H308-L319 WeakPolarHBondContact O-CA 3.31Å; I309-L319 HydrophobicContact CG1-CD1 4.22Å; I309-L319 HydrophobicContact CG1-CG 4.3Å; L319-A321 HydrophobicContact CD2-CB 3.9Å; L319-F348 HydrophobicContact CB-CD1 3.98Å; L319-F348 HydrophobicContact CB-CE1 3.81Å; L319-F348 HydrophobicContact CB-CZ 4.19Å; L319-F348 HydrophobicContact CD1-CE1 4.1Å; L319-F348 HydrophobicContact CD1-CE2 3.99Å; L319-F348 HydrophobicContact CD1-CZ 3.62Å; L319-S350 PolarHBondContact N-O 3.35Å; L319-I351 HydrophobicContact CB-CG2 4.44Å; L319-I351 HydrophobicContact CD2-CG2 3.89Å; L319-I351 WeakPolarHBondContact O-CA 3.33Å; L319-T352 PolarHBondContact O-N 3.38Å |
| 320 | S | 94.8 | Very high | 89.1 | Confident | 32 Ų | 32 | 25.9 Ų | 25.9 | 22% | 0.224 | 15% | 0.147 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -128.6 | 133.8 | 163.8 | -169.7 | 0 | 0 | 0 | 0 | 109.1 | H308 T352 | H308-S320 PolarHBondContact N-O 3.46Å; H308-S320 PolarHBondContact O-N 2.64Å; S320-T352 CarbonylContact C-O 3.59Å; S320-T352 VanDerWaalsContact CA-O 3.26Å; S320-T352 WeakPolarHBondContact CA-O 3.48Å |
| 321 | A | 95.1 | Very high | 88.9 | Confident | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 15% | 0.153 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.6 | 154.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | L307 L319 I323 T352 I353 Q354 | L307-A321 HydrophobicContact CB-CB 4.5Å; L307-A321 HydrophobicContact CD1-CB 3.73Å; L319-A321 HydrophobicContact CD2-CB 3.9Å; A321-I323 HydrophobicContact CB-CD1 4.12Å; A321-T352 PolarHBondContact N-O 3.01Å; A321-I353 WeakPolarHBondContact O-CA 3.32Å; A321-Q354 PolarHBondContact O-N 2.87Å |
| 322 | H | 93.7 | Very high | 88.8 | Confident | 30 Ų | 30 | 32.7 Ų | 32.7 | 14% | 0.139 | 19% | 0.186 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.1 | 131.4 | 169.9 | -65.6 | -144.3 | 0 | 0 | 0 | 108.8 | H305 N306 Q354 E356 | H305-H322 WeakPolarHBondContact CE1-CB 3.48Å; H305-H322 PolarHBondContact N-O 3.49Å; H305-H322 WeakPolarHBondContact O-CB 3.47Å; H305-H322 PolarHBondContact O-N 2.89Å; H305-H322 VanDerWaalsContact O-O 3.08Å; N306-H322 HydrophobicContact CB-CB 4.3Å; N306-H322 PolarHBondContact ND2-NE2 3.2Å; N306-H322 VanDerWaalsContact ND2-NE2 3.1Å; H322-Q354 WeakPolarHBondContact CA-O 3.44Å; H322-Q354 VanDerWaalsContact CE1-CD 3.5Å; H322-Q354 PolarHBondContact CE1-NE2 3.04Å; H322-Q354 PolarHBondContact ND1-NE2 2.87Å; H322-E356 IonicContact CE1-OE1 3.53Å; H322-E356 IonicContact CG-OE1 2.83Å; H322-E356 IonicContact ND1-OE1 3.57Å; H322-E356 PolarHBondContact ND1-OE1 2.74Å |
| 323 | I | 94.5 | Very high | 88.9 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 117.8 | -173.3 | -51.8 | -57.3 | 0 | 0 | 0 | 108.6 | V301 V304 A321 I325 M338 I353 Q354 M355 E356 | V301-I323 HydrophobicContact CB-CG2 4.41Å; V301-I323 HydrophobicContact CG1-CG2 3.76Å; V301-I323 HydrophobicContact CG2-CG2 3.91Å; V304-I323 HydrophobicContact CB-CD1 4.07Å; V304-I323 HydrophobicContact CG1-CD1 3.8Å; V304-I323 HydrophobicContact CG2-CD1 3.56Å; A321-I323 HydrophobicContact CB-CD1 4.12Å; I323-I325 HydrophobicContact CG2-CG2 4.06Å; I323-M338 HydrophobicContact CB-CE 4.21Å; I323-M338 HydrophobicContact CB-SD 4.4Å; I323-M338 HydrophobicContact CD1-CE 3.44Å; I323-M338 VanDerWaalsContact CD1-CE 3.44Å; I323-M338 HydrophobicContact CG1-CE 3.5Å; I323-M338 HydrophobicContact CG1-SD 4.06Å; I323-M338 HydrophobicContact CG2-CE 3.69Å; I323-M338 HydrophobicContact CG2-SD 3.78Å; I323-I353 HydrophobicContact CB-CG2 4.22Å; I323-I353 HydrophobicContact CD1-CG2 4.44Å; I323-I353 HydrophobicContact CG1-CG2 3.34Å; I323-Q354 PolarHBondContact N-O 3.4Å; I323-M355 HydrophobicContact CB-SD 4.23Å; I323-M355 HydrophobicContact CG2-CE 4.45Å; I323-E356 PolarHBondContact O-N 2.93Å |
| 324 | A | 93 | Very high | 89.1 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 20% | 0.202 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -88.5 | 122.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | K302 A303 E356 L361 | K302-A324 PolarHBondContact N-O 2.97Å; A303-A324 HydrophobicContact CB-CB 4.13Å; A303-A324 PolarHBondContact N-O 2.95Å; A303-A324 PolarHBondContact O-N 3.31Å; A324-E356 WeakPolarHBondContact CA-O 3.15Å; A324-L361 HydrophobicContact CB-CD1 3.56Å; A324-L361 HydrophobicContact CB-CD2 4.06Å; A324-L361 HydrophobicContact CB-CG 3.86Å |
| 325 | I | 94 | Very high | 89.7 | Confident | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.005 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 162.8 | 177.8 | 60.2 | 168.8 | 0 | 0 | 0 | 111.6 | G300 I323 A331 I334 M355 E356 Q358 | G300-I325 WeakPolarHBondContact O-CA 3.3Å; I323-I325 HydrophobicContact CG2-CG2 4.06Å; I325-A331 HydrophobicContact CD1-CB 3.61Å; I325-I334 HydrophobicContact CG2-CG2 4.01Å; I325-M355 HydrophobicContact CB-CE 4.49Å; I325-M355 HydrophobicContact CD1-CE 3.98Å; I325-M355 HydrophobicContact CG1-CE 4.36Å; I325-M355 HydrophobicContact CG2-CE 3.4Å; I325-M355 VanDerWaalsContact CG2-CE 3.4Å; I325-E356 WeakPolarHBondContact CG1-O 3.33Å; I325-E356 PolarHBondContact N-O 3.25Å; I325-Q358 PolarHBondContact O-N 2.84Å |
| 326 | D | 88.8 | Confident | 90.2 | Very high | 41 Ų | 41 | 42.5 Ų | 42.5 | 22% | 0.219 | 23% | 0.23 | C | C | . | . | trans | -60.9 | 146.4 | 169.5 | -156.3 | -69.7 | 0 | 0 | 0 | 111.5 | G300 K302 S328 V329 R357 | G300-D326 PolarHBondContact O-N 2.99Å; K302-D326 WeakPolarHBondContact CE-OD2 3.32Å; K302-D326 IonicContact NZ-OD2 2.82Å; K302-D326 PolarHBondContact NZ-OD2 2.76Å; D326-S328 PolarHBondContact O-N 3.08Å; D326-S328 PolarHBondContact OD1-N 3.24Å; D326-S328 PolarHBondContact OD1-OG 3.42Å; D326-V329 HydrophobicContact CB-CG2 4Å; D326-V329 PolarHBondContact O-N 2.94Å; D326-R357 PolarHBondContact O-NH1 3.41Å | ||
| 327 | D | 84.5 | Confident | 90.5 | Very high | 91 Ų | 91 | 46.2 Ų | 46.2 | 49% | 0.487 | 25% | 0.248 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -24.6 | 178.8 | -69 | -26.2 | 0 | 0 | 0 | 112 | V329 R357 | D327-V329 VanDerWaalsContact C-N 3.33Å; D327-V329 PolarHBondContact O-N 3.17Å; D327-R357 PolarHBondContact O-NH1 3.47Å; D327-R357 WeakPolarHBondContact OD1-CB 3.31Å; D327-R357 WeakPolarHBondContact OD1-CD 3.48Å |
| 328 | S | 85.8 | Confident | 90.5 | Very high | 103 Ų | 103 | 45.9 Ų | 45.9 | 72% | 0.72 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -81 | -9.6 | -177.9 | 77.3 | 0 | 0 | 0 | 0 | 114.6 | D326 | D326-S328 PolarHBondContact O-N 3.08Å; D326-S328 PolarHBondContact OD1-N 3.24Å; D326-S328 PolarHBondContact OD1-OG 3.42Å |
| 329 | V | 87.6 | Confident | 90.3 | Very high | 43 Ų | 43 | 46.9 Ų | 46.9 | 26% | 0.261 | 25% | 0.251 | S | S | . | . | S | Bend | trans | -104.3 | 145.6 | -170.9 | -175.4 | 0 | 0 | 0 | 0 | 110.8 | D326 D327 A331 I334 R357 | D326-V329 HydrophobicContact CB-CG2 4Å; D326-V329 PolarHBondContact O-N 2.94Å; D327-V329 VanDerWaalsContact C-N 3.33Å; D327-V329 PolarHBondContact O-N 3.17Å; V329-A331 PolarHBondContact O-N 3.38Å; V329-I334 HydrophobicContact CG1-CD1 3.79Å; V329-I334 HydrophobicContact CG1-CG1 3.52Å; V329-R357 PolarHBondContact O-NH1 3.13Å; V329-R357 VanDerWaalsContact O-NH1 3.14Å |
| 330 | D | 90.1 | Very high | 89.8 | Confident | 89 Ų | 89 | 52.1 Ų | 52.1 | 48% | 0.476 | 28% | 0.275 | S | S | . | . | trans | -72.6 | 119.8 | 172.6 | 171.8 | 47.3 | 0 | 0 | 0 | 111.2 | Q332 T333 I334 | D330-Q332 VanDerWaalsContact C-N 3.29Å; D330-Q332 PolarHBondContact O-N 3.47Å; D330-Q332 PolarHBondContact OD1-N 2.98Å; D330-T333 PolarHBondContact O-N 3.43Å; D330-T333 WeakPolarHBondContact OD2-CB 3.46Å; D330-T333 PolarHBondContact OD2-N 3.48Å; D330-T333 PolarHBondContact OD2-OG1 2.91Å; D330-I334 PolarHBondContact O-N 2.77Å | ||
| 331 | A | 89.9 | Confident | 89.3 | Confident | 30 Ų | 30 | 51.5 Ų | 51.5 | 25% | 0.248 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.2 | -34.5 | -177 | 0 | 0 | 0 | 0 | 0 | 112.9 | I325 V329 I334 L335 M355 | I325-A331 HydrophobicContact CD1-CB 3.61Å; V329-A331 PolarHBondContact O-N 3.38Å; A331-I334 PolarHBondContact O-N 3.49Å; A331-L335 VanDerWaalsContact O-CB 3.27Å; A331-L335 WeakPolarHBondContact O-CB 3.4Å; A331-L335 PolarHBondContact O-N 3.5Å; A331-M355 HydrophobicContact CB-CB 4.29Å; A331-M355 HydrophobicContact CB-CE 4.39Å; A331-M355 HydrophobicContact CB-CG 4.39Å |
| 332 | Q | 88.5 | Confident | 88.8 | Confident | 149 Ų | 149 | 51.7 Ų | 51.7 | 70% | 0.696 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -72.7 | -35.3 | -175.2 | -169.6 | 163.7 | -2.4 | 0 | 0 | 111.9 | D330 R336 | D330-Q332 VanDerWaalsContact C-N 3.29Å; D330-Q332 PolarHBondContact O-N 3.47Å; D330-Q332 PolarHBondContact OD1-N 2.98Å; Q332-R336 WeakPolarHBondContact O-CB 3.43Å; Q332-R336 PolarHBondContact O-N 3.23Å |
| 333 | T | 88.8 | Confident | 88.1 | Confident | 64 Ų | 64 | 52.4 Ų | 52.4 | 39% | 0.393 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63 | -48.3 | 173.7 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | D330 R336 E337 | D330-T333 PolarHBondContact O-N 3.43Å; D330-T333 WeakPolarHBondContact OD2-CB 3.46Å; D330-T333 PolarHBondContact OD2-N 3.48Å; D330-T333 PolarHBondContact OD2-OG1 2.91Å; T333-R336 PolarHBondContact O-N 3.31Å; T333-E337 PolarHBondContact O-N 3.15Å; T333-E337 VanDerWaalsContact O-N 3.09Å |
| 334 | I | 91 | Very high | 87.3 | Confident | 8 Ų | 8 | 55.8 Ų | 55.8 | 4% | 0.041 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -63.9 | -45.7 | 177.6 | -60.6 | -52.2 | 0 | 0 | 0 | 111.5 | V298 D299 V301 I325 V329 D330 A331 R336 E337 M338 M355 | V298-I334 HydrophobicContact CG1-CG2 4.34Å; D299-I334 WeakPolarHBondContact O-CD1 3.29Å; V301-I334 HydrophobicContact CG2-CG2 3.9Å; I325-I334 HydrophobicContact CG2-CG2 4.01Å; V329-I334 HydrophobicContact CG1-CD1 3.79Å; V329-I334 HydrophobicContact CG1-CG1 3.52Å; D330-I334 PolarHBondContact O-N 2.77Å; A331-I334 PolarHBondContact O-N 3.49Å; I334-R336 VanDerWaalsContact C-N 3.26Å; I334-R336 PolarHBondContact O-N 3.38Å; I334-E337 PolarHBondContact O-N 3.05Å; I334-E337 VanDerWaalsContact O-N 3.14Å; I334-M338 HydrophobicContact CG2-CG 4.06Å; I334-M338 HydrophobicContact CG2-SD 3.63Å; I334-M338 VanDerWaalsContact O-CG 3.3Å; I334-M338 WeakPolarHBondContact O-CG 3.4Å; I334-M338 PolarHBondContact O-N 3.09Å; I334-M355 HydrophobicContact CB-CE 4.15Å; I334-M355 HydrophobicContact CG2-CE 3.97Å |
| 335 | L | 91.2 | Very high | 86.5 | Confident | 56 Ų | 56 | 57.8 Ų | 57.8 | 29% | 0.293 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -55 | -43.8 | 176.8 | 175.8 | 61.6 | 0 | 0 | 0 | 111.6 | A331 T339 I353 M355 | A331-L335 VanDerWaalsContact O-CB 3.27Å; A331-L335 WeakPolarHBondContact O-CB 3.4Å; A331-L335 PolarHBondContact O-N 3.5Å; L335-T339 VanDerWaalsContact O-CB 3.22Å; L335-T339 WeakPolarHBondContact O-CB 3.36Å; L335-T339 PolarHBondContact O-N 3.42Å; L335-T339 PolarHBondContact O-OG1 2.96Å; L335-I353 HydrophobicContact CD1-CB 3.58Å; L335-I353 HydrophobicContact CD1-CD1 4.19Å; L335-I353 HydrophobicContact CD1-CG1 4.3Å; L335-I353 HydrophobicContact CD1-CG2 3.99Å; L335-M355 HydrophobicContact CB-CG 4.38Å; L335-M355 HydrophobicContact CB-SD 4.14Å; L335-M355 HydrophobicContact CD1-SD 4.26Å |
| 336 | R | 86.9 | Confident | 85.6 | Confident | 135 Ų | 135 | 58.7 Ų | 58.7 | 51% | 0.509 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.6 | -45.8 | 178.4 | -173.7 | 177.7 | 67.8 | -175 | -0.2 | 111.5 | Q332 T333 I334 T339 Q340 | Q332-R336 WeakPolarHBondContact O-CB 3.43Å; Q332-R336 PolarHBondContact O-N 3.23Å; T333-R336 PolarHBondContact O-N 3.31Å; I334-R336 VanDerWaalsContact C-N 3.26Å; I334-R336 PolarHBondContact O-N 3.38Å; R336-T339 PolarHBondContact O-N 3.24Å; R336-Q340 WeakPolarHBondContact O-CB 3.49Å; R336-Q340 PolarHBondContact O-N 3.42Å |
| 337 | E | 88.3 | Confident | 84.8 | Confident | 91 Ų | 91 | 58.4 Ų | 58.4 | 43% | 0.425 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.5 | -47.2 | 179.4 | -172.2 | 171.5 | 171.5 | 0 | 0 | 112 | V298 T333 I334 T339 Q340 A341 | V298-E337 HydrophobicContact CG1-CB 4.32Å; V298-E337 HydrophobicContact CG1-CG 4.02Å; T333-E337 PolarHBondContact O-N 3.15Å; T333-E337 VanDerWaalsContact O-N 3.09Å; I334-E337 PolarHBondContact O-N 3.05Å; I334-E337 VanDerWaalsContact O-N 3.14Å; E337-T339 PolarHBondContact O-N 3.08Å; E337-Q340 PolarHBondContact O-N 3.25Å; E337-A341 WeakPolarHBondContact O-CB 3.36Å; E337-A341 PolarHBondContact O-N 3.46Å |
| 338 | M | 88.7 | Confident | 84.7 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 176.8 | -66.5 | 178.6 | 85.9 | 0 | 0 | 111.9 | L295 V298 V301 I323 I334 Q340 A341 C342 I353 | L295-M338 HydrophobicContact CB-CE 3.67Å; L295-M338 HydrophobicContact CD2-CB 4.06Å; L295-M338 HydrophobicContact CD2-CE 3.38Å; L295-M338 HydrophobicContact CD2-CG 4.37Å; L295-M338 HydrophobicContact CG-CE 4.04Å; V298-M338 HydrophobicContact CB-CG 4.13Å; V298-M338 HydrophobicContact CG1-CG 4.02Å; V298-M338 HydrophobicContact CG2-CG 3.94Å; V301-M338 HydrophobicContact CG2-CE 3.97Å; V301-M338 HydrophobicContact CG2-SD 3.79Å; I323-M338 HydrophobicContact CB-CE 4.21Å; I323-M338 HydrophobicContact CB-SD 4.4Å; I323-M338 HydrophobicContact CD1-CE 3.44Å; I323-M338 VanDerWaalsContact CD1-CE 3.44Å; I323-M338 HydrophobicContact CG1-CE 3.5Å; I323-M338 HydrophobicContact CG1-SD 4.06Å; I323-M338 HydrophobicContact CG2-CE 3.69Å; I323-M338 HydrophobicContact CG2-SD 3.78Å; I334-M338 HydrophobicContact CG2-CG 4.06Å; I334-M338 HydrophobicContact CG2-SD 3.63Å; I334-M338 VanDerWaalsContact O-CG 3.3Å; I334-M338 WeakPolarHBondContact O-CG 3.4Å; I334-M338 PolarHBondContact O-N 3.09Å; M338-Q340 VanDerWaalsContact C-N 3.32Å; M338-Q340 PolarHBondContact O-N 3.07Å; M338-A341 PolarHBondContact O-N 3.28Å; M338-C342 PolarHBondContact O-N 3.07Å; M338-I353 HydrophobicContact CB-CD1 4Å |
| 339 | T | 87.6 | Confident | 84.5 | Confident | 21 Ų | 21 | 52 Ų | 52 | 13% | 0.129 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.2 | -44.4 | 177.4 | -60.5 | 0 | 0 | 0 | 0 | 110.6 | L335 R336 E337 C342 F343 | L335-T339 VanDerWaalsContact O-CB 3.22Å; L335-T339 WeakPolarHBondContact O-CB 3.36Å; L335-T339 PolarHBondContact O-N 3.42Å; L335-T339 PolarHBondContact O-OG1 2.96Å; R336-T339 PolarHBondContact O-N 3.24Å; E337-T339 PolarHBondContact O-N 3.08Å; T339-C342 PolarHBondContact O-N 3.12Å; T339-F343 HydrophobicContact CG2-CD2 3.65Å; T339-F343 HydrophobicContact CG2-CE2 3.5Å; T339-F343 WeakPolarHBondContact O-CD2 3.47Å; T339-F343 PolarHBondContact O-N 3.23Å |
| 340 | Q | 83.9 | Confident | 84.5 | Confident | 110 Ų | 110 | 51.9 Ų | 51.9 | 51% | 0.514 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -66.7 | -39.7 | 176.6 | -178.3 | 172.2 | -14.7 | 0 | 0 | 112.6 | R336 E337 M338 C342 F343 S344 | R336-Q340 WeakPolarHBondContact O-CB 3.49Å; R336-Q340 PolarHBondContact O-N 3.42Å; E337-Q340 PolarHBondContact O-N 3.25Å; M338-Q340 VanDerWaalsContact C-N 3.32Å; M338-Q340 PolarHBondContact O-N 3.07Å; Q340-C342 VanDerWaalsContact C-N 3.33Å; Q340-C342 PolarHBondContact O-N 3Å; Q340-F343 PolarHBondContact O-N 2.98Å; Q340-S344 VanDerWaalsContact O-CB 3.28Å; Q340-S344 WeakPolarHBondContact O-CB 3.29Å; Q340-S344 PolarHBondContact O-N 3.41Å; Q340-S344 PolarHBondContact O-OG 3.03Å |
| 341 | A | 83.4 | Confident | 84.4 | Confident | 20 Ų | 20 | 48.9 Ų | 48.9 | 17% | 0.165 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62 | -40.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | E337 M338 S344 S345 | E337-A341 WeakPolarHBondContact O-CB 3.36Å; E337-A341 PolarHBondContact O-N 3.46Å; M338-A341 PolarHBondContact O-N 3.28Å; A341-S344 WeakPolarHBondContact CA-OG 3.24Å; A341-S344 PolarHBondContact O-OG 3.5Å; A341-S345 WeakPolarHBondContact O-CB 3.23Å; A341-S345 PolarHBondContact O-N 3.08Å; A341-S345 PolarHBondContact O-OG 3.47Å |
| 342 | C | 83.8 | Confident | 84.6 | Confident | 3 Ų | 3 | 51.1 Ų | 51.1 | 2% | 0.02 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -67.4 | -49.6 | 175.9 | -79.7 | 0 | 0 | 0 | 0 | 112.8 | M338 T339 Q340 S344 S345 Y346 F348 I351 | M338-C342 PolarHBondContact O-N 3.07Å; T339-C342 PolarHBondContact O-N 3.12Å; Q340-C342 VanDerWaalsContact C-N 3.33Å; Q340-C342 PolarHBondContact O-N 3Å; C342-S344 VanDerWaalsContact C-N 3.33Å; C342-S344 PolarHBondContact O-N 3.37Å; C342-S345 PolarHBondContact O-N 3.05Å; C342-Y346 PolarHBondContact O-N 2.85Å; C342-F348 HydrophobicContact CB-CD2 4.01Å; C342-F348 HydrophobicContact CB-CE2 4.12Å; C342-I351 HydrophobicContact CB-CD1 3.41Å; C342-I351 VanDerWaalsContact CB-CD1 3.41Å |
| 343 | F | 81 | Confident | 84.8 | Confident | 45 Ų | 45 | 45 Ų | 45 | 20% | 0.197 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -68.4 | -30.1 | -179 | -79.2 | -59.8 | 0 | 0 | 0 | 113.7 | T339 Q340 Y346 F348 I351 | T339-F343 HydrophobicContact CG2-CD2 3.65Å; T339-F343 HydrophobicContact CG2-CE2 3.5Å; T339-F343 WeakPolarHBondContact O-CD2 3.47Å; T339-F343 PolarHBondContact O-N 3.23Å; Q340-F343 PolarHBondContact O-N 2.98Å; F343-Y346 VanDerWaalsContact O-O 3.14Å; F343-F348 HydrophobicContact CE1-CB 4.27Å; F343-F348 WeakPolarHBondContact CE1-O 3.48Å; F343-I351 HydrophobicContact CD1-CD1 4.13Å; F343-I351 HydrophobicContact CD2-CD1 3.88Å; F343-I351 HydrophobicContact CE1-CD1 3.96Å; F343-I351 HydrophobicContact CE1-CG1 4.25Å; F343-I351 HydrophobicContact CE2-CD1 3.71Å; F343-I351 HydrophobicContact CE2-CG1 4.29Å; F343-I351 HydrophobicContact CG-CD1 4.08Å; F343-I351 HydrophobicContact CZ-CD1 3.75Å; F343-I351 HydrophobicContact CZ-CG1 3.94Å |
| 344 | S | 77.2 | Confident | 85.1 | Confident | 72 Ų | 72 | 46.6 Ų | 46.6 | 50% | 0.503 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -70.3 | -38.7 | 175.9 | 55 | 0 | 0 | 0 | 0 | 111.9 | R210 Q340 A341 C342 | R210-S344 PolarHBondContact NH2-O 3.46Å; Q340-S344 VanDerWaalsContact O-CB 3.28Å; Q340-S344 WeakPolarHBondContact O-CB 3.29Å; Q340-S344 PolarHBondContact O-N 3.41Å; Q340-S344 PolarHBondContact O-OG 3.03Å; A341-S344 WeakPolarHBondContact CA-OG 3.24Å; A341-S344 PolarHBondContact O-OG 3.5Å; C342-S344 VanDerWaalsContact C-N 3.33Å; C342-S344 PolarHBondContact O-N 3.37Å |
| 345 | S | 74.9 | Confident | 85.2 | Confident | 42 Ų | 42 | 48.5 Ų | 48.5 | 29% | 0.294 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -87.3 | -37 | -174 | -48.3 | 0 | 0 | 0 | 0 | 112.6 | R294 A341 C342 | R294-S345 PolarHBondContact NE-OG 2.94Å; A341-S345 WeakPolarHBondContact O-CB 3.23Å; A341-S345 PolarHBondContact O-N 3.08Å; A341-S345 PolarHBondContact O-OG 3.47Å; C342-S345 PolarHBondContact O-N 3.05Å |
| 346 | Y | 75.9 | Confident | 85.2 | Confident | 20 Ų | 20 | 47.5 Ų | 47.5 | 8% | 0.078 | 25% | 0.245 | C | C | . | . | S | Bend | trans | -128.9 | 160.7 | -171.6 | -53.8 | -77.7 | 0 | 0 | 0 | 112.2 | V286 E290 V291 C342 F343 F348 | V286-Y346 HydrophobicContact CG1-CD1 4.24Å; V286-Y346 HydrophobicContact CG1-CE1 4.32Å; V286-Y346 HydrophobicContact CG2-CD1 4.14Å; E290-Y346 WeakPolarHBondContact CG-OH 3.31Å; V291-Y346 HydrophobicContact CG2-CD2 4.23Å; V291-Y346 HydrophobicContact CG2-CE1 4.2Å; V291-Y346 HydrophobicContact CG2-CE2 3.7Å; C342-Y346 PolarHBondContact O-N 2.85Å; F343-Y346 VanDerWaalsContact O-O 3.14Å; Y346-F348 VanDerWaalsContact C-N 3.35Å; Y346-F348 VanDerWaalsContact CB-CE2 3.47Å; Y346-F348 AromaticContact CD2-CE2 3.71Å; Y346-F348 HydrophobicContact CD2-CE2 3.71Å; Y346-F348 HydrophobicContact CD2-CZ 4.38Å; Y346-F348 HydrophobicContact CG-CD2 4.49Å; Y346-F348 AromaticContact CG-CE2 3.82Å; Y346-F348 HydrophobicContact CG-CE2 3.82Å; Y346-F348 HydrophobicContact CG-CZ 4.31Å; Y346-F348 PolarHBondContact O-N 3.41Å |
| 347 | N | 72.9 | Confident | 85.3 | Confident | 34 Ų | 34 | 45.6 Ų | 45.6 | 18% | 0.182 | 24% | 0.238 | C | C | . | . | trans | -95.4 | 54.5 | 178.7 | -162.1 | 22.7 | 0 | 0 | 0 | 112.3 | ||||
| 348 | F | 82.5 | Confident | 84.9 | Confident | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 24% | 0.238 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -64.4 | 137.5 | 175.9 | -69.8 | -65.8 | 0 | 0 | 0 | 110.8 | N44 V286 V291 I309 A317 L319 C342 F343 Y346 I351 | N44-F348 PolarHBondContact ND2-O 2.91Å; V286-F348 HydrophobicContact CG1-CZ 4.14Å; V291-F348 HydrophobicContact CG2-CZ 4.24Å; I309-F348 HydrophobicContact CG2-CE1 4.05Å; A317-F348 HydrophobicContact CB-CD1 3.63Å; A317-F348 HydrophobicContact CB-CE1 3.86Å; A317-F348 CarbonylContact O-C 3.56Å; A317-F348 WeakPolarHBondContact O-CA 3.47Å; L319-F348 HydrophobicContact CB-CD1 3.98Å; L319-F348 HydrophobicContact CB-CE1 3.81Å; L319-F348 HydrophobicContact CB-CZ 4.19Å; L319-F348 HydrophobicContact CD1-CE1 4.1Å; L319-F348 HydrophobicContact CD1-CE2 3.99Å; L319-F348 HydrophobicContact CD1-CZ 3.62Å; C342-F348 HydrophobicContact CB-CD2 4.01Å; C342-F348 HydrophobicContact CB-CE2 4.12Å; F343-F348 HydrophobicContact CE1-CB 4.27Å; F343-F348 WeakPolarHBondContact CE1-O 3.48Å; Y346-F348 VanDerWaalsContact C-N 3.35Å; Y346-F348 VanDerWaalsContact CB-CE2 3.47Å; Y346-F348 AromaticContact CD2-CE2 3.71Å; Y346-F348 HydrophobicContact CD2-CE2 3.71Å; Y346-F348 HydrophobicContact CD2-CZ 4.38Å; Y346-F348 HydrophobicContact CG-CD2 4.49Å; Y346-F348 AromaticContact CG-CE2 3.82Å; Y346-F348 HydrophobicContact CG-CE2 3.82Å; Y346-F348 HydrophobicContact CG-CZ 4.31Å; Y346-F348 PolarHBondContact O-N 3.41Å; F348-I351 HydrophobicContact CB-CD1 3.95Å; F348-I351 HydrophobicContact CB-CG1 3.67Å; F348-I351 HydrophobicContact CD2-CD1 3.92Å; F348-I351 HydrophobicContact CD2-CG1 4.23Å; F348-I351 HydrophobicContact CG-CD1 4.19Å; F348-I351 HydrophobicContact CG-CG1 4.03Å |
| 349 | H | 81.4 | Confident | 84.4 | Confident | 61 Ų | 61 | 49.6 Ų | 49.6 | 28% | 0.282 | 27% | 0.27 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.5 | -46 | 169.5 | -177.8 | -7.5 | 0 | 0 | 0 | 110.6 | Y125 Q316 A317 V318 | Y125-H349 AromaticContact CE2-NE2 3.63Å; Q316-H349 HydrophobicContact CB-CB 4.2Å; Q316-H349 HydrophobicContact CG-CB 4.5Å; Q316-H349 PolarHBondContact NE2-CD2 3.38Å; Q316-H349 VanDerWaalsContact NE2-CD2 3.29Å; A317-H349 WeakPolarHBondContact O-CB 3.24Å; A317-H349 PolarHBondContact O-N 3.22Å; V318-H349 HydrophobicContact CG2-CB 4.44Å |
| 350 | S | 86 | Confident | 83.9 | Confident | 39 Ų | 39 | 53.6 Ų | 53.6 | 27% | 0.273 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.8 | 147.8 | 179 | -169.1 | 0 | 0 | 0 | 0 | 109.4 | V318 L319 | V318-S350 WeakPolarHBondContact CA-O 3.44Å; L319-S350 PolarHBondContact N-O 3.35Å |
| 351 | I | 89.6 | Confident | 83.7 | Confident | 27 Ų | 27 | 51.4 Ų | 51.4 | 14% | 0.138 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.4 | 124.8 | 178.9 | -55.3 | 179.5 | 0 | 0 | 0 | 106.5 | L319 C342 F343 F348 I353 | L319-I351 HydrophobicContact CB-CG2 4.44Å; L319-I351 HydrophobicContact CD2-CG2 3.89Å; L319-I351 WeakPolarHBondContact O-CA 3.33Å; C342-I351 HydrophobicContact CB-CD1 3.41Å; C342-I351 VanDerWaalsContact CB-CD1 3.41Å; F343-I351 HydrophobicContact CD1-CD1 4.13Å; F343-I351 HydrophobicContact CD2-CD1 3.88Å; F343-I351 HydrophobicContact CE1-CD1 3.96Å; F343-I351 HydrophobicContact CE1-CG1 4.25Å; F343-I351 HydrophobicContact CE2-CD1 3.71Å; F343-I351 HydrophobicContact CE2-CG1 4.29Å; F343-I351 HydrophobicContact CG-CD1 4.08Å; F343-I351 HydrophobicContact CZ-CD1 3.75Å; F343-I351 HydrophobicContact CZ-CG1 3.94Å; F348-I351 HydrophobicContact CB-CD1 3.95Å; F348-I351 HydrophobicContact CB-CG1 3.67Å; F348-I351 HydrophobicContact CD2-CD1 3.92Å; F348-I351 HydrophobicContact CD2-CG1 4.23Å; F348-I351 HydrophobicContact CG-CD1 4.19Å; F348-I351 HydrophobicContact CG-CG1 4.03Å; I351-I353 HydrophobicContact CG2-CD1 3.89Å; I351-I353 HydrophobicContact CG2-CG1 3.72Å |
| 352 | T | 92.6 | Very high | 83.4 | Confident | 76 Ų | 76 | 58.2 Ų | 58.2 | 47% | 0.466 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 123.9 | 170.8 | -53.9 | 0 | 0 | 0 | 0 | 107.8 | L319 S320 A321 | L319-T352 PolarHBondContact O-N 3.38Å; S320-T352 CarbonylContact C-O 3.59Å; S320-T352 VanDerWaalsContact CA-O 3.26Å; S320-T352 WeakPolarHBondContact CA-O 3.48Å; A321-T352 PolarHBondContact N-O 3.01Å |
| 353 | I | 94.1 | Very high | 83.1 | Confident | 21 Ų | 21 | 64 Ų | 64 | 11% | 0.108 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 117.1 | 179.3 | -58.2 | -178.6 | 0 | 0 | 0 | 107.1 | A321 I323 L335 M338 I351 M355 | A321-I353 WeakPolarHBondContact O-CA 3.32Å; I323-I353 HydrophobicContact CB-CG2 4.22Å; I323-I353 HydrophobicContact CD1-CG2 4.44Å; I323-I353 HydrophobicContact CG1-CG2 3.34Å; L335-I353 HydrophobicContact CD1-CB 3.58Å; L335-I353 HydrophobicContact CD1-CD1 4.19Å; L335-I353 HydrophobicContact CD1-CG1 4.3Å; L335-I353 HydrophobicContact CD1-CG2 3.99Å; M338-I353 HydrophobicContact CB-CD1 4Å; I351-I353 HydrophobicContact CG2-CD1 3.89Å; I351-I353 HydrophobicContact CG2-CG1 3.72Å; I353-M355 HydrophobicContact CG2-SD 3.78Å |
| 354 | Q | 94.3 | Very high | 82.9 | Confident | 98 Ų | 98 | 65.2 Ų | 65.2 | 46% | 0.458 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87 | 122.5 | 171.3 | -179.8 | 167 | -45.9 | 0 | 0 | 108.5 | A321 H322 I323 E356 | A321-Q354 PolarHBondContact O-N 2.87Å; H322-Q354 WeakPolarHBondContact CA-O 3.44Å; H322-Q354 VanDerWaalsContact CE1-CD 3.5Å; H322-Q354 PolarHBondContact CE1-NE2 3.04Å; H322-Q354 PolarHBondContact ND1-NE2 2.87Å; I323-Q354 PolarHBondContact N-O 3.4Å; Q354-E356 HydrophobicContact CG-CG 4.24Å; Q354-E356 PolarHBondContact NE2-OE1 3.45Å |
| 355 | M | 93.1 | Very high | 83 | Confident | 48 Ų | 48 | 63.7 Ų | 63.7 | 24% | 0.236 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 128.5 | 177.1 | -57.3 | -57.9 | -65.1 | 0 | 0 | 109.2 | I323 I325 A331 I334 L335 I353 | I323-M355 HydrophobicContact CB-SD 4.23Å; I323-M355 HydrophobicContact CG2-CE 4.45Å; I325-M355 HydrophobicContact CB-CE 4.49Å; I325-M355 HydrophobicContact CD1-CE 3.98Å; I325-M355 HydrophobicContact CG1-CE 4.36Å; I325-M355 HydrophobicContact CG2-CE 3.4Å; I325-M355 VanDerWaalsContact CG2-CE 3.4Å; A331-M355 HydrophobicContact CB-CB 4.29Å; A331-M355 HydrophobicContact CB-CE 4.39Å; A331-M355 HydrophobicContact CB-CG 4.39Å; I334-M355 HydrophobicContact CB-CE 4.15Å; I334-M355 HydrophobicContact CG2-CE 3.97Å; L335-M355 HydrophobicContact CB-CG 4.38Å; L335-M355 HydrophobicContact CB-SD 4.14Å; L335-M355 HydrophobicContact CD1-SD 4.26Å; I353-M355 HydrophobicContact CG2-SD 3.78Å |
| 356 | E | 91.7 | Very high | 83.3 | Confident | 35 Ų | 35 | 66.8 Ų | 66.8 | 16% | 0.164 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 154.9 | 179.2 | -63.8 | -176.2 | -176.6 | 0 | 0 | 110.1 | H305 H322 I323 A324 I325 Q354 | H305-E356 IonicContact CE1-OE2 3.1Å; H305-E356 PolarHBondContact CE1-OE2 3.14Å; H305-E356 IonicContact NE2-OE2 3.39Å; H305-E356 PolarHBondContact NE2-OE2 3.18Å; H322-E356 IonicContact CE1-OE1 3.53Å; H322-E356 IonicContact CG-OE1 2.83Å; H322-E356 IonicContact ND1-OE1 3.57Å; H322-E356 PolarHBondContact ND1-OE1 2.74Å; I323-E356 PolarHBondContact O-N 2.93Å; A324-E356 WeakPolarHBondContact CA-O 3.15Å; I325-E356 WeakPolarHBondContact CG1-O 3.33Å; I325-E356 PolarHBondContact N-O 3.25Å; Q354-E356 HydrophobicContact CG-CG 4.24Å; Q354-E356 PolarHBondContact NE2-OE1 3.45Å |
| 357 | R | 87.8 | Confident | 83.6 | Confident | 95 Ų | 95 | 72.8 Ų | 72.8 | 36% | 0.358 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.3 | 152.1 | 172.5 | -66.6 | -58.7 | -166.2 | 174.2 | 2.3 | 109.8 | D326 D327 V329 A359 D360 | D326-R357 PolarHBondContact O-NH1 3.41Å; D327-R357 PolarHBondContact O-NH1 3.47Å; D327-R357 WeakPolarHBondContact OD1-CB 3.31Å; D327-R357 WeakPolarHBondContact OD1-CD 3.48Å; V329-R357 PolarHBondContact O-NH1 3.13Å; V329-R357 VanDerWaalsContact O-NH1 3.14Å; R357-A359 PolarHBondContact O-N 3.48Å; R357-A359 VanDerWaalsContact O-N 3.15Å; R357-D360 WeakPolarHBondContact CB-OD2 3.24Å; R357-D360 PolarHBondContact N-OD2 3.28Å; R357-D360 WeakPolarHBondContact O-CB 3.36Å; R357-D360 PolarHBondContact O-N 2.98Å |
| 358 | Q | 81.6 | Confident | 83.9 | Confident | 92 Ų | 92 | 73.2 Ų | 73.2 | 43% | 0.43 | 42% | 0.415 | S | S | . | . | G | 310 helix | trans | -56.9 | -32.7 | 177.4 | -174 | 176.6 | -1.3 | 0 | 0 | 112.2 | I325 D360 L361 | I325-Q358 PolarHBondContact O-N 2.84Å; Q358-D360 PolarHBondContact O-N 3.34Å; Q358-L361 HydrophobicContact CG-CD1 4.18Å; Q358-L361 WeakPolarHBondContact O-CB 3.2Å; Q358-L361 PolarHBondContact O-N 3.49Å |
| 359 | A | 77.8 | Confident | 83.8 | Confident | 82 Ų | 82 | 79.4 Ų | 79.4 | 68% | 0.678 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | -62.5 | -23.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114 | R357 L361 | R357-A359 PolarHBondContact O-N 3.48Å; R357-A359 VanDerWaalsContact O-N 3.15Å; A359-L361 VanDerWaalsContact C-N 3.32Å |
| 360 | D | 76.8 | Confident | 83.7 | Confident | 106 Ų | 106 | 80.1 Ų | 80.1 | 57% | 0.567 | 45% | 0.449 | S | S | * | . | G | 310 helix | trans | -84.2 | -9.3 | -177.4 | -57.4 | -41 | 0 | 0 | 0 | 112.6 | R357 Q358 K362 | R357-D360 WeakPolarHBondContact CB-OD2 3.24Å; R357-D360 PolarHBondContact N-OD2 3.28Å; R357-D360 WeakPolarHBondContact O-CB 3.36Å; R357-D360 PolarHBondContact O-N 2.98Å; Q358-D360 PolarHBondContact O-N 3.34Å; D360-K362 PolarHBondContact O-N 3.08Å; D360-K362 VanDerWaalsContact O-N 3.13Å |
| 361 | L | 79.2 | Confident | 83.5 | Confident | 63 Ų | 63 | 81.9 Ų | 81.9 | 33% | 0.33 | 46% | 0.46 | S | S | . | . | trans | -68.9 | 109.5 | 177.7 | -75.5 | 163.8 | 0 | 0 | 0 | 110.9 | A303 A324 Q358 A359 P363 | A303-L361 HydrophobicContact CB-CD1 4.28Å; A303-L361 HydrophobicContact CB-CD2 4.49Å; A324-L361 HydrophobicContact CB-CD1 3.56Å; A324-L361 HydrophobicContact CB-CD2 4.06Å; A324-L361 HydrophobicContact CB-CG 3.86Å; Q358-L361 HydrophobicContact CG-CD1 4.18Å; Q358-L361 WeakPolarHBondContact O-CB 3.2Å; Q358-L361 PolarHBondContact O-N 3.49Å; A359-L361 VanDerWaalsContact C-N 3.32Å; L361-P363 WeakPolarHBondContact O-CD 3.46Å | ||
| 362 | K | 77.9 | Confident | 82.9 | Confident | 164 Ų | 164 | 89.8 Ų | 89.8 | 71% | 0.713 | 50% | 0.496 | S | S | * | . | trans | -78.3 | 116.9 | 172.1 | -169.5 | 176.6 | -178.5 | -179.3 | 0 | 110.6 | D360 G364 C365 | D360-K362 PolarHBondContact O-N 3.08Å; D360-K362 VanDerWaalsContact O-N 3.13Å; K362-G364 PolarHBondContact O-N 3.34Å; K362-C365 HydrophobicContact CB-CB 4.48Å; K362-C365 PolarHBondContact O-N 2.92Å | ||
| 363 | P | 76.9 | Confident | 81.3 | Confident | 125 Ų | 125 | 97 Ų | 97 | 81% | 0.812 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | 133.4 | 176.6 | 24.3 | -31.2 | 0 | 0 | 0 | 110.6 | L361 | L361-P363 WeakPolarHBondContact O-CD 3.46Š|
| 364 | G | 76.4 | Confident | 80.7 | Confident | 70 Ų | 70 | 100.8 Ų | 100.8 | 72% | 0.722 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 75 | 23.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | K362 T366 | K362-G364 PolarHBondContact O-N 3.34Å; G364-T366 PolarHBondContact O-N 3.5Å; G364-T366 VanDerWaalsContact O-N 3.15Å |
| 365 | C | 80.6 | Confident | 80 | Confident | 40 Ų | 40 | 100.9 Ų | 100.9 | 27% | 0.27 | 56% | 0.559 | S | S | . | * | trans | -69.3 | 106.7 | 171.9 | -173.9 | 0 | 0 | 0 | 0 | 110.8 | K362 L367 C368 E369 | K362-C365 HydrophobicContact CB-CB 4.48Å; K362-C365 PolarHBondContact O-N 2.92Å; C365-L367 PolarHBondContact O-N 3.45Å; C365-C368 HydrophobicContact CB-CB 4.06Å; C365-C368 PolarHBondContact O-N 2.89Å; C365-C368 VanDerWaalsContact SG-SG 3.65Å; C365-E369 PolarHBondContact O-N 2.96Å | ||
| 366 | T | 81.2 | Confident | 79.3 | Confident | 106 Ų | 106 | 103.9 Ų | 103.9 | 65% | 0.65 | 58% | 0.576 | S | S | * | * | G | 310 helix | trans | -63.5 | -26 | -179.9 | 54 | 0 | 0 | 0 | 0 | 113.6 | G364 C368 | G364-T366 PolarHBondContact O-N 3.5Å; G364-T366 VanDerWaalsContact O-N 3.15Å; T366-C368 VanDerWaalsContact C-N 3.27Å; T366-C368 PolarHBondContact O-N 3.41Å |
| 367 | L | 81.5 | Confident | 78.5 | Confident | 147 Ų | 147 | 107.9 Ų | 107.9 | 77% | 0.77 | 60% | 0.601 | S | S | * | * | G | 310 helix | trans | -74.3 | -18.7 | 175.9 | -63.3 | 174.5 | 0 | 0 | 0 | 113 | C365 | C365-L367 PolarHBondContact O-N 3.45Š|
| 368 | C | 78.4 | Confident | 77.9 | Confident | 42 Ų | 42 | 108.8 Ų | 108.8 | 28% | 0.284 | 62% | 0.616 | S | S | . | * | G | 310 helix | trans | -103.5 | 0.9 | -179.6 | -66.3 | 0 | 0 | 0 | 0 | 112.5 | H305 C365 T366 | H305-C368 HydrophobicContact CB-CB 4.04Å; C365-C368 HydrophobicContact CB-CB 4.06Å; C365-C368 PolarHBondContact O-N 2.89Å; C365-C368 VanDerWaalsContact SG-SG 3.65Å; T366-C368 VanDerWaalsContact C-N 3.27Å; T366-C368 PolarHBondContact O-N 3.41Å |
| 369 | E | 80.2 | Confident | 77.7 | Confident | 131 Ų | 131 | 109.9 Ų | 109.9 | 61% | 0.612 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -65 | 146.3 | 176.5 | -77.1 | -178.5 | -177.8 | 0 | 0 | 111 | C365 | C365-E369 PolarHBondContact O-N 2.96Š|
| 370 | N | 80.4 | Confident | 77.7 | Confident | 75 Ų | 75 | 111.9 Ų | 111.9 | 40% | 0.401 | 63% | 0.625 | S | S | . | * | P | Polyproline II helix | trans | -66.6 | 140.8 | 177.4 | -62.9 | -65.1 | 0 | 0 | 0 | 109.5 | R292 | R292-N370 PolarHBondContact NE-OD1 3.01Š|
| 371 | P | 82.1 | Confident | 77.8 | Confident | 77 Ų | 77 | 112.3 Ų | 112.3 | 50% | 0.5 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 144.9 | 172.6 | 23.9 | -30.8 | 0 | 0 | 0 | 110.7 | Y288 | Y288-P371 HydrophobicContact CD1-CG 4.45Å; Y288-P371 HydrophobicContact CD2-CG 4.49Å; Y288-P371 HydrophobicContact CE1-CG 3.88Å; Y288-P371 HydrophobicContact CE2-CG 3.89Å; Y288-P371 WeakPolarHBondContact OH-CD 3.25Å |
| 372 | Q | 75.8 | Confident | 77.6 | Confident | 192 Ų | 192 | 116.4 Ų | 116.4 | 90% | 0.897 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 143.1 | 175.5 | -63.1 | -179.8 | 0.5 | 0 | 0 | 109.9 | ||
| 373 | N | 60.3 | Low | 77.6 | Confident | 228 Ų | 228 | 112.1 Ų | 112.1 | 100% | 1.219 | 65% | 0.649 | S | S | * | * | trans | -71 | 0 | -179.9 | -86.8 | -14.3 | 0 | 0 | 0 | 113.4 |
Retrieved 373 of 373 residues in 692 ms
(Link to these results)