| 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 | 39.7 | Very low | 45.6 | Very low | 238 Ų | 238 | 139.6 Ų | 139.6 | 100% | 1.172 | 85% | 0.846 | S | S | * | * | 0 | 81.1 | 0 | -64.7 | -179.6 | 164 | 0 | 0 | 106.5 | |||||
| 2 | Q | 46 | Very low | 45.6 | Very low | 206 Ų | 206 | 136.7 Ų | 136.7 | 96% | 0.963 | 83% | 0.832 | S | S | * | * | 69.1 | 110.9 | 108.2 | -86.6 | 164.9 | 36.5 | 0 | 0 | 113.9 | |||||
| 3 | G | 46.5 | Very low | 45.6 | Very low | 78 Ų | 78 | 140.1 Ų | 140.1 | 80% | 0.804 | 84% | 0.841 | S | S | * | * | trans | 172.7 | 74.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 4 | R | 47.2 | Very low | 45.1 | Very low | 250 Ų | 250 | 138.1 Ų | 138.1 | 94% | 0.943 | 83% | 0.83 | S | S | * | * | trans | 40.3 | 119.6 | 152.7 | -75.5 | -176.6 | 164.8 | 152 | -3.6 | 121.7 | ||||
| 5 | A | 47.1 | Very low | 44.7 | Very low | 91 Ų | 91 | 137.9 Ų | 137.9 | 75% | 0.752 | 82% | 0.817 | S | S | * | * | trans | -52.4 | 131.9 | 150.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 6 | A | 48.7 | Very low | 44.3 | Very low | 96 Ų | 96 | 142.6 Ų | 142.6 | 79% | 0.793 | 82% | 0.816 | S | S | * | * | 60.4 | 136.9 | 87.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 7 | E | 45.4 | Very low | 44.1 | Very low | 182 Ų | 182 | 138.8 Ų | 138.8 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | cis | -177.9 | 167.4 | -7.6 | -130.9 | -102.3 | 82 | 0 | 0 | 105 | ||||
| 8 | A | 44.1 | Very low | 43.5 | Very low | 82 Ų | 82 | 138.2 Ų | 138.2 | 68% | 0.678 | 81% | 0.808 | S | S | * | * | trans | 70.1 | 118.1 | 159.2 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 9 | G | 43.5 | Very low | 43.8 | Very low | 70 Ų | 70 | 139.7 Ų | 139.7 | 72% | 0.722 | 81% | 0.812 | S | S | * | * | trans | -79.1 | -154.5 | 149.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 10 | P | 47 | Very low | 43.8 | Very low | 132 Ų | 132 | 139.7 Ų | 139.7 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | cis | -119.6 | 178.9 | -15.1 | 36.5 | -18.6 | 0 | 0 | 0 | 113 | ||||
| 11 | S | 47 | Very low | 43.4 | Very low | 111 Ų | 111 | 139.1 Ų | 139.1 | 78% | 0.776 | 80% | 0.801 | S | S | * | * | trans | -57.2 | 174 | 164.3 | -35.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 12 | P | 45.7 | Very low | 43.7 | Very low | 104 Ų | 104 | 135.1 Ų | 135.1 | 68% | 0.675 | 79% | 0.79 | S | S | * | * | cis | -137.2 | 166.4 | 8.6 | 39.9 | -21.1 | 0 | 0 | 0 | 114.5 | ||||
| 13 | L | 45.1 | Very low | 43.2 | Very low | 181 Ų | 181 | 131.6 Ų | 131.6 | 95% | 0.948 | 77% | 0.773 | S | S | * | * | trans | -134.8 | 117.3 | 153.2 | -87.1 | -179.2 | 0 | 0 | 0 | 111.1 | ||||
| 14 | T | 38.3 | Very low | 42.8 | Very low | 112 Ų | 112 | 137.7 Ų | 137.7 | 69% | 0.687 | 77% | 0.772 | S | S | * | * | trans | -68.2 | 169.5 | 173.4 | -50.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 15 | E | 39.5 | Very low | 42.6 | Very low | 135 Ų | 135 | 131.5 Ų | 131.5 | 63% | 0.631 | 76% | 0.764 | S | S | * | * | trans | 102.8 | 91.7 | 163.5 | -64 | -77.5 | 87.1 | 0 | 0 | 113.3 | ||||
| 16 | R | 37.9 | Very low | 41.8 | Very low | 214 Ų | 214 | 131 Ų | 131 | 81% | 0.808 | 77% | 0.768 | S | S | * | * | 77.3 | 99.2 | 88.4 | -94.6 | -166.7 | 170.7 | 158 | -9.3 | 111.3 | |||||
| 17 | G | 40.5 | Very low | 41.4 | Very low | 78 Ų | 78 | 130.9 Ų | 130.9 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -149.7 | 85.6 | 159.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | L19 | G17-L19 PolarHBondContact O-N 3.2Š| ||
| 18 | D | 34.3 | Very low | 41 | Very low | 128 Ų | 128 | 131 Ų | 131 | 68% | 0.684 | 77% | 0.768 | S | S | * | * | trans | -44.7 | 131.9 | 165.3 | -74.1 | -66.4 | 0 | 0 | 0 | 110.8 | ||||
| 19 | L | 48 | Very low | 41.6 | Very low | 167 Ų | 167 | 132.4 Ų | 132.4 | 87% | 0.874 | 77% | 0.769 | S | S | * | * | -162.9 | 82.3 | 125.8 | -125.9 | 94.7 | 0 | 0 | 0 | 111.3 | G17 N21 | G17-L19 PolarHBondContact O-N 3.2Å; L19-N21 PolarHBondContact O-N 3.09Å | |||
| 20 | I | 44 | Very low | 41.9 | Very low | 138 Ų | 138 | 134.2 Ų | 134.2 | 71% | 0.708 | 77% | 0.769 | S | S | * | * | trans | -42.9 | 115.2 | 138 | 36.2 | 155.8 | 0 | 0 | 0 | 111.4 | ||||
| 21 | N | 36.3 | Very low | 41.7 | Very low | 129 Ų | 129 | 136.5 Ų | 136.5 | 69% | 0.69 | 77% | 0.768 | S | S | * | * | trans | 163.3 | 91.7 | 131.9 | -99.6 | -84.3 | 0 | 0 | 0 | 110.9 | L19 H23 | L19-N21 PolarHBondContact O-N 3.09Å; N21-H23 PolarHBondContact O-N 3.16Å; N21-H23 VanDerWaalsContact O-N 3.16Å | ||
| 22 | T | 44.9 | Very low | 41.8 | Very low | 154 Ų | 154 | 139.2 Ų | 139.2 | 95% | 0.945 | 77% | 0.768 | S | S | * | * | trans | -77.7 | 76.7 | 150.6 | 22.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 23 | H | 36.5 | Very low | 41.8 | Very low | 131 Ų | 131 | 141.6 Ų | 141.6 | 61% | 0.606 | 78% | 0.775 | S | S | * | * | trans | -152.7 | 119.5 | 162.4 | -165.2 | -102.7 | 0 | 0 | 0 | 112.8 | N21 | N21-H23 PolarHBondContact O-N 3.16Å; N21-H23 VanDerWaalsContact O-N 3.16Å | ||
| 24 | R | 37.6 | Very low | 42.3 | Very low | 206 Ų | 206 | 137 Ų | 137 | 78% | 0.777 | 75% | 0.751 | S | S | * | * | trans | 109 | 133.8 | 150.4 | -159.2 | 172.4 | -80.5 | 149.7 | -5.7 | 116.9 | ||||
| 25 | P | 42.9 | Very low | 43.1 | Very low | 120 Ų | 120 | 136.6 Ų | 136.6 | 78% | 0.779 | 75% | 0.75 | S | S | * | * | trans | -76.2 | 127.7 | -178.9 | 1.2 | 18.3 | 0 | 0 | 0 | 109.7 | A27 | P25-A27 PolarHBondContact O-N 2.98Š| ||
| 26 | G | 31.2 | Very low | 43.9 | Very low | 80 Ų | 80 | 139.4 Ų | 139.4 | 83% | 0.825 | 76% | 0.755 | S | S | * | * | trans | -78 | 113.3 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 27 | A | 40.3 | Very low | 44.8 | Very low | 94 Ų | 94 | 131.3 Ų | 131.3 | 78% | 0.777 | 73% | 0.734 | S | S | * | * | trans | -64.8 | 134 | 157.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | P25 | P25-A27 PolarHBondContact O-N 2.98Š| ||
| 28 | E | 35.7 | Very low | 45.4 | Very low | 186 Ų | 186 | 133.3 Ų | 133.3 | 87% | 0.869 | 73% | 0.726 | S | S | * | * | -169.7 | 150 | 101.6 | -86 | -153.7 | 103.5 | 0 | 0 | 111.4 | |||||
| 29 | P | 57.7 | Low | 46.1 | Very low | 110 Ų | 110 | 135.2 Ų | 135.2 | 71% | 0.714 | 72% | 0.723 | S | S | * | * | trans | -94.6 | -167 | -169.9 | 42.9 | -34.1 | 0 | 0 | 0 | 109.7 | ||||
| 30 | P | 50.1 | Low | 46.5 | Very low | 109 Ų | 109 | 132.4 Ų | 132.4 | 71% | 0.708 | 71% | 0.709 | S | S | * | * | cis | -120.7 | 155 | 0.6 | 39.4 | -25.4 | 0 | 0 | 0 | 111.8 | ||||
| 31 | Q | 42.9 | Very low | 46.9 | Very low | 180 Ų | 180 | 136 Ų | 136 | 84% | 0.841 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -159.5 | 110.7 | 130.6 | -71.7 | -137.8 | 16.2 | 0 | 0 | 107.8 | ||
| 32 | Q | 48.3 | Very low | 47.6 | Very low | 167 Ų | 167 | 133.5 Ų | 133.5 | 78% | 0.78 | 71% | 0.71 | S | S | * | * | trans | 53.5 | 79.3 | 140.1 | -153.5 | 165.9 | -74.8 | 0 | 0 | 115.1 | D34 | Q32-D34 PolarHBondContact O-N 3.28Š| ||
| 33 | L | 46.7 | Very low | 47.9 | Very low | 155 Ų | 155 | 132.2 Ų | 132.2 | 81% | 0.812 | 69% | 0.694 | S | S | * | * | trans | -58.1 | 109.7 | 159.5 | -98.8 | 84.3 | 0 | 0 | 0 | 107.5 | P35 | L33-P35 WeakPolarHBondContact O-CD 3.44Š| ||
| 34 | D | 54.1 | Low | 48.1 | Very low | 85 Ų | 85 | 131.3 Ų | 131.3 | 46% | 0.455 | 70% | 0.702 | S | S | . | * | trans | -57.5 | 123.3 | 177.2 | -169.8 | -75 | 0 | 0 | 0 | 109 | Q32 R36 A37 | Q32-D34 PolarHBondContact O-N 3.28Å; D34-R36 PolarHBondContact O-N 3.21Å; D34-R36 VanDerWaalsContact OD1-CA 3.29Å; D34-R36 WeakPolarHBondContact OD1-CA 3.35Å; D34-R36 WeakPolarHBondContact OD1-CB 3.37Å; D34-R36 VanDerWaalsContact OD1-CG 3.23Å; D34-R36 WeakPolarHBondContact OD1-CG 3.31Å; D34-R36 PolarHBondContact OD1-N 3.47Å; D34-A37 HydrophobicContact CB-CB 4.49Å; D34-A37 WeakPolarHBondContact O-CB 3.15Å; D34-A37 PolarHBondContact O-N 2.83Å | ||
| 35 | P | 54.8 | Low | 48.5 | Very low | 102 Ų | 102 | 124.5 Ų | 124.5 | 66% | 0.662 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -55.3 | -20.5 | 178 | -25.1 | 32.7 | 0 | 0 | 0 | 113.6 | L33 W39 | L33-P35 WeakPolarHBondContact O-CD 3.44Å; P35-W39 PolarHBondContact O-N 3.48Å |
| 36 | R | 56.4 | Low | 48.7 | Very low | 194 Ų | 194 | 122.2 Ų | 122.2 | 73% | 0.732 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -81.8 | -28.9 | 177.8 | -52.3 | -145.2 | 167.4 | -144.1 | 1.2 | 113.5 | D34 L38 W39 L40 | D34-R36 PolarHBondContact O-N 3.21Å; D34-R36 VanDerWaalsContact OD1-CA 3.29Å; D34-R36 WeakPolarHBondContact OD1-CA 3.35Å; D34-R36 WeakPolarHBondContact OD1-CB 3.37Å; D34-R36 VanDerWaalsContact OD1-CG 3.23Å; D34-R36 WeakPolarHBondContact OD1-CG 3.31Å; D34-R36 PolarHBondContact OD1-N 3.47Å; R36-L38 VanDerWaalsContact C-N 3.27Å; R36-L38 PolarHBondContact O-N 3.2Å; R36-W39 WeakPolarHBondContact O-CB 3.44Å; R36-W39 PolarHBondContact O-N 3.47Å; R36-L40 WeakPolarHBondContact O-CG 3.43Å; R36-L40 PolarHBondContact O-N 3.27Å |
| 37 | A | 58.2 | Low | 49.4 | Very low | 44 Ų | 44 | 121.8 Ų | 121.8 | 36% | 0.364 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -62.4 | -43.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | D34 W39 L40 W41 | D34-A37 HydrophobicContact CB-CB 4.49Å; D34-A37 WeakPolarHBondContact O-CB 3.15Å; D34-A37 PolarHBondContact O-N 2.83Å; A37-W39 VanDerWaalsContact C-N 3.26Å; A37-W39 PolarHBondContact O-N 2.91Å; A37-L40 PolarHBondContact O-N 2.95Å; A37-L40 VanDerWaalsContact O-N 3.12Å; A37-W41 PolarHBondContact O-N 2.87Å |
| 38 | L | 51.9 | Low | 49.3 | Very low | 121 Ų | 121 | 122 Ų | 122 | 63% | 0.634 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -64.4 | -32.8 | 177.5 | -148.5 | 143.4 | 0 | 0 | 0 | 112.2 | R36 A42 | R36-L38 VanDerWaalsContact C-N 3.27Å; R36-L38 PolarHBondContact O-N 3.2Å; L38-A42 WeakPolarHBondContact O-CB 3.37Å; L38-A42 PolarHBondContact O-N 3.37Å; L38-A42 VanDerWaalsContact O-N 3.13Å |
| 39 | W | 50.2 | Low | 49.8 | Very low | 167 Ų | 167 | 119.5 Ų | 119.5 | 63% | 0.633 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -67.6 | -41.4 | 171.8 | -133.5 | 81.2 | 0 | 0 | 0 | 112.7 | P35 R36 A37 A42 E43 | P35-W39 PolarHBondContact O-N 3.48Å; R36-W39 WeakPolarHBondContact O-CB 3.44Å; R36-W39 PolarHBondContact O-N 3.47Å; A37-W39 VanDerWaalsContact C-N 3.26Å; A37-W39 PolarHBondContact O-N 2.91Å; W39-A42 PolarHBondContact O-N 3.45Å; W39-E43 VanDerWaalsContact CZ3-OE2 3.22Å; W39-E43 WeakPolarHBondContact CZ3-OE2 3.49Å; W39-E43 WeakPolarHBondContact O-CB 3.34Å; W39-E43 PolarHBondContact O-N 3.38Å |
| 40 | L | 55.9 | Low | 49 | Very low | 109 Ų | 109 | 120.2 Ų | 120.2 | 57% | 0.571 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -71.5 | -32.3 | 177.8 | -71.5 | 167.8 | 0 | 0 | 0 | 112.9 | R36 A37 E43 S44 | R36-L40 WeakPolarHBondContact O-CG 3.43Å; R36-L40 PolarHBondContact O-N 3.27Å; A37-L40 PolarHBondContact O-N 2.95Å; A37-L40 VanDerWaalsContact O-N 3.12Å; L40-E43 PolarHBondContact O-N 2.88Å; L40-S44 WeakPolarHBondContact O-CB 3.28Å; L40-S44 PolarHBondContact O-N 3.45Å |
| 41 | W | 51.8 | Low | 48.2 | Very low | 214 Ų | 214 | 123.2 Ų | 123.2 | 81% | 0.811 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -68.6 | -34.7 | 170.5 | -83.6 | 85.9 | 0 | 0 | 0 | 112.1 | A37 G45 | A37-W41 PolarHBondContact O-N 2.87Å; W41-G45 PolarHBondContact O-N 2.82Å |
| 42 | A | 50.8 | Low | 48 | Very low | 75 Ų | 75 | 121.2 Ų | 121.2 | 62% | 0.62 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -70.4 | -31.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L38 W39 | L38-A42 WeakPolarHBondContact O-CB 3.37Å; L38-A42 PolarHBondContact O-N 3.37Å; L38-A42 VanDerWaalsContact O-N 3.13Å; W39-A42 PolarHBondContact O-N 3.45Å |
| 43 | E | 51.1 | Low | 47.6 | Very low | 128 Ų | 128 | 118.1 Ų | 118.1 | 60% | 0.598 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -81.6 | -34.1 | 178 | -162.5 | 158.2 | 88.7 | 0 | 0 | 112.7 | W39 L40 G45 | W39-E43 VanDerWaalsContact CZ3-OE2 3.22Å; W39-E43 WeakPolarHBondContact CZ3-OE2 3.49Å; W39-E43 WeakPolarHBondContact O-CB 3.34Å; W39-E43 PolarHBondContact O-N 3.38Å; L40-E43 PolarHBondContact O-N 2.88Å; E43-G45 VanDerWaalsContact C-N 3.31Å; E43-G45 PolarHBondContact O-N 3.38Å |
| 44 | S | 42.1 | Very low | 47 | Very low | 111 Ų | 111 | 119.6 Ų | 119.6 | 78% | 0.776 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -78 | -14.1 | 176.5 | -163.3 | 0 | 0 | 0 | 0 | 113.4 | L40 G46 | L40-S44 WeakPolarHBondContact O-CB 3.28Å; L40-S44 PolarHBondContact O-N 3.45Å; S44-G46 VanDerWaalsContact C-N 3.31Å; S44-G46 PolarHBondContact O-N 3.3Å |
| 45 | G | 44.5 | Very low | 46.4 | Very low | 63 Ų | 63 | 122.1 Ų | 122.1 | 65% | 0.649 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | 13 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115 | W41 E43 G47 | W41-G45 PolarHBondContact O-N 2.82Å; E43-G45 VanDerWaalsContact C-N 3.31Å; E43-G45 PolarHBondContact O-N 3.38Å; G45-G47 PolarHBondContact O-N 3.49Å |
| 46 | G | 47.5 | Very low | 45.6 | Very low | 73 Ų | 73 | 126 Ų | 126 | 75% | 0.753 | 72% | 0.718 | S | S | * | * | trans | -83.8 | 81.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | S44 | S44-G46 VanDerWaalsContact C-N 3.31Å; S44-G46 PolarHBondContact O-N 3.3Å | ||
| 47 | G | 45.8 | Very low | 44.7 | Very low | 70 Ų | 70 | 121.4 Ų | 121.4 | 72% | 0.722 | 72% | 0.715 | S | S | * | * | trans | 172.3 | 83.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | G45 | G45-G47 PolarHBondContact O-N 3.49Š| ||
| 48 | A | 39.8 | Very low | 44 | Very low | 98 Ų | 98 | 125.3 Ų | 125.3 | 81% | 0.81 | 74% | 0.737 | S | S | * | * | trans | -153.7 | 98.5 | 143.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 49 | C | 45.7 | Very low | 43.3 | Very low | 134 Ų | 134 | 124.9 Ų | 124.9 | 91% | 0.905 | 74% | 0.744 | S | S | * | * | trans | -59.7 | 136.9 | 173.1 | -54.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 50 | C | 40.4 | Very low | 43 | Very low | 125 Ų | 125 | 122.2 Ų | 122.2 | 85% | 0.845 | 75% | 0.749 | S | S | * | * | trans | -150.7 | 129.6 | 153.7 | 55.2 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 51 | E | 33.7 | Very low | 41.6 | Very low | 173 Ų | 173 | 124.2 Ų | 124.2 | 81% | 0.808 | 76% | 0.758 | S | S | * | * | cis | -164.3 | 115.9 | -12.8 | 172.3 | 167.6 | 85 | 0 | 0 | 102.1 | ||||
| 52 | T | 39.3 | Very low | 40.4 | Very low | 137 Ų | 137 | 119.5 Ų | 119.5 | 84% | 0.84 | 76% | 0.757 | S | S | * | * | trans | -107.3 | 88.2 | 171.5 | 166.1 | 0 | 0 | 0 | 0 | 107 | F54 | T52-F54 PolarHBondContact O-N 3.5Š| ||
| 53 | T | 39 | Very low | 39.3 | Very low | 102 Ų | 102 | 121 Ų | 121 | 63% | 0.626 | 76% | 0.762 | S | S | * | * | trans | -68.1 | 97.1 | 176.4 | -53.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 54 | F | 33.9 | Very low | 38.6 | Very low | 187 Ų | 187 | 120 Ų | 120 | 82% | 0.82 | 77% | 0.769 | S | S | * | * | trans | -67.7 | 125.5 | 162 | -178.6 | -100.2 | 0 | 0 | 0 | 108.3 | T52 | T52-F54 PolarHBondContact O-N 3.5Š| ||
| 55 | I | 41 | Very low | 38 | Very low | 137 Ų | 137 | 121.7 Ų | 121.7 | 70% | 0.703 | 77% | 0.774 | S | S | * | * | trans | -88.8 | 117.1 | -172.9 | -50.6 | 179.5 | 0 | 0 | 0 | 109.2 | ||||
| 56 | E | 37.8 | Very low | 37.2 | Very low | 185 Ų | 185 | 122 Ų | 122 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | -105.4 | 126.9 | 152 | -172.6 | 150.9 | 82.8 | 0 | 0 | 108 | ||||
| 57 | S | 38.2 | Very low | 36.3 | Very low | 96 Ų | 96 | 124.1 Ų | 124.1 | 67% | 0.671 | 78% | 0.781 | S | S | * | * | trans | -79.9 | 158.7 | -169.5 | -50.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 58 | P | 43.6 | Very low | 35.5 | Very low | 127 Ų | 127 | 125.9 Ų | 125.9 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | -142.1 | 150.4 | 56.5 | 26.4 | -1.6 | 0 | 0 | 0 | 117.4 | |||||
| 59 | S | 37.4 | Very low | 35.1 | Very low | 112 Ų | 112 | 131.5 Ų | 131.5 | 78% | 0.783 | 78% | 0.782 | S | S | * | * | trans | -58.2 | 164.3 | 175.3 | 63.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 60 | P | 42.9 | Very low | 34.6 | Very low | 111 Ų | 111 | 134 Ų | 134 | 72% | 0.721 | 78% | 0.781 | S | S | * | * | -151.1 | -176.3 | 57.6 | 36.9 | -12.9 | 0 | 0 | 0 | 117.3 | |||||
| 61 | I | 28 | Very low | 34 | Very low | 150 Ų | 150 | 133.4 Ų | 133.4 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | 99.5 | 84.7 | 175.1 | -49.6 | 163.2 | 0 | 0 | 0 | 112.1 | ||||
| 62 | C | 26.8 | Very low | 33.9 | Very low | 116 Ų | 116 | 132.5 Ų | 132.5 | 78% | 0.784 | 77% | 0.774 | S | S | * | * | 67.5 | 128.5 | 85.5 | -69.5 | 0 | 0 | 0 | 0 | 112 | |||||
| 63 | C | 27 | Very low | 33.5 | Very low | 107 Ų | 107 | 137.6 Ų | 137.6 | 72% | 0.723 | 78% | 0.777 | S | S | * | * | cis | -162.2 | 134.1 | 12.1 | -86.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 64 | S | 35.4 | Very low | 32.9 | Very low | 107 Ų | 107 | 137.4 Ų | 137.4 | 75% | 0.748 | 78% | 0.779 | S | S | * | * | 63.7 | 124.4 | 105.9 | -50.1 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 65 | T | 31 | Very low | 32.8 | Very low | 145 Ų | 145 | 134.7 Ų | 134.7 | 89% | 0.89 | 78% | 0.784 | S | S | * | * | 176.1 | 142.1 | 79 | -61.9 | 0 | 0 | 0 | 0 | 106.7 | |||||
| 66 | G | 27.6 | Very low | 32.7 | Very low | 71 Ų | 71 | 135 Ų | 135 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | cis | 151.4 | 139.8 | 7.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 67 | S | 28.4 | Very low | 32.4 | Very low | 117 Ų | 117 | 130.8 Ų | 130.8 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | 149.6 | 88.5 | 149 | -172.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 68 | S | 28.3 | Very low | 32.1 | Very low | 106 Ų | 106 | 135.8 Ų | 135.8 | 74% | 0.741 | 79% | 0.787 | S | S | * | * | 79.4 | 110.3 | 73.7 | -155.5 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 69 | R | 31.7 | Very low | 31.8 | Very low | 216 Ų | 216 | 136.2 Ų | 136.2 | 82% | 0.815 | 78% | 0.782 | S | S | * | * | 158.1 | 105.5 | 119.2 | -80.5 | 175.6 | 92.2 | 121.2 | 3.9 | 111.9 | |||||
| 70 | E | 34.6 | Very low | 31.8 | Very low | 186 Ų | 186 | 138.2 Ų | 138.2 | 87% | 0.869 | 78% | 0.783 | S | S | * | * | trans | -83.1 | 127.1 | 156.2 | 58.2 | -146.8 | 105.7 | 0 | 0 | 109.9 | ||||
| 71 | T | 28.6 | Very low | 31.3 | Very low | 113 Ų | 113 | 141 Ų | 141 | 69% | 0.693 | 79% | 0.786 | S | S | * | * | trans | -154.3 | 97.2 | 165.3 | 47.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 72 | L | 31.7 | Very low | 31.6 | Very low | 155 Ų | 155 | 141.7 Ų | 141.7 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | 44.2 | 110.9 | 118.1 | -156.3 | 151.8 | 0 | 0 | 0 | 120.2 | C74 | L72-C74 HydrophobicContact CD2-CB 4.23Š| |||
| 73 | R | 30.2 | Very low | 31.8 | Very low | 243 Ų | 243 | 141.8 Ų | 141.8 | 92% | 0.917 | 79% | 0.793 | S | S | * | * | trans | -158.1 | 116.6 | 133.1 | -77 | -149.9 | 151.7 | 110 | 1.2 | 105.9 | ||||
| 74 | C | 26.6 | Very low | 32.3 | Very low | 99 Ų | 99 | 140.1 Ų | 140.1 | 67% | 0.669 | 79% | 0.793 | S | S | * | * | cis | 61.9 | 97.8 | 43.3 | -152.6 | 0 | 0 | 0 | 0 | 114.4 | L72 | L72-C74 HydrophobicContact CD2-CB 4.23Š| ||
| 75 | S | 32.8 | Very low | 32.3 | Very low | 130 Ų | 130 | 142.2 Ų | 142.2 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | -150.5 | 130.9 | 121.8 | -76.8 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 76 | D | 37.6 | Very low | 33 | Very low | 144 Ų | 144 | 143.7 Ų | 143.7 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | trans | -107.2 | 176.3 | -168.6 | -156.5 | -67.4 | 0 | 0 | 0 | 109 | ||||
| 77 | S | 31.9 | Very low | 33.6 | Very low | 96 Ų | 96 | 145.7 Ų | 145.7 | 67% | 0.671 | 79% | 0.791 | S | S | * | * | trans | 86.3 | 98.3 | 153.4 | 71.3 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 78 | K | 33 | Very low | 34 | Very low | 201 Ų | 201 | 148.9 Ų | 148.9 | 87% | 0.874 | 79% | 0.79 | S | S | * | * | 61.4 | 131 | 104.5 | -149.1 | 179.6 | -171.9 | -179.1 | 0 | 119.1 | |||||
| 79 | L | 35.5 | Very low | 34.8 | Very low | 135 Ų | 135 | 151.7 Ų | 151.7 | 71% | 0.707 | 80% | 0.795 | S | S | * | * | trans | 121.1 | 121.7 | 130.7 | -142.9 | -178.9 | 0 | 0 | 0 | 115.2 | ||||
| 80 | L | 37.3 | Very low | 35 | Very low | 155 Ų | 155 | 144.6 Ų | 144.6 | 81% | 0.812 | 78% | 0.777 | S | S | * | * | trans | 131.9 | 78 | 153.9 | -69.9 | 175.7 | 0 | 0 | 0 | 108 | ||||
| 81 | E | 32.5 | Very low | 35.5 | Very low | 169 Ų | 169 | 141.7 Ų | 141.7 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | 27.4 | 121.5 | 76.1 | -92.4 | -159.2 | 101.5 | 0 | 0 | 117.1 | |||||
| 82 | L | 35.7 | Very low | 36.1 | Very low | 165 Ų | 165 | 144.2 Ų | 144.2 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | trans | 91.1 | 92.9 | 161.1 | -59.3 | 166.6 | 0 | 0 | 0 | 119 | ||||
| 83 | S | 31.2 | Very low | 36.4 | Very low | 118 Ų | 118 | 142.1 Ų | 142.1 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | -177.3 | 106.2 | 123.8 | -161.6 | 0 | 0 | 0 | 0 | 105.9 | |||||
| 84 | G | 36.4 | Very low | 36.9 | Very low | 71 Ų | 71 | 140.3 Ų | 140.3 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | 70.8 | 71.2 | 60.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 85 | D | 35.3 | Very low | 37.2 | Very low | 151 Ų | 151 | 142.1 Ų | 142.1 | 81% | 0.807 | 78% | 0.777 | S | S | * | * | trans | -171.6 | 131 | 139.2 | -163.9 | -129.9 | 0 | 0 | 0 | 111.3 | ||||
| 86 | E | 46.2 | Very low | 38 | Very low | 176 Ų | 176 | 146 Ų | 146 | 82% | 0.822 | 77% | 0.771 | S | S | * | * | trans | -75.7 | 119.4 | 175.3 | 171.8 | -162.4 | 108.1 | 0 | 0 | 109 | ||||
| 87 | T | 39.4 | Very low | 38 | Very low | 114 Ų | 114 | 145.7 Ų | 145.7 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | trans | -157.6 | 105.8 | 155 | -84.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 88 | K | 38.4 | Very low | 38.4 | Very low | 184 Ų | 184 | 144.1 Ų | 144.1 | 80% | 0.8 | 77% | 0.773 | S | S | * | * | trans | 10.1 | 112.1 | 139.7 | -168.4 | 176.6 | -176.4 | -177.4 | 0 | 115.2 | P90 | K88-P90 VanDerWaalsContact O-CD 3.29Å; K88-P90 WeakPolarHBondContact O-CD 3.26Å | ||
| 89 | I | 43.7 | Very low | 38.3 | Very low | 164 Ų | 164 | 140.6 Ų | 140.6 | 84% | 0.841 | 76% | 0.764 | S | S | * | * | trans | -102 | 103.5 | 168 | -53.6 | 162.3 | 0 | 0 | 0 | 107.8 | ||||
| 90 | P | 37.1 | Very low | 38.7 | Very low | 67 Ų | 67 | 142.1 Ų | 142.1 | 44% | 0.435 | 77% | 0.767 | S | S | . | * | trans | -69.1 | 147 | 165 | -13.9 | 29.6 | 0 | 0 | 0 | 110.4 | K88 M92 | K88-P90 VanDerWaalsContact O-CD 3.29Å; K88-P90 WeakPolarHBondContact O-CD 3.26Å; P90-M92 HydrophobicContact CB-CE 4.44Å; P90-M92 PolarHBondContact O-N 2.95Å; P90-M92 VanDerWaalsContact O-N 3.17Å | ||
| 91 | P | 44.7 | Very low | 38.6 | Very low | 126 Ų | 126 | 143.2 Ų | 143.2 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | -71.9 | 110.3 | 175.3 | 29.7 | -30 | 0 | 0 | 0 | 108.6 | ||||
| 92 | M | 41 | Very low | 38.9 | Very low | 165 Ų | 165 | 143.3 Ų | 143.3 | 81% | 0.813 | 77% | 0.773 | S | S | * | * | trans | -95.2 | 131.8 | 174.3 | -66.8 | -66.3 | -174.9 | 0 | 0 | 109.8 | P90 | P90-M92 HydrophobicContact CB-CE 4.44Å; P90-M92 PolarHBondContact O-N 2.95Å; P90-M92 VanDerWaalsContact O-N 3.17Å | ||
| 93 | T | 38.2 | Very low | 38.8 | Very low | 112 Ų | 112 | 144.7 Ų | 144.7 | 69% | 0.687 | 78% | 0.775 | S | S | * | * | trans | -64.5 | 141.3 | -169.4 | 43.4 | 0 | 0 | 0 | 0 | 112.5 | D95 | T93-D95 PolarHBondContact O-N 3.43Å; T93-D95 VanDerWaalsContact O-N 3.1Å | ||
| 94 | F | 39.6 | Very low | 38.8 | Very low | 204 Ų | 204 | 144 Ų | 144 | 90% | 0.895 | 77% | 0.771 | S | S | * | * | trans | -77.1 | 93.6 | 167.9 | -160.5 | -87.3 | 0 | 0 | 0 | 108.2 | ||||
| 95 | D | 33.8 | Very low | 38.6 | Very low | 138 Ų | 138 | 148 Ų | 148 | 74% | 0.738 | 78% | 0.776 | S | S | * | * | trans | -88.3 | 135.1 | 164.7 | -99.6 | -66.1 | 0 | 0 | 0 | 109.8 | T93 | T93-D95 PolarHBondContact O-N 3.43Å; T93-D95 VanDerWaalsContact O-N 3.1Å | ||
| 96 | R | 49.3 | Very low | 38.7 | Very low | 212 Ų | 212 | 150.6 Ų | 150.6 | 80% | 0.8 | 78% | 0.78 | S | S | * | * | trans | -85.5 | 159.6 | 177.7 | -176.5 | -175.5 | -68.4 | 117.1 | -2.2 | 108.8 | ||||
| 97 | V | 38.2 | Very low | 38.5 | Very low | 136 Ų | 136 | 147.9 Ų | 147.9 | 82% | 0.824 | 78% | 0.78 | S | S | * | * | trans | 104 | 125.1 | 173.9 | -177.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 98 | G | 39.5 | Very low | 38.4 | Very low | 63 Ų | 63 | 147.8 Ų | 147.8 | 65% | 0.649 | 78% | 0.784 | S | S | * | * | cis | 140.2 | 78.4 | -4.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 99 | D | 31.7 | Very low | 38.3 | Very low | 128 Ų | 128 | 143.5 Ų | 143.5 | 68% | 0.684 | 78% | 0.783 | S | S | * | * | trans | -172.3 | 120.6 | 172.4 | 31.1 | -26 | 0 | 0 | 0 | 112.9 | ||||
| 100 | E | 44 | Very low | 37.7 | Very low | 166 Ų | 166 | 141.1 Ų | 141.1 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | trans | 51.5 | 147.6 | 149.4 | 58.7 | -132.9 | 76.4 | 0 | 0 | 126.2 | ||||
| 101 | E | 35.3 | Very low | 37.8 | Very low | 179 Ų | 179 | 144.4 Ų | 144.4 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | trans | 101 | 87.7 | 153.7 | -44.7 | -166.5 | 111.2 | 0 | 0 | 119.6 | ||||
| 102 | L | 38.2 | Very low | 37.2 | Very low | 170 Ų | 170 | 145.8 Ų | 145.8 | 89% | 0.89 | 80% | 0.801 | S | S | * | * | trans | -164.5 | 101.4 | 132.1 | 56.4 | 118.9 | 0 | 0 | 0 | 112.4 | ||||
| 103 | E | 32.7 | Very low | 37 | Very low | 194 Ų | 194 | 143 Ų | 143 | 91% | 0.907 | 80% | 0.798 | S | S | * | * | trans | -85.1 | 162.3 | 157.2 | -68.5 | -153.1 | 87.3 | 0 | 0 | 110.4 | ||||
| 104 | S | 31.5 | Very low | 37.2 | Very low | 105 Ų | 105 | 144 Ų | 144 | 73% | 0.734 | 80% | 0.799 | S | S | * | * | trans | 97.9 | 119.3 | 179.8 | 72.2 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 105 | D | 33.3 | Very low | 37.8 | Very low | 155 Ų | 155 | 141.1 Ų | 141.1 | 83% | 0.829 | 79% | 0.793 | S | S | * | * | S | Bend | cis | -154.2 | 115.8 | 15.2 | -84.7 | -60.2 | 0 | 0 | 0 | 110.1 | ||
| 106 | F | 36.5 | Very low | 38.6 | Very low | 205 Ų | 205 | 138.6 Ų | 138.6 | 90% | 0.899 | 79% | 0.791 | S | S | * | * | trans | -160.6 | 62.7 | 153.7 | -157.2 | -99.3 | 0 | 0 | 0 | 111.2 | ||||
| 107 | S | 43 | Very low | 38.1 | Very low | 118 Ų | 118 | 136.5 Ų | 136.5 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -90.8 | 111.1 | 165.7 | -66.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 108 | S | 37.2 | Very low | 38.4 | Very low | 112 Ų | 112 | 138.4 Ų | 138.4 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | 172.5 | 90.8 | 127.9 | -75.8 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 109 | A | 35.9 | Very low | 39 | Very low | 94 Ų | 94 | 142.8 Ų | 142.8 | 78% | 0.777 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -161.9 | 118.5 | 146.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 110 | S | 30.7 | Very low | 39.6 | Very low | 115 Ų | 115 | 144.5 Ų | 144.5 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | 81.2 | 99.4 | 171.5 | 68.7 | 0 | 0 | 0 | 0 | 118.1 | Q112 | S110-Q112 PolarHBondContact O-N 3.04Š| ||
| 111 | S | 38.7 | Very low | 39.6 | Very low | 136 Ų | 136 | 141.1 Ų | 141.1 | 95% | 0.951 | 80% | 0.801 | S | S | * | * | trans | -50.2 | 114.1 | 153.7 | -64.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 112 | Q | 32 | Very low | 40.1 | Very low | 154 Ų | 154 | 138 Ų | 138 | 72% | 0.72 | 80% | 0.796 | S | S | * | * | trans | -120.2 | 108.9 | 160.8 | -179.4 | 161.4 | 103.6 | 0 | 0 | 105.2 | S110 D114 | S110-Q112 PolarHBondContact O-N 3.04Å; Q112-D114 PolarHBondContact O-N 3.26Å; Q112-D114 VanDerWaalsContact O-N 3.09Å | ||
| 113 | S | 38.3 | Very low | 40.5 | Very low | 107 Ų | 107 | 139.9 Ų | 139.9 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | trans | -71.9 | 99.4 | 176.2 | 51 | 0 | 0 | 0 | 0 | 108.6 | D115 | S113-D115 PolarHBondContact O-N 2.87Å; S113-D115 VanDerWaalsContact O-N 3.16Å | ||
| 114 | D | 40.8 | Very low | 40.9 | Very low | 134 Ų | 134 | 133.6 Ų | 133.6 | 72% | 0.717 | 76% | 0.764 | S | S | * | * | trans | -81.6 | 46.3 | 178.4 | -73.7 | -56.2 | 0 | 0 | 0 | 112.7 | Q112 | Q112-D114 PolarHBondContact O-N 3.26Å; Q112-D114 VanDerWaalsContact O-N 3.09Å | ||
| 115 | D | 52.2 | Low | 41.7 | Very low | 142 Ų | 142 | 135.6 Ų | 135.6 | 76% | 0.759 | 76% | 0.762 | S | S | * | * | trans | -114.4 | 119.5 | 178.3 | -64.1 | -67 | 0 | 0 | 0 | 110 | S113 | S113-D115 PolarHBondContact O-N 2.87Å; S113-D115 VanDerWaalsContact O-N 3.16Å | ||
| 116 | A | 52.2 | Low | 42.4 | Very low | 85 Ų | 85 | 136.1 Ų | 136.1 | 70% | 0.702 | 75% | 0.752 | S | S | * | * | S | Bend | trans | 88.8 | 47.1 | 169.9 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||
| 117 | F | 39 | Very low | 43.3 | Very low | 168 Ų | 168 | 130.6 Ų | 130.6 | 74% | 0.737 | 74% | 0.739 | S | S | * | * | trans | -137.7 | 38.9 | 152.5 | -73.6 | -77.1 | 0 | 0 | 0 | 113.5 | L119 | F117-L119 PolarHBondContact O-N 2.74Š| ||
| 118 | L | 42.8 | Very low | 43.8 | Very low | 176 Ų | 176 | 131.5 Ų | 131.5 | 92% | 0.921 | 73% | 0.734 | S | S | * | * | trans | -70.9 | 30 | 165.2 | -70.2 | -175.8 | 0 | 0 | 0 | 113.5 | ||||
| 119 | L | 52.9 | Low | 44.8 | Very low | 156 Ų | 156 | 129.3 Ų | 129.3 | 82% | 0.817 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -138.8 | 114.7 | 170.7 | -65.8 | 174.7 | 0 | 0 | 0 | 108.1 | F117 | F117-L119 PolarHBondContact O-N 2.74Š|
| 120 | L | 43.8 | Very low | 46 | Very low | 163 Ų | 163 | 128.6 Ų | 128.6 | 85% | 0.853 | 71% | 0.705 | S | S | * | * | S | Bend | trans | 101.8 | 146.8 | 169.1 | -137.7 | 75.6 | 0 | 0 | 0 | 116.8 | ||
| 121 | P | 45.4 | Very low | 47.5 | Very low | 95 Ų | 95 | 128 Ų | 128 | 62% | 0.617 | 69% | 0.688 | S | S | * | * | S | Bend | -71.5 | 179.3 | -117.7 | 17 | 9.6 | 0 | 0 | 0 | 112.3 | R123 | P121-R123 PolarHBondContact O-N 3.05Š| |
| 122 | P | 44.7 | Very low | 48.3 | Very low | 113 Ų | 113 | 124.8 Ų | 124.8 | 73% | 0.734 | 67% | 0.665 | S | S | * | * | trans | -47.7 | 101.9 | -176.7 | -23.5 | 32.4 | 0 | 0 | 0 | 110.5 | D124 | P122-D124 PolarHBondContact O-N 2.97Š| ||
| 123 | R | 47.7 | Very low | 49.8 | Very low | 211 Ų | 211 | 123.6 Ų | 123.6 | 80% | 0.796 | 66% | 0.661 | S | S | * | * | trans | -74 | 93.6 | -176.9 | -119.1 | -175 | -177.4 | 149.7 | 1.1 | 104.9 | P121 H125 | P121-R123 PolarHBondContact O-N 3.05Å; R123-H125 PolarHBondContact O-N 2.92Å | ||
| 124 | D | 40.1 | Very low | 50.9 | Low | 61 Ų | 61 | 123 Ų | 123 | 33% | 0.326 | 65% | 0.649 | S | S | . | * | trans | -56.4 | 126.8 | -171.7 | -59.2 | -72.3 | 0 | 0 | 0 | 109.7 | P122 R126 | P122-D124 PolarHBondContact O-N 2.97Å; D124-R126 HydrophobicContact CB-CB 3.68Å; D124-R126 HydrophobicContact CB-CG 3.57Å; D124-R126 PolarHBondContact O-N 2.99Å; D124-R126 IonicContact OD1-CZ 3.96Å; D124-R126 IonicContact OD1-NE 2.65Å; D124-R126 IonicContact OD1-NH1 3.94Å; D124-R126 PolarHBondContact OD1-NH1 3.19Å; D124-R126 VanDerWaalsContact OD1-NH1 3.12Å; D124-R126 IonicContact OD2-CZ 3.46Å; D124-R126 IonicContact OD2-NE 3.55Å; D124-R126 IonicContact OD2-NH1 3.12Å; D124-R126 PolarHBondContact OD2-NH1 2.95Å | ||
| 125 | H | 49 | Very low | 51.7 | Low | 147 Ų | 147 | 117.7 Ų | 117.7 | 68% | 0.681 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.7 | 7.7 | 153.8 | 42.7 | -86.7 | 0 | 0 | 0 | 114 | R123 S127 L128 S129 | R123-H125 PolarHBondContact O-N 2.92Å; H125-S127 VanDerWaalsContact C-N 3.29Å; H125-S127 PolarHBondContact O-N 3.05Å; H125-L128 PolarHBondContact O-N 3.33Å; H125-S129 WeakPolarHBondContact O-CB 3.29Å; H125-S129 PolarHBondContact O-N 3.32Å |
| 126 | R | 48 | Very low | 51.9 | Low | 166 Ų | 166 | 112.3 Ų | 112.3 | 63% | 0.626 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -58.9 | -34.7 | 172.2 | -81.1 | 170.7 | -175.3 | 141.3 | 3.8 | 112.1 | D124 V130 | D124-R126 HydrophobicContact CB-CB 3.68Å; D124-R126 HydrophobicContact CB-CG 3.57Å; D124-R126 PolarHBondContact O-N 2.99Å; D124-R126 IonicContact OD1-CZ 3.96Å; D124-R126 IonicContact OD1-NE 2.65Å; D124-R126 IonicContact OD1-NH1 3.94Å; D124-R126 PolarHBondContact OD1-NH1 3.19Å; D124-R126 VanDerWaalsContact OD1-NH1 3.12Å; D124-R126 IonicContact OD2-CZ 3.46Å; D124-R126 IonicContact OD2-NE 3.55Å; D124-R126 IonicContact OD2-NH1 3.12Å; D124-R126 PolarHBondContact OD2-NH1 2.95Å; R126-V130 WeakPolarHBondContact O-CB 3.44Å; R126-V130 WeakPolarHBondContact O-CG2 3.17Å; R126-V130 PolarHBondContact O-N 3.23Å |
| 127 | S | 54.4 | Low | 51.9 | Low | 89 Ų | 89 | 113.6 Ų | 113.6 | 62% | 0.622 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -73.7 | -37.7 | 176.1 | 52.8 | 0 | 0 | 0 | 0 | 112.4 | H125 F131 | H125-S127 VanDerWaalsContact C-N 3.29Å; H125-S127 PolarHBondContact O-N 3.05Å; S127-F131 WeakPolarHBondContact O-CA 3.34Å; S127-F131 WeakPolarHBondContact O-CB 3.29Å; S127-F131 PolarHBondContact O-N 2.91Å |
| 128 | L | 53.8 | Low | 52.7 | Low | 137 Ų | 137 | 116 Ų | 116 | 72% | 0.717 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -75.7 | -37.1 | -178.5 | -139.8 | 133.9 | 0 | 0 | 0 | 112.2 | H125 S132 | H125-L128 PolarHBondContact O-N 3.33Å; L128-S132 VanDerWaalsContact O-CB 3.31Å; L128-S132 WeakPolarHBondContact O-CB 3.25Å; L128-S132 PolarHBondContact O-N 2.82Å |
| 129 | S | 57.9 | Low | 53.3 | Low | 67 Ų | 67 | 112.1 Ų | 112.1 | 47% | 0.469 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -71.2 | -43.8 | 172.9 | 179.4 | 0 | 0 | 0 | 0 | 112.2 | H125 F131 S132 M133 | H125-S129 WeakPolarHBondContact O-CB 3.29Å; H125-S129 PolarHBondContact O-N 3.32Å; S129-F131 VanDerWaalsContact C-N 3.34Å; S129-S132 CarbonylContact O-C 3.59Å; S129-S132 PolarHBondContact O-N 3.49Å; S129-M133 WeakPolarHBondContact O-CB 3.49Å; S129-M133 WeakPolarHBondContact O-CG 3.31Å; S129-M133 PolarHBondContact O-N 2.89Å |
| 130 | V | 62.6 | Low | 53.4 | Low | 79 Ų | 79 | 110.8 Ų | 110.8 | 48% | 0.479 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.6 | -35.9 | 173.7 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | R126 M133 L134 | R126-V130 WeakPolarHBondContact O-CB 3.44Å; R126-V130 WeakPolarHBondContact O-CG2 3.17Å; R126-V130 PolarHBondContact O-N 3.23Å; V130-M133 CarbonylContact O-C 3.5Å; V130-M133 PolarHBondContact O-N 2.72Å; V130-L134 HydrophobicContact CG1-CD1 3.61Å; V130-L134 HydrophobicContact CG1-CG 3.99Å; V130-L134 WeakPolarHBondContact O-CB 3.43Å; V130-L134 WeakPolarHBondContact O-CG 3.22Å; V130-L134 PolarHBondContact O-N 3.07Å |
| 131 | F | 60.9 | Low | 54.2 | Low | 103 Ų | 103 | 104 Ų | 104 | 45% | 0.452 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.2 | -39 | 172.9 | -170.1 | -99.1 | 0 | 0 | 0 | 111.4 | S127 S129 M133 L134 C135 Y185 | S127-F131 WeakPolarHBondContact O-CA 3.34Å; S127-F131 WeakPolarHBondContact O-CB 3.29Å; S127-F131 PolarHBondContact O-N 2.91Å; S129-F131 VanDerWaalsContact C-N 3.34Å; F131-M133 VanDerWaalsContact C-N 3.33Å; F131-M133 PolarHBondContact O-N 3.44Å; F131-L134 PolarHBondContact O-N 2.96Å; F131-C135 WeakPolarHBondContact O-CB 3.36Å; F131-C135 PolarHBondContact O-N 2.84Å; F131-C135 PolarHBondContact O-SG 2.82Å; F131-C135 VanDerWaalsContact O-SG 3.35Å; F131-Y185 HydrophobicContact CZ-CE2 4.4Å |
| 132 | S | 56.3 | Low | 55 | Low | 67 Ų | 67 | 105 Ų | 105 | 47% | 0.469 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.6 | -32.8 | 171.4 | -171.7 | 0 | 0 | 0 | 0 | 112.8 | L128 S129 C136 | L128-S132 VanDerWaalsContact O-CB 3.31Å; L128-S132 WeakPolarHBondContact O-CB 3.25Å; L128-S132 PolarHBondContact O-N 2.82Å; S129-S132 CarbonylContact O-C 3.59Å; S129-S132 PolarHBondContact O-N 3.49Å; S132-C136 PolarHBondContact O-SG 2.89Å |
| 133 | M | 62.4 | Low | 55.7 | Low | 129 Ų | 129 | 102.6 Ų | 102.6 | 64% | 0.635 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -79.5 | -27.4 | 173.6 | -72.1 | -69.9 | 161 | 0 | 0 | 112.7 | S129 V130 F131 C136 | S129-M133 WeakPolarHBondContact O-CB 3.49Å; S129-M133 WeakPolarHBondContact O-CG 3.31Å; S129-M133 PolarHBondContact O-N 2.89Å; V130-M133 CarbonylContact O-C 3.5Å; V130-M133 PolarHBondContact O-N 2.72Å; F131-M133 VanDerWaalsContact C-N 3.33Å; F131-M133 PolarHBondContact O-N 3.44Å; M133-C136 VanDerWaalsContact O-CB 3.26Å; M133-C136 WeakPolarHBondContact O-CB 3.46Å; M133-C136 PolarHBondContact O-N 2.73Å |
| 134 | L | 61.6 | Low | 56.4 | Low | 96 Ų | 96 | 95.1 Ų | 95.1 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -80.6 | -33.4 | 175.4 | -76.9 | 168.3 | 0 | 0 | 0 | 111.6 | V130 F131 C136 F137 | V130-L134 HydrophobicContact CG1-CD1 3.61Å; V130-L134 HydrophobicContact CG1-CG 3.99Å; V130-L134 WeakPolarHBondContact O-CB 3.43Å; V130-L134 WeakPolarHBondContact O-CG 3.22Å; V130-L134 PolarHBondContact O-N 3.07Å; F131-L134 PolarHBondContact O-N 2.96Å; L134-C136 PolarHBondContact O-N 2.82Å; L134-F137 WeakPolarHBondContact O-CA 3.38Å; L134-F137 WeakPolarHBondContact O-CD2 3.41Å; L134-F137 PolarHBondContact O-N 3.43Å |
| 135 | C | 58.3 | Low | 57.4 | Low | 21 Ų | 21 | 98.6 Ų | 98.6 | 14% | 0.142 | 52% | 0.522 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -8.3 | 164.6 | -71.4 | 0 | 0 | 0 | 0 | 112.1 | F131 S177 | F131-C135 WeakPolarHBondContact O-CB 3.36Å; F131-C135 PolarHBondContact O-N 2.84Å; F131-C135 PolarHBondContact O-SG 2.82Å; F131-C135 VanDerWaalsContact O-SG 3.35Å; C135-S177 VanDerWaalsContact O-O 3.14Å; C135-S177 PolarHBondContact O-OG 3.18Å |
| 136 | C | 56.8 | Low | 58.1 | Low | 29 Ų | 29 | 98.4 Ų | 98.4 | 20% | 0.196 | 52% | 0.516 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | -4 | 164.4 | -59.6 | 0 | 0 | 0 | 0 | 114.5 | S132 M133 L134 G141 S177 | S132-C136 PolarHBondContact O-SG 2.89Å; M133-C136 VanDerWaalsContact O-CB 3.26Å; M133-C136 WeakPolarHBondContact O-CB 3.46Å; M133-C136 PolarHBondContact O-N 2.73Å; L134-C136 PolarHBondContact O-N 2.82Å; C136-G141 VanDerWaalsContact O-CA 3.26Å; C136-G141 WeakPolarHBondContact O-CA 3.21Å; C136-G141 PolarHBondContact O-N 2.87Å; C136-S177 VanDerWaalsContact CA-OG 3.26Å; C136-S177 WeakPolarHBondContact CA-OG 3.34Å |
| 137 | F | 50.8 | Low | 58.8 | Low | 113 Ų | 113 | 95.2 Ų | 95.2 | 50% | 0.496 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 44.9 | 122.6 | 174.6 | -114.3 | -96.7 | 0 | 0 | 0 | 120.6 | L134 P139 L140 G141 | L134-F137 WeakPolarHBondContact O-CA 3.38Å; L134-F137 WeakPolarHBondContact O-CD2 3.41Å; L134-F137 PolarHBondContact O-N 3.43Å; F137-P139 VanDerWaalsContact C-N 3.31Å; F137-P139 VanDerWaalsContact O-CD 3.23Å; F137-P139 WeakPolarHBondContact O-CD 3.14Å; F137-L140 PolarHBondContact O-N 3.35Å; F137-G141 PolarHBondContact O-N 3.26Å |
| 138 | W | 56.7 | Low | 59 | Low | 217 Ų | 217 | 93.7 Ų | 93.7 | 82% | 0.822 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 35.2 | -32 | 136.4 | -154.6 | 15.4 | 0 | 0 | 0 | 123.1 | ||
| 139 | P | 55.3 | Low | 58.9 | Low | 96 Ų | 96 | 93.6 Ų | 93.6 | 62% | 0.623 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -140.1 | -15.3 | 153.6 | 18.1 | 3.7 | 0 | 0 | 0 | 114 | F137 | F137-P139 VanDerWaalsContact C-N 3.31Å; F137-P139 VanDerWaalsContact O-CD 3.23Å; F137-P139 WeakPolarHBondContact O-CD 3.14Å |
| 140 | L | 54.1 | Low | 58.6 | Low | 127 Ų | 127 | 95.1 Ų | 95.1 | 67% | 0.665 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -91.4 | -35.5 | -166.1 | -160.9 | 63.3 | 0 | 0 | 0 | 111.6 | F137 I142 A143 A144 | F137-L140 PolarHBondContact O-N 3.35Å; L140-I142 VanDerWaalsContact C-N 3.29Å; L140-I142 PolarHBondContact O-N 3.47Å; L140-A143 PolarHBondContact O-N 2.81Å; L140-A144 PolarHBondContact O-N 2.95Å |
| 141 | G | 61.8 | Low | 57.9 | Low | 22 Ų | 22 | 93.6 Ų | 93.6 | 23% | 0.227 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -65.5 | -29.9 | 171 | 0 | 0 | 0 | 0 | 0 | 113.4 | C136 F137 A144 F145 | C136-G141 VanDerWaalsContact O-CA 3.26Å; C136-G141 WeakPolarHBondContact O-CA 3.21Å; C136-G141 PolarHBondContact O-N 2.87Å; F137-G141 PolarHBondContact O-N 3.26Å; G141-A144 PolarHBondContact O-N 3.32Å; G141-F145 PolarHBondContact O-N 3.46Å |
| 142 | I | 61.6 | Low | 57.6 | Low | 115 Ų | 115 | 93 Ų | 93 | 59% | 0.59 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -68.1 | -39.1 | 178.3 | -58.2 | 167.2 | 0 | 0 | 0 | 110.4 | L140 F145 Y146 | L140-I142 VanDerWaalsContact C-N 3.29Å; L140-I142 PolarHBondContact O-N 3.47Å; I142-F145 PolarHBondContact O-N 2.95Å; I142-Y146 WeakPolarHBondContact O-CB 3.46Å; I142-Y146 PolarHBondContact O-N 2.92Å |
| 143 | A | 59.4 | Low | 57.1 | Low | 62 Ų | 62 | 99.8 Ų | 99.8 | 51% | 0.512 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.5 | -38.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L140 Y146 L147 | L140-A143 PolarHBondContact O-N 2.81Å; A143-Y146 PolarHBondContact O-N 3.41Å; A143-L147 PolarHBondContact O-N 3.5Å; A143-L147 VanDerWaalsContact O-N 3.1Å |
| 144 | A | 62.3 | Low | 56.2 | Low | 54 Ų | 54 | 96.8 Ų | 96.8 | 45% | 0.446 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.7 | -40.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | L140 G141 A148 | L140-A144 PolarHBondContact O-N 2.95Å; G141-A144 PolarHBondContact O-N 3.32Å; A144-A148 PolarHBondContact O-N 3.33Å; A144-A148 VanDerWaalsContact O-N 3.11Å |
| 145 | F | 62.7 | Low | 55.5 | Low | 135 Ų | 135 | 96.5 Ų | 96.5 | 59% | 0.592 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70.5 | -33.4 | 173.7 | -169.1 | -96.2 | 0 | 0 | 0 | 112.5 | G141 I142 A148 H149 | G141-F145 PolarHBondContact O-N 3.46Å; I142-F145 PolarHBondContact O-N 2.95Å; F145-A148 WeakPolarHBondContact O-CB 3.22Å; F145-A148 PolarHBondContact O-N 2.88Å; F145-H149 WeakPolarHBondContact O-CB 3.43Å; F145-H149 PolarHBondContact O-N 3.27Å |
| 146 | Y | 62.8 | Low | 54.9 | Low | 143 Ų | 143 | 100.3 Ų | 100.3 | 56% | 0.561 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.1 | -42.1 | 177.6 | -166.5 | -98 | 0 | 0 | 0 | 111.2 | I142 A143 H149 Q150 | I142-Y146 WeakPolarHBondContact O-CB 3.46Å; I142-Y146 PolarHBondContact O-N 2.92Å; A143-Y146 PolarHBondContact O-N 3.41Å; Y146-H149 PolarHBondContact O-N 3.25Å; Y146-Q150 HydrophobicContact CE1-CG 4.34Å; Y146-Q150 PolarHBondContact O-N 3.42Å; Y146-Q150 PolarHBondContact OH-NE2 2.77Å |
| 147 | L | 62.1 | Low | 54.7 | Low | 99 Ų | 99 | 104.5 Ų | 104.5 | 52% | 0.518 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.8 | -42.8 | 171.7 | -167.2 | 65.1 | 0 | 0 | 0 | 110.6 | A143 H149 Q150 T151 | A143-L147 PolarHBondContact O-N 3.5Å; A143-L147 VanDerWaalsContact O-N 3.1Å; L147-H149 VanDerWaalsContact C-N 3.27Å; L147-H149 PolarHBondContact O-N 3Å; L147-Q150 PolarHBondContact O-N 3.29Å; L147-T151 WeakPolarHBondContact O-CB 3.25Å; L147-T151 PolarHBondContact O-N 3.21Å; L147-T151 PolarHBondContact O-OG1 3.28Å |
| 148 | A | 59.7 | Low | 54.4 | Low | 56 Ų | 56 | 101.8 Ų | 101.8 | 46% | 0.463 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -59.4 | -36.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | A144 F145 S152 | A144-A148 PolarHBondContact O-N 3.33Å; A144-A148 VanDerWaalsContact O-N 3.11Å; F145-A148 WeakPolarHBondContact O-CB 3.22Å; F145-A148 PolarHBondContact O-N 2.88Å; A148-S152 WeakPolarHBondContact O-CB 3.39Å; A148-S152 PolarHBondContact O-N 2.86Å |
| 149 | H | 51.8 | Low | 54.1 | Low | 135 Ų | 135 | 98 Ų | 98 | 63% | 0.625 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -74.9 | -33.9 | 179.8 | -153.5 | -96.6 | 0 | 0 | 0 | 113 | F145 Y146 L147 | F145-H149 WeakPolarHBondContact O-CB 3.43Å; F145-H149 PolarHBondContact O-N 3.27Å; Y146-H149 PolarHBondContact O-N 3.25Å; L147-H149 VanDerWaalsContact C-N 3.27Å; L147-H149 PolarHBondContact O-N 3Å |
| 150 | Q | 50.9 | Low | 54 | Low | 100 Ų | 100 | 100.1 Ų | 100.1 | 47% | 0.467 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -80 | -36.5 | 173.8 | -72.1 | -170.3 | -13.8 | 0 | 0 | 112.8 | Y146 L147 S152 R153 | Y146-Q150 HydrophobicContact CE1-CG 4.34Å; Y146-Q150 PolarHBondContact O-N 3.42Å; Y146-Q150 PolarHBondContact OH-NE2 2.77Å; L147-Q150 PolarHBondContact O-N 3.29Å; Q150-S152 PolarHBondContact O-N 3.29Å; Q150-R153 PolarHBondContact O-N 3.35Å |
| 151 | T | 47.8 | Very low | 53.7 | Low | 47 Ų | 47 | 103.2 Ų | 103.2 | 29% | 0.288 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -77.7 | -22 | -174.9 | -40.4 | 0 | 0 | 0 | 0 | 112.6 | L147 R153 A154 V155 | L147-T151 WeakPolarHBondContact O-CB 3.25Å; L147-T151 PolarHBondContact O-N 3.21Å; L147-T151 PolarHBondContact O-OG1 3.28Å; T151-R153 PolarHBondContact O-N 3.17Å; T151-A154 PolarHBondContact O-N 2.84Å; T151-V155 WeakPolarHBondContact O-CG2 3.22Å; T151-V155 PolarHBondContact O-N 2.77Å; T151-V155 VanDerWaalsContact O-N 3.16Å |
| 152 | S | 54.3 | Low | 53.1 | Low | 91 Ų | 91 | 108.7 Ų | 108.7 | 64% | 0.636 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -60.9 | -29.2 | 172.7 | -175.7 | 0 | 0 | 0 | 0 | 112.8 | A148 Q150 | A148-S152 WeakPolarHBondContact O-CB 3.39Å; A148-S152 PolarHBondContact O-N 2.86Å; Q150-S152 PolarHBondContact O-N 3.29Å |
| 153 | R | 46.2 | Very low | 52.3 | Low | 208 Ų | 208 | 105.2 Ų | 105.2 | 79% | 0.785 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -81.4 | -26 | 178.8 | -61.4 | -174.4 | 67.9 | 176.2 | -0.3 | 113 | Q150 T151 S156 | Q150-R153 PolarHBondContact O-N 3.35Å; T151-R153 PolarHBondContact O-N 3.17Å; R153-S156 PolarHBondContact O-OG 3.48Å |
| 154 | A | 44.4 | Very low | 51.9 | Low | 67 Ų | 67 | 104.3 Ų | 104.3 | 55% | 0.554 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -89.9 | -14.5 | -180 | 0 | 0 | 0 | 0 | 0 | 113.9 | T151 S156 T157 | T151-A154 PolarHBondContact O-N 2.84Å; A154-S156 PolarHBondContact O-N 2.98Å; A154-T157 PolarHBondContact O-N 3.3Å |
| 155 | V | 46.6 | Very low | 51.4 | Low | 89 Ų | 89 | 105 Ų | 105 | 54% | 0.539 | 59% | 0.59 | S | S | . | * | G | 310 helix | trans | -73 | -6.4 | 170.8 | 165.7 | 0 | 0 | 0 | 0 | 112.4 | T151 T157 | T151-V155 WeakPolarHBondContact O-CG2 3.22Å; T151-V155 PolarHBondContact O-N 2.77Å; T151-V155 VanDerWaalsContact O-N 3.16Å; V155-T157 PolarHBondContact O-N 3.1Å |
| 156 | S | 44.2 | Very low | 51.1 | Low | 102 Ų | 102 | 102 Ų | 102 | 71% | 0.713 | 58% | 0.583 | S | S | * | * | G | 310 helix | trans | -76 | -5.9 | 172.7 | 66.1 | 0 | 0 | 0 | 0 | 114.1 | R153 A154 | R153-S156 PolarHBondContact O-OG 3.48Å; A154-S156 PolarHBondContact O-N 2.98Å |
| 157 | T | 53.2 | Low | 50.9 | Low | 117 Ų | 117 | 98.3 Ų | 98.3 | 72% | 0.718 | 58% | 0.577 | S | S | * | * | G | 310 helix | trans | -97.8 | -0.3 | -175.3 | -44.6 | 0 | 0 | 0 | 0 | 114.4 | A154 V155 | A154-T157 PolarHBondContact O-N 3.3Å; V155-T157 PolarHBondContact O-N 3.1Å |
| 158 | G | 45.6 | Very low | 50.9 | Low | 56 Ų | 56 | 102.5 Ų | 102.5 | 58% | 0.577 | 59% | 0.586 | S | S | * | * | trans | 85.9 | 14.8 | 156.7 | 0 | 0 | 0 | 0 | 0 | 118.9 | L160 | G158-L160 PolarHBondContact O-N 3.42Š| ||
| 159 | D | 50.1 | Low | 50.9 | Low | 137 Ų | 137 | 109 Ų | 109 | 73% | 0.733 | 60% | 0.599 | S | S | * | * | trans | -99 | 74.7 | 171.7 | -87.5 | -40 | 0 | 0 | 0 | 112.4 | H161 | D159-H161 PolarHBondContact O-N 3Š| ||
| 160 | L | 52.7 | Low | 51.8 | Low | 141 Ų | 141 | 105.3 Ų | 105.3 | 74% | 0.738 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.6 | -15.2 | -178.6 | -69.2 | 167.7 | 0 | 0 | 0 | 113.8 | G158 | G158-L160 PolarHBondContact O-N 3.42Å |
| 161 | H | 48.7 | Very low | 52.6 | Low | 191 Ų | 191 | 105.5 Ų | 105.5 | 88% | 0.884 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -82.2 | -23.9 | -176.9 | -158.7 | -105.8 | 0 | 0 | 0 | 113.3 | D159 | D159-H161 PolarHBondContact O-N 3Å |
| 162 | L | 48.3 | Very low | 53.8 | Low | 138 Ų | 138 | 110 Ų | 110 | 72% | 0.723 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -95.9 | -24.7 | 174.4 | -156.2 | 71.1 | 0 | 0 | 0 | 112.5 | G164 S165 | L162-G164 VanDerWaalsContact C-N 3.27Å; L162-G164 PolarHBondContact O-N 2.75Å; L162-S165 PolarHBondContact O-N 2.65Å; L162-S165 PolarHBondContact O-OG 3.12Å |
| 163 | A | 43.9 | Very low | 54.5 | Low | 41 Ų | 41 | 110.8 Ų | 110.8 | 34% | 0.339 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -65.1 | -23 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | S165 T166 | A163-S165 PolarHBondContact O-N 3.39Å; A163-T166 PolarHBondContact O-N 2.91Å |
| 164 | G | 52.4 | Low | 55.7 | Low | 44 Ų | 44 | 103 Ų | 103 | 45% | 0.454 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.2 | -23.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114 | L162 | L162-G164 VanDerWaalsContact C-N 3.27Å; L162-G164 PolarHBondContact O-N 2.75Å |
| 165 | S | 50.6 | Low | 57.3 | Low | 69 Ų | 69 | 103.6 Ų | 103.6 | 48% | 0.483 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -75.5 | -26.9 | 178.7 | 70 | 0 | 0 | 0 | 0 | 113.2 | L162 A163 | L162-S165 PolarHBondContact O-N 2.65Å; L162-S165 PolarHBondContact O-OG 3.12Å; A163-S165 PolarHBondContact O-N 3.39Å |
| 166 | T | 56.3 | Low | 58.8 | Low | 72 Ų | 72 | 103.7 Ų | 103.7 | 44% | 0.442 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -76.6 | -26.4 | 178.5 | -50 | 0 | 0 | 0 | 0 | 112.2 | A163 A170 | A163-T166 PolarHBondContact O-N 2.91Å; T166-A170 WeakPolarHBondContact O-CB 3.27Å; T166-A170 PolarHBondContact O-N 3.39Å; T166-A170 VanDerWaalsContact O-N 3.15Å |
| 167 | S | 59.2 | Low | 60.4 | Low | 64 Ų | 64 | 99.8 Ų | 99.8 | 45% | 0.448 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67.8 | -43.8 | 177.5 | 178.7 | 0 | 0 | 0 | 0 | 112.7 | R169 A170 L171 | S167-R169 VanDerWaalsContact C-N 3.33Å; S167-R169 PolarHBondContact O-N 2.89Å; S167-A170 PolarHBondContact O-N 3.28Å; S167-L171 WeakPolarHBondContact O-CB 3.37Å; S167-L171 WeakPolarHBondContact O-CG 3.31Å; S167-L171 PolarHBondContact O-N 2.93Å |
| 168 | R | 61.3 | Low | 61.7 | Low | 187 Ų | 187 | 98.1 Ų | 98.1 | 71% | 0.706 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.5 | -41.5 | -180 | -64.5 | -175.5 | -174.2 | -132.6 | 0.8 | 111.4 | L171 F172 | R168-L171 PolarHBondContact O-N 3.45Å; R168-F172 WeakPolarHBondContact O-CD2 3.32Å; R168-F172 PolarHBondContact O-N 3.48Å |
| 169 | R | 60 | Low | 63.6 | Low | 192 Ų | 192 | 99.2 Ų | 99.2 | 73% | 0.725 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67.4 | -39.2 | 177.9 | -65.3 | -177.4 | 177.3 | -172.7 | -0.2 | 112.4 | S167 F172 L173 | S167-R169 VanDerWaalsContact C-N 3.33Å; S167-R169 PolarHBondContact O-N 2.89Å; R169-F172 PolarHBondContact O-N 3.18Å; R169-L173 WeakPolarHBondContact O-CG 3.31Å; R169-L173 PolarHBondContact O-N 2.97Å |
| 170 | A | 70.2 | Confident | 65.3 | Low | 58 Ų | 58 | 97.3 Ų | 97.3 | 48% | 0.479 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.2 | -41 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | T166 S167 L173 A174 | T166-A170 WeakPolarHBondContact O-CB 3.27Å; T166-A170 PolarHBondContact O-N 3.39Å; T166-A170 VanDerWaalsContact O-N 3.15Å; S167-A170 PolarHBondContact O-N 3.28Å; A170-L173 PolarHBondContact O-N 3.15Å; A170-A174 WeakPolarHBondContact O-CB 3.44Å; A170-A174 PolarHBondContact O-N 3.05Å |
| 171 | L | 69.3 | Low | 66.7 | Low | 105 Ų | 105 | 91.1 Ų | 91.1 | 55% | 0.55 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 174 | -72.6 | 174.2 | 0 | 0 | 0 | 111.7 | S167 R168 L173 A174 V175 | S167-L171 WeakPolarHBondContact O-CB 3.37Å; S167-L171 WeakPolarHBondContact O-CG 3.31Å; S167-L171 PolarHBondContact O-N 2.93Å; R168-L171 PolarHBondContact O-N 3.45Å; L171-L173 PolarHBondContact O-N 2.81Å; L171-A174 PolarHBondContact O-N 3.26Å; L171-V175 WeakPolarHBondContact O-CB 2.97Å; L171-V175 WeakPolarHBondContact O-CG2 3.44Å; L171-V175 PolarHBondContact O-N 3.23Å |
| 172 | F | 72.3 | Confident | 68.5 | Low | 141 Ų | 141 | 85.5 Ų | 85.5 | 62% | 0.618 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61 | -43 | 175 | -84.3 | -65.5 | 0 | 0 | 0 | 112.1 | R168 R169 V175 L176 | R168-F172 WeakPolarHBondContact O-CD2 3.32Å; R168-F172 PolarHBondContact O-N 3.48Å; R169-F172 PolarHBondContact O-N 3.18Å; F172-V175 PolarHBondContact O-N 3.26Å; F172-L176 VanDerWaalsContact O-CB 3.25Å; F172-L176 WeakPolarHBondContact O-CB 3.41Å; F172-L176 WeakPolarHBondContact O-CG 3.45Å; F172-L176 PolarHBondContact O-N 3.29Å |
| 173 | L | 68.2 | Low | 70.4 | Confident | 107 Ų | 107 | 81 Ų | 81 | 56% | 0.56 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -65.4 | -41.2 | 177.3 | -71.5 | 173.4 | 0 | 0 | 0 | 112.4 | R169 A170 L171 S177 | R169-L173 WeakPolarHBondContact O-CG 3.31Å; R169-L173 PolarHBondContact O-N 2.97Å; A170-L173 PolarHBondContact O-N 3.15Å; L171-L173 PolarHBondContact O-N 2.81Å; L173-S177 WeakPolarHBondContact O-CB 3.45Å; L173-S177 PolarHBondContact O-N 3.46Å |
| 174 | A | 72 | Confident | 72.5 | Confident | 44 Ų | 44 | 84 Ų | 84 | 36% | 0.364 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.1 | -48.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | A170 L171 S177 I178 | A170-A174 WeakPolarHBondContact O-CB 3.44Å; A170-A174 PolarHBondContact O-N 3.05Å; L171-A174 PolarHBondContact O-N 3.26Å; A174-S177 PolarHBondContact O-N 3.46Å; A174-I178 WeakPolarHBondContact O-CD1 3.26Å; A174-I178 WeakPolarHBondContact O-CG1 3.34Å; A174-I178 PolarHBondContact O-N 2.7Å |
| 175 | V | 78.4 | Confident | 74.1 | Confident | 80 Ų | 80 | 88.3 Ų | 88.3 | 49% | 0.485 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64.3 | -45.7 | 179.2 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | L171 F172 S177 I178 T179 | L171-V175 WeakPolarHBondContact O-CB 2.97Å; L171-V175 WeakPolarHBondContact O-CG2 3.44Å; L171-V175 PolarHBondContact O-N 3.23Å; F172-V175 PolarHBondContact O-N 3.26Å; V175-S177 VanDerWaalsContact C-N 3.31Å; V175-S177 PolarHBondContact O-N 3.3Å; V175-I178 PolarHBondContact O-N 3.29Å; V175-T179 HydrophobicContact CG1-CG2 4.34Å; V175-T179 VanDerWaalsContact O-CG2 3.29Å; V175-T179 WeakPolarHBondContact O-CG2 3.26Å; V175-T179 PolarHBondContact O-N 2.81Å; V175-T179 PolarHBondContact O-OG1 3.06Å |
| 176 | L | 78.5 | Confident | 76 | Confident | 91 Ų | 91 | 88.9 Ų | 88.9 | 48% | 0.476 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 176.5 | -72.6 | 172.7 | 0 | 0 | 0 | 111 | F172 I178 T179 I180 | F172-L176 VanDerWaalsContact O-CB 3.25Å; F172-L176 WeakPolarHBondContact O-CB 3.41Å; F172-L176 WeakPolarHBondContact O-CG 3.45Å; F172-L176 PolarHBondContact O-N 3.29Å; L176-I178 PolarHBondContact O-N 3.29Å; L176-T179 WeakPolarHBondContact CA-OG1 3.26Å; L176-T179 PolarHBondContact O-N 3.28Å; L176-T179 PolarHBondContact O-OG1 3.36Å; L176-I180 WeakPolarHBondContact O-CB 3.05Å; L176-I180 WeakPolarHBondContact O-CD1 3.01Å; L176-I180 WeakPolarHBondContact O-CG1 3.07Å; L176-I180 PolarHBondContact O-N 3.11Å |
| 177 | S | 76.6 | Confident | 77.8 | Confident | 20 Ų | 20 | 87.3 Ų | 87.3 | 14% | 0.14 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -62.4 | -43.3 | 177.1 | -166 | 0 | 0 | 0 | 0 | 112.4 | C135 C136 L173 A174 V175 I180 G181 | C135-S177 VanDerWaalsContact O-O 3.14Å; C135-S177 PolarHBondContact O-OG 3.18Å; C136-S177 VanDerWaalsContact CA-OG 3.26Å; C136-S177 WeakPolarHBondContact CA-OG 3.34Å; L173-S177 WeakPolarHBondContact O-CB 3.45Å; L173-S177 PolarHBondContact O-N 3.46Å; A174-S177 PolarHBondContact O-N 3.46Å; V175-S177 VanDerWaalsContact C-N 3.31Å; V175-S177 PolarHBondContact O-N 3.3Å; S177-I180 PolarHBondContact O-N 3.44Å; S177-G181 PolarHBondContact O-N 3.4Å |
| 178 | I | 81.8 | Confident | 79.3 | Confident | 83 Ų | 83 | 88.5 Ų | 88.5 | 43% | 0.426 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.1 | -49.2 | 176.7 | -66.7 | 160.9 | 0 | 0 | 0 | 109.9 | A174 V175 L176 I180 G181 T182 | A174-I178 WeakPolarHBondContact O-CD1 3.26Å; A174-I178 WeakPolarHBondContact O-CG1 3.34Å; A174-I178 PolarHBondContact O-N 2.7Å; V175-I178 PolarHBondContact O-N 3.29Å; L176-I178 PolarHBondContact O-N 3.29Å; I178-I180 PolarHBondContact O-N 3.38Å; I178-G181 PolarHBondContact O-N 3.43Å; I178-T182 WeakPolarHBondContact O-CB 3.2Å; I178-T182 PolarHBondContact O-N 3.16Å; I178-T182 PolarHBondContact O-OG1 3.22Å; I178-T182 VanDerWaalsContact O-OG1 3.05Å |
| 179 | T | 85.8 | Confident | 80.7 | Confident | 78 Ų | 78 | 82.7 Ų | 82.7 | 48% | 0.479 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.4 | -41.9 | -178.3 | 58.9 | 0 | 0 | 0 | 0 | 112.6 | V175 L176 G183 | V175-T179 HydrophobicContact CG1-CG2 4.34Å; V175-T179 VanDerWaalsContact O-CG2 3.29Å; V175-T179 WeakPolarHBondContact O-CG2 3.26Å; V175-T179 PolarHBondContact O-N 2.81Å; V175-T179 PolarHBondContact O-OG1 3.06Å; L176-T179 WeakPolarHBondContact CA-OG1 3.26Å; L176-T179 PolarHBondContact O-N 3.28Å; L176-T179 PolarHBondContact O-OG1 3.36Å; T179-G183 PolarHBondContact O-N 2.89Å |
| 180 | I | 84.1 | Confident | 82.4 | Confident | 97 Ų | 97 | 77.9 Ų | 77.9 | 50% | 0.497 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -67.5 | -45.2 | 177.2 | -66.3 | 165.7 | 0 | 0 | 0 | 110.1 | L176 S177 I178 G183 I184 | L176-I180 WeakPolarHBondContact O-CB 3.05Å; L176-I180 WeakPolarHBondContact O-CD1 3.01Å; L176-I180 WeakPolarHBondContact O-CG1 3.07Å; L176-I180 PolarHBondContact O-N 3.11Å; S177-I180 PolarHBondContact O-N 3.44Å; I178-I180 PolarHBondContact O-N 3.38Å; I180-G183 PolarHBondContact O-N 2.8Å; I180-I184 HydrophobicContact CG2-CD1 3.59Å; I180-I184 HydrophobicContact CG2-CG1 4.3Å; I180-I184 WeakPolarHBondContact O-CB 2.93Å; I180-I184 VanDerWaalsContact O-CG1 3.27Å; I180-I184 WeakPolarHBondContact O-CG1 3.21Å; I180-I184 PolarHBondContact O-N 2.54Å |
| 181 | G | 83.5 | Confident | 83.6 | Confident | 12 Ų | 12 | 78 Ų | 78 | 12% | 0.124 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -59.6 | -48 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S177 I178 Y185 | S177-G181 PolarHBondContact O-N 3.4Å; I178-G181 PolarHBondContact O-N 3.43Å; G181-Y185 VanDerWaalsContact O-CB 3.31Å; G181-Y185 WeakPolarHBondContact O-CB 3.14Å; G181-Y185 PolarHBondContact O-N 3.3Å |
| 182 | T | 84.8 | Confident | 84.7 | Confident | 72 Ų | 72 | 77.7 Ų | 77.7 | 44% | 0.442 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.8 | -42.7 | 176.5 | -54.5 | 0 | 0 | 0 | 0 | 111.6 | I178 I184 Y185 V186 | I178-T182 WeakPolarHBondContact O-CB 3.2Å; I178-T182 PolarHBondContact O-N 3.16Å; I178-T182 PolarHBondContact O-OG1 3.22Å; I178-T182 VanDerWaalsContact O-OG1 3.05Å; T182-I184 PolarHBondContact O-N 3.5Å; T182-Y185 PolarHBondContact O-N 3.23Å; T182-V186 HydrophobicContact CG2-CG2 4.44Å; T182-V186 WeakPolarHBondContact O-CG2 3.41Å; T182-V186 PolarHBondContact O-N 3.27Å |
| 183 | G | 88.4 | Confident | 85.7 | Confident | 44 Ų | 44 | 75.1 Ų | 75.1 | 45% | 0.454 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | T179 I180 G187 | T179-G183 PolarHBondContact O-N 2.89Å; I180-G183 PolarHBondContact O-N 2.8Å; G183-G187 PolarHBondContact O-N 3.37Å |
| 184 | I | 88.8 | Confident | 87 | Confident | 103 Ų | 103 | 72.3 Ų | 72.3 | 53% | 0.528 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -66.1 | -44.4 | 176.1 | -67.1 | 169.7 | 0 | 0 | 0 | 110.6 | I180 T182 V186 G187 V188 | I180-I184 HydrophobicContact CG2-CD1 3.59Å; I180-I184 HydrophobicContact CG2-CG1 4.3Å; I180-I184 WeakPolarHBondContact O-CB 2.93Å; I180-I184 VanDerWaalsContact O-CG1 3.27Å; I180-I184 WeakPolarHBondContact O-CG1 3.21Å; I180-I184 PolarHBondContact O-N 2.54Å; T182-I184 PolarHBondContact O-N 3.5Å; I184-V186 PolarHBondContact O-N 3.04Å; I184-G187 PolarHBondContact O-N 2.84Å; I184-V188 HydrophobicContact CG2-CG2 4Å; I184-V188 WeakPolarHBondContact O-CB 3.5Å; I184-V188 VanDerWaalsContact O-CG2 3.31Å; I184-V188 WeakPolarHBondContact O-CG2 3.23Å; I184-V188 PolarHBondContact O-N 3.18Å |
| 185 | Y | 85.8 | Confident | 88 | Confident | 136 Ų | 136 | 77.1 Ų | 77.1 | 53% | 0.533 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -57.7 | -48.8 | 179.4 | 178.3 | -103.1 | 0 | 0 | 0 | 111.9 | F131 G181 T182 T189 | F131-Y185 HydrophobicContact CZ-CE2 4.4Å; G181-Y185 VanDerWaalsContact O-CB 3.31Å; G181-Y185 WeakPolarHBondContact O-CB 3.14Å; G181-Y185 PolarHBondContact O-N 3.3Å; T182-Y185 PolarHBondContact O-N 3.23Å; Y185-T189 WeakPolarHBondContact O-CB 3.49Å; Y185-T189 PolarHBondContact O-N 3.3Å; Y185-T189 PolarHBondContact O-OG1 3.32Å |
| 186 | V | 91.6 | Very high | 88.5 | Confident | 80 Ų | 80 | 77.6 Ų | 77.6 | 49% | 0.485 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.2 | -44 | 176.5 | 176.8 | 0 | 0 | 0 | 0 | 110.7 | T182 I184 T189 V190 | T182-V186 HydrophobicContact CG2-CG2 4.44Å; T182-V186 WeakPolarHBondContact O-CG2 3.41Å; T182-V186 PolarHBondContact O-N 3.27Å; I184-V186 PolarHBondContact O-N 3.04Å; V186-T189 PolarHBondContact O-N 3.36Å; V186-V190 HydrophobicContact CG1-CG2 4.39Å; V186-V190 WeakPolarHBondContact O-CG2 3.47Å; V186-V190 PolarHBondContact O-N 3.1Å |
| 187 | G | 92.7 | Very high | 89 | Confident | 40 Ų | 40 | 76.5 Ų | 76.5 | 41% | 0.412 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | G183 I184 T189 V190 A191 | G183-G187 PolarHBondContact O-N 3.37Å; I184-G187 PolarHBondContact O-N 2.84Å; G187-T189 VanDerWaalsContact C-N 3.34Å; G187-V190 PolarHBondContact O-N 2.78Å; G187-A191 WeakPolarHBondContact O-CB 3.21Å; G187-A191 PolarHBondContact O-N 3.5Å |
| 188 | V | 91.3 | Very high | 89.5 | Confident | 89 Ų | 89 | 82.7 Ų | 82.7 | 54% | 0.539 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63 | -42 | 175.9 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | I184 A191 L192 | I184-V188 HydrophobicContact CG2-CG2 4Å; I184-V188 WeakPolarHBondContact O-CB 3.5Å; I184-V188 VanDerWaalsContact O-CG2 3.31Å; I184-V188 WeakPolarHBondContact O-CG2 3.23Å; I184-V188 PolarHBondContact O-N 3.18Å; V188-A191 PolarHBondContact O-N 3.49Å; V188-L192 VanDerWaalsContact O-CB 3.25Å; V188-L192 WeakPolarHBondContact O-CB 3.2Å; V188-L192 PolarHBondContact O-N 2.77Å |
| 189 | T | 90.4 | Very high | 89.6 | Confident | 64 Ų | 64 | 81.9 Ų | 81.9 | 39% | 0.393 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.4 | -48.3 | 179.1 | -58.6 | 0 | 0 | 0 | 0 | 111 | Y185 V186 G187 L192 V193 | Y185-T189 WeakPolarHBondContact O-CB 3.49Å; Y185-T189 PolarHBondContact O-N 3.3Å; Y185-T189 PolarHBondContact O-OG1 3.32Å; V186-T189 PolarHBondContact O-N 3.36Å; G187-T189 VanDerWaalsContact C-N 3.34Å; T189-L192 PolarHBondContact O-N 2.92Å; T189-V193 WeakPolarHBondContact O-CG2 3.22Å; T189-V193 PolarHBondContact O-N 3.44Å |
| 190 | V | 95.3 | Very high | 88.8 | Confident | 92 Ų | 92 | 85.6 Ų | 85.6 | 56% | 0.558 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.6 | -43.5 | 177.4 | 174.7 | 0 | 0 | 0 | 0 | 111.3 | V186 G187 L192 V193 A194 | V186-V190 HydrophobicContact CG1-CG2 4.39Å; V186-V190 WeakPolarHBondContact O-CG2 3.47Å; V186-V190 PolarHBondContact O-N 3.1Å; G187-V190 PolarHBondContact O-N 2.78Å; V190-L192 VanDerWaalsContact C-N 3.33Å; V190-L192 PolarHBondContact O-N 3.39Å; V190-V193 PolarHBondContact O-N 3.23Å; V190-A194 VanDerWaalsContact O-CB 3.31Å; V190-A194 WeakPolarHBondContact O-CB 3.41Å; V190-A194 PolarHBondContact O-N 3.23Å |
| 191 | A | 94.9 | Very high | 87.7 | Confident | 59 Ų | 59 | 89 Ų | 89 | 49% | 0.488 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -41.6 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | G187 V188 A194 Y195 | G187-A191 WeakPolarHBondContact O-CB 3.21Å; G187-A191 PolarHBondContact O-N 3.5Å; V188-A191 PolarHBondContact O-N 3.49Å; A191-A194 PolarHBondContact O-N 3.42Å; A191-Y195 WeakPolarHBondContact O-CB 3.5Å; A191-Y195 PolarHBondContact O-N 3.13Å |
| 192 | L | 93.4 | Very high | 86.2 | Confident | 99 Ų | 99 | 102.2 Ų | 102.2 | 52% | 0.518 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.7 | -47.6 | 177.4 | -176.4 | 62.5 | 0 | 0 | 0 | 111.2 | V188 T189 V190 A194 Y195 L196 | V188-L192 VanDerWaalsContact O-CB 3.25Å; V188-L192 WeakPolarHBondContact O-CB 3.2Å; V188-L192 PolarHBondContact O-N 2.77Å; T189-L192 PolarHBondContact O-N 2.92Å; V190-L192 VanDerWaalsContact C-N 3.33Å; V190-L192 PolarHBondContact O-N 3.39Å; L192-A194 PolarHBondContact O-N 2.99Å; L192-Y195 PolarHBondContact O-N 2.91Å; L192-L196 HydrophobicContact CD1-CD1 4.42Å; L192-L196 HydrophobicContact CD1-CG 4.44Å; L192-L196 HydrophobicContact CG-CD1 4.23Å; L192-L196 WeakPolarHBondContact O-CB 3.43Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 3.23Å |
| 193 | V | 93.8 | Very high | 86.3 | Confident | 87 Ų | 87 | 103.8 Ų | 103.8 | 53% | 0.527 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.2 | -48.5 | 176.4 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | T189 V190 Y195 L196 S197 | T189-V193 WeakPolarHBondContact O-CG2 3.22Å; T189-V193 PolarHBondContact O-N 3.44Å; V190-V193 PolarHBondContact O-N 3.23Å; V193-Y195 VanDerWaalsContact C-N 3.31Å; V193-Y195 PolarHBondContact O-N 3.12Å; V193-L196 PolarHBondContact O-N 2.89Å; V193-S197 WeakPolarHBondContact O-CB 3.35Å; V193-S197 PolarHBondContact O-N 3.24Å; V193-S197 PolarHBondContact O-OG 3.31Å |
| 194 | A | 94.1 | Very high | 86.2 | Confident | 48 Ų | 48 | 106.9 Ų | 106.9 | 40% | 0.397 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.9 | -37.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | V190 A191 L192 K198 | V190-A194 VanDerWaalsContact O-CB 3.31Å; V190-A194 WeakPolarHBondContact O-CB 3.41Å; V190-A194 PolarHBondContact O-N 3.23Å; A191-A194 PolarHBondContact O-N 3.42Å; L192-A194 PolarHBondContact O-N 2.99Å; A194-K198 WeakPolarHBondContact O-CB 3.23Å; A194-K198 WeakPolarHBondContact O-CG 2.98Å; A194-K198 PolarHBondContact O-N 3.29Å |
| 195 | Y | 93.3 | Very high | 86 | Confident | 145 Ų | 145 | 107.1 Ų | 107.1 | 57% | 0.569 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -64.7 | -48.7 | 175.1 | -177.9 | -99.9 | 0 | 0 | 0 | 110.6 | A191 L192 V193 S197 K198 N199 | A191-Y195 WeakPolarHBondContact O-CB 3.5Å; A191-Y195 PolarHBondContact O-N 3.13Å; L192-Y195 PolarHBondContact O-N 2.91Å; V193-Y195 VanDerWaalsContact C-N 3.31Å; V193-Y195 PolarHBondContact O-N 3.12Å; Y195-S197 PolarHBondContact O-N 3.33Å; Y195-K198 PolarHBondContact O-N 2.75Å; Y195-N199 WeakPolarHBondContact CD1-ND2 3.29Å; Y195-N199 VanDerWaalsContact CE1-ND2 3.26Å; Y195-N199 WeakPolarHBondContact CE1-ND2 3.49Å; Y195-N199 VanDerWaalsContact CE2-ND2 3.34Å; Y195-N199 WeakPolarHBondContact CE2-ND2 3.41Å; Y195-N199 PolarHBondContact O-N 2.9Å; Y195-N199 PolarHBondContact O-ND2 2.95Å |
| 196 | L | 90.2 | Very high | 86.1 | Confident | 90 Ų | 90 | 105.4 Ų | 105.4 | 47% | 0.471 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.9 | -45.9 | 176.1 | -67.7 | 174 | 0 | 0 | 0 | 111 | L192 V193 K198 N199 Q200 | L192-L196 HydrophobicContact CD1-CD1 4.42Å; L192-L196 HydrophobicContact CD1-CG 4.44Å; L192-L196 HydrophobicContact CG-CD1 4.23Å; L192-L196 WeakPolarHBondContact O-CB 3.43Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.48Å; L192-L196 PolarHBondContact O-N 3.23Å; V193-L196 PolarHBondContact O-N 2.89Å; L196-K198 VanDerWaalsContact C-N 3.27Å; L196-K198 PolarHBondContact O-N 2.99Å; L196-N199 CarbonylContact O-C 3.47Å; L196-N199 PolarHBondContact O-N 3.49Å; L196-Q200 WeakPolarHBondContact O-CG 3.21Å; L196-Q200 PolarHBondContact O-N 3.47Å |
| 197 | S | 89.2 | Confident | 85.7 | Confident | 68 Ų | 68 | 107 Ų | 107 | 48% | 0.476 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62 | -31.3 | 176.9 | -58.7 | 0 | 0 | 0 | 0 | 113.5 | V193 Y195 | V193-S197 WeakPolarHBondContact O-CB 3.35Å; V193-S197 PolarHBondContact O-N 3.24Å; V193-S197 PolarHBondContact O-OG 3.31Å; Y195-S197 PolarHBondContact O-N 3.33Å |
| 198 | K | 86.2 | Confident | 85.3 | Confident | 150 Ų | 150 | 111.5 Ų | 111.5 | 65% | 0.652 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -71.3 | -40.2 | 171.9 | -85.1 | 176.1 | 161.9 | 169.9 | 0 | 112 | A194 Y195 L196 Q200 K201 | A194-K198 WeakPolarHBondContact O-CB 3.23Å; A194-K198 WeakPolarHBondContact O-CG 2.98Å; A194-K198 PolarHBondContact O-N 3.29Å; Y195-K198 PolarHBondContact O-N 2.75Å; L196-K198 VanDerWaalsContact C-N 3.27Å; L196-K198 PolarHBondContact O-N 2.99Å; K198-Q200 VanDerWaalsContact C-N 3.28Å; K198-Q200 PolarHBondContact O-N 3.16Å; K198-K201 PolarHBondContact O-N 3.36Å |
| 199 | N | 83.8 | Confident | 84.8 | Confident | 66 Ų | 66 | 113.1 Ų | 113.1 | 35% | 0.353 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -79.4 | -6 | 179.9 | -73.4 | -79 | 0 | 0 | 0 | 113.8 | Y195 L196 W202 | Y195-N199 WeakPolarHBondContact CD1-ND2 3.29Å; Y195-N199 VanDerWaalsContact CE1-ND2 3.26Å; Y195-N199 WeakPolarHBondContact CE1-ND2 3.49Å; Y195-N199 VanDerWaalsContact CE2-ND2 3.34Å; Y195-N199 WeakPolarHBondContact CE2-ND2 3.41Å; Y195-N199 PolarHBondContact O-N 2.9Å; Y195-N199 PolarHBondContact O-ND2 2.95Å; L196-N199 CarbonylContact O-C 3.47Å; L196-N199 PolarHBondContact O-N 3.49Å; N199-W202 PolarHBondContact O-NE1 3Å |
| 200 | Q | 68.1 | Low | 84.4 | Confident | 156 Ų | 156 | 116.8 Ų | 116.8 | 73% | 0.729 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | 4.9 | 173.3 | -69.5 | -74 | -46.9 | 0 | 0 | 112.8 | L196 K198 W202 | L196-Q200 WeakPolarHBondContact O-CG 3.21Å; L196-Q200 PolarHBondContact O-N 3.47Å; K198-Q200 VanDerWaalsContact C-N 3.28Å; K198-Q200 PolarHBondContact O-N 3.16Å; Q200-W202 PolarHBondContact O-N 3.48Å |
| 201 | K | 61.3 | Low | 83.5 | Confident | 169 Ų | 169 | 118.9 Ų | 118.9 | 74% | 0.735 | 58% | 0.584 | S | S | * | * | trans | -86.8 | 40 | 177.6 | -60.3 | -178.8 | 179.9 | -171.4 | 0 | 112.8 | K198 | K198-K201 PolarHBondContact O-N 3.36Š| ||
| 202 | W | 53.4 | Low | 82.4 | Confident | 290 Ų | 290 | 124.4 Ų | 124.4 | 100% | 1.098 | 59% | 0.593 | S | S | * | * | trans | -100.1 | 0 | 170.8 | -59.8 | 90.2 | 0 | 0 | 0 | 109.4 | N199 Q200 | N199-W202 PolarHBondContact O-NE1 3Å; Q200-W202 PolarHBondContact O-N 3.48Å |
Retrieved 202 of 202 residues in 170.6 ms
(Link to these results)