| 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 | Very low | 45 | Very low | 242 Ų | 242 | 157.2 Ų | 157.2 | 100% | 1.192 | 79% | 0.791 | S | S | * | * | 0 | 96 | 0 | -61.3 | -177.4 | -168.4 | 0 | 0 | 104.7 | |||||
| 2 | A | 41.1 | Very low | 44.1 | Very low | 96 Ų | 96 | 158.9 Ų | 158.9 | 79% | 0.793 | 79% | 0.794 | S | S | * | * | 61.9 | 127.1 | 93.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 3 | E | 52.8 | Low | 45.3 | Very low | 184 Ų | 184 | 154.3 Ų | 154.3 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | cis | -163.3 | 171.7 | -1.8 | -104 | -88.2 | 134.6 | 0 | 0 | 104.9 | ||||
| 4 | P | 65.5 | Low | 44.5 | Very low | 71 Ų | 71 | 157.2 Ų | 157.2 | 46% | 0.461 | 79% | 0.792 | S | S | . | * | trans | -129.8 | -168.2 | -152 | 20.3 | 7.8 | 0 | 0 | 0 | 113.9 | ||||
| 5 | F | 47.2 | Very low | 44.7 | Very low | 172 Ų | 172 | 155.4 Ų | 155.4 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | trans | 81.7 | 119 | 143.8 | -64 | -42.2 | 0 | 0 | 0 | 121 | ||||
| 6 | L | 43.3 | Very low | 44.5 | Very low | 145 Ų | 145 | 153 Ų | 153 | 76% | 0.759 | 79% | 0.794 | S | S | * | * | 83.9 | 151.7 | 92.5 | -69.8 | 170 | 0 | 0 | 0 | 112.1 | |||||
| 7 | S | 45.1 | Very low | 44.3 | Very low | 93 Ų | 93 | 153.4 Ų | 153.4 | 65% | 0.65 | 80% | 0.798 | S | S | * | * | cis | -164.2 | 152.5 | 4 | -130.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 8 | E | 46.4 | Very low | 43.6 | Very low | 166 Ų | 166 | 152.5 Ų | 152.5 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | trans | -28.1 | 143.7 | 143.3 | -133.3 | 161.8 | -163.3 | 0 | 0 | 115.2 | ||||
| 9 | Y | 37.9 | Very low | 43.2 | Very low | 205 Ų | 205 | 152 Ų | 152 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | 176.9 | 149.2 | 116.9 | -109.3 | -92.5 | 0 | 0 | 0 | 113.5 | |||||
| 10 | Q | 43 | Very low | 42.7 | Very low | 170 Ų | 170 | 148.4 Ų | 148.4 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -95.2 | 144 | -171.1 | -176.5 | 170.1 | 30.1 | 0 | 0 | 111.3 | ||||
| 11 | H | 34.1 | Very low | 42.2 | Very low | 185 Ų | 185 | 146.1 Ų | 146.1 | 86% | 0.856 | 81% | 0.81 | S | S | * | * | trans | -148.7 | 133.7 | 167.2 | -85.8 | -67.7 | 0 | 0 | 0 | 114.3 | ||||
| 12 | Q | 34.3 | Very low | 42 | Very low | 178 Ų | 178 | 139.5 Ų | 139.5 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | trans | -132.3 | 175.5 | 155.9 | -154.6 | -160.5 | -23.7 | 0 | 0 | 106.6 | ||||
| 13 | P | 59.1 | Low | 41.7 | Very low | 99 Ų | 99 | 139.6 Ų | 139.6 | 64% | 0.643 | 80% | 0.795 | S | S | * | * | -109.4 | 172.3 | -85.2 | 36.7 | -23.4 | 0 | 0 | 0 | 113.1 | |||||
| 14 | Q | 34 | Very low | 40.8 | Very low | 195 Ų | 195 | 137.4 Ų | 137.4 | 91% | 0.911 | 79% | 0.794 | S | S | * | * | trans | -153.1 | 146.4 | 150.9 | -80.3 | -138.4 | -41.3 | 0 | 0 | 114.1 | ||||
| 15 | T | 47.4 | Very low | 39.2 | Very low | 130 Ų | 130 | 142.3 Ų | 142.3 | 80% | 0.798 | 81% | 0.811 | S | S | * | * | trans | -75.5 | 150.6 | 179.9 | 53.5 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 16 | S | 41.8 | Very low | 38.7 | Very low | 117 Ų | 117 | 143.1 Ų | 143.1 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | -159 | 133.8 | 144.1 | 60.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 17 | N | 40.9 | Very low | 38.6 | Very low | 160 Ų | 160 | 144.5 Ų | 144.5 | 86% | 0.856 | 82% | 0.819 | S | S | * | * | trans | -83.3 | 144.9 | 168.1 | -64 | -37.6 | 0 | 0 | 0 | 109.1 | ||||
| 18 | C | 32.7 | Very low | 38.4 | Very low | 137 Ų | 137 | 145.1 Ų | 145.1 | 93% | 0.926 | 82% | 0.821 | S | S | * | * | trans | -149.8 | 121.8 | 153.9 | -90.8 | 0 | 0 | 0 | 0 | 112 | ||||
| 19 | T | 35.6 | Very low | 37.8 | Very low | 143 Ų | 143 | 144.3 Ų | 144.3 | 88% | 0.877 | 82% | 0.822 | S | S | * | * | trans | -69.7 | 143.3 | 171.9 | -55.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 20 | G | 32.2 | Very low | 38.2 | Very low | 79 Ų | 79 | 140 Ų | 140 | 81% | 0.814 | 82% | 0.819 | S | S | * | * | trans | -156.9 | 96.4 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 21 | A | 33.8 | Very low | 38.2 | Very low | 101 Ų | 101 | 140.5 Ų | 140.5 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | trans | -80.8 | 137.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 22 | A | 32.9 | Very low | 38.4 | Very low | 103 Ų | 103 | 143 Ų | 143 | 85% | 0.851 | 82% | 0.824 | S | S | * | * | trans | -143.5 | 110.5 | 157.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 23 | A | 36 | Very low | 38.9 | Very low | 99 Ų | 99 | 140 Ų | 140 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -83.4 | 134 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 24 | V | 33.1 | Very low | 37.9 | Very low | 137 Ų | 137 | 141.9 Ų | 141.9 | 83% | 0.83 | 83% | 0.832 | S | S | * | * | trans | -142.6 | 101.4 | 158.1 | -176.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 25 | Q | 32.5 | Very low | 38.5 | Very low | 175 Ų | 175 | 136.5 Ų | 136.5 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | 45.8 | 110.6 | 142 | -57.4 | -156.6 | -4.3 | 0 | 0 | 121.3 | ||||
| 26 | E | 37.7 | Very low | 38 | Very low | 189 Ų | 189 | 135.1 Ų | 135.1 | 88% | 0.883 | 83% | 0.83 | S | S | * | * | trans | -74.5 | 127.5 | 157.2 | -143.1 | 179.6 | 166.2 | 0 | 0 | 109.5 | ||||
| 27 | E | 39.6 | Very low | 38.1 | Very low | 173 Ų | 173 | 138.2 Ų | 138.2 | 81% | 0.808 | 83% | 0.831 | S | S | * | * | trans | -104.2 | 121.1 | 164.8 | -91.9 | -83.7 | 141.8 | 0 | 0 | 107.7 | ||||
| 28 | P | 41.1 | Very low | 37.9 | Very low | 106 Ų | 106 | 139.4 Ų | 139.4 | 69% | 0.688 | 83% | 0.832 | S | S | * | * | trans | -86.5 | 121.2 | -178.7 | 30.9 | -28.9 | 0 | 0 | 0 | 111.1 | P30 | P28-P30 WeakPolarHBondContact O-CD 3.34Š| ||
| 29 | N | 34.4 | Very low | 38.3 | Very low | 149 Ų | 149 | 143.5 Ų | 143.5 | 80% | 0.797 | 83% | 0.828 | S | S | * | * | trans | -76.8 | 116.8 | 168.5 | -173.6 | 6.5 | 0 | 0 | 0 | 110.1 | E31 | N29-E31 PolarHBondContact O-N 2.86Š| ||
| 30 | P | 45.9 | Very low | 38.7 | Very low | 116 Ų | 116 | 142.4 Ų | 142.4 | 75% | 0.753 | 82% | 0.821 | S | S | * | * | trans | -100.1 | 68.2 | -172.8 | 38.5 | -31.7 | 0 | 0 | 0 | 112.4 | P28 | P28-P30 WeakPolarHBondContact O-CD 3.34Š| ||
| 31 | E | 42.7 | Very low | 39.2 | Very low | 180 Ų | 180 | 144.3 Ų | 144.3 | 84% | 0.841 | 82% | 0.819 | S | S | * | * | trans | -147 | 81.1 | 163.3 | -76 | -157.4 | 153.8 | 0 | 0 | 111.9 | N29 | N29-E31 PolarHBondContact O-N 2.86Š| ||
| 32 | R | 38.3 | Very low | 39.9 | Very low | 238 Ų | 238 | 148.6 Ų | 148.6 | 90% | 0.898 | 82% | 0.822 | S | S | * | * | trans | -155.6 | 127.9 | 154.3 | -165.6 | 170.9 | -77.6 | -170.1 | -3.7 | 110.9 | ||||
| 33 | P | 44.9 | Very low | 40.1 | Very low | 114 Ų | 114 | 152.3 Ų | 152.3 | 74% | 0.74 | 82% | 0.821 | S | S | * | * | trans | -72.8 | 149.9 | -178 | 29 | -34.4 | 0 | 0 | 0 | 112.4 | ||||
| 34 | P | 38.3 | Very low | 40.4 | Very low | 139 Ų | 139 | 153.1 Ų | 153.1 | 90% | 0.903 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -84.7 | 119 | 176.8 | 33 | -29.4 | 0 | 0 | 0 | 110 | ||
| 35 | G | 47.2 | Very low | 41.3 | Very low | 82 Ų | 82 | 150.7 Ų | 150.7 | 85% | 0.845 | 80% | 0.801 | S | S | * | * | trans | 143.3 | 69.6 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 36 | A | 35.8 | Very low | 41.9 | Very low | 100 Ų | 100 | 151.8 Ų | 151.8 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | trans | -146.9 | 105.2 | 156.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | E38 | A36-E38 PolarHBondContact O-N 3.06Š| ||
| 37 | E | 44 | Very low | 42.1 | Very low | 182 Ų | 182 | 153 Ų | 153 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | -59.4 | 127.2 | 168.7 | -69 | -165.5 | 149.8 | 0 | 0 | 109.1 | R39 | E37-R39 PolarHBondContact O-N 2.77Š| ||
| 38 | E | 37.1 | Very low | 42.2 | Very low | 185 Ų | 185 | 152.7 Ų | 152.7 | 86% | 0.864 | 79% | 0.793 | S | S | * | * | trans | -66.9 | 98.5 | 169.2 | -173.6 | 177.7 | 168.1 | 0 | 0 | 108.2 | A36 V40 | A36-E38 PolarHBondContact O-N 3.06Å; E38-V40 PolarHBondContact O-N 2.75Å | ||
| 39 | R | 41.3 | Very low | 42.3 | Very low | 223 Ų | 223 | 153.2 Ų | 153.2 | 84% | 0.842 | 80% | 0.799 | S | S | * | * | trans | -78.6 | 114.2 | 165.7 | -76 | -161.2 | -179.8 | 173.2 | 1.4 | 108.8 | E37 | E37-R39 PolarHBondContact O-N 2.77Š| ||
| 40 | V | 44 | Very low | 42.7 | Very low | 121 Ų | 121 | 157.2 Ų | 157.2 | 73% | 0.733 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 135 | 163.6 | -179.6 | 0 | 0 | 0 | 0 | 109.7 | E38 E42 | E38-V40 PolarHBondContact O-N 2.75Å; V40-E42 PolarHBondContact O-N 3.21Å |
| 41 | P | 42.3 | Very low | 42.4 | Very low | 119 Ų | 119 | 155.2 Ų | 155.2 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 119.2 | 171.4 | -19.3 | 31.8 | 0 | 0 | 0 | 110.3 | ||
| 42 | E | 48.4 | Very low | 42.1 | Very low | 191 Ų | 191 | 155.7 Ų | 155.7 | 89% | 0.893 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 125.5 | 172.7 | -157.1 | 162.4 | -170.8 | 0 | 0 | 108.3 | V40 D44 | V40-E42 PolarHBondContact O-N 3.21Å; E42-D44 PolarHBondContact O-N 3.43Å |
| 43 | E | 38.3 | Very low | 42.3 | Very low | 180 Ų | 180 | 150.5 Ų | 150.5 | 84% | 0.841 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 123.7 | -175.8 | -72.1 | -167.1 | 138 | 0 | 0 | 111.8 | S45 | E43-S45 PolarHBondContact O-N 2.83Å; E43-S45 PolarHBondContact O-OG 3.35Å |
| 44 | D | 41.8 | Very low | 41.8 | Very low | 117 Ų | 117 | 154 Ų | 154 | 63% | 0.626 | 80% | 0.799 | S | S | * | * | trans | -66.5 | 94.3 | -177.4 | -165.7 | 1.5 | 0 | 0 | 0 | 110.8 | E42 R46 | E42-D44 PolarHBondContact O-N 3.43Å; D44-R46 PolarHBondContact O-N 3.36Å; D44-R46 WeakPolarHBondContact OD1-CB 3.35Å; D44-R46 PolarHBondContact OD1-N 2.87Å | ||
| 45 | S | 51 | Low | 41.9 | Very low | 86 Ų | 86 | 156 Ų | 156 | 60% | 0.601 | 80% | 0.801 | S | S | * | * | G | 310 helix | trans | -71.7 | 9.3 | 180 | -64.4 | 0 | 0 | 0 | 0 | 113.9 | E43 W47 Q48 | E43-S45 PolarHBondContact O-N 2.83Å; E43-S45 PolarHBondContact O-OG 3.35Å; S45-W47 PolarHBondContact O-N 2.64Å; S45-W47 VanDerWaalsContact O-N 3.13Å; S45-Q48 PolarHBondContact O-N 3Å |
| 46 | R | 45.6 | Very low | 41.3 | Very low | 197 Ų | 197 | 155.4 Ų | 155.4 | 74% | 0.743 | 80% | 0.795 | S | S | * | * | G | 310 helix | trans | -61.6 | -22.3 | -174.1 | -176.3 | 178.5 | -75.1 | -149.1 | -1.5 | 114.1 | D44 | D44-R46 PolarHBondContact O-N 3.36Å; D44-R46 WeakPolarHBondContact OD1-CB 3.35Å; D44-R46 PolarHBondContact OD1-N 2.87Å |
| 47 | W | 41.3 | Very low | 41.1 | Very low | 214 Ų | 214 | 154.5 Ų | 154.5 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | G | 310 helix | trans | -99 | -9.9 | -176.5 | -64.8 | 105.2 | 0 | 0 | 0 | 115.5 | S45 S49 | S45-W47 PolarHBondContact O-N 2.64Å; S45-W47 VanDerWaalsContact O-N 3.13Å; W47-S49 PolarHBondContact O-N 3Å |
| 48 | Q | 42.7 | Very low | 40.7 | Very low | 167 Ų | 167 | 157.6 Ų | 157.6 | 78% | 0.78 | 80% | 0.8 | S | S | * | * | G | 310 helix | trans | -78.9 | -16.2 | -175.7 | -69.2 | -137.4 | 21.3 | 0 | 0 | 114.5 | S45 R50 | S45-Q48 PolarHBondContact O-N 3Å; Q48-R50 PolarHBondContact O-N 3.21Å |
| 49 | S | 42.5 | Very low | 41 | Very low | 117 Ų | 117 | 154.6 Ų | 154.6 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | G | 310 helix | trans | -86.1 | 3.3 | -170.9 | -54.7 | 0 | 0 | 0 | 0 | 115.6 | W47 | W47-S49 PolarHBondContact O-N 3Š|
| 50 | R | 43.2 | Very low | 40.5 | Very low | 234 Ų | 234 | 147.5 Ų | 147.5 | 88% | 0.883 | 79% | 0.793 | S | S | * | * | G | 310 helix | trans | -96.3 | -0.5 | -173.3 | -131.5 | 179.5 | -162.2 | -90.9 | 2.3 | 115.8 | Q48 | Q48-R50 PolarHBondContact O-N 3.21Š|
| 51 | A | 40.6 | Very low | 40.7 | Very low | 73 Ų | 73 | 146.8 Ų | 146.8 | 60% | 0.603 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -130.5 | 45.2 | -169.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 52 | F | 36 | Very low | 40.2 | Very low | 191 Ų | 191 | 150 Ų | 150 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | trans | -155.2 | 122.7 | 158 | -72 | -72.3 | 0 | 0 | 0 | 111.6 | Q54 | F52-Q54 PolarHBondContact O-N 3.49Š| ||
| 53 | P | 41.8 | Very low | 39.4 | Very low | 128 Ų | 128 | 144.1 Ų | 144.1 | 83% | 0.831 | 79% | 0.786 | S | S | * | * | trans | -71 | 108.9 | 157.7 | -10 | 26.3 | 0 | 0 | 0 | 108.3 | L55 | P53-L55 PolarHBondContact O-N 3.34Å; P53-L55 VanDerWaalsContact O-N 3.12Å | ||
| 54 | Q | 34.8 | Very low | 39.2 | Very low | 189 Ų | 189 | 145.4 Ų | 145.4 | 88% | 0.883 | 79% | 0.792 | S | S | * | * | trans | -63.1 | 109.9 | 166.2 | -80.7 | -171.3 | 33.3 | 0 | 0 | 109.1 | F52 G56 | F52-Q54 PolarHBondContact O-N 3.49Å; Q54-G56 VanDerWaalsContact C-N 3.27Å; Q54-G56 PolarHBondContact O-N 2.9Å | ||
| 55 | L | 40.8 | Very low | 38.8 | Very low | 180 Ų | 180 | 143.3 Ų | 143.3 | 94% | 0.942 | 80% | 0.798 | S | S | * | * | trans | -70.2 | 88.2 | 158.8 | -80.9 | 163.8 | 0 | 0 | 0 | 108.3 | P53 | P53-L55 PolarHBondContact O-N 3.34Å; P53-L55 VanDerWaalsContact O-N 3.12Å | ||
| 56 | G | 34.1 | Very low | 37.9 | Very low | 70 Ų | 70 | 145.5 Ų | 145.5 | 72% | 0.722 | 81% | 0.813 | S | S | * | * | trans | -90 | 103.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | Q54 | Q54-G56 VanDerWaalsContact C-N 3.27Å; Q54-G56 PolarHBondContact O-N 2.9Å | ||
| 57 | G | 31.2 | Very low | 37.5 | Very low | 81 Ų | 81 | 143.6 Ų | 143.6 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | -66.8 | 154 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 58 | R | 35.5 | Very low | 37.1 | Very low | 246 Ų | 246 | 142 Ų | 142 | 93% | 0.928 | 82% | 0.818 | S | S | * | * | trans | -118.1 | 143.7 | 165.9 | -132.6 | -177.3 | -176.8 | -94.8 | 0.8 | 108.6 | ||||
| 59 | P | 43.8 | Very low | 36.6 | Very low | 123 Ų | 123 | 139 Ų | 139 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | trans | -94.1 | 131 | -166.3 | 33.8 | -29.8 | 0 | 0 | 0 | 114.4 | ||||
| 60 | G | 31.7 | Very low | 36.1 | Very low | 74 Ų | 74 | 141.9 Ų | 141.9 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | trans | 68.9 | 169.9 | 145.7 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 61 | P | 46.8 | Very low | 36.1 | Very low | 106 Ų | 106 | 135.8 Ų | 135.8 | 69% | 0.688 | 81% | 0.808 | S | S | * | * | cis | -129.5 | -177.7 | -11.1 | 22.2 | 3.3 | 0 | 0 | 0 | 114.3 | ||||
| 62 | E | 33.1 | Very low | 36.3 | Very low | 186 Ų | 186 | 137.7 Ų | 137.7 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | trans | 62.9 | 132.9 | 154.4 | 52.2 | -154.3 | 127 | 0 | 0 | 119.6 | ||||
| 63 | G | 30.9 | Very low | 36.8 | Very low | 68 Ų | 68 | 134.1 Ų | 134.1 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | cis | 179.9 | 172 | 3.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 64 | E | 34.6 | Very low | 36.4 | Very low | 206 Ų | 206 | 136.8 Ų | 136.8 | 96% | 0.963 | 82% | 0.816 | S | S | * | * | trans | 76.2 | 127.1 | 167.4 | -52 | -157.3 | 143.3 | 0 | 0 | 120.2 | ||||
| 65 | G | 32.3 | Very low | 36.2 | Very low | 73 Ų | 73 | 136.7 Ų | 136.7 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | trans | 131 | 82.8 | 139.3 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 66 | S | 32.5 | Very low | 36.2 | Very low | 132 Ų | 132 | 133.8 Ų | 133.8 | 92% | 0.923 | 81% | 0.807 | S | S | * | * | trans | 79 | 128.5 | 137.2 | -147.5 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 67 | L | 36.9 | Very low | 36 | Very low | 158 Ų | 158 | 139.8 Ų | 139.8 | 83% | 0.827 | 82% | 0.817 | S | S | * | * | trans | -74.6 | 172.2 | 179.3 | -74.9 | 154.3 | 0 | 0 | 0 | 113.6 | ||||
| 68 | E | 32.8 | Very low | 35.8 | Very low | 179 Ų | 179 | 139.6 Ų | 139.6 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | trans | 92.8 | 129.7 | 148.2 | -131.4 | 156 | 162.9 | 0 | 0 | 115.5 | ||||
| 69 | S | 33.1 | Very low | 35.3 | Very low | 105 Ų | 105 | 133.8 Ų | 133.8 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | cis | -164.6 | 149 | -0.2 | -112 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 70 | Q | 32.1 | Very low | 35.3 | Very low | 177 Ų | 177 | 133.1 Ų | 133.1 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | -98.8 | 163.3 | 151.9 | -105.8 | -146.4 | 1.8 | 0 | 0 | 108.2 | ||||
| 71 | P | 42.3 | Very low | 35 | Very low | 107 Ų | 107 | 138.7 Ų | 138.7 | 70% | 0.695 | 80% | 0.804 | S | S | * | * | cis | -152 | -144.4 | 41.8 | 38.9 | -13.2 | 0 | 0 | 0 | 112.8 | ||||
| 72 | P | 44.9 | Very low | 34.3 | Very low | 112 Ų | 112 | 139.5 Ų | 139.5 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | -121.5 | -171.7 | -54.3 | 26.4 | -4.1 | 0 | 0 | 0 | 113 | |||||
| 73 | P | 47.4 | Very low | 34.2 | Very low | 116 Ų | 116 | 135.6 Ų | 135.6 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | trans | -101.8 | 164.6 | -164.5 | 39.4 | -30 | 0 | 0 | 0 | 114.5 | ||||
| 74 | L | 32.6 | Very low | 34 | Very low | 184 Ų | 184 | 138.3 Ų | 138.3 | 96% | 0.963 | 81% | 0.813 | S | S | * | * | trans | -134.1 | 141.2 | 167.6 | -73.7 | 176.9 | 0 | 0 | 0 | 113.6 | ||||
| 75 | Q | 31.5 | Very low | 33.8 | Very low | 188 Ų | 188 | 135.6 Ų | 135.6 | 88% | 0.879 | 80% | 0.804 | S | S | * | * | trans | -81.9 | 172.9 | -171.3 | -102.3 | -173.3 | -7.2 | 0 | 0 | 113.8 | ||||
| 76 | P | 39.8 | Very low | 33.7 | Very low | 118 Ų | 118 | 139.3 Ų | 139.3 | 77% | 0.766 | 81% | 0.805 | S | S | * | * | trans | -84.5 | 153.6 | -162.1 | 34.7 | -35.1 | 0 | 0 | 0 | 114 | ||||
| 77 | Q | 30.4 | Very low | 33.6 | Very low | 197 Ų | 197 | 142.2 Ų | 142.2 | 92% | 0.921 | 80% | 0.801 | S | S | * | * | trans | -132.1 | 142 | 166.6 | -90.1 | -127.3 | 18.8 | 0 | 0 | 111.3 | ||||
| 78 | A | 26.6 | Very low | 33.2 | Very low | 77 Ų | 77 | 137.6 Ų | 137.6 | 64% | 0.636 | 79% | 0.792 | S | S | * | * | trans | -104.7 | 153.6 | -172.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 79 | C | 24.9 | Very low | 33.3 | Very low | 123 Ų | 123 | 137.7 Ų | 137.7 | 83% | 0.831 | 79% | 0.792 | S | S | * | * | trans | 72.6 | 161.9 | 151.5 | -67.6 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 80 | P | 43.6 | Very low | 33.3 | Very low | 109 Ų | 109 | 142.3 Ų | 142.3 | 71% | 0.708 | 80% | 0.799 | S | S | * | * | cis | -137.3 | 168.2 | -11.5 | 23.1 | 1.9 | 0 | 0 | 0 | 116.2 | ||||
| 81 | E | 26.8 | Very low | 33.3 | Very low | 191 Ų | 191 | 137 Ų | 137 | 89% | 0.893 | 79% | 0.792 | S | S | * | * | trans | 43 | 121 | 138.8 | -59.8 | 175.9 | -176.8 | 0 | 0 | 122.1 | ||||
| 82 | S | 31.4 | Very low | 33.1 | Very low | 123 Ų | 123 | 141.1 Ų | 141.1 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | trans | -142.3 | 113.4 | 139 | -176.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 83 | S | 29.8 | Very low | 32.4 | Very low | 105 Ų | 105 | 143.2 Ų | 143.2 | 73% | 0.734 | 81% | 0.807 | S | S | * | * | trans | -86.3 | 139.8 | 168 | 77.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 84 | C | 28.4 | Very low | 31.8 | Very low | 125 Ų | 125 | 140.7 Ų | 140.7 | 85% | 0.845 | 80% | 0.802 | S | S | * | * | trans | -158.6 | 93.7 | 145.8 | -93.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 85 | L | 30.6 | Very low | 31.9 | Very low | 148 Ų | 148 | 140.2 Ų | 140.2 | 78% | 0.775 | 80% | 0.8 | S | S | * | * | trans | 37.5 | 112.4 | 138 | -70.6 | 164.2 | 0 | 0 | 0 | 123 | ||||
| 86 | I | 28.3 | Very low | 32.1 | Very low | 152 Ų | 152 | 139.1 Ų | 139.1 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | 49.5 | 117.7 | 116.5 | -56.3 | 179.9 | 0 | 0 | 0 | 120.4 | |||||
| 87 | K | 31 | Very low | 31.9 | Very low | 192 Ų | 192 | 142.1 Ų | 142.1 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | -166 | 116 | 120.4 | -144.5 | 169.7 | 178.8 | -178.4 | 0 | 108 | |||||
| 88 | G | 29.8 | Very low | 32.2 | Very low | 61 Ų | 61 | 139 Ų | 139 | 63% | 0.629 | 81% | 0.809 | S | S | * | * | 57.8 | 120.9 | 96.2 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 89 | E | 33.2 | Very low | 32.5 | Very low | 182 Ų | 182 | 140 Ų | 140 | 85% | 0.85 | 82% | 0.818 | S | S | * | * | cis | -169.5 | 164.4 | 45 | -74.2 | 172.9 | 96.7 | 0 | 0 | 110.3 | ||||
| 90 | K | 34.8 | Very low | 32.6 | Very low | 202 Ų | 202 | 138.3 Ų | 138.3 | 88% | 0.878 | 82% | 0.82 | S | S | * | * | trans | 11 | 130.6 | 153.9 | -77.5 | 170.3 | 156.8 | -178.4 | 0 | 118.2 | ||||
| 91 | G | 32 | Very low | 31.9 | Very low | 65 Ų | 65 | 137 Ų | 137 | 67% | 0.67 | 83% | 0.827 | S | S | * | * | cis | 82.7 | 98.7 | 43.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 92 | Q | 36.5 | Very low | 32 | Very low | 194 Ų | 194 | 134.7 Ų | 134.7 | 91% | 0.907 | 82% | 0.821 | S | S | * | * | trans | -177.5 | 141.2 | 144.6 | -104.1 | 163.8 | -7.9 | 0 | 0 | 113.2 | ||||
| 93 | N | 31.3 | Very low | 31.9 | Very low | 156 Ų | 156 | 137.5 Ų | 137.5 | 83% | 0.834 | 82% | 0.818 | S | S | * | * | trans | -55.4 | 149.7 | 168.1 | -47.8 | -53.2 | 0 | 0 | 0 | 109.8 | ||||
| 94 | G | 33.7 | Very low | 32.8 | Very low | 63 Ų | 63 | 137.8 Ų | 137.8 | 65% | 0.649 | 82% | 0.818 | S | S | * | * | 81.9 | 104.2 | 60.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 95 | D | 35.2 | Very low | 34 | Very low | 173 Ų | 173 | 137.2 Ų | 137.2 | 93% | 0.925 | 81% | 0.812 | S | S | * | * | trans | -175 | 112.6 | 157.7 | -82.4 | -32 | 0 | 0 | 0 | 109.7 | ||||
| 96 | D | 35.8 | Very low | 34.6 | Very low | 166 Ų | 166 | 135.9 Ų | 135.9 | 89% | 0.888 | 81% | 0.813 | S | S | * | * | trans | -95.6 | 125.9 | 168.2 | -86.7 | -43.8 | 0 | 0 | 0 | 109.2 | ||||
| 97 | L | 35.4 | Very low | 34.8 | Very low | 180 Ų | 180 | 133 Ų | 133 | 94% | 0.942 | 81% | 0.811 | S | S | * | * | trans | -143.6 | 116.8 | 159.3 | -72.5 | 178.3 | 0 | 0 | 0 | 108.6 | ||||
| 98 | S | 37.8 | Very low | 34.6 | Very low | 132 Ų | 132 | 133.4 Ų | 133.4 | 92% | 0.923 | 82% | 0.816 | S | S | * | * | trans | -117.4 | 128.1 | 171.8 | -163.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 99 | A | 32.2 | Very low | 34.5 | Very low | 99 Ų | 99 | 134.4 Ų | 134.4 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -117.1 | 136 | -175.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 100 | G | 26.5 | Very low | 34.4 | Very low | 86 Ų | 86 | 134.2 Ų | 134.2 | 89% | 0.887 | 83% | 0.825 | S | S | * | * | trans | 78.9 | 133.4 | 137.4 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 101 | G | 28.8 | Very low | 34.5 | Very low | 83 Ų | 83 | 130.2 Ų | 130.2 | 86% | 0.856 | 82% | 0.82 | S | S | * | * | trans | 162.9 | 102.1 | 156.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 102 | D | 30 | Very low | 34.4 | Very low | 141 Ų | 141 | 134.6 Ų | 134.6 | 75% | 0.754 | 82% | 0.821 | S | S | * | * | trans | -92.9 | 138 | -174.3 | -89 | -36.5 | 0 | 0 | 0 | 115.7 | ||||
| 103 | F | 28.8 | Very low | 34.6 | Very low | 182 Ų | 182 | 131 Ų | 131 | 80% | 0.798 | 81% | 0.814 | S | S | * | * | trans | 56.7 | 170.2 | 135.3 | -71.6 | -65 | 0 | 0 | 0 | 124.3 | ||||
| 104 | P | 48.2 | Very low | 34.4 | Very low | 112 Ų | 112 | 131.2 Ų | 131.2 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | cis | -140.3 | -142.5 | -25.9 | 32.5 | -6.2 | 0 | 0 | 0 | 114.4 | ||||
| 105 | P | 55.2 | Low | 34.2 | Very low | 112 Ų | 112 | 133.4 Ų | 133.4 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | -123.3 | -164 | -88 | 44.8 | -25.3 | 0 | 0 | 0 | 113.8 | |||||
| 106 | P | 41.5 | Very low | 33.7 | Very low | 121 Ų | 121 | 133.2 Ų | 133.2 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | -156.2 | 154.5 | 73.5 | 38.9 | -15.4 | 0 | 0 | 0 | 120.7 | |||||
| 107 | A | 33 | Very low | 33.2 | Very low | 91 Ų | 91 | 132.2 Ų | 132.2 | 75% | 0.752 | 81% | 0.809 | S | S | * | * | trans | 31.3 | 126.6 | 137.7 | 0 | 0 | 0 | 0 | 0 | 128 | ||||
| 108 | E | 27.9 | Very low | 32.8 | Very low | 201 Ų | 201 | 131.6 Ų | 131.6 | 94% | 0.939 | 81% | 0.806 | S | S | * | * | 65.5 | 132.2 | 126.6 | -61.4 | -160.1 | 174.3 | 0 | 0 | 126.1 | |||||
| 109 | G | 27.7 | Very low | 32.3 | Very low | 81 Ų | 81 | 130.2 Ų | 130.2 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | 149.4 | 95 | 145.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 110 | E | 29.6 | Very low | 32.2 | Very low | 179 Ų | 179 | 134.2 Ų | 134.2 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | trans | -77.8 | 170.2 | 155.8 | -86.4 | -99.4 | 152 | 0 | 0 | 110.5 | ||||
| 111 | P | 38.1 | Very low | 32.4 | Very low | 117 Ų | 117 | 134.9 Ų | 134.9 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | cis | -148.3 | 179.1 | 32.4 | 38.9 | -14.9 | 0 | 0 | 0 | 119.4 | ||||
| 112 | K | 28.9 | Very low | 32.1 | Very low | 158 Ų | 158 | 137.1 Ų | 137.1 | 69% | 0.687 | 79% | 0.794 | S | S | * | * | trans | -52.8 | 164.5 | 171.3 | -143 | -172.6 | 177.7 | -177.5 | 0 | 116.8 | ||||
| 113 | P | 41.1 | Very low | 32.1 | Very low | 119 Ų | 119 | 138.4 Ų | 138.4 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | -146.3 | 140.8 | 89.6 | 34.5 | -15.3 | 0 | 0 | 0 | 115.5 | |||||
| 114 | E | 27.5 | Very low | 31.9 | Very low | 159 Ų | 159 | 136.9 Ų | 136.9 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | 39.7 | 118 | 113.3 | -72.1 | -162.8 | 174.5 | 0 | 0 | 119.4 | |||||
| 115 | A | 28.1 | Very low | 31.4 | Very low | 109 Ų | 109 | 136.5 Ų | 136.5 | 90% | 0.901 | 80% | 0.796 | S | S | * | * | 171.1 | 155.7 | 109.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 116 | E | 25.6 | Very low | 30.1 | Very low | 170 Ų | 170 | 140.6 Ų | 140.6 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | trans | -80.4 | 153.7 | -168.4 | -100.5 | 178.5 | 139.4 | 0 | 0 | 116.6 | ||||
| 117 | L | 25 | Very low | 29.8 | Very low | 144 Ų | 144 | 139.7 Ų | 139.7 | 75% | 0.754 | 81% | 0.808 | S | S | * | * | trans | 83 | 140.6 | 135.7 | -71.2 | 171.4 | 0 | 0 | 0 | 123.2 | ||||
| 118 | L | 26.5 | Very low | 29.6 | Very low | 168 Ų | 168 | 140.8 Ų | 140.8 | 88% | 0.88 | 81% | 0.81 | S | S | * | * | trans | 91.6 | 96.4 | 158.1 | -65.2 | 170.3 | 0 | 0 | 0 | 119.1 | ||||
| 119 | A | 28.8 | Very low | 29.9 | Very low | 102 Ų | 102 | 140 Ų | 140 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | trans | -110.7 | 115.3 | 154.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 120 | Q | 28.8 | Very low | 30 | Very low | 183 Ų | 183 | 144.1 Ų | 144.1 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -142.2 | 152.2 | 159.5 | -94.7 | -104.3 | -41.6 | 0 | 0 | 109.1 | ||||
| 121 | P | 31.3 | Very low | 30 | Very low | 100 Ų | 100 | 139.4 Ų | 139.4 | 65% | 0.649 | 80% | 0.804 | S | S | * | * | trans | -100.4 | 149.1 | -145.8 | 0.9 | 21.1 | 0 | 0 | 0 | 113.6 | ||||
| 122 | C | 22.6 | Very low | 29.6 | Very low | 131 Ų | 131 | 138.4 Ų | 138.4 | 89% | 0.885 | 81% | 0.806 | S | S | * | * | trans | -102.5 | 115.7 | 168.4 | -63.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 123 | H | 29.5 | Very low | 30.4 | Very low | 167 Ų | 167 | 137.2 Ų | 137.2 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | trans | -116.1 | 140.8 | 157.6 | -83.4 | -68.1 | 0 | 0 | 0 | 108.6 | ||||
| 124 | D | 25.9 | Very low | 29.9 | Very low | 151 Ų | 151 | 136.2 Ų | 136.2 | 81% | 0.807 | 82% | 0.816 | S | S | * | * | trans | 156.5 | 99.8 | 141.4 | -75.3 | -19.5 | 0 | 0 | 0 | 107.2 | ||||
| 125 | S | 36.6 | Very low | 30.2 | Very low | 104 Ų | 104 | 133.5 Ų | 133.5 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | 55.8 | 104.2 | 76 | -58.9 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 126 | E | 29.1 | Very low | 30.2 | Very low | 197 Ų | 197 | 132.5 Ų | 132.5 | 92% | 0.921 | 82% | 0.821 | S | S | * | * | trans | -154.9 | 116.6 | 140.1 | -77.9 | -148.4 | 143.2 | 0 | 0 | 110.6 | ||||
| 127 | A | 33.7 | Very low | 30.5 | Very low | 103 Ų | 103 | 128.2 Ų | 128.2 | 85% | 0.851 | 82% | 0.823 | S | S | * | * | trans | -141.1 | 104.7 | 157.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 128 | S | 29.3 | Very low | 30.9 | Very low | 114 Ų | 114 | 130.2 Ų | 130.2 | 80% | 0.797 | 83% | 0.829 | S | S | * | * | trans | -43.1 | 152.6 | 165.5 | -56.1 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 129 | K | 33.8 | Very low | 31.2 | Very low | 185 Ų | 185 | 130.5 Ų | 130.5 | 80% | 0.804 | 83% | 0.825 | S | S | * | * | 152.7 | 109.4 | 111.2 | -159.7 | 169.9 | -169.1 | -175.9 | 0 | 112.5 | |||||
| 130 | L | 30.5 | Very low | 31.6 | Very low | 167 Ų | 167 | 133.4 Ų | 133.4 | 87% | 0.874 | 82% | 0.822 | S | S | * | * | trans | 36.9 | 133 | 136.6 | -55.3 | 172.4 | 0 | 0 | 0 | 121 | ||||
| 131 | G | 28.5 | Very low | 31.6 | Very low | 79 Ų | 79 | 136.5 Ų | 136.5 | 81% | 0.814 | 83% | 0.825 | S | S | * | * | trans | 146 | 93.6 | 137.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 132 | A | 30.9 | Very low | 31.7 | Very low | 97 Ų | 97 | 134.5 Ų | 134.5 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | trans | -87.1 | 157.1 | 150.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 133 | P | 45.1 | Very low | 32.9 | Very low | 133 Ų | 133 | 137.5 Ų | 137.5 | 86% | 0.864 | 82% | 0.824 | S | S | * | * | -142.9 | 166.3 | 93.3 | 34 | -16.7 | 0 | 0 | 0 | 115.5 | |||||
| 134 | A | 30.9 | Very low | 33.2 | Very low | 97 Ų | 97 | 138.1 Ų | 138.1 | 80% | 0.802 | 83% | 0.827 | S | S | * | * | trans | -79.5 | 156.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 135 | A | 33.1 | Very low | 34.3 | Very low | 103 Ų | 103 | 140 Ų | 140 | 85% | 0.851 | 83% | 0.831 | S | S | * | * | 158.5 | 127.8 | 117.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 136 | G | 29.1 | Very low | 34.6 | Very low | 87 Ų | 87 | 146 Ų | 146 | 90% | 0.897 | 84% | 0.838 | S | S | * | * | trans | 94.6 | 125.3 | 134.1 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 137 | G | 30.7 | Very low | 35.5 | Very low | 81 Ų | 81 | 144.8 Ų | 144.8 | 84% | 0.835 | 83% | 0.832 | S | S | * | * | trans | 123.8 | 103.2 | 146.7 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 138 | E | 33.9 | Very low | 36.3 | Very low | 186 Ų | 186 | 148.3 Ų | 148.3 | 87% | 0.869 | 84% | 0.836 | S | S | * | * | trans | -63.2 | 149.4 | 165.8 | -64.2 | 157.7 | 150.7 | 0 | 0 | 109.7 | ||||
| 139 | E | 33.3 | Very low | 37.1 | Very low | 174 Ų | 174 | 145.9 Ų | 145.9 | 81% | 0.813 | 83% | 0.829 | S | S | * | * | cis | -171.9 | 140.9 | 49.4 | -126.6 | 160.4 | -153.6 | 0 | 0 | 110.2 | ||||
| 140 | E | 37.7 | Very low | 38.5 | Very low | 163 Ų | 163 | 146.9 Ų | 146.9 | 76% | 0.762 | 83% | 0.833 | S | S | * | * | trans | 57 | 95.6 | 142.6 | -149.9 | 170.8 | -162.4 | 0 | 0 | 123 | ||||
| 141 | W | 27.6 | Very low | 40 | Very low | 247 Ų | 247 | 148 Ų | 148 | 94% | 0.936 | 83% | 0.831 | S | S | * | * | -179.1 | 130.4 | 112.6 | -112 | 79.4 | 0 | 0 | 0 | 110.5 | |||||
| 142 | G | 34.2 | Very low | 41.8 | Very low | 58 Ų | 58 | 153.7 Ų | 153.7 | 60% | 0.598 | 83% | 0.833 | S | S | * | * | S | Bend | trans | 91.6 | 130.9 | 156.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||
| 143 | Q | 47 | Very low | 43.4 | Very low | 194 Ų | 194 | 157.4 Ų | 157.4 | 91% | 0.907 | 83% | 0.834 | S | S | * | * | trans | 58.9 | 76.1 | 149.5 | -55 | -177.8 | 32.4 | 0 | 0 | 116.6 | ||||
| 144 | Q | 35.7 | Very low | 44.4 | Very low | 181 Ų | 181 | 162.1 Ų | 162.1 | 85% | 0.846 | 83% | 0.834 | S | S | * | * | trans | -98.3 | 98.4 | 154.1 | -78.9 | -178.8 | 4.8 | 0 | 0 | 110 | R146 | Q144-R146 VanDerWaalsContact C-N 3.26Å; Q144-R146 PolarHBondContact O-N 3.5Å | ||
| 145 | Q | 49.4 | Very low | 46.2 | Very low | 189 Ų | 189 | 168.6 Ų | 168.6 | 88% | 0.883 | 84% | 0.838 | S | S | * | * | trans | -37.9 | 95.3 | 142.4 | -85.2 | 171.3 | -73 | 0 | 0 | 109.5 | Q147 | Q145-Q147 VanDerWaalsContact C-N 3.26Å; Q145-Q147 PolarHBondContact O-N 3.19Å | ||
| 146 | R | 44.1 | Very low | 47.9 | Very low | 230 Ų | 230 | 174.6 Ų | 174.6 | 87% | 0.868 | 84% | 0.839 | S | S | * | * | trans | -78.2 | 90.8 | 158.6 | -100.4 | -178.8 | 178.5 | -102.3 | 0.7 | 107.5 | Q144 | Q144-R146 VanDerWaalsContact C-N 3.26Å; Q144-R146 PolarHBondContact O-N 3.5Å | ||
| 147 | Q | 47.1 | Very low | 49.6 | Very low | 172 Ų | 172 | 175.7 Ų | 175.7 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | 26.5 | 108.2 | 136.2 | -62.5 | -66.9 | -2.2 | 0 | 0 | 114.9 | Q145 G149 | Q145-Q147 VanDerWaalsContact C-N 3.26Å; Q145-Q147 PolarHBondContact O-N 3.19Å; Q147-G149 PolarHBondContact O-N 2.95Å | ||
| 148 | L | 50.7 | Low | 51.3 | Low | 178 Ų | 178 | 176.5 Ų | 176.5 | 93% | 0.932 | 82% | 0.823 | S | S | * | * | trans | -57.5 | 81.6 | 171.1 | -69.6 | 164.5 | 0 | 0 | 0 | 110.7 | K150 | L148-K150 PolarHBondContact O-N 3.32Š| ||
| 149 | G | 46.8 | Very low | 52.8 | Low | 63 Ų | 63 | 177.2 Ų | 177.2 | 65% | 0.649 | 82% | 0.823 | S | S | * | * | trans | -62.4 | 116.6 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | Q147 K151 | Q147-G149 PolarHBondContact O-N 2.95Å; G149-K151 PolarHBondContact O-N 2.93Å | ||
| 150 | K | 61.6 | Low | 54.3 | Low | 206 Ų | 206 | 177.6 Ų | 177.6 | 90% | 0.896 | 82% | 0.822 | S | S | * | * | trans | -50.2 | 98 | 174.9 | -65.2 | -179.5 | 179.7 | -179.7 | 0 | 109 | L148 K152 | L148-K150 PolarHBondContact O-N 3.32Å; K150-K152 VanDerWaalsContact C-N 3.33Å; K150-K152 PolarHBondContact O-N 3.24Å | ||
| 151 | K | 63.8 | Low | 55.7 | Low | 191 Ų | 191 | 178.5 Ų | 178.5 | 83% | 0.83 | 82% | 0.823 | S | S | * | * | trans | -67.5 | 94.5 | 177.5 | -122.3 | 175.4 | 178.9 | 172.1 | 0 | 106.6 | G149 H153 | G149-K151 PolarHBondContact O-N 2.93Å; K151-H153 PolarHBondContact O-N 3.12Å | ||
| 152 | K | 65.9 | Low | 57.9 | Low | 198 Ų | 198 | 174.4 Ų | 174.4 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | trans | -59.2 | 111.7 | 169.2 | -68.7 | -170.3 | 177.7 | -174.8 | 0 | 107 | K150 R154 | K150-K152 VanDerWaalsContact C-N 3.33Å; K150-K152 PolarHBondContact O-N 3.24Å; K152-R154 VanDerWaalsContact C-N 3.27Å; K152-R154 PolarHBondContact O-N 3.01Å | ||
| 153 | H | 64.1 | Low | 59.3 | Low | 175 Ų | 175 | 179.9 Ų | 179.9 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -64.5 | 88.5 | 172.7 | -90.8 | -127.6 | 0 | 0 | 0 | 108.8 | K151 R155 | K151-H153 PolarHBondContact O-N 3.12Å; H153-R155 VanDerWaalsContact C-N 3.25Å; H153-R155 PolarHBondContact O-N 2.97Å | ||
| 154 | R | 66.1 | Low | 60.8 | Low | 231 Ų | 231 | 177.7 Ų | 177.7 | 87% | 0.872 | 80% | 0.801 | S | S | * | * | trans | -74.2 | 88.2 | 165.1 | -169.7 | 173.3 | 172.9 | 163.8 | -1.8 | 107.2 | K152 R156 | K152-R154 VanDerWaalsContact C-N 3.27Å; K152-R154 PolarHBondContact O-N 3.01Å; R154-R156 PolarHBondContact O-N 2.95Å | ||
| 155 | R | 68.1 | Low | 63.1 | Low | 233 Ų | 233 | 174.5 Ų | 174.5 | 88% | 0.879 | 78% | 0.784 | S | S | * | * | trans | -51.7 | 109.9 | 166.4 | -75.6 | -176.9 | 167.5 | -171.8 | -2.9 | 107 | H153 | H153-R155 VanDerWaalsContact C-N 3.25Å; H153-R155 PolarHBondContact O-N 2.97Å | ||
| 156 | R | 70 | Confident | 65 | Low | 230 Ų | 230 | 166.9 Ų | 166.9 | 87% | 0.868 | 75% | 0.751 | S | S | * | * | trans | -62.1 | 130.1 | 170.8 | -70.8 | -173.9 | 170.7 | -143.1 | -1.1 | 106.9 | R154 S158 | R154-R156 PolarHBondContact O-N 2.95Å; R156-S158 PolarHBondContact O-N 3Å | ||
| 157 | P | 63.1 | Low | 66.9 | Low | 109 Ų | 109 | 160 Ų | 160 | 71% | 0.708 | 73% | 0.726 | S | S | * | * | trans | -61.8 | 112.2 | 171.7 | 21.4 | -27.2 | 0 | 0 | 0 | 107.7 | K159 | P157-K159 PolarHBondContact O-N 3.31Š| ||
| 158 | S | 67.3 | Low | 68.7 | Low | 98 Ų | 98 | 160.6 Ų | 160.6 | 69% | 0.685 | 72% | 0.722 | S | S | * | * | trans | -63.2 | 103.7 | 176.5 | 178.7 | 0 | 0 | 0 | 0 | 107.9 | R156 K160 | R156-S158 PolarHBondContact O-N 3Å; S158-K160 PolarHBondContact O-N 3.08Å; S158-K160 PolarHBondContact OG-O 3.35Å | ||
| 159 | K | 65.5 | Low | 70.5 | Confident | 201 Ų | 201 | 158.7 Ų | 158.7 | 87% | 0.874 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -70.5 | 9.2 | -176.8 | -72.2 | -161.7 | 177.1 | -173.4 | 0 | 114.3 | P157 | P157-K159 PolarHBondContact O-N 3.31Š|
| 160 | K | 65 | Low | 72.5 | Confident | 182 Ų | 182 | 157.2 Ų | 157.2 | 79% | 0.791 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -132.1 | 94.3 | 172.2 | -62.8 | -177.2 | -178.2 | -178 | 0 | 107 | S158 R162 | S158-K160 PolarHBondContact O-N 3.08Å; S158-K160 PolarHBondContact OG-O 3.35Å; K160-R162 PolarHBondContact O-N 3.22Å |
| 161 | K | 67.1 | Low | 73.8 | Confident | 182 Ų | 182 | 151 Ų | 151 | 79% | 0.791 | 66% | 0.663 | S | S | * | * | trans | -58.3 | 112.8 | 165.8 | -70.8 | -170.6 | 176.1 | -175 | 0 | 105.7 | H163 | K161-H163 PolarHBondContact O-CE1 3.5Å; K161-H163 PolarHBondContact O-N 3.01Å; K161-H163 PolarHBondContact O-ND1 2.9Å | ||
| 162 | R | 72.4 | Confident | 74.9 | Confident | 162 Ų | 162 | 151 Ų | 151 | 61% | 0.611 | 66% | 0.658 | S | S | * | * | trans | -58.3 | 115.6 | 174.7 | -166.5 | 174.7 | 178.3 | -126.8 | -3.2 | 105.7 | K160 W164 | K160-R162 PolarHBondContact O-N 3.22Å; R162-W164 PolarHBondContact O-N 3.32Å | ||
| 163 | H | 65.1 | Low | 75.9 | Confident | 173 Ų | 173 | 147.8 Ų | 147.8 | 80% | 0.801 | 65% | 0.646 | S | S | * | * | trans | -72.4 | 83.6 | 179.7 | -62.7 | 8.3 | 0 | 0 | 0 | 106.7 | K161 K165 | K161-H163 PolarHBondContact O-CE1 3.5Å; K161-H163 PolarHBondContact O-N 3.01Å; K161-H163 PolarHBondContact O-ND1 2.9Å; H163-K165 VanDerWaalsContact C-N 3.31Å; H163-K165 PolarHBondContact O-N 3.49Å | ||
| 164 | W | 77.4 | Confident | 77.2 | Confident | 147 Ų | 147 | 142.8 Ų | 142.8 | 56% | 0.557 | 62% | 0.623 | S | S | * | * | trans | -73.8 | 97.1 | 170.2 | -166.6 | 70.3 | 0 | 0 | 0 | 105.9 | R162 P166 Y167 F178 | R162-W164 PolarHBondContact O-N 3.32Å; W164-P166 HydrophobicContact CZ3-CB 4.17Å; W164-Y167 HydrophobicContact CH2-CD2 4.21Å; W164-Y167 AromaticContact CZ2-CD2 3.73Å; W164-Y167 HydrophobicContact CZ2-CD2 3.73Å; W164-Y167 AromaticContact CZ2-CE2 3.91Å; W164-Y167 HydrophobicContact CZ2-CE2 3.91Å; W164-F178 AromaticContact NE1-CZ 3.76Å | ||
| 165 | K | 85.4 | Confident | 78.2 | Confident | 114 Ų | 114 | 136.3 Ų | 136.3 | 50% | 0.496 | 60% | 0.601 | S | S | . | * | trans | -65 | 126.2 | 166.2 | -71.3 | -177.4 | -177.7 | -177.5 | 0 | 106.1 | H163 L170 E174 | H163-K165 VanDerWaalsContact C-N 3.31Å; H163-K165 PolarHBondContact O-N 3.49Å; K165-L170 HydrophobicContact CB-CD1 3.3Å; K165-L170 HydrophobicContact CD-CD1 3.92Å; K165-L170 HydrophobicContact CG-CD1 4.3Å; K165-E174 IonicContact NZ-OE1 3.37Å; K165-E174 PolarHBondContact NZ-OE1 3.02Å | ||
| 166 | P | 88.5 | Confident | 79.1 | Confident | 30 Ų | 30 | 130.3 Ų | 130.3 | 20% | 0.195 | 58% | 0.581 | C | S | . | * | trans | -67.6 | 148.9 | 180 | 28.8 | -34.6 | 0 | 0 | 0 | 110.7 | W164 Y168 K169 | W164-P166 HydrophobicContact CZ3-CB 4.17Å; P166-Y168 HydrophobicContact CB-CD1 3.8Å; P166-Y168 HydrophobicContact CB-CE1 3.34Å; P166-Y168 HydrophobicContact CG-CD1 4.18Å; P166-Y168 HydrophobicContact CG-CE1 3.5Å; P166-Y168 HydrophobicContact CG-CE2 4.3Å; P166-Y168 PolarHBondContact O-N 3.48Å; P166-Y168 VanDerWaalsContact O-N 3.12Å; P166-K169 HydrophobicContact CG-CB 4.42Å; P166-K169 HydrophobicContact CG-CD 4.03Å; P166-K169 HydrophobicContact CG-CG 4.06Å; P166-K169 PolarHBondContact O-N 3.17Å | ||
| 167 | Y | 83.6 | Confident | 80.1 | Confident | 86 Ų | 86 | 125.7 Ų | 125.7 | 34% | 0.337 | 57% | 0.567 | S | S | . | * | G | 310 helix | trans | -52.7 | -36.2 | -171.1 | -92.1 | -89.9 | 0 | 0 | 0 | 114.3 | W164 K169 L170 K175 F178 D179 | W164-Y167 HydrophobicContact CH2-CD2 4.21Å; W164-Y167 AromaticContact CZ2-CD2 3.73Å; W164-Y167 HydrophobicContact CZ2-CD2 3.73Å; W164-Y167 AromaticContact CZ2-CE2 3.91Å; W164-Y167 HydrophobicContact CZ2-CE2 3.91Å; Y167-K169 VanDerWaalsContact C-N 3.26Å; Y167-K169 PolarHBondContact O-N 2.92Å; Y167-L170 PolarHBondContact O-N 2.85Å; Y167-K175 HydrophobicContact CD1-CD 4.12Å; Y167-K175 HydrophobicContact CD1-CG 3.9Å; Y167-K175 HydrophobicContact CE1-CG 3.95Å; Y167-F178 HydrophobicContact CE1-CD1 4.28Å; Y167-F178 HydrophobicContact CE2-CD1 4.44Å; Y167-F178 HydrophobicContact CE2-CE1 4.12Å; Y167-F178 AromaticContact CZ-CD1 3.75Å; Y167-F178 AromaticContact CZ-CE1 3.8Å; Y167-F178 WeakPolarHBondContact OH-CD1 3.23Å; Y167-F178 WeakPolarHBondContact OH-CE1 3.31Å; Y167-D179 WeakPolarHBondContact CE1-OD1 3.49Å; Y167-D179 PolarHBondContact OH-OD1 3.26Å |
| 168 | Y | 85.6 | Confident | 81.2 | Confident | 183 Ų | 183 | 122.6 Ų | 122.6 | 72% | 0.718 | 54% | 0.543 | S | S | * | . | G | 310 helix | trans | -70.5 | -16.8 | -179.9 | 65.1 | -93.6 | 0 | 0 | 0 | 114.3 | P166 | P166-Y168 HydrophobicContact CB-CD1 3.8Å; P166-Y168 HydrophobicContact CB-CE1 3.34Å; P166-Y168 HydrophobicContact CG-CD1 4.18Å; P166-Y168 HydrophobicContact CG-CE1 3.5Å; P166-Y168 HydrophobicContact CG-CE2 4.3Å; P166-Y168 PolarHBondContact O-N 3.48Å; P166-Y168 VanDerWaalsContact O-N 3.12Å |
| 169 | K | 88 | Confident | 82.2 | Confident | 139 Ų | 139 | 120.6 Ų | 120.6 | 60% | 0.604 | 52% | 0.524 | S | S | * | . | G | 310 helix | trans | -99.3 | -2.5 | 174.5 | -58.2 | -170.9 | -177.5 | -176.8 | 0 | 112.8 | P166 Y167 | P166-K169 HydrophobicContact CG-CB 4.42Å; P166-K169 HydrophobicContact CG-CD 4.03Å; P166-K169 HydrophobicContact CG-CG 4.06Å; P166-K169 PolarHBondContact O-N 3.17Å; Y167-K169 VanDerWaalsContact C-N 3.26Å; Y167-K169 PolarHBondContact O-N 2.92Å |
| 170 | L | 88 | Confident | 83.3 | Confident | 31 Ų | 31 | 115.9 Ų | 115.9 | 16% | 0.162 | 51% | 0.505 | C | S | . | . | S | Bend | trans | -81 | 137.7 | 174 | -104.9 | 66.9 | 0 | 0 | 0 | 108.9 | K165 Y167 E174 F178 | K165-L170 HydrophobicContact CB-CD1 3.3Å; K165-L170 HydrophobicContact CD-CD1 3.92Å; K165-L170 HydrophobicContact CG-CD1 4.3Å; Y167-L170 PolarHBondContact O-N 2.85Å; L170-E174 HydrophobicContact CB-CB 4.17Å; L170-E174 HydrophobicContact CD2-CB 3.89Å; L170-E174 HydrophobicContact CG-CB 3.68Å; L170-F178 HydrophobicContact CD2-CB 4.24Å |
| 171 | T | 89.6 | Confident | 84.6 | Confident | 77 Ų | 77 | 112.8 Ų | 112.8 | 47% | 0.472 | 49% | 0.492 | S | S | . | . | trans | -63.1 | 155.2 | 163.9 | 55.7 | 0 | 0 | 0 | 0 | 109.7 | E173 E174 K175 | T171-E173 PolarHBondContact O-N 2.88Å; T171-E174 PolarHBondContact N-OE2 2.98Å; T171-E174 PolarHBondContact O-N 3.17Å; T171-E174 WeakPolarHBondContact OG1-CB 3.45Å; T171-E174 WeakPolarHBondContact OG1-CG 3.38Å; T171-E174 PolarHBondContact OG1-N 3.24Å; T171-E174 PolarHBondContact OG1-OE2 2.97Å; T171-K175 PolarHBondContact O-N 2.98Å | ||
| 172 | W | 86.3 | Confident | 85.5 | Confident | 190 Ų | 190 | 107.3 Ų | 107.3 | 72% | 0.72 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -55.9 | -39.3 | 179.4 | -171.4 | 91.3 | 0 | 0 | 0 | 112.2 | K175 K176 | W172-K175 WeakPolarHBondContact O-CB 3.34Å; W172-K175 PolarHBondContact O-N 3.26Å; W172-K176 HydrophobicContact CH2-CD 4.02Å; W172-K176 HydrophobicContact CZ3-CD 4Å; W172-K176 WeakPolarHBondContact O-CB 3.23Å; W172-K176 PolarHBondContact O-N 2.88Å |
| 173 | E | 88.1 | Confident | 86.2 | Confident | 130 Ų | 130 | 102.9 Ų | 102.9 | 61% | 0.607 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -64.1 | -40.8 | 174.5 | -64.2 | -176 | -172.4 | 0 | 0 | 113.2 | T171 K175 K177 | T171-E173 PolarHBondContact O-N 2.88Å; E173-K175 VanDerWaalsContact C-N 3.34Å; E173-K177 WeakPolarHBondContact O-CB 3.49Å; E173-K177 WeakPolarHBondContact O-CG 3.49Å; E173-K177 PolarHBondContact O-N 3.01Å; E173-K177 VanDerWaalsContact O-N 3.08Å |
| 174 | E | 89.8 | Confident | 87.4 | Confident | 70 Ų | 70 | 100.4 Ų | 100.4 | 33% | 0.327 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -67.4 | -37.1 | 174.8 | -74 | 171.7 | 127.3 | 0 | 0 | 111.2 | K165 L170 T171 F178 | K165-E174 IonicContact NZ-OE1 3.37Å; K165-E174 PolarHBondContact NZ-OE1 3.02Å; L170-E174 HydrophobicContact CB-CB 4.17Å; L170-E174 HydrophobicContact CD2-CB 3.89Å; L170-E174 HydrophobicContact CG-CB 3.68Å; T171-E174 PolarHBondContact N-OE2 2.98Å; T171-E174 PolarHBondContact O-N 3.17Å; T171-E174 WeakPolarHBondContact OG1-CB 3.45Å; T171-E174 WeakPolarHBondContact OG1-CG 3.38Å; T171-E174 PolarHBondContact OG1-N 3.24Å; T171-E174 PolarHBondContact OG1-OE2 2.97Å; E174-F178 VanDerWaalsContact O-CB 3.28Å; E174-F178 WeakPolarHBondContact O-CB 3.39Å; E174-F178 PolarHBondContact O-N 3.45Å |
| 175 | K | 89.1 | Confident | 88 | Confident | 96 Ų | 96 | 98.6 Ų | 98.6 | 42% | 0.417 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.2 | -52.1 | 176.3 | -177.7 | 177 | 179.1 | -173.3 | 0 | 110.4 | Y167 T171 W172 E173 K177 F178 D179 | Y167-K175 HydrophobicContact CD1-CD 4.12Å; Y167-K175 HydrophobicContact CD1-CG 3.9Å; Y167-K175 HydrophobicContact CE1-CG 3.95Å; T171-K175 PolarHBondContact O-N 2.98Å; W172-K175 WeakPolarHBondContact O-CB 3.34Å; W172-K175 PolarHBondContact O-N 3.26Å; E173-K175 VanDerWaalsContact C-N 3.34Å; K175-K177 PolarHBondContact O-N 3.17Å; K175-F178 WeakPolarHBondContact O-CB 3.45Å; K175-F178 PolarHBondContact O-N 2.83Å; K175-F178 VanDerWaalsContact O-N 3.08Å; K175-D179 PolarHBondContact O-N 3.08Å |
| 176 | K | 86.7 | Confident | 88.2 | Confident | 107 Ų | 107 | 94.9 Ų | 94.9 | 47% | 0.465 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -55.5 | -48.7 | 176.8 | -174.3 | 173.9 | -178.8 | 173 | 0 | 112.1 | W172 F178 D179 E180 | W172-K176 HydrophobicContact CH2-CD 4.02Å; W172-K176 HydrophobicContact CZ3-CD 4Å; W172-K176 WeakPolarHBondContact O-CB 3.23Å; W172-K176 PolarHBondContact O-N 2.88Å; K176-F178 VanDerWaalsContact C-N 3.32Å; K176-F178 PolarHBondContact O-N 3.31Å; K176-D179 PolarHBondContact O-N 3.04Å; K176-E180 WeakPolarHBondContact CE-OE1 3.41Å; K176-E180 WeakPolarHBondContact O-CB 3.34Å; K176-E180 WeakPolarHBondContact O-CG 3.49Å; K176-E180 PolarHBondContact O-N 3.44Å |
| 177 | K | 89.3 | Confident | 88.1 | Confident | 132 Ų | 132 | 96.6 Ų | 96.6 | 57% | 0.574 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.3 | -34.8 | 177.2 | -74.2 | 172.6 | -179.7 | 163.7 | 0 | 112.9 | E173 K175 K181 | E173-K177 WeakPolarHBondContact O-CB 3.49Å; E173-K177 WeakPolarHBondContact O-CG 3.49Å; E173-K177 PolarHBondContact O-N 3.01Å; E173-K177 VanDerWaalsContact O-N 3.08Å; K175-K177 PolarHBondContact O-N 3.17Å; K177-K181 WeakPolarHBondContact O-CB 3.49Å; K177-K181 PolarHBondContact O-N 2.71Å; K177-K181 VanDerWaalsContact O-N 3.1Å |
| 178 | F | 88.1 | Confident | 88.5 | Confident | 45 Ų | 45 | 101.2 Ų | 101.2 | 20% | 0.197 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -68.1 | -45.4 | 177.4 | -177.1 | -88.9 | 0 | 0 | 0 | 111.1 | W164 Y167 L170 E174 K175 K176 K181 Q182 | W164-F178 AromaticContact NE1-CZ 3.76Å; Y167-F178 HydrophobicContact CE1-CD1 4.28Å; Y167-F178 HydrophobicContact CE2-CD1 4.44Å; Y167-F178 HydrophobicContact CE2-CE1 4.12Å; Y167-F178 AromaticContact CZ-CD1 3.75Å; Y167-F178 AromaticContact CZ-CE1 3.8Å; Y167-F178 WeakPolarHBondContact OH-CD1 3.23Å; Y167-F178 WeakPolarHBondContact OH-CE1 3.31Å; L170-F178 HydrophobicContact CD2-CB 4.24Å; E174-F178 VanDerWaalsContact O-CB 3.28Å; E174-F178 WeakPolarHBondContact O-CB 3.39Å; E174-F178 PolarHBondContact O-N 3.45Å; K175-F178 WeakPolarHBondContact O-CB 3.45Å; K175-F178 PolarHBondContact O-N 2.83Å; K175-F178 VanDerWaalsContact O-N 3.08Å; K176-F178 VanDerWaalsContact C-N 3.32Å; K176-F178 PolarHBondContact O-N 3.31Å; F178-K181 PolarHBondContact O-N 3.26Å; F178-Q182 HydrophobicContact CD1-CG 4.08Å; F178-Q182 HydrophobicContact CE1-CG 3.68Å; F178-Q182 HydrophobicContact CZ-CG 4.19Å; F178-Q182 WeakPolarHBondContact O-CG 3.41Å; F178-Q182 PolarHBondContact O-N 3.36Å |
| 179 | D | 87.2 | Confident | 88.8 | Confident | 55 Ų | 55 | 97.1 Ų | 97.1 | 29% | 0.294 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.7 | -47 | 179.2 | -66.7 | -21.3 | 0 | 0 | 0 | 110.7 | Y167 K175 K176 K181 Q182 S183 | Y167-D179 WeakPolarHBondContact CE1-OD1 3.49Å; Y167-D179 PolarHBondContact OH-OD1 3.26Å; K175-D179 PolarHBondContact O-N 3.08Å; K176-D179 PolarHBondContact O-N 3.04Å; D179-K181 PolarHBondContact O-N 3.44Å; D179-Q182 CarbonylContact O-C 3.53Å; D179-Q182 WeakPolarHBondContact O-CA 3.47Å; D179-Q182 PolarHBondContact O-N 3.13Å; D179-S183 PolarHBondContact O-N 2.85Å; D179-S183 PolarHBondContact O-OG 3.21Å; D179-S183 VanDerWaalsContact O-OG 3.13Å |
| 180 | E | 89.4 | Confident | 88.8 | Confident | 102 Ų | 102 | 92.7 Ų | 92.7 | 48% | 0.477 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -53.2 | -42.8 | 171.5 | -81.6 | 175.6 | -168.4 | 0 | 0 | 111.8 | K176 S183 L184 | K176-E180 WeakPolarHBondContact CE-OE1 3.41Å; K176-E180 WeakPolarHBondContact O-CB 3.34Å; K176-E180 WeakPolarHBondContact O-CG 3.49Å; K176-E180 PolarHBondContact O-N 3.44Å; E180-S183 PolarHBondContact O-N 2.97Å; E180-L184 WeakPolarHBondContact O-CB 3.27Å; E180-L184 VanDerWaalsContact O-CG 3.31Å; E180-L184 WeakPolarHBondContact O-CG 3.25Å; E180-L184 PolarHBondContact O-N 2.85Å |
| 181 | K | 90.9 | Very high | 88.9 | Confident | 117 Ų | 117 | 94 Ų | 94 | 51% | 0.509 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -69.5 | -32.2 | 178.2 | -172 | 171.5 | -172.1 | 164.7 | 0 | 112.8 | K177 F178 D179 R185 | K177-K181 WeakPolarHBondContact O-CB 3.49Å; K177-K181 PolarHBondContact O-N 2.71Å; K177-K181 VanDerWaalsContact O-N 3.1Å; F178-K181 PolarHBondContact O-N 3.26Å; D179-K181 PolarHBondContact O-N 3.44Å; K181-R185 WeakPolarHBondContact O-CD 3.29Å; K181-R185 VanDerWaalsContact O-CG 3.23Å; K181-R185 WeakPolarHBondContact O-CG 3.42Å; K181-R185 PolarHBondContact O-N 3.4Å |
| 182 | Q | 86.9 | Confident | 89.1 | Confident | 67 Ų | 67 | 95 Ų | 95 | 31% | 0.313 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -70.3 | -43.9 | 171.5 | -68.5 | -40.4 | -66.2 | 0 | 0 | 110.6 | F178 D179 L184 R185 A186 | F178-Q182 HydrophobicContact CD1-CG 4.08Å; F178-Q182 HydrophobicContact CE1-CG 3.68Å; F178-Q182 HydrophobicContact CZ-CG 4.19Å; F178-Q182 WeakPolarHBondContact O-CG 3.41Å; F178-Q182 PolarHBondContact O-N 3.36Å; D179-Q182 CarbonylContact O-C 3.53Å; D179-Q182 WeakPolarHBondContact O-CA 3.47Å; D179-Q182 PolarHBondContact O-N 3.13Å; Q182-L184 PolarHBondContact O-N 3.36Å; Q182-R185 WeakPolarHBondContact O-CB 3.3Å; Q182-R185 PolarHBondContact O-N 3.31Å; Q182-R185 VanDerWaalsContact O-N 3.08Å; Q182-A186 PolarHBondContact O-N 2.8Å |
| 183 | S | 86.9 | Confident | 89.2 | Confident | 70 Ų | 70 | 89.1 Ų | 89.1 | 49% | 0.49 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -58.1 | -46.9 | 176.4 | -60.4 | 0 | 0 | 0 | 0 | 111.3 | D179 E180 R185 A186 S187 | D179-S183 PolarHBondContact O-N 2.85Å; D179-S183 PolarHBondContact O-OG 3.21Å; D179-S183 VanDerWaalsContact O-OG 3.13Å; E180-S183 PolarHBondContact O-N 2.97Å; S183-R185 VanDerWaalsContact C-N 3.29Å; S183-R185 PolarHBondContact O-N 2.76Å; S183-A186 WeakPolarHBondContact O-CB 3.41Å; S183-A186 PolarHBondContact O-N 2.97Å; S183-A186 VanDerWaalsContact O-N 3.17Å; S183-S187 WeakPolarHBondContact O-CB 3.36Å; S183-S187 PolarHBondContact O-N 3.46Å; S183-S187 PolarHBondContact O-OG 3.05Å |
| 184 | L | 90.3 | Very high | 89.3 | Confident | 120 Ų | 120 | 88.5 Ų | 88.5 | 63% | 0.628 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -61.1 | -36.2 | 175.3 | -73.1 | 171.8 | 0 | 0 | 0 | 113.2 | E180 Q182 R188 | E180-L184 WeakPolarHBondContact O-CB 3.27Å; E180-L184 VanDerWaalsContact O-CG 3.31Å; E180-L184 WeakPolarHBondContact O-CG 3.25Å; E180-L184 PolarHBondContact O-N 2.85Å; Q182-L184 PolarHBondContact O-N 3.36Å; L184-R188 WeakPolarHBondContact O-CB 3.21Å; L184-R188 PolarHBondContact O-N 2.94Å; L184-R188 VanDerWaalsContact O-N 3.08Å |
| 185 | R | 91.3 | Very high | 89.3 | Confident | 110 Ų | 110 | 89.5 Ų | 89.5 | 42% | 0.415 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -69 | -43.3 | 175.1 | -75 | 170.3 | 177.6 | -140.1 | -6.6 | 111.3 | K181 Q182 S183 R188 I189 | K181-R185 WeakPolarHBondContact O-CD 3.29Å; K181-R185 VanDerWaalsContact O-CG 3.23Å; K181-R185 WeakPolarHBondContact O-CG 3.42Å; K181-R185 PolarHBondContact O-N 3.4Å; Q182-R185 WeakPolarHBondContact O-CB 3.3Å; Q182-R185 PolarHBondContact O-N 3.31Å; Q182-R185 VanDerWaalsContact O-N 3.08Å; S183-R185 VanDerWaalsContact C-N 3.29Å; S183-R185 PolarHBondContact O-N 2.76Å; R185-R188 PolarHBondContact O-N 2.87Å; R185-I189 WeakPolarHBondContact O-CG1 3.4Å; R185-I189 PolarHBondContact O-N 3.14Å |
| 186 | A | 88 | Confident | 89.5 | Confident | 36 Ų | 36 | 91.1 Ų | 91.1 | 30% | 0.298 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.8 | -47.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q182 S183 R188 I189 R190 Y203 | Q182-A186 PolarHBondContact O-N 2.8Å; S183-A186 WeakPolarHBondContact O-CB 3.41Å; S183-A186 PolarHBondContact O-N 2.97Å; S183-A186 VanDerWaalsContact O-N 3.17Å; A186-R188 VanDerWaalsContact C-N 3.31Å; A186-R188 PolarHBondContact O-N 3.42Å; A186-I189 PolarHBondContact O-N 2.9Å; A186-R190 WeakPolarHBondContact O-CB 3.49Å; A186-R190 PolarHBondContact O-N 3.33Å; A186-Y203 PolarHBondContact O-OH 2.91Å |
| 187 | S | 87.3 | Confident | 89.7 | Confident | 65 Ų | 65 | 89.1 Ų | 89.1 | 46% | 0.455 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.3 | -40.8 | 175.8 | -59.9 | 0 | 0 | 0 | 0 | 112.3 | S183 R190 A191 | S183-S187 WeakPolarHBondContact O-CB 3.36Å; S183-S187 PolarHBondContact O-N 3.46Å; S183-S187 PolarHBondContact O-OG 3.05Å; S187-R190 PolarHBondContact O-N 3.38Å; S187-A191 WeakPolarHBondContact O-CB 3.26Å; S187-A191 PolarHBondContact O-N 2.87Å |
| 188 | R | 92.9 | Very high | 89.7 | Confident | 183 Ų | 183 | 87.6 Ų | 87.6 | 69% | 0.691 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -64.6 | -47 | 176.1 | -173.7 | -176.4 | -57.5 | 176.5 | -0.1 | 112.5 | L184 R185 A186 R190 A191 E192 | L184-R188 WeakPolarHBondContact O-CB 3.21Å; L184-R188 PolarHBondContact O-N 2.94Å; L184-R188 VanDerWaalsContact O-N 3.08Å; R185-R188 PolarHBondContact O-N 2.87Å; A186-R188 VanDerWaalsContact C-N 3.31Å; A186-R188 PolarHBondContact O-N 3.42Å; R188-R190 VanDerWaalsContact C-N 3.31Å; R188-R190 PolarHBondContact O-N 2.89Å; R188-A191 PolarHBondContact O-N 2.93Å; R188-E192 PolarHBondContact O-N 2.75Å |
| 189 | I | 90.3 | Very high | 89.4 | Confident | 98 Ų | 98 | 91.6 Ų | 91.6 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 178.7 | -69.7 | 169.1 | 0 | 0 | 0 | 109.7 | R185 A186 A191 E192 M193 | R185-I189 WeakPolarHBondContact O-CG1 3.4Å; R185-I189 PolarHBondContact O-N 3.14Å; A186-I189 PolarHBondContact O-N 2.9Å; I189-A191 PolarHBondContact O-N 3.19Å; I189-E192 WeakPolarHBondContact O-CB 3.42Å; I189-E192 PolarHBondContact O-N 2.79Å; I189-M193 HydrophobicContact CG2-CG 4.4Å; I189-M193 WeakPolarHBondContact O-CG 3.48Å; I189-M193 PolarHBondContact O-N 2.79Å |
| 190 | R | 88 | Confident | 89.3 | Confident | 45 Ų | 45 | 90.7 Ų | 90.7 | 17% | 0.17 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -58.5 | -48.5 | 175.5 | 169.4 | 172.6 | -68.4 | -132.5 | 1.6 | 111.7 | A186 S187 R188 E192 M193 F194 V200 A201 Y203 | A186-R190 WeakPolarHBondContact O-CB 3.49Å; A186-R190 PolarHBondContact O-N 3.33Å; S187-R190 PolarHBondContact O-N 3.38Å; R188-R190 VanDerWaalsContact C-N 3.31Å; R188-R190 PolarHBondContact O-N 2.89Å; R190-E192 VanDerWaalsContact C-N 3.27Å; R190-E192 PolarHBondContact O-N 2.75Å; R190-M193 PolarHBondContact O-N 3.1Å; R190-F194 HydrophobicContact CG-CD2 3.47Å; R190-F194 VanDerWaalsContact CG-CD2 3.47Å; R190-F194 HydrophobicContact CG-CE2 3.38Å; R190-F194 VanDerWaalsContact O-CD2 3.23Å; R190-F194 WeakPolarHBondContact O-CD2 3.18Å; R190-F194 PolarHBondContact O-N 3.36Å; R190-V200 HydrophobicContact CB-CG1 4.47Å; R190-V200 HydrophobicContact CG-CB 4.42Å; R190-V200 HydrophobicContact CG-CG1 3.95Å; R190-V200 HydrophobicContact CG-CG2 4.44Å; R190-V200 VanDerWaalsContact CZ-CG1 3.48Å; R190-A201 VanDerWaalsContact CZ-O 3.32Å; R190-A201 PolarHBondContact NH1-O 3.05Å; R190-A201 PolarHBondContact NH2-O 3.43Å; R190-Y203 WeakPolarHBondContact CB-OH 3.46Å; R190-Y203 PolarHBondContact NE-OH 3.05Å |
| 191 | A | 90.7 | Very high | 88.8 | Confident | 59 Ų | 59 | 89.2 Ų | 89.2 | 49% | 0.488 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.1 | -38.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S187 R188 I189 F194 A195 | S187-A191 WeakPolarHBondContact O-CB 3.26Å; S187-A191 PolarHBondContact O-N 2.87Å; R188-A191 PolarHBondContact O-N 2.93Å; I189-A191 PolarHBondContact O-N 3.19Å; A191-F194 PolarHBondContact O-N 2.9Å; A191-A195 WeakPolarHBondContact O-CB 3.42Å; A191-A195 PolarHBondContact O-N 2.93Å |
| 192 | E | 93.7 | Very high | 88.2 | Confident | 98 Ų | 98 | 89.4 Ų | 89.4 | 46% | 0.458 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.1 | -42.4 | 174.9 | -173 | -177.3 | 167.6 | 0 | 0 | 112.3 | R188 I189 R190 A195 K196 | R188-E192 PolarHBondContact O-N 2.75Å; I189-E192 WeakPolarHBondContact O-CB 3.42Å; I189-E192 PolarHBondContact O-N 2.79Å; R190-E192 VanDerWaalsContact C-N 3.27Å; R190-E192 PolarHBondContact O-N 2.75Å; E192-A195 PolarHBondContact O-N 3.34Å; E192-K196 HydrophobicContact CG-CD 4.4Å; E192-K196 WeakPolarHBondContact O-CG 3.22Å; E192-K196 PolarHBondContact O-N 2.75Å; E192-K196 WeakPolarHBondContact OE1-CE 3.41Å; E192-K196 IonicContact OE1-NZ 2.86Å; E192-K196 PolarHBondContact OE1-NZ 3.04Å |
| 193 | M | 89.3 | Confident | 87.6 | Confident | 67 Ų | 67 | 91.4 Ų | 91.4 | 33% | 0.33 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.2 | -43.1 | 175.5 | -66 | -51.9 | -156.7 | 0 | 0 | 111.5 | I189 R190 A195 K196 G197 Q198 V200 | I189-M193 HydrophobicContact CG2-CG 4.4Å; I189-M193 WeakPolarHBondContact O-CG 3.48Å; I189-M193 PolarHBondContact O-N 2.79Å; R190-M193 PolarHBondContact O-N 3.1Å; M193-A195 PolarHBondContact O-N 3.29Å; M193-K196 CarbonylContact O-C 3.56Å; M193-K196 PolarHBondContact O-N 2.98Å; M193-G197 PolarHBondContact O-N 3.35Å; M193-Q198 HydrophobicContact CB-CB 4.34Å; M193-Q198 PolarHBondContact O-N 2.81Å; M193-Q198 PolarHBondContact SD-OE1 3.29Å; M193-V200 HydrophobicContact CB-CG2 3.41Å; M193-V200 VanDerWaalsContact CB-CG2 3.41Å; M193-V200 HydrophobicContact CG-CG2 4.31Å |
| 194 | F | 89.1 | Confident | 86.9 | Confident | 116 Ų | 116 | 95.5 Ų | 95.5 | 51% | 0.509 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 172.9 | -88.1 | -69.4 | 0 | 0 | 0 | 111.8 | R190 A191 K196 G197 V200 | R190-F194 HydrophobicContact CG-CD2 3.47Å; R190-F194 VanDerWaalsContact CG-CD2 3.47Å; R190-F194 HydrophobicContact CG-CE2 3.38Å; R190-F194 VanDerWaalsContact O-CD2 3.23Å; R190-F194 WeakPolarHBondContact O-CD2 3.18Å; R190-F194 PolarHBondContact O-N 3.36Å; A191-F194 PolarHBondContact O-N 2.9Å; F194-K196 PolarHBondContact O-N 3.13Å; F194-G197 WeakPolarHBondContact O-CA 3.33Å; F194-G197 PolarHBondContact O-N 3.22Å; F194-V200 HydrophobicContact CD2-CB 4.28Å; F194-V200 HydrophobicContact CD2-CG2 4.08Å; F194-V200 HydrophobicContact CE2-CB 3.78Å; F194-V200 HydrophobicContact CE2-CG1 4.39Å; F194-V200 HydrophobicContact CE2-CG2 4.1Å; F194-V200 HydrophobicContact CG-CG2 4.49Å; F194-V200 HydrophobicContact CZ-CB 3.96Å |
| 195 | A | 91.1 | Very high | 86.1 | Confident | 91 Ų | 91 | 93.7 Ų | 93.7 | 75% | 0.752 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.5 | -30.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A191 E192 M193 G197 | A191-A195 WeakPolarHBondContact O-CB 3.42Å; A191-A195 PolarHBondContact O-N 2.93Å; E192-A195 PolarHBondContact O-N 3.34Å; M193-A195 PolarHBondContact O-N 3.29Å; A195-G197 PolarHBondContact O-N 2.93Å |
| 196 | K | 93.4 | Very high | 85.3 | Confident | 130 Ų | 130 | 92.3 Ų | 92.3 | 57% | 0.565 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | 2.8 | 173 | -69.4 | 174.7 | -173.8 | 171.6 | 0 | 113.4 | E192 M193 F194 Q198 | E192-K196 HydrophobicContact CG-CD 4.4Å; E192-K196 WeakPolarHBondContact O-CG 3.22Å; E192-K196 PolarHBondContact O-N 2.75Å; E192-K196 WeakPolarHBondContact OE1-CE 3.41Å; E192-K196 IonicContact OE1-NZ 2.86Å; E192-K196 PolarHBondContact OE1-NZ 3.04Å; M193-K196 CarbonylContact O-C 3.56Å; M193-K196 PolarHBondContact O-N 2.98Å; F194-K196 PolarHBondContact O-N 3.13Å; K196-Q198 HydrophobicContact CB-CG 4.46Å; K196-Q198 PolarHBondContact O-N 3Å |
| 197 | G | 90.6 | Very high | 84.5 | Confident | 65 Ų | 65 | 94.9 Ų | 94.9 | 67% | 0.67 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.5 | 15.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | M193 F194 A195 | M193-G197 PolarHBondContact O-N 3.35Å; F194-G197 WeakPolarHBondContact O-CA 3.33Å; F194-G197 PolarHBondContact O-N 3.22Å; A195-G197 PolarHBondContact O-N 2.93Å |
| 198 | Q | 88.9 | Confident | 83.6 | Confident | 101 Ų | 101 | 99 Ų | 99 | 47% | 0.472 | 54% | 0.542 | S | S | . | . | P | Polyproline II helix | trans | -80.8 | 128.9 | 176 | -68.3 | -168.4 | -32.8 | 0 | 0 | 109.4 | M193 K196 V200 | M193-Q198 HydrophobicContact CB-CB 4.34Å; M193-Q198 PolarHBondContact O-N 2.81Å; M193-Q198 PolarHBondContact SD-OE1 3.29Å; K196-Q198 HydrophobicContact CB-CG 4.46Å; K196-Q198 PolarHBondContact O-N 3Å; Q198-V200 PolarHBondContact O-N 3.36Å; Q198-V200 VanDerWaalsContact O-N 3.17Å |
| 199 | P | 82.3 | Confident | 82.8 | Confident | 129 Ų | 129 | 95 Ų | 95 | 84% | 0.838 | 53% | 0.534 | S | S | * | . | P | Polyproline II helix | trans | -65.9 | 118.1 | 178 | 26.3 | -32.4 | 0 | 0 | 0 | 109.3 | ||
| 200 | V | 84.4 | Confident | 81.9 | Confident | 36 Ų | 36 | 95.4 Ų | 95.4 | 22% | 0.218 | 54% | 0.535 | C | S | . | . | P | Polyproline II helix | trans | -99.7 | 121.6 | 174.6 | -176.8 | 0 | 0 | 0 | 0 | 108.5 | R190 M193 F194 Q198 | R190-V200 HydrophobicContact CB-CG1 4.47Å; R190-V200 HydrophobicContact CG-CB 4.42Å; R190-V200 HydrophobicContact CG-CG1 3.95Å; R190-V200 HydrophobicContact CG-CG2 4.44Å; R190-V200 VanDerWaalsContact CZ-CG1 3.48Å; M193-V200 HydrophobicContact CB-CG2 3.41Å; M193-V200 VanDerWaalsContact CB-CG2 3.41Å; M193-V200 HydrophobicContact CG-CG2 4.31Å; F194-V200 HydrophobicContact CD2-CB 4.28Å; F194-V200 HydrophobicContact CD2-CG2 4.08Å; F194-V200 HydrophobicContact CE2-CB 3.78Å; F194-V200 HydrophobicContact CE2-CG1 4.39Å; F194-V200 HydrophobicContact CE2-CG2 4.1Å; F194-V200 HydrophobicContact CG-CG2 4.49Å; F194-V200 HydrophobicContact CZ-CB 3.96Å; Q198-V200 PolarHBondContact O-N 3.36Å; Q198-V200 VanDerWaalsContact O-N 3.17Å |
| 201 | A | 78.8 | Confident | 81.2 | Confident | 71 Ų | 71 | 97.1 Ų | 97.1 | 59% | 0.587 | 55% | 0.547 | S | S | * | . | P | Polyproline II helix | trans | -57 | 146.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | R190 Y203 | R190-A201 VanDerWaalsContact CZ-O 3.32Å; R190-A201 PolarHBondContact NH1-O 3.05Å; R190-A201 PolarHBondContact NH2-O 3.43Å; A201-Y203 PolarHBondContact O-N 3.22Å |
| 202 | P | 79.3 | Confident | 80.3 | Confident | 120 Ų | 120 | 98.9 Ų | 98.9 | 78% | 0.779 | 55% | 0.548 | S | S | * | . | P | Polyproline II helix | trans | -52.2 | 139 | 169.2 | -22.2 | 32.8 | 0 | 0 | 0 | 110.2 | N204 | P202-N204 PolarHBondContact O-N 3.27Š|
| 203 | Y | 73.6 | Confident | 78.9 | Confident | 109 Ų | 109 | 101.2 Ų | 101.2 | 43% | 0.427 | 56% | 0.559 | S | S | . | * | P | Polyproline II helix | trans | -71.5 | 122.3 | 172.5 | -71 | -60.1 | 0 | 0 | 0 | 107.6 | A186 R190 A201 T205 | A186-Y203 PolarHBondContact O-OH 2.91Å; R190-Y203 WeakPolarHBondContact CB-OH 3.46Å; R190-Y203 PolarHBondContact NE-OH 3.05Å; A201-Y203 PolarHBondContact O-N 3.22Å; Y203-T205 PolarHBondContact O-N 3.45Å |
| 204 | N | 72.3 | Confident | 77.6 | Confident | 156 Ų | 156 | 104.9 Ų | 104.9 | 83% | 0.834 | 58% | 0.58 | S | S | * | * | trans | -72.8 | 87.7 | 158.2 | -176.6 | -20.6 | 0 | 0 | 0 | 106.8 | P202 | P202-N204 PolarHBondContact O-N 3.27Š| ||
| 205 | T | 73.7 | Confident | 76.3 | Confident | 83 Ų | 83 | 107.9 Ų | 107.9 | 51% | 0.509 | 60% | 0.595 | S | S | . | * | trans | -96.4 | 136.5 | 166.2 | 53.6 | 0 | 0 | 0 | 0 | 107.9 | Y203 Q207 | Y203-T205 PolarHBondContact O-N 3.45Å; T205-Q207 PolarHBondContact O-N 3.06Å | ||
| 206 | T | 72.9 | Confident | 74.8 | Confident | 80 Ų | 80 | 111.5 Ų | 111.5 | 49% | 0.491 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.7 | 23.5 | 167.4 | 54.3 | 0 | 0 | 0 | 0 | 112.4 | F208 L209 M210 | T206-F208 VanDerWaalsContact C-N 3.27Å; T206-F208 PolarHBondContact O-N 3.09Å; T206-L209 HydrophobicContact CG2-CD1 4.09Å; T206-L209 WeakPolarHBondContact O-CB 3.38Å; T206-L209 PolarHBondContact O-N 2.9Å; T206-M210 WeakPolarHBondContact O-CG 3.22Å; T206-M210 PolarHBondContact O-N 2.95Å |
| 207 | Q | 72.3 | Confident | 73.1 | Confident | 91 Ų | 91 | 114.1 Ų | 114.1 | 43% | 0.425 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -60.7 | -36.9 | -174.8 | -168 | 67 | 49.7 | 0 | 0 | 111.6 | T205 L209 M210 D211 | T205-Q207 PolarHBondContact O-N 3.06Å; Q207-L209 VanDerWaalsContact C-N 3.35Å; Q207-L209 PolarHBondContact O-N 3.04Å; Q207-M210 PolarHBondContact O-N 3.01Å; Q207-D211 PolarHBondContact NE2-OD1 3.44Å; Q207-D211 WeakPolarHBondContact O-CB 3.41Å; Q207-D211 VanDerWaalsContact O-CG 3.29Å; Q207-D211 PolarHBondContact O-N 2.86Å |
| 208 | F | 68.9 | Low | 71.7 | Confident | 152 Ų | 152 | 115.5 Ų | 115.5 | 67% | 0.667 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -59.2 | -44.8 | 173 | 175.3 | -99.8 | 0 | 0 | 0 | 112 | T206 D212 | T206-F208 VanDerWaalsContact C-N 3.27Å; T206-F208 PolarHBondContact O-N 3.09Å; F208-D212 WeakPolarHBondContact CZ-OD2 3.44Å; F208-D212 PolarHBondContact O-N 3.42Å |
| 209 | L | 75.3 | Confident | 70.2 | Confident | 98 Ų | 98 | 115.9 Ų | 115.9 | 51% | 0.513 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65 | -41.8 | 176.1 | -67.9 | 160.2 | 0 | 0 | 0 | 111 | T206 Q207 H213 | T206-L209 HydrophobicContact CG2-CD1 4.09Å; T206-L209 WeakPolarHBondContact O-CB 3.38Å; T206-L209 PolarHBondContact O-N 2.9Å; Q207-L209 VanDerWaalsContact C-N 3.35Å; Q207-L209 PolarHBondContact O-N 3.04Å; L209-H213 PolarHBondContact O-CD2 3.38Å; L209-H213 PolarHBondContact O-N 3.28Å; L209-H213 PolarHBondContact O-NE2 2.87Å |
| 210 | M | 71.6 | Confident | 69.1 | Low | 107 Ų | 107 | 117.7 Ų | 117.7 | 53% | 0.527 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -71.6 | -38.7 | -178.1 | -66.2 | 179.3 | 66.8 | 0 | 0 | 113.5 | T206 Q207 D212 H213 | T206-M210 WeakPolarHBondContact O-CG 3.22Å; T206-M210 PolarHBondContact O-N 2.95Å; Q207-M210 PolarHBondContact O-N 3.01Å; M210-D212 VanDerWaalsContact C-N 3.33Å; M210-H213 PolarHBondContact O-N 3.22Å |
| 211 | D | 72.6 | Confident | 67.5 | Low | 81 Ų | 81 | 123.9 Ų | 123.9 | 43% | 0.433 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -68 | -33.4 | 180 | -75.2 | -9.9 | 0 | 0 | 0 | 111.6 | Q207 H213 | Q207-D211 PolarHBondContact NE2-OD1 3.44Å; Q207-D211 WeakPolarHBondContact O-CB 3.41Å; Q207-D211 VanDerWaalsContact O-CG 3.29Å; Q207-D211 PolarHBondContact O-N 2.86Å; D211-H213 VanDerWaalsContact C-N 3.32Å |
| 212 | D | 72.8 | Confident | 66.2 | Low | 96 Ų | 96 | 126.9 Ų | 126.9 | 51% | 0.513 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -70.1 | -28.1 | 176 | -75.8 | -3.3 | 0 | 0 | 0 | 112.3 | F208 M210 | F208-D212 WeakPolarHBondContact CZ-OD2 3.44Å; F208-D212 PolarHBondContact O-N 3.42Å; M210-D212 VanDerWaalsContact C-N 3.33Å |
| 213 | H | 63.7 | Low | 64.8 | Low | 146 Ų | 146 | 124.4 Ų | 124.4 | 68% | 0.676 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -80.4 | -14.2 | 179.4 | -69 | -52.7 | 0 | 0 | 0 | 114.4 | L209 M210 D211 | L209-H213 PolarHBondContact O-CD2 3.38Å; L209-H213 PolarHBondContact O-N 3.28Å; L209-H213 PolarHBondContact O-NE2 2.87Å; M210-H213 PolarHBondContact O-N 3.22Å; D211-H213 VanDerWaalsContact C-N 3.32Å |
| 214 | D | 61.4 | Low | 63.5 | Low | 145 Ų | 145 | 127.1 Ų | 127.1 | 78% | 0.775 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -9 | 180 | -78.6 | -19.6 | 0 | 0 | 0 | 113.1 | ||
| 215 | Q | 62.1 | Low | 61.9 | Low | 178 Ų | 178 | 130.7 Ų | 130.7 | 83% | 0.832 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -98 | -17.1 | -173.1 | -67.2 | -142.5 | -13 | 0 | 0 | 116.1 | ||
| 216 | E | 60.5 | Low | 60.2 | Low | 167 Ų | 167 | 132 Ų | 132 | 78% | 0.78 | 68% | 0.684 | S | S | * | * | trans | -158.7 | 73.7 | -170.7 | -154.9 | 170.5 | -167.7 | 0 | 0 | 114.5 | ||||
| 217 | E | 57.6 | Low | 58.7 | Low | 186 Ų | 186 | 138.3 Ų | 138.3 | 87% | 0.869 | 71% | 0.705 | S | S | * | * | trans | -118.6 | 106.1 | 139.5 | -74.6 | -161.8 | 176.8 | 0 | 0 | 108.2 | D219 | E217-D219 PolarHBondContact O-N 3.04Š| ||
| 218 | P | 60.9 | Low | 57.1 | Low | 93 Ų | 93 | 145.4 Ų | 145.4 | 60% | 0.604 | 73% | 0.727 | S | S | * | * | trans | -57.5 | 129.5 | 160.7 | 22.6 | -29.2 | 0 | 0 | 0 | 107.9 | L220 | P218-L220 VanDerWaalsContact C-N 3.25Å; P218-L220 PolarHBondContact O-N 3.36Å | ||
| 219 | D | 58.1 | Low | 55.9 | Low | 109 Ų | 109 | 143 Ų | 143 | 58% | 0.583 | 74% | 0.735 | S | S | * | * | trans | -60.8 | 83.2 | -179.8 | -161.6 | 26.4 | 0 | 0 | 0 | 110.5 | E217 K221 | E217-D219 PolarHBondContact O-N 3.04Å; D219-K221 PolarHBondContact O-N 3.47Å; D219-K221 WeakPolarHBondContact OD1-CD 3.5Å; D219-K221 WeakPolarHBondContact OD1-CE 3.38Å; D219-K221 WeakPolarHBondContact OD1-CG 3.35Å; D219-K221 IonicContact OD1-NZ 2.75Å | ||
| 220 | L | 57.8 | Low | 54 | Low | 168 Ų | 168 | 143 Ų | 143 | 88% | 0.88 | 75% | 0.749 | S | S | * | * | trans | -72.4 | 30.5 | 178.8 | -85.9 | 162.1 | 0 | 0 | 0 | 112.4 | P218 | P218-L220 VanDerWaalsContact C-N 3.25Å; P218-L220 PolarHBondContact O-N 3.36Å | ||
| 221 | K | 51.5 | Low | 52.7 | Low | 166 Ų | 166 | 142 Ų | 142 | 72% | 0.722 | 76% | 0.758 | S | S | * | * | trans | -126.2 | 50 | 174.5 | 45.2 | -176.8 | 171.8 | -172.1 | 0 | 110.8 | D219 | D219-K221 PolarHBondContact O-N 3.47Å; D219-K221 WeakPolarHBondContact OD1-CD 3.5Å; D219-K221 WeakPolarHBondContact OD1-CE 3.38Å; D219-K221 WeakPolarHBondContact OD1-CG 3.35Å; D219-K221 IonicContact OD1-NZ 2.75Å | ||
| 222 | T | 50.8 | Low | 51.3 | Low | 133 Ų | 133 | 147.5 Ų | 147.5 | 82% | 0.816 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -135.4 | 90.2 | 154.5 | -39.7 | 0 | 0 | 0 | 0 | 110.4 | ||
| 223 | G | 51.3 | Low | 49.6 | Very low | 68 Ų | 68 | 148.3 Ų | 148.3 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | S | Bend | trans | 129.3 | 7.3 | 141.6 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||
| 224 | L | 46.3 | Very low | 48.5 | Very low | 167 Ų | 167 | 148.5 Ų | 148.5 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -129 | 31 | -179.1 | -68.7 | 175.9 | 0 | 0 | 0 | 116.8 | S226 | L224-S226 PolarHBondContact O-N 2.91Å; L224-S226 VanDerWaalsContact O-N 3.17Å | ||
| 225 | Y | 37.9 | Very low | 47.5 | Very low | 231 Ų | 231 | 149 Ų | 149 | 91% | 0.906 | 80% | 0.8 | S | S | * | * | trans | -83.5 | 84.1 | 158.8 | -73.7 | -79.8 | 0 | 0 | 0 | 110.2 | K227 | Y225-K227 VanDerWaalsContact C-N 3.31Å; Y225-K227 PolarHBondContact O-N 3.23Å | ||
| 226 | S | 38.5 | Very low | 46.6 | Very low | 111 Ų | 111 | 145.8 Ų | 145.8 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | -68 | 95 | 157 | -75 | 0 | 0 | 0 | 0 | 108.4 | L224 R228 | L224-S226 PolarHBondContact O-N 2.91Å; L224-S226 VanDerWaalsContact O-N 3.17Å; S226-R228 PolarHBondContact O-N 3.04Å | ||
| 227 | K | 41.1 | Very low | 45.8 | Very low | 212 Ų | 212 | 143 Ų | 143 | 92% | 0.922 | 79% | 0.792 | S | S | * | * | trans | -53.4 | 102.9 | 160.7 | -101.8 | 177.8 | 177.7 | 169 | 0 | 108.2 | Y225 | Y225-K227 VanDerWaalsContact C-N 3.31Å; Y225-K227 PolarHBondContact O-N 3.23Å | ||
| 228 | R | 38.8 | Very low | 45 | Very low | 239 Ų | 239 | 141.3 Ų | 141.3 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | trans | -102.7 | 107.6 | 153.5 | -149.5 | 175.3 | -66.8 | 176.7 | 1.7 | 106.7 | S226 A230 | S226-R228 PolarHBondContact O-N 3.04Å; R228-A230 PolarHBondContact O-N 3.38Å | ||
| 229 | A | 42.5 | Very low | 44.2 | Very low | 101 Ų | 101 | 144.4 Ų | 144.4 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | -59.8 | 123.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 230 | A | 36 | Very low | 43.5 | Very low | 98 Ų | 98 | 145.8 Ų | 145.8 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | trans | -151.7 | 118.7 | 151.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | R228 | R228-A230 PolarHBondContact O-N 3.38Š| ||
| 231 | A | 45.1 | Very low | 42.4 | Very low | 87 Ų | 87 | 145.9 Ų | 145.9 | 72% | 0.719 | 80% | 0.801 | S | S | * | * | trans | -49.8 | 149.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 232 | K | 42.3 | Very low | 42 | Very low | 197 Ų | 197 | 146 Ų | 146 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | 178.9 | 143.7 | 100 | -67 | -123.6 | 176.6 | 179.3 | 0 | 111.5 | |||||
| 233 | S | 37.5 | Very low | 41.8 | Very low | 112 Ų | 112 | 147.9 Ų | 147.9 | 78% | 0.783 | 81% | 0.806 | S | S | * | * | trans | 56.7 | 100.1 | 155.5 | 58.6 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 234 | D | 40.5 | Very low | 41.6 | Very low | 150 Ų | 150 | 153.9 Ų | 153.9 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | -33.4 | 127.9 | 127.7 | -168.3 | 43.8 | 0 | 0 | 0 | 114 | |||||
| 235 | D | 41.5 | Very low | 41.3 | Very low | 155 Ų | 155 | 149.5 Ų | 149.5 | 83% | 0.829 | 81% | 0.811 | S | S | * | * | trans | -164.3 | 148.8 | 136.2 | -161.5 | 22.8 | 0 | 0 | 0 | 111.4 | ||||
| 236 | T | 43.2 | Very low | 41.3 | Very low | 111 Ų | 111 | 141.9 Ų | 141.9 | 68% | 0.681 | 80% | 0.803 | S | S | * | * | trans | -108.1 | 130.2 | -159.6 | -64 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 237 | S | 42.6 | Very low | 41.7 | Very low | 110 Ų | 110 | 145.1 Ų | 145.1 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -168.4 | 127.9 | 144.6 | 85.1 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 238 | D | 41.3 | Very low | 41.8 | Very low | 149 Ų | 149 | 143.9 Ų | 143.9 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | cis | 54.5 | 83.1 | 37.6 | -144.5 | 73.4 | 0 | 0 | 0 | 113 | ||||
| 239 | D | 43.3 | Very low | 42.3 | Very low | 159 Ų | 159 | 140.4 Ų | 140.4 | 85% | 0.85 | 80% | 0.802 | S | S | * | * | trans | -146.3 | 131.6 | 140.1 | -157.7 | -128.8 | 0 | 0 | 0 | 109.2 | ||||
| 240 | D | 42.9 | Very low | 42.9 | Very low | 138 Ų | 138 | 138.8 Ų | 138.8 | 74% | 0.738 | 80% | 0.796 | S | S | * | * | trans | -78.7 | 159.8 | -177.5 | -110.2 | -30.1 | 0 | 0 | 0 | 111 | ||||
| 241 | F | 36.6 | Very low | 43.4 | Very low | 169 Ų | 169 | 137.6 Ų | 137.6 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | 70.7 | 101.3 | 140.3 | -160.6 | -95.2 | 0 | 0 | 0 | 120.1 | ||||
| 242 | M | 41.3 | Very low | 43.9 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 83% | 0.833 | 80% | 0.797 | S | S | * | * | -157.8 | 103.5 | 125.7 | -90.3 | -52.1 | -168.7 | 0 | 0 | 109.5 | |||||
| 243 | E | 47.5 | Very low | 44.4 | Very low | 173 Ų | 173 | 136.7 Ų | 136.7 | 81% | 0.808 | 79% | 0.794 | S | S | * | * | trans | -88 | 158.1 | 153.2 | 177 | 176.3 | -167.5 | 0 | 0 | 107.7 | ||||
| 244 | E | 46.3 | Very low | 45.3 | Very low | 194 Ų | 194 | 134.1 Ų | 134.1 | 91% | 0.907 | 79% | 0.786 | S | S | * | * | trans | 89.6 | 124.7 | 169.5 | -154.8 | 166.2 | -152.2 | 0 | 0 | 113.6 | ||||
| 245 | G | 40.3 | Very low | 46 | Very low | 74 Ų | 74 | 135.5 Ų | 135.5 | 76% | 0.763 | 79% | 0.789 | S | S | * | * | cis | 162.3 | 147 | 11.2 | 0 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 246 | G | 37.7 | Very low | 46.7 | Very low | 71 Ų | 71 | 130.2 Ų | 130.2 | 73% | 0.732 | 77% | 0.771 | S | S | * | * | trans | 150.1 | 98.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 247 | E | 46.8 | Very low | 47.5 | Very low | 179 Ų | 179 | 127.7 Ų | 127.7 | 84% | 0.836 | 77% | 0.767 | S | S | * | * | trans | -45.2 | 159.7 | 156.6 | 46.3 | -120.5 | 101 | 0 | 0 | 116 | ||||
| 248 | E | 44.7 | Very low | 48.2 | Very low | 186 Ų | 186 | 129.1 Ų | 129.1 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | trans | 90 | 116.4 | 161.3 | -58.1 | -168.8 | 162.5 | 0 | 0 | 119.7 | ||||
| 249 | D | 48.6 | Very low | 49.4 | Very low | 166 Ų | 166 | 123.9 Ų | 123.9 | 89% | 0.888 | 75% | 0.747 | S | S | * | * | trans | 84.6 | 126.8 | 140 | -155.6 | 30.2 | 0 | 0 | 0 | 119.8 | G251 | D249-G251 PolarHBondContact O-N 3.32Š| ||
| 250 | G | 54.9 | Low | 50.6 | Low | 68 Ų | 68 | 119.3 Ų | 119.3 | 70% | 0.701 | 73% | 0.728 | S | S | * | * | trans | 76.5 | 23.3 | 140.5 | 0 | 0 | 0 | 0 | 0 | 119.2 | S252 | G250-S252 PolarHBondContact O-N 2.91Å; G250-S252 VanDerWaalsContact O-N 3.07Å | ||
| 251 | G | 46.1 | Very low | 52.4 | Low | 72 Ų | 72 | 118.8 Ų | 118.8 | 74% | 0.742 | 72% | 0.721 | S | S | * | * | trans | -81.3 | 56.4 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | D249 D253 | D249-G251 PolarHBondContact O-N 3.32Å; G251-D253 PolarHBondContact O-N 2.86Å | ||
| 252 | S | 56.5 | Low | 54.6 | Low | 115 Ų | 115 | 116.6 Ų | 116.6 | 80% | 0.804 | 71% | 0.711 | S | S | * | * | trans | -68.4 | 80.1 | 160 | 169.5 | 0 | 0 | 0 | 0 | 107.7 | G250 G254 | G250-S252 PolarHBondContact O-N 2.91Å; G250-S252 VanDerWaalsContact O-N 3.07Å; S252-G254 PolarHBondContact O-N 3.4Å | ||
| 253 | D | 53.2 | Low | 56.8 | Low | 150 Ų | 150 | 113 Ų | 113 | 80% | 0.802 | 70% | 0.695 | S | S | * | * | trans | -67.8 | 87.3 | 166.1 | -88.7 | -18.6 | 0 | 0 | 0 | 107.8 | G251 M255 | G251-D253 PolarHBondContact O-N 2.86Å; D253-M255 PolarHBondContact O-N 3.45Å | ||
| 254 | G | 56 | Low | 58.9 | Low | 59 Ų | 59 | 111.2 Ų | 111.2 | 61% | 0.608 | 69% | 0.687 | S | S | * | * | trans | -60.9 | 77.4 | 162.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | S252 | S252-G254 PolarHBondContact O-N 3.4Š| ||
| 255 | M | 53.9 | Low | 61.2 | Low | 178 Ų | 178 | 110.9 Ų | 110.9 | 88% | 0.877 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -138 | 82.3 | 163.7 | -72.4 | -60 | 156.8 | 0 | 0 | 108.6 | D253 | D253-M255 PolarHBondContact O-N 3.45Š|
| 256 | G | 58.1 | Low | 63.7 | Low | 44 Ų | 44 | 110.2 Ų | 110.2 | 45% | 0.454 | 66% | 0.656 | S | S | . | * | trans | 139 | 19.2 | 166.1 | 0 | 0 | 0 | 0 | 0 | 118.6 | D258 S260 | G256-D258 PolarHBondContact O-N 2.95Å; G256-S260 WeakPolarHBondContact O-CB 3.28Å; G256-S260 PolarHBondContact O-N 3.38Å; G256-S260 PolarHBondContact O-OG 2.66Å | ||
| 257 | G | 58.5 | Low | 66.6 | Low | 58 Ų | 58 | 114 Ų | 114 | 60% | 0.598 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.1 | -30.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 116 | E261 | G257-E261 WeakPolarHBondContact O-CG 3.43Š|
| 258 | D | 58.8 | Low | 68.9 | Low | 141 Ų | 141 | 108 Ų | 108 | 75% | 0.754 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | -23.6 | -177.3 | -173.2 | 29.2 | 0 | 0 | 0 | 112.8 | G256 | G256-D258 PolarHBondContact O-N 2.95Š|
| 259 | G | 65.6 | Low | 71.4 | Confident | 38 Ų | 38 | 103.3 Ų | 103.3 | 39% | 0.392 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -82 | -29.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113.4 | F262 L263 | G259-F262 PolarHBondContact O-N 3.28Å; G259-L263 WeakPolarHBondContact O-CB 3.39Å; G259-L263 WeakPolarHBondContact O-CD1 3.42Å; G259-L263 PolarHBondContact O-N 2.95Å |
| 260 | S | 69.4 | Low | 73.7 | Confident | 63 Ų | 63 | 99 Ų | 99 | 44% | 0.441 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.3 | -37 | -179.5 | 59 | 0 | 0 | 0 | 0 | 112.4 | G256 L263 Q264 | G256-S260 WeakPolarHBondContact O-CB 3.28Å; G256-S260 PolarHBondContact O-N 3.38Å; G256-S260 PolarHBondContact O-OG 2.66Å; S260-L263 PolarHBondContact O-N 3.47Å; S260-Q264 WeakPolarHBondContact O-CB 3.5Å; S260-Q264 PolarHBondContact O-N 3.41Å |
| 261 | E | 80.7 | Confident | 75.8 | Confident | 127 Ų | 127 | 103 Ų | 103 | 59% | 0.593 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -66.9 | -42.5 | 175.9 | -40.8 | -172.9 | -161.2 | 0 | 0 | 111.3 | G257 Q264 R265 | G257-E261 WeakPolarHBondContact O-CG 3.43Å; E261-Q264 PolarHBondContact O-N 3.15Å; E261-R265 WeakPolarHBondContact O-CB 3.5Å; E261-R265 PolarHBondContact O-N 3.49Å |
| 262 | F | 82.3 | Confident | 78.2 | Confident | 123 Ų | 123 | 105.6 Ų | 105.6 | 54% | 0.539 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -62.4 | -46.7 | 174.5 | 177.8 | -102.1 | 0 | 0 | 0 | 111.1 | G259 R265 D266 | G259-F262 PolarHBondContact O-N 3.28Å; F262-R265 PolarHBondContact O-N 3.36Å; F262-D266 VanDerWaalsContact CE1-OD2 3.28Å; F262-D266 WeakPolarHBondContact CE1-OD2 3.38Å; F262-D266 VanDerWaalsContact CZ-OD2 3.28Å; F262-D266 WeakPolarHBondContact CZ-OD2 3.33Å; F262-D266 WeakPolarHBondContact O-CB 3.5Å; F262-D266 PolarHBondContact O-N 2.92Å |
| 263 | L | 86.9 | Confident | 80.2 | Confident | 94 Ų | 94 | 105 Ų | 105 | 49% | 0.492 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.3 | -44.8 | 175.4 | -94 | 74.8 | 0 | 0 | 0 | 111.8 | G259 S260 R265 D266 F267 | G259-L263 WeakPolarHBondContact O-CB 3.39Å; G259-L263 WeakPolarHBondContact O-CD1 3.42Å; G259-L263 PolarHBondContact O-N 2.95Å; S260-L263 PolarHBondContact O-N 3.47Å; L263-R265 VanDerWaalsContact C-N 3.28Å; L263-R265 PolarHBondContact O-N 3.37Å; L263-D266 PolarHBondContact O-N 3Å; L263-F267 HydrophobicContact CB-CE2 4.41Å; L263-F267 WeakPolarHBondContact O-CD2 3.45Å; L263-F267 PolarHBondContact O-N 2.92Å |
| 264 | Q | 91.8 | Very high | 82.3 | Confident | 135 Ų | 135 | 105.1 Ų | 105.1 | 63% | 0.631 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.7 | -38.8 | 177.8 | -178.8 | 172.5 | -3 | 0 | 0 | 111.1 | S260 E261 F267 S268 | S260-Q264 WeakPolarHBondContact O-CB 3.5Å; S260-Q264 PolarHBondContact O-N 3.41Å; E261-Q264 PolarHBondContact O-N 3.15Å; Q264-F267 PolarHBondContact O-N 3.28Å; Q264-S268 WeakPolarHBondContact O-CB 3.17Å; Q264-S268 PolarHBondContact O-N 3Å; Q264-S268 PolarHBondContact O-OG 3.37Å |
| 265 | R | 94.3 | Very high | 84.3 | Confident | 188 Ų | 188 | 106.5 Ų | 106.5 | 71% | 0.709 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.3 | -45.5 | 174.1 | -171.2 | 176.3 | -178 | 99.9 | 4.9 | 111.2 | E261 F262 L263 F267 S268 E269 | E261-R265 WeakPolarHBondContact O-CB 3.5Å; E261-R265 PolarHBondContact O-N 3.49Å; F262-R265 PolarHBondContact O-N 3.36Å; L263-R265 VanDerWaalsContact C-N 3.28Å; L263-R265 PolarHBondContact O-N 3.37Å; R265-F267 VanDerWaalsContact C-N 3.34Å; R265-F267 PolarHBondContact O-N 3.44Å; R265-S268 PolarHBondContact O-N 3.19Å; R265-E269 VanDerWaalsContact O-CB 3.23Å; R265-E269 WeakPolarHBondContact O-CB 3.5Å; R265-E269 PolarHBondContact O-N 3.02Å |
| 266 | D | 93.9 | Very high | 86.4 | Confident | 59 Ų | 59 | 101.3 Ų | 101.3 | 32% | 0.316 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.7 | -38.8 | 176.6 | -80.1 | 5.8 | 0 | 0 | 0 | 112.1 | F262 L263 T270 | F262-D266 VanDerWaalsContact CE1-OD2 3.28Å; F262-D266 WeakPolarHBondContact CE1-OD2 3.38Å; F262-D266 VanDerWaalsContact CZ-OD2 3.28Å; F262-D266 WeakPolarHBondContact CZ-OD2 3.33Å; F262-D266 WeakPolarHBondContact O-CB 3.5Å; F262-D266 PolarHBondContact O-N 2.92Å; L263-D266 PolarHBondContact O-N 3Å; D266-T270 VanDerWaalsContact O-CB 3.22Å; D266-T270 WeakPolarHBondContact O-CB 3.42Å; D266-T270 PolarHBondContact O-N 3.27Å; D266-T270 PolarHBondContact O-OG1 2.9Å |
| 267 | F | 96.8 | Very high | 88.3 | Confident | 150 Ų | 150 | 104.1 Ų | 104.1 | 66% | 0.658 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.1 | -46.2 | 173.1 | -78.8 | -61.4 | 0 | 0 | 0 | 111.8 | L263 Q264 R265 E269 T270 Y271 | L263-F267 HydrophobicContact CB-CE2 4.41Å; L263-F267 WeakPolarHBondContact O-CD2 3.45Å; L263-F267 PolarHBondContact O-N 2.92Å; Q264-F267 PolarHBondContact O-N 3.28Å; R265-F267 VanDerWaalsContact C-N 3.34Å; R265-F267 PolarHBondContact O-N 3.44Å; F267-E269 VanDerWaalsContact C-N 3.35Å; F267-T270 PolarHBondContact O-N 3.12Å; F267-Y271 WeakPolarHBondContact O-CB 3.45Å; F267-Y271 PolarHBondContact O-N 3.35Å |
| 268 | S | 95.8 | Very high | 90.2 | Very high | 55 Ų | 55 | 103.8 Ų | 103.8 | 39% | 0.385 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 178.3 | -55.7 | 0 | 0 | 0 | 0 | 110.6 | Q264 R265 T270 Y271 E272 | Q264-S268 WeakPolarHBondContact O-CB 3.17Å; Q264-S268 PolarHBondContact O-N 3Å; Q264-S268 PolarHBondContact O-OG 3.37Å; R265-S268 PolarHBondContact O-N 3.19Å; S268-T270 PolarHBondContact O-N 2.94Å; S268-Y271 PolarHBondContact O-N 2.92Å; S268-E272 WeakPolarHBondContact O-CB 3.28Å; S268-E272 WeakPolarHBondContact O-CG 3.4Å; S268-E272 PolarHBondContact O-N 3.05Å |
| 269 | E | 97.3 | Very high | 92.1 | Very high | 87 Ų | 87 | 100.1 Ų | 100.1 | 41% | 0.407 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.2 | -39.9 | 178.6 | -164.8 | -165.2 | -163.7 | 0 | 0 | 111.6 | R265 F267 E272 R273 | R265-E269 VanDerWaalsContact O-CB 3.23Å; R265-E269 WeakPolarHBondContact O-CB 3.5Å; R265-E269 PolarHBondContact O-N 3.02Å; F267-E269 VanDerWaalsContact C-N 3.35Å; E269-E272 PolarHBondContact O-N 3.08Å; E269-R273 VanDerWaalsContact CG-NH1 3.33Å; E269-R273 WeakPolarHBondContact O-CB 3.2Å; E269-R273 WeakPolarHBondContact O-CG 3.47Å; E269-R273 PolarHBondContact O-N 2.86Å; E269-R273 IonicContact OE1-NH1 3.19Å; E269-R273 PolarHBondContact OE1-NH1 3.4Å; E269-R273 IonicContact OE2-CZ 3.09Å; E269-R273 IonicContact OE2-NH1 2.94Å; E269-R273 PolarHBondContact OE2-NH1 3.08Å; E269-R273 IonicContact OE2-NH2 2.9Å; E269-R273 PolarHBondContact OE2-NH2 3.38Å; E269-R273 VanDerWaalsContact OE2-NH2 3.11Å |
| 270 | T | 97.3 | Very high | 93.6 | Very high | 74 Ų | 74 | 105.6 Ų | 105.6 | 45% | 0.454 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.2 | -39.4 | 176 | -57.7 | 0 | 0 | 0 | 0 | 111.6 | D266 F267 S268 R273 Y274 | D266-T270 VanDerWaalsContact O-CB 3.22Å; D266-T270 WeakPolarHBondContact O-CB 3.42Å; D266-T270 PolarHBondContact O-N 3.27Å; D266-T270 PolarHBondContact O-OG1 2.9Å; F267-T270 PolarHBondContact O-N 3.12Å; S268-T270 PolarHBondContact O-N 2.94Å; T270-R273 PolarHBondContact OG1-NH2 2.89Å; T270-Y274 WeakPolarHBondContact O-CB 3.41Å; T270-Y274 PolarHBondContact O-N 2.92Å |
| 271 | Y | 97.9 | Very high | 95 | Very high | 153 Ų | 153 | 109.3 Ų | 109.3 | 60% | 0.6 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.7 | -45.2 | 173.5 | 179.7 | -93.5 | 0 | 0 | 0 | 111.5 | F267 S268 Y274 H275 | F267-Y271 WeakPolarHBondContact O-CB 3.45Å; F267-Y271 PolarHBondContact O-N 3.35Å; S268-Y271 PolarHBondContact O-N 2.92Å; Y271-Y274 PolarHBondContact O-N 2.69Å; Y271-H275 HydrophobicContact CE1-CB 4.4Å; Y271-H275 WeakPolarHBondContact O-CB 3.42Å; Y271-H275 PolarHBondContact O-N 2.86Å |
| 272 | E | 97.6 | Very high | 95.8 | Very high | 126 Ų | 126 | 105.8 Ų | 105.8 | 59% | 0.589 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.8 | -43.5 | 177.3 | -75.1 | 177.4 | -171.8 | 0 | 0 | 111.9 | S268 E269 H275 T276 | S268-E272 WeakPolarHBondContact O-CB 3.28Å; S268-E272 WeakPolarHBondContact O-CG 3.4Å; S268-E272 PolarHBondContact O-N 3.05Å; E269-E272 PolarHBondContact O-N 3.08Å; E272-H275 PolarHBondContact O-N 2.78Å; E272-T276 WeakPolarHBondContact O-CB 3.42Å; E272-T276 VanDerWaalsContact O-CG2 3.31Å; E272-T276 WeakPolarHBondContact O-CG2 3.18Å; E272-T276 PolarHBondContact O-N 3.29Å; E272-T276 PolarHBondContact O-OG1 3.4Å |
| 273 | R | 98 | Very high | 96.6 | Very high | 102 Ų | 102 | 102.6 Ų | 102.6 | 39% | 0.385 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58 | -52.1 | 172.6 | -79.2 | -173.5 | -69.1 | -105.8 | -6.3 | 111.3 | E269 T270 H275 T276 E277 | E269-R273 VanDerWaalsContact CG-NH1 3.33Å; E269-R273 WeakPolarHBondContact O-CB 3.2Å; E269-R273 WeakPolarHBondContact O-CG 3.47Å; E269-R273 PolarHBondContact O-N 2.86Å; E269-R273 IonicContact OE1-NH1 3.19Å; E269-R273 PolarHBondContact OE1-NH1 3.4Å; E269-R273 IonicContact OE2-CZ 3.09Å; E269-R273 IonicContact OE2-NH1 2.94Å; E269-R273 PolarHBondContact OE2-NH1 3.08Å; E269-R273 IonicContact OE2-NH2 2.9Å; E269-R273 PolarHBondContact OE2-NH2 3.38Å; E269-R273 VanDerWaalsContact OE2-NH2 3.11Å; T270-R273 PolarHBondContact OG1-NH2 2.89Å; R273-H275 VanDerWaalsContact C-N 3.32Å; R273-H275 PolarHBondContact O-N 2.98Å; R273-T276 PolarHBondContact O-N 2.86Å; R273-T276 PolarHBondContact O-OG1 3.47Å; R273-E277 WeakPolarHBondContact O-CB 3.41Å; R273-E277 VanDerWaalsContact O-CG 3.29Å; R273-E277 WeakPolarHBondContact O-CG 3.36Å; R273-E277 PolarHBondContact O-N 3.17Å |
| 274 | Y | 98.2 | Very high | 97.1 | Very high | 154 Ų | 154 | 105.9 Ų | 105.9 | 60% | 0.604 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.5 | -41 | 178.9 | 176.6 | -98.7 | 0 | 0 | 0 | 112.4 | T270 Y271 E277 S278 | T270-Y274 WeakPolarHBondContact O-CB 3.41Å; T270-Y274 PolarHBondContact O-N 2.92Å; Y271-Y274 PolarHBondContact O-N 2.69Å; Y274-E277 PolarHBondContact O-N 2.71Å; Y274-S278 WeakPolarHBondContact O-CB 3.32Å; Y274-S278 PolarHBondContact O-N 2.89Å |
| 275 | H | 98 | Very high | 97.4 | Very high | 87 Ų | 87 | 105.2 Ų | 105.2 | 40% | 0.403 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.6 | -44.7 | 179.3 | -175.6 | 59 | 0 | 0 | 0 | 111.1 | Y271 E272 R273 S278 L279 | Y271-H275 HydrophobicContact CE1-CB 4.4Å; Y271-H275 WeakPolarHBondContact O-CB 3.42Å; Y271-H275 PolarHBondContact O-N 2.86Å; E272-H275 PolarHBondContact O-N 2.78Å; R273-H275 VanDerWaalsContact C-N 3.32Å; R273-H275 PolarHBondContact O-N 2.98Å; H275-S278 WeakPolarHBondContact O-CB 3.45Å; H275-S278 PolarHBondContact O-N 2.81Å; H275-L279 VanDerWaalsContact O-CG 3.3Å; H275-L279 WeakPolarHBondContact O-CG 3.22Å; H275-L279 PolarHBondContact O-N 3.37Å |
| 276 | T | 98.1 | Very high | 97.6 | Very high | 69 Ų | 69 | 100.6 Ų | 100.6 | 42% | 0.423 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.4 | -40.5 | 176.3 | 53.7 | 0 | 0 | 0 | 0 | 112.3 | E272 R273 L279 Q280 | E272-T276 WeakPolarHBondContact O-CB 3.42Å; E272-T276 VanDerWaalsContact O-CG2 3.31Å; E272-T276 WeakPolarHBondContact O-CG2 3.18Å; E272-T276 PolarHBondContact O-N 3.29Å; E272-T276 PolarHBondContact O-OG1 3.4Å; R273-T276 PolarHBondContact O-N 2.86Å; R273-T276 PolarHBondContact O-OG1 3.47Å; T276-L279 PolarHBondContact O-N 3.05Å; T276-Q280 WeakPolarHBondContact O-CB 3.18Å; T276-Q280 VanDerWaalsContact O-CG 3.28Å; T276-Q280 WeakPolarHBondContact O-CG 3.37Å; T276-Q280 PolarHBondContact O-N 2.81Å |
| 277 | E | 97.9 | Very high | 97.9 | Very high | 103 Ų | 103 | 101.5 Ų | 101.5 | 48% | 0.481 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.6 | -44 | 172 | -73.8 | 172.9 | -168.9 | 0 | 0 | 111.5 | R273 Y274 L279 Q280 N281 | R273-E277 WeakPolarHBondContact O-CB 3.41Å; R273-E277 VanDerWaalsContact O-CG 3.29Å; R273-E277 WeakPolarHBondContact O-CG 3.36Å; R273-E277 PolarHBondContact O-N 3.17Å; Y274-E277 PolarHBondContact O-N 2.71Å; E277-L279 VanDerWaalsContact C-N 3.32Å; E277-L279 PolarHBondContact O-N 3.5Å; E277-Q280 PolarHBondContact O-N 3.1Å; E277-N281 WeakPolarHBondContact O-CB 3.36Å; E277-N281 VanDerWaalsContact O-CG 3.25Å; E277-N281 PolarHBondContact O-N 3.06Å; E277-N281 PolarHBondContact O-OD1 3.35Å |
| 278 | S | 98 | Very high | 97.9 | Very high | 52 Ų | 52 | 97.7 Ų | 97.7 | 36% | 0.364 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.2 | -43.7 | 175.3 | -171.8 | 0 | 0 | 0 | 0 | 111.6 | Y274 H275 N281 M282 | Y274-S278 WeakPolarHBondContact O-CB 3.32Å; Y274-S278 PolarHBondContact O-N 2.89Å; H275-S278 WeakPolarHBondContact O-CB 3.45Å; H275-S278 PolarHBondContact O-N 2.81Å; S278-N281 PolarHBondContact O-N 2.79Å; S278-M282 WeakPolarHBondContact O-CG 3.31Å; S278-M282 PolarHBondContact O-N 3.35Å |
| 279 | L | 97.9 | Very high | 98.1 | Very high | 64 Ų | 64 | 101.7 Ų | 101.7 | 34% | 0.335 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.5 | -38.7 | 175.8 | -67.4 | 171.6 | 0 | 0 | 0 | 112.1 | H275 T276 E277 N281 M282 L287 | H275-L279 VanDerWaalsContact O-CG 3.3Å; H275-L279 WeakPolarHBondContact O-CG 3.22Å; H275-L279 PolarHBondContact O-N 3.37Å; T276-L279 PolarHBondContact O-N 3.05Å; E277-L279 VanDerWaalsContact C-N 3.32Å; E277-L279 PolarHBondContact O-N 3.5Å; L279-N281 VanDerWaalsContact C-N 3.31Å; L279-M282 HydrophobicContact CD2-CE 3.56Å; L279-M282 PolarHBondContact O-N 3.33Å; L279-L287 HydrophobicContact CD2-CD1 3.81Å |
| 280 | Q | 97.9 | Very high | 98.1 | Very high | 152 Ų | 152 | 102.6 Ų | 102.6 | 71% | 0.71 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -66.7 | -33 | 176.8 | -75.6 | 177.1 | 3.7 | 0 | 0 | 112.6 | T276 E277 M282 | T276-Q280 WeakPolarHBondContact O-CB 3.18Å; T276-Q280 VanDerWaalsContact O-CG 3.28Å; T276-Q280 WeakPolarHBondContact O-CG 3.37Å; T276-Q280 PolarHBondContact O-N 2.81Å; E277-Q280 PolarHBondContact O-N 3.1Å; Q280-M282 VanDerWaalsContact C-N 3.31Å |
| 281 | N | 98.2 | Very high | 98.2 | Very high | 141 Ų | 141 | 105.8 Ų | 105.8 | 75% | 0.754 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -79.2 | -15.4 | 179.8 | -71.8 | 25.2 | 0 | 0 | 0 | 112.9 | E277 S278 L279 | E277-N281 WeakPolarHBondContact O-CB 3.36Å; E277-N281 VanDerWaalsContact O-CG 3.25Å; E277-N281 PolarHBondContact O-N 3.06Å; E277-N281 PolarHBondContact O-OD1 3.35Å; S278-N281 PolarHBondContact O-N 2.79Å; L279-N281 VanDerWaalsContact C-N 3.31Å |
| 282 | M | 97.6 | Very high | 98.2 | Very high | 54 Ų | 54 | 102.4 Ų | 102.4 | 27% | 0.266 | 49% | 0.488 | S | S | . | . | S | Bend | trans | -75.7 | 145.6 | 172.5 | -72.5 | -161.5 | -66.4 | 0 | 0 | 111.7 | S278 L279 Q280 E286 L287 E290 | S278-M282 WeakPolarHBondContact O-CG 3.31Å; S278-M282 PolarHBondContact O-N 3.35Å; L279-M282 HydrophobicContact CD2-CE 3.56Å; L279-M282 PolarHBondContact O-N 3.33Å; Q280-M282 VanDerWaalsContact C-N 3.31Å; M282-E286 HydrophobicContact CB-CB 4.28Å; M282-E286 HydrophobicContact SD-CB 4.31Å; M282-L287 HydrophobicContact CE-CD1 4.03Å; M282-E290 HydrophobicContact CE-CG 4.46Å; M282-E290 HydrophobicContact SD-CG 4.39Å |
| 283 | S | 98.4 | Very high | 98.2 | Very high | 55 Ų | 55 | 102.4 Ų | 102.4 | 39% | 0.385 | 49% | 0.488 | S | S | . | . | trans | -68.6 | 154.9 | 170.9 | 71.6 | 0 | 0 | 0 | 0 | 110.8 | Q285 E286 L287 | S283-Q285 PolarHBondContact O-N 3.12Å; S283-Q285 VanDerWaalsContact O-N 3.08Å; S283-E286 VanDerWaalsContact CB-OE2 3.25Å; S283-E286 WeakPolarHBondContact CB-OE2 3.47Å; S283-E286 PolarHBondContact N-OE2 3.36Å; S283-E286 PolarHBondContact O-N 3.48Å; S283-E286 WeakPolarHBondContact OG-CG 3.3Å; S283-E286 PolarHBondContact OG-N 2.96Å; S283-E286 PolarHBondContact OG-OE2 2.86Å; S283-L287 PolarHBondContact O-N 3.13Å | ||
| 284 | K | 98.5 | Very high | 98.3 | Very high | 163 Ų | 163 | 102.7 Ų | 102.7 | 71% | 0.709 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -52.5 | -35.1 | 175.2 | -177.1 | 177.4 | 179.6 | 179.9 | 0 | 112.6 | I288 | K284-I288 HydrophobicContact CG-CD1 3.98Å; K284-I288 WeakPolarHBondContact O-CD1 3.41Å; K284-I288 WeakPolarHBondContact O-CG1 3.45Å; K284-I288 PolarHBondContact O-N 3.42Å; K284-I288 VanDerWaalsContact O-N 3.09Å |
| 285 | Q | 98.7 | Very high | 98.3 | Very high | 122 Ų | 122 | 99.8 Ų | 99.8 | 57% | 0.57 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -71.6 | -39.5 | -179.7 | -66.2 | -60.8 | -39.7 | 0 | 0 | 112.1 | S283 I288 K289 | S283-Q285 PolarHBondContact O-N 3.12Å; S283-Q285 VanDerWaalsContact O-N 3.08Å; Q285-I288 PolarHBondContact O-N 2.76Å; Q285-K289 WeakPolarHBondContact O-CG 3.46Å; Q285-K289 PolarHBondContact O-N 2.95Å; Q285-K289 VanDerWaalsContact O-N 3.13Å |
| 286 | E | 98.4 | Very high | 98.3 | Very high | 91 Ų | 91 | 102 Ų | 102 | 43% | 0.425 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.5 | -45.9 | 174.5 | -71.4 | 154.9 | 158.4 | 0 | 0 | 110.6 | M282 S283 I288 K289 E290 | M282-E286 HydrophobicContact CB-CB 4.28Å; M282-E286 HydrophobicContact SD-CB 4.31Å; S283-E286 VanDerWaalsContact CB-OE2 3.25Å; S283-E286 WeakPolarHBondContact CB-OE2 3.47Å; S283-E286 PolarHBondContact N-OE2 3.36Å; S283-E286 PolarHBondContact O-N 3.48Å; S283-E286 WeakPolarHBondContact OG-CG 3.3Å; S283-E286 PolarHBondContact OG-N 2.96Å; S283-E286 PolarHBondContact OG-OE2 2.86Å; E286-I288 VanDerWaalsContact C-N 3.28Å; E286-I288 PolarHBondContact O-N 3.37Å; E286-K289 WeakPolarHBondContact O-CB 3.47Å; E286-K289 PolarHBondContact O-N 2.93Å; E286-E290 WeakPolarHBondContact O-CG 3.37Å; E286-E290 PolarHBondContact O-N 3.14Å |
| 287 | L | 98.6 | Very high | 98.3 | Very high | 77 Ų | 77 | 101.1 Ų | 101.1 | 40% | 0.403 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.5 | -40.3 | 177.3 | -171.2 | 66.7 | 0 | 0 | 0 | 112.4 | L279 M282 S283 Y291 | L279-L287 HydrophobicContact CD2-CD1 3.81Å; M282-L287 HydrophobicContact CE-CD1 4.03Å; S283-L287 PolarHBondContact O-N 3.13Å; L287-Y291 VanDerWaalsContact O-CB 3.23Å; L287-Y291 WeakPolarHBondContact O-CB 3.44Å; L287-Y291 PolarHBondContact O-N 3.4Å |
| 288 | I | 98.6 | Very high | 98.3 | Very high | 71 Ų | 71 | 100.5 Ų | 100.5 | 36% | 0.364 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.5 | -41.3 | 175 | -70.7 | 164 | 0 | 0 | 0 | 111.1 | K284 Q285 E286 Y291 L292 | K284-I288 HydrophobicContact CG-CD1 3.98Å; K284-I288 WeakPolarHBondContact O-CD1 3.41Å; K284-I288 WeakPolarHBondContact O-CG1 3.45Å; K284-I288 PolarHBondContact O-N 3.42Å; K284-I288 VanDerWaalsContact O-N 3.09Å; Q285-I288 PolarHBondContact O-N 2.76Å; E286-I288 VanDerWaalsContact C-N 3.28Å; E286-I288 PolarHBondContact O-N 3.37Å; I288-Y291 PolarHBondContact O-N 2.87Å; I288-L292 HydrophobicContact CG2-CD1 3.9Å; I288-L292 HydrophobicContact CG2-CG 4.37Å; I288-L292 WeakPolarHBondContact O-CB 3.41Å; I288-L292 VanDerWaalsContact O-CG 3.23Å; I288-L292 WeakPolarHBondContact O-CG 3.39Å; I288-L292 PolarHBondContact O-N 2.99Å |
| 289 | K | 98.5 | Very high | 98.3 | Very high | 138 Ų | 138 | 100.7 Ų | 100.7 | 60% | 0.6 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64 | -50.4 | 179.1 | -71.2 | 170.1 | -175.5 | 178 | 0 | 111.4 | Q285 E286 Y291 L292 E293 | Q285-K289 WeakPolarHBondContact O-CG 3.46Å; Q285-K289 PolarHBondContact O-N 2.95Å; Q285-K289 VanDerWaalsContact O-N 3.13Å; E286-K289 WeakPolarHBondContact O-CB 3.47Å; E286-K289 PolarHBondContact O-N 2.93Å; K289-Y291 VanDerWaalsContact C-N 3.31Å; K289-Y291 PolarHBondContact O-N 3.34Å; K289-L292 PolarHBondContact O-N 3.12Å; K289-E293 PolarHBondContact O-N 3.4Å |
| 290 | E | 97.9 | Very high | 98.4 | Very high | 107 Ų | 107 | 105 Ų | 105 | 50% | 0.5 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.7 | -43.8 | 177.2 | -67.4 | -63 | 151.4 | 0 | 0 | 111.1 | M282 E286 L292 E293 L294 | M282-E290 HydrophobicContact CE-CG 4.46Å; M282-E290 HydrophobicContact SD-CG 4.39Å; E286-E290 WeakPolarHBondContact O-CG 3.37Å; E286-E290 PolarHBondContact O-N 3.14Å; E290-L292 PolarHBondContact O-N 3Å; E290-E293 PolarHBondContact O-N 3.24Å; E290-L294 WeakPolarHBondContact O-CB 3.48Å; E290-L294 PolarHBondContact O-N 3.12Å |
| 291 | Y | 98.3 | Very high | 98.4 | Very high | 140 Ų | 140 | 103.5 Ų | 103.5 | 55% | 0.549 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 178.1 | -169.5 | -98.7 | 0 | 0 | 0 | 112.4 | L287 I288 K289 E293 L294 E295 | L287-Y291 VanDerWaalsContact O-CB 3.23Å; L287-Y291 WeakPolarHBondContact O-CB 3.44Å; L287-Y291 PolarHBondContact O-N 3.4Å; I288-Y291 PolarHBondContact O-N 2.87Å; K289-Y291 VanDerWaalsContact C-N 3.31Å; K289-Y291 PolarHBondContact O-N 3.34Å; Y291-E293 VanDerWaalsContact C-N 3.3Å; Y291-E293 PolarHBondContact O-N 3.2Å; Y291-L294 PolarHBondContact O-N 3.41Å; Y291-E295 HydrophobicContact CD1-CG 4.01Å; Y291-E295 VanDerWaalsContact CE1-CD 3.4Å; Y291-E295 HydrophobicContact CE1-CG 3.76Å; Y291-E295 WeakPolarHBondContact CE1-OE1 3.33Å; Y291-E295 WeakPolarHBondContact O-CG 3.45Å; Y291-E295 PolarHBondContact O-N 3.3Å |
| 292 | L | 98.6 | Very high | 98.4 | Very high | 82 Ų | 82 | 101.9 Ų | 101.9 | 43% | 0.429 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.6 | -34.2 | 176.4 | -73 | 171.4 | 0 | 0 | 0 | 112.4 | I288 K289 E290 K296 | I288-L292 HydrophobicContact CG2-CD1 3.9Å; I288-L292 HydrophobicContact CG2-CG 4.37Å; I288-L292 WeakPolarHBondContact O-CB 3.41Å; I288-L292 VanDerWaalsContact O-CG 3.23Å; I288-L292 WeakPolarHBondContact O-CG 3.39Å; I288-L292 PolarHBondContact O-N 2.99Å; K289-L292 PolarHBondContact O-N 3.12Å; E290-L292 PolarHBondContact O-N 3Å; L292-K296 WeakPolarHBondContact O-CD 3.24Å; L292-K296 VanDerWaalsContact O-CG 3.24Å; L292-K296 WeakPolarHBondContact O-CG 3.18Å; L292-K296 PolarHBondContact O-N 3.24Å; L292-K296 VanDerWaalsContact O-N 3.15Å |
| 293 | E | 98.5 | Very high | 98.4 | Very high | 127 Ų | 127 | 104.3 Ų | 104.3 | 59% | 0.593 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -69.8 | -42.6 | 174.2 | -177.9 | 161.6 | -167.8 | 0 | 0 | 111.7 | K289 E290 Y291 K296 C297 | K289-E293 PolarHBondContact O-N 3.4Å; E290-E293 PolarHBondContact O-N 3.24Å; Y291-E293 VanDerWaalsContact C-N 3.3Å; Y291-E293 PolarHBondContact O-N 3.2Å; E293-K296 WeakPolarHBondContact O-CB 3.36Å; E293-K296 PolarHBondContact O-N 3.32Å; E293-C297 PolarHBondContact O-N 2.96Å |
| 294 | L | 98.5 | Very high | 98.3 | Very high | 108 Ų | 108 | 106.4 Ų | 106.4 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.3 | -44.2 | 174.8 | -172.1 | 63.7 | 0 | 0 | 0 | 111.5 | E290 Y291 K296 C297 L298 | E290-L294 WeakPolarHBondContact O-CB 3.48Å; E290-L294 PolarHBondContact O-N 3.12Å; Y291-L294 PolarHBondContact O-N 3.41Å; L294-K296 VanDerWaalsContact C-N 3.34Å; L294-K296 PolarHBondContact O-N 2.82Å; L294-C297 WeakPolarHBondContact O-CB 3.4Å; L294-C297 PolarHBondContact O-N 2.95Å; L294-L298 VanDerWaalsContact O-CB 3.29Å; L294-L298 WeakPolarHBondContact O-CB 3.3Å; L294-L298 PolarHBondContact O-N 3.31Å |
| 295 | E | 98.3 | Very high | 98.3 | Very high | 93 Ų | 93 | 102.5 Ų | 102.5 | 44% | 0.435 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.5 | -43.9 | 174.2 | -78.2 | -173.5 | 145.4 | 0 | 0 | 111.8 | Y291 C297 L298 S299 | Y291-E295 HydrophobicContact CD1-CG 4.01Å; Y291-E295 VanDerWaalsContact CE1-CD 3.4Å; Y291-E295 HydrophobicContact CE1-CG 3.76Å; Y291-E295 WeakPolarHBondContact CE1-OE1 3.33Å; Y291-E295 WeakPolarHBondContact O-CG 3.45Å; Y291-E295 PolarHBondContact O-N 3.3Å; E295-C297 PolarHBondContact O-N 3.48Å; E295-L298 PolarHBondContact O-N 3.39Å; E295-S299 VanDerWaalsContact O-CB 3.31Å; E295-S299 WeakPolarHBondContact O-CB 3.44Å; E295-S299 PolarHBondContact O-N 3.49Å |
| 296 | K | 98.6 | Very high | 98.2 | Very high | 132 Ų | 132 | 101.4 Ų | 101.4 | 57% | 0.574 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.4 | -41.7 | 175.5 | -71.7 | 167.4 | -172.5 | 173.4 | 0 | 111.6 | L292 E293 L294 R300 | L292-K296 WeakPolarHBondContact O-CD 3.24Å; L292-K296 VanDerWaalsContact O-CG 3.24Å; L292-K296 WeakPolarHBondContact O-CG 3.18Å; L292-K296 PolarHBondContact O-N 3.24Å; L292-K296 VanDerWaalsContact O-N 3.15Å; E293-K296 WeakPolarHBondContact O-CB 3.36Å; E293-K296 PolarHBondContact O-N 3.32Å; L294-K296 VanDerWaalsContact C-N 3.34Å; L294-K296 PolarHBondContact O-N 2.82Å; K296-R300 WeakPolarHBondContact O-CG 3.49Å; K296-R300 PolarHBondContact O-N 2.97Å; K296-R300 VanDerWaalsContact O-N 3.09Å; K296-R300 PolarHBondContact O-NH1 2.91Å |
| 297 | C | 98.3 | Very high | 98.1 | Very high | 51 Ų | 51 | 103.2 Ų | 103.2 | 35% | 0.345 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.2 | -46.5 | 178.3 | -168.9 | 0 | 0 | 0 | 0 | 111.1 | E293 L294 E295 R300 M301 | E293-C297 PolarHBondContact O-N 2.96Å; L294-C297 WeakPolarHBondContact O-CB 3.4Å; L294-C297 PolarHBondContact O-N 2.95Å; E295-C297 PolarHBondContact O-N 3.48Å; C297-R300 PolarHBondContact O-N 3.05Å; C297-M301 WeakPolarHBondContact O-CB 3.46Å; C297-M301 PolarHBondContact O-N 3.32Å |
| 298 | L | 98.4 | Very high | 97.9 | Very high | 90 Ų | 90 | 103.7 Ų | 103.7 | 47% | 0.471 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.9 | -45.6 | 179.1 | -166.8 | 140.6 | 0 | 0 | 0 | 111 | L294 E295 R300 M301 E302 | L294-L298 VanDerWaalsContact O-CB 3.29Å; L294-L298 WeakPolarHBondContact O-CB 3.3Å; L294-L298 PolarHBondContact O-N 3.31Å; E295-L298 PolarHBondContact O-N 3.39Å; L298-R300 PolarHBondContact O-N 3.02Å; L298-M301 PolarHBondContact O-N 3.47Å; L298-E302 VanDerWaalsContact CD2-CD 3.42Å; L298-E302 HydrophobicContact CD2-CG 4.1Å; L298-E302 VanDerWaalsContact CD2-OE1 3.28Å; L298-E302 WeakPolarHBondContact CD2-OE1 3.19Å; L298-E302 WeakPolarHBondContact O-CB 3.5Å; L298-E302 WeakPolarHBondContact O-CG 3.49Å; L298-E302 PolarHBondContact O-N 3.45Å |
| 299 | S | 98.3 | Very high | 97.7 | Very high | 57 Ų | 57 | 107.4 Ų | 107.4 | 40% | 0.399 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.2 | -44.7 | 174.8 | 171.9 | 0 | 0 | 0 | 0 | 112.7 | E295 M301 E302 D303 | E295-S299 VanDerWaalsContact O-CB 3.31Å; E295-S299 WeakPolarHBondContact O-CB 3.44Å; E295-S299 PolarHBondContact O-N 3.49Å; S299-M301 VanDerWaalsContact C-N 3.34Å; S299-M301 PolarHBondContact O-N 3.44Å; S299-E302 PolarHBondContact O-N 2.81Å; S299-D303 PolarHBondContact O-N 2.79Å |
| 300 | R | 98.4 | Very high | 97.3 | Very high | 153 Ų | 153 | 105.4 Ų | 105.4 | 58% | 0.577 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.3 | -43.3 | 175.6 | -72.8 | -168.2 | -49 | -88.9 | 5 | 112 | K296 C297 L298 D303 E304 | K296-R300 WeakPolarHBondContact O-CG 3.49Å; K296-R300 PolarHBondContact O-N 2.97Å; K296-R300 VanDerWaalsContact O-N 3.09Å; K296-R300 PolarHBondContact O-NH1 2.91Å; C297-R300 PolarHBondContact O-N 3.05Å; L298-R300 PolarHBondContact O-N 3.02Å; R300-D303 PolarHBondContact O-N 2.84Å; R300-E304 WeakPolarHBondContact O-CB 3.24Å; R300-E304 PolarHBondContact O-N 3.25Å |
| 301 | M | 98.3 | Very high | 96.8 | Very high | 122 Ų | 122 | 104.6 Ų | 104.6 | 60% | 0.601 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.1 | -39.2 | 179.5 | -171.4 | -172.1 | -60 | 0 | 0 | 111.5 | C297 L298 S299 E304 N305 | C297-M301 WeakPolarHBondContact O-CB 3.46Å; C297-M301 PolarHBondContact O-N 3.32Å; L298-M301 PolarHBondContact O-N 3.47Å; S299-M301 VanDerWaalsContact C-N 3.34Å; S299-M301 PolarHBondContact O-N 3.44Å; M301-E304 PolarHBondContact O-N 3.46Å; M301-N305 VanDerWaalsContact O-CB 3.28Å; M301-N305 WeakPolarHBondContact O-CB 3.33Å; M301-N305 PolarHBondContact O-N 3.41Å |
| 302 | E | 97.8 | Very high | 96.2 | Very high | 107 Ų | 107 | 101.8 Ų | 101.8 | 50% | 0.5 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.4 | -44.6 | 175.7 | -76.4 | -178.5 | 157.8 | 0 | 0 | 111.8 | L298 S299 E304 N305 N306 | L298-E302 VanDerWaalsContact CD2-CD 3.42Å; L298-E302 HydrophobicContact CD2-CG 4.1Å; L298-E302 VanDerWaalsContact CD2-OE1 3.28Å; L298-E302 WeakPolarHBondContact CD2-OE1 3.19Å; L298-E302 WeakPolarHBondContact O-CB 3.5Å; L298-E302 WeakPolarHBondContact O-CG 3.49Å; L298-E302 PolarHBondContact O-N 3.45Å; S299-E302 PolarHBondContact O-N 2.81Å; E302-E304 VanDerWaalsContact C-N 3.32Å; E302-E304 PolarHBondContact O-N 3.41Å; E302-N305 PolarHBondContact O-N 3.48Å; E302-N306 VanDerWaalsContact O-CB 3.3Å; E302-N306 WeakPolarHBondContact O-CB 3.49Å; E302-N306 PolarHBondContact O-N 3.28Å; E302-N306 PolarHBondContact O-ND2 3.27Å; E302-N306 VanDerWaalsContact O-ND2 3.11Å |
| 303 | D | 97.9 | Very high | 95.5 | Very high | 105 Ų | 105 | 105 Ų | 105 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.5 | -43.1 | 175.2 | -75.7 | -21 | 0 | 0 | 0 | 111.4 | S299 R300 N306 R307 | S299-D303 PolarHBondContact O-N 2.79Å; R300-D303 PolarHBondContact O-N 2.84Å; D303-N306 PolarHBondContact O-N 3.46Å; D303-R307 WeakPolarHBondContact O-CB 3.38Å; D303-R307 PolarHBondContact O-N 3.06Å |
| 304 | E | 97.8 | Very high | 94.5 | Very high | 99 Ų | 99 | 108.2 Ų | 108.2 | 46% | 0.463 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.9 | -43.3 | 174.9 | 178.6 | 154.3 | -134.2 | 0 | 0 | 112.3 | R300 M301 E302 N306 R307 L308 | R300-E304 WeakPolarHBondContact O-CB 3.24Å; R300-E304 PolarHBondContact O-N 3.25Å; M301-E304 PolarHBondContact O-N 3.46Å; E302-E304 VanDerWaalsContact C-N 3.32Å; E302-E304 PolarHBondContact O-N 3.41Å; E304-N306 VanDerWaalsContact C-N 3.32Å; E304-N306 PolarHBondContact O-N 2.96Å; E304-R307 WeakPolarHBondContact O-CB 2.95Å; E304-R307 PolarHBondContact O-N 2.62Å; E304-R307 IonicContact OE1-NH2 3.73Å; E304-R307 PolarHBondContact OE1-NH2 3.24Å; E304-L308 HydrophobicContact CG-CD1 4.02Å; E304-L308 HydrophobicContact CG-CG 4.32Å; E304-L308 WeakPolarHBondContact O-CB 3.31Å; E304-L308 VanDerWaalsContact O-CG 3.3Å; E304-L308 WeakPolarHBondContact O-CG 3.43Å; E304-L308 PolarHBondContact O-N 2.79Å |
| 305 | N | 97.4 | Very high | 93.1 | Very high | 81 Ų | 81 | 108 Ų | 108 | 43% | 0.433 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 176.4 | -160.8 | -65.5 | 0 | 0 | 0 | 110.5 | M301 E302 R307 L308 R309 | M301-N305 VanDerWaalsContact O-CB 3.28Å; M301-N305 WeakPolarHBondContact O-CB 3.33Å; M301-N305 PolarHBondContact O-N 3.41Å; E302-N305 PolarHBondContact O-N 3.48Å; N305-R307 PolarHBondContact O-N 3.5Å; N305-L308 PolarHBondContact O-N 2.9Å; N305-R309 WeakPolarHBondContact O-CB 3.44Å; N305-R309 VanDerWaalsContact O-CG 3.24Å; N305-R309 WeakPolarHBondContact O-CG 3.28Å; N305-R309 PolarHBondContact O-N 3.44Å; N305-R309 WeakPolarHBondContact OD1-CD 3.3Å |
| 306 | N | 96.9 | Very high | 91.4 | Very high | 98 Ų | 98 | 105.5 Ų | 105.5 | 52% | 0.524 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.9 | -43 | 176.1 | -73.7 | -32.1 | 0 | 0 | 0 | 112 | E302 D303 E304 R309 L310 | E302-N306 VanDerWaalsContact O-CB 3.3Å; E302-N306 WeakPolarHBondContact O-CB 3.49Å; E302-N306 PolarHBondContact O-N 3.28Å; E302-N306 PolarHBondContact O-ND2 3.27Å; E302-N306 VanDerWaalsContact O-ND2 3.11Å; D303-N306 PolarHBondContact O-N 3.46Å; E304-N306 VanDerWaalsContact C-N 3.32Å; E304-N306 PolarHBondContact O-N 2.96Å; N306-R309 PolarHBondContact O-N 3.32Å; N306-L310 WeakPolarHBondContact O-CB 3.4Å; N306-L310 PolarHBondContact O-N 2.98Å |
| 307 | R | 96.7 | Very high | 89.8 | Confident | 129 Ų | 129 | 101.4 Ų | 101.4 | 49% | 0.487 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.8 | -50.5 | 173.1 | -179.5 | -177.3 | 69.9 | 96.4 | -6.1 | 111.1 | D303 E304 N305 R309 L310 E311 | D303-R307 WeakPolarHBondContact O-CB 3.38Å; D303-R307 PolarHBondContact O-N 3.06Å; E304-R307 WeakPolarHBondContact O-CB 2.95Å; E304-R307 PolarHBondContact O-N 2.62Å; E304-R307 IonicContact OE1-NH2 3.73Å; E304-R307 PolarHBondContact OE1-NH2 3.24Å; N305-R307 PolarHBondContact O-N 3.5Å; R307-R309 PolarHBondContact O-N 3.48Å; R307-L310 PolarHBondContact O-N 2.79Å; R307-E311 IonicContact NH1-OE2 3.64Å; R307-E311 WeakPolarHBondContact O-CB 3.29Å; R307-E311 PolarHBondContact O-N 3.5Å |
| 308 | L | 94.6 | Very high | 88.4 | Confident | 87 Ų | 87 | 103.9 Ų | 103.9 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.4 | -39.2 | 179.1 | -71 | 173.5 | 0 | 0 | 0 | 112.1 | E304 N305 L310 E311 S312 | E304-L308 HydrophobicContact CG-CD1 4.02Å; E304-L308 HydrophobicContact CG-CG 4.32Å; E304-L308 WeakPolarHBondContact O-CB 3.31Å; E304-L308 VanDerWaalsContact O-CG 3.3Å; E304-L308 WeakPolarHBondContact O-CG 3.43Å; E304-L308 PolarHBondContact O-N 2.79Å; N305-L308 PolarHBondContact O-N 2.9Å; L308-L310 VanDerWaalsContact C-N 3.32Å; L308-L310 PolarHBondContact O-N 2.83Å; L308-E311 PolarHBondContact O-N 3.46Å; L308-S312 WeakPolarHBondContact O-CB 3.32Å; L308-S312 PolarHBondContact O-N 3.09Å |
| 309 | R | 92.9 | Very high | 87.5 | Confident | 149 Ų | 149 | 103.8 Ų | 103.8 | 56% | 0.562 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -38.1 | 174.4 | -73 | -177.7 | 87.2 | 97 | 5.1 | 111.6 | N305 N306 R307 K313 | N305-R309 WeakPolarHBondContact O-CB 3.44Å; N305-R309 VanDerWaalsContact O-CG 3.24Å; N305-R309 WeakPolarHBondContact O-CG 3.28Å; N305-R309 PolarHBondContact O-N 3.44Å; N305-R309 WeakPolarHBondContact OD1-CD 3.3Å; N306-R309 PolarHBondContact O-N 3.32Å; R307-R309 PolarHBondContact O-N 3.48Å; R309-K313 WeakPolarHBondContact O-CB 3.44Å; R309-K313 WeakPolarHBondContact O-CD 3.28Å; R309-K313 WeakPolarHBondContact O-CG 3.4Å; R309-K313 PolarHBondContact O-N 3.44Å |
| 310 | L | 90.5 | Very high | 86.8 | Confident | 97 Ų | 97 | 103.6 Ų | 103.6 | 51% | 0.508 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -71.3 | -41.2 | 177 | -168.9 | 67.5 | 0 | 0 | 0 | 111.4 | N306 R307 L308 K313 R314 | N306-L310 WeakPolarHBondContact O-CB 3.4Å; N306-L310 PolarHBondContact O-N 2.98Å; R307-L310 PolarHBondContact O-N 2.79Å; L308-L310 VanDerWaalsContact C-N 3.32Å; L308-L310 PolarHBondContact O-N 2.83Å; L310-K313 PolarHBondContact O-N 3.18Å; L310-R314 WeakPolarHBondContact O-CG 2.71Å; L310-R314 PolarHBondContact O-N 2.87Å |
| 311 | E | 88.3 | Confident | 86.2 | Confident | 90 Ų | 90 | 103 Ų | 103 | 42% | 0.421 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.7 | -45.5 | 176 | -171.3 | 167.5 | -164.3 | 0 | 0 | 111.3 | R307 L308 K313 R314 L315 | R307-E311 IonicContact NH1-OE2 3.64Å; R307-E311 WeakPolarHBondContact O-CB 3.29Å; R307-E311 PolarHBondContact O-N 3.5Å; L308-E311 PolarHBondContact O-N 3.46Å; E311-K313 VanDerWaalsContact C-N 3.31Å; E311-K313 PolarHBondContact O-N 3.2Å; E311-R314 PolarHBondContact O-N 3.15Å; E311-L315 HydrophobicContact CG-CD1 3.97Å; E311-L315 HydrophobicContact CG-CG 4.41Å; E311-L315 WeakPolarHBondContact O-CB 3.23Å; E311-L315 WeakPolarHBondContact O-CG 3.46Å; E311-L315 PolarHBondContact O-N 3.36Å |
| 312 | S | 85.9 | Confident | 85.8 | Confident | 81 Ų | 81 | 100.3 Ų | 100.3 | 57% | 0.566 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58.5 | -40.5 | 173 | 176.1 | 0 | 0 | 0 | 0 | 112.1 | L308 G316 | L308-S312 WeakPolarHBondContact O-CB 3.32Å; L308-S312 PolarHBondContact O-N 3.09Å; S312-G316 PolarHBondContact O-N 3.29Å |
| 313 | K | 83.6 | Confident | 85.5 | Confident | 150 Ų | 150 | 101 Ų | 101 | 65% | 0.652 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66.7 | -35.4 | 173.1 | -74.4 | 169.4 | -177 | -178 | 0 | 113.1 | R309 L310 E311 | R309-K313 WeakPolarHBondContact O-CB 3.44Å; R309-K313 WeakPolarHBondContact O-CD 3.28Å; R309-K313 WeakPolarHBondContact O-CG 3.4Å; R309-K313 PolarHBondContact O-N 3.44Å; L310-K313 PolarHBondContact O-N 3.18Å; E311-K313 VanDerWaalsContact C-N 3.31Å; E311-K313 PolarHBondContact O-N 3.2Å |
| 314 | R | 77.4 | Confident | 85.3 | Confident | 193 Ų | 193 | 101.1 Ų | 101.1 | 73% | 0.728 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -71.4 | -43.5 | 176.7 | -75.8 | -169.7 | -178.2 | -99.6 | 2.9 | 111.9 | L310 E311 G316 G317 | L310-R314 WeakPolarHBondContact O-CG 2.71Å; L310-R314 PolarHBondContact O-N 2.87Å; E311-R314 PolarHBondContact O-N 3.15Å; R314-G316 VanDerWaalsContact C-N 3.26Å; R314-G316 PolarHBondContact O-N 2.95Å; R314-G317 PolarHBondContact O-N 3.44Å; R314-G317 VanDerWaalsContact O-N 3.12Å |
| 315 | L | 68.7 | Low | 85.2 | Confident | 105 Ų | 105 | 100.5 Ų | 100.5 | 55% | 0.55 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.9 | -27.2 | 174.3 | -64.7 | 172.6 | 0 | 0 | 0 | 111.7 | E311 G317 D318 | E311-L315 HydrophobicContact CG-CD1 3.97Å; E311-L315 HydrophobicContact CG-CG 4.41Å; E311-L315 WeakPolarHBondContact O-CB 3.23Å; E311-L315 WeakPolarHBondContact O-CG 3.46Å; E311-L315 PolarHBondContact O-N 3.36Å; L315-G317 PolarHBondContact O-N 2.82Å; L315-G317 VanDerWaalsContact O-N 3.1Å; L315-D318 WeakPolarHBondContact O-CB 3.25Å; L315-D318 PolarHBondContact O-N 3.11Å |
| 316 | G | 63.4 | Low | 85.2 | Confident | 40 Ų | 40 | 101.6 Ų | 101.6 | 41% | 0.412 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -8.1 | 168.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | S312 R314 D318 D319 | S312-G316 PolarHBondContact O-N 3.29Å; R314-G316 VanDerWaalsContact C-N 3.26Å; R314-G316 PolarHBondContact O-N 2.95Å; G316-D318 PolarHBondContact O-N 3.28Å; G316-D319 VanDerWaalsContact O-CB 3.22Å; G316-D319 WeakPolarHBondContact O-CB 3.23Å; G316-D319 PolarHBondContact O-N 2.88Å |
| 317 | G | 64.8 | Low | 85.2 | Confident | 46 Ų | 46 | 103 Ų | 103 | 47% | 0.474 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.4 | -28.1 | 167.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | R314 L315 D319 A320 | R314-G317 PolarHBondContact O-N 3.44Å; R314-G317 VanDerWaalsContact O-N 3.12Å; L315-G317 PolarHBondContact O-N 2.82Å; L315-G317 VanDerWaalsContact O-N 3.1Å; G317-D319 PolarHBondContact O-N 3.27Å; G317-A320 PolarHBondContact O-N 3.5Å |
| 318 | D | 68.6 | Low | 85.2 | Confident | 102 Ų | 102 | 100.6 Ų | 100.6 | 55% | 0.545 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.5 | -24.5 | 177.4 | -66 | -28.2 | 0 | 0 | 0 | 111.6 | L315 G316 A320 R321 V322 | L315-D318 WeakPolarHBondContact O-CB 3.25Å; L315-D318 PolarHBondContact O-N 3.11Å; G316-D318 PolarHBondContact O-N 3.28Å; D318-A320 VanDerWaalsContact C-N 3.3Å; D318-A320 PolarHBondContact O-N 3.01Å; D318-R321 CarbonylContact O-C 3.6Å; D318-R321 PolarHBondContact O-N 3Å; D318-R321 VanDerWaalsContact O-N 3.12Å; D318-V322 WeakPolarHBondContact O-CB 3.4Å; D318-V322 WeakPolarHBondContact O-CG2 3.48Å; D318-V322 PolarHBondContact O-N 3.13Å |
| 319 | D | 80.4 | Confident | 85.4 | Confident | 88 Ų | 88 | 100.8 Ų | 100.8 | 47% | 0.471 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.5 | -36.7 | 177.9 | -174.4 | 36 | 0 | 0 | 0 | 112.3 | G316 G317 R323 | G316-D319 VanDerWaalsContact O-CB 3.22Å; G316-D319 WeakPolarHBondContact O-CB 3.23Å; G316-D319 PolarHBondContact O-N 2.88Å; G317-D319 PolarHBondContact O-N 3.27Å; D319-R323 WeakPolarHBondContact O-CB 3.34Å; D319-R323 VanDerWaalsContact O-CG 3.3Å; D319-R323 WeakPolarHBondContact O-CG 3.17Å; D319-R323 PolarHBondContact O-N 2.8Å; D319-R323 IonicContact OD1-NH1 3.11Å; D319-R323 PolarHBondContact OD1-NH1 3.26Å; D319-R323 IonicContact OD2-CZ 3Å; D319-R323 IonicContact OD2-NH1 2.78Å; D319-R323 PolarHBondContact OD2-NH1 3.42Å |
| 320 | A | 82.8 | Confident | 85.6 | Confident | 54 Ų | 54 | 97.8 Ų | 97.8 | 45% | 0.446 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.2 | -39.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G317 D318 E324 | G317-A320 PolarHBondContact O-N 3.5Å; D318-A320 VanDerWaalsContact C-N 3.3Å; D318-A320 PolarHBondContact O-N 3.01Å; A320-E324 PolarHBondContact O-N 2.67Å; A320-E324 VanDerWaalsContact O-N 3.14Å |
| 321 | R | 86.6 | Confident | 86 | Confident | 140 Ų | 140 | 98.9 Ų | 98.9 | 53% | 0.528 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -72.5 | -37.3 | 176.9 | 179.6 | 55.9 | 172.7 | -164.4 | -2.2 | 111.7 | D318 E324 L325 | D318-R321 CarbonylContact O-C 3.6Å; D318-R321 PolarHBondContact O-N 3Å; D318-R321 VanDerWaalsContact O-N 3.12Å; R321-E324 WeakPolarHBondContact CD-OE2 3.46Å; R321-E324 IonicContact CZ-OE2 3.91Å; R321-E324 IonicContact NE-OE2 3.63Å; R321-E324 IonicContact NH1-OE2 3.27Å; R321-E324 PolarHBondContact NH1-OE2 2.84Å; R321-E324 PolarHBondContact O-N 3.44Å; R321-L325 HydrophobicContact CG-CD1 4.16Å; R321-L325 WeakPolarHBondContact O-CB 3.12Å; R321-L325 VanDerWaalsContact O-CG 3.28Å; R321-L325 WeakPolarHBondContact O-CG 3.3Å; R321-L325 PolarHBondContact O-N 2.98Å |
| 322 | V | 89.7 | Confident | 86.5 | Confident | 65 Ų | 65 | 97.7 Ų | 97.7 | 39% | 0.394 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.9 | -49.1 | 173.9 | 168.2 | 0 | 0 | 0 | 0 | 109.6 | D318 E324 L325 E326 | D318-V322 WeakPolarHBondContact O-CB 3.4Å; D318-V322 WeakPolarHBondContact O-CG2 3.48Å; D318-V322 PolarHBondContact O-N 3.13Å; V322-E324 VanDerWaalsContact C-N 3.34Å; V322-E324 PolarHBondContact O-N 2.85Å; V322-L325 PolarHBondContact O-N 3.32Å; V322-L325 VanDerWaalsContact O-N 3.15Å; V322-E326 HydrophobicContact CG1-CG 4.37Å; V322-E326 VanDerWaalsContact O-CG 3.31Å; V322-E326 WeakPolarHBondContact O-CG 3.34Å; V322-E326 PolarHBondContact O-N 2.7Å |
| 323 | R | 91.5 | Very high | 87 | Confident | 122 Ų | 122 | 101 Ų | 101 | 46% | 0.46 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.3 | -41.3 | 175 | -74.6 | -169.2 | -56.8 | -96 | 0.1 | 113.7 | D319 E326 L327 | D319-R323 WeakPolarHBondContact O-CB 3.34Å; D319-R323 VanDerWaalsContact O-CG 3.3Å; D319-R323 WeakPolarHBondContact O-CG 3.17Å; D319-R323 PolarHBondContact O-N 2.8Å; D319-R323 IonicContact OD1-NH1 3.11Å; D319-R323 PolarHBondContact OD1-NH1 3.26Å; D319-R323 IonicContact OD2-CZ 3Å; D319-R323 IonicContact OD2-NH1 2.78Å; D319-R323 PolarHBondContact OD2-NH1 3.42Å; R323-E326 PolarHBondContact O-N 3.08Å; R323-L327 WeakPolarHBondContact O-CG 3.47Å; R323-L327 PolarHBondContact O-N 3.28Å; R323-L327 VanDerWaalsContact O-N 3.13Å |
| 324 | E | 93.4 | Very high | 87.7 | Confident | 108 Ų | 108 | 96.2 Ų | 96.2 | 51% | 0.505 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.8 | -45 | 176 | -177.7 | -175.5 | -150.1 | 0 | 0 | 111.3 | A320 R321 V322 L327 E328 | A320-E324 PolarHBondContact O-N 2.67Å; A320-E324 VanDerWaalsContact O-N 3.14Å; R321-E324 WeakPolarHBondContact CD-OE2 3.46Å; R321-E324 IonicContact CZ-OE2 3.91Å; R321-E324 IonicContact NE-OE2 3.63Å; R321-E324 IonicContact NH1-OE2 3.27Å; R321-E324 PolarHBondContact NH1-OE2 2.84Å; R321-E324 PolarHBondContact O-N 3.44Å; V322-E324 VanDerWaalsContact C-N 3.34Å; V322-E324 PolarHBondContact O-N 2.85Å; E324-L327 PolarHBondContact O-N 3.09Å; E324-E328 PolarHBondContact O-N 2.99Å; E324-E328 VanDerWaalsContact O-N 3.12Å |
| 325 | L | 95.8 | Very high | 88.7 | Confident | 86 Ų | 86 | 90.8 Ų | 90.8 | 45% | 0.45 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.2 | -35 | 178.1 | -70.6 | 170 | 0 | 0 | 0 | 112.5 | R321 V322 E328 L329 | R321-L325 HydrophobicContact CG-CD1 4.16Å; R321-L325 WeakPolarHBondContact O-CB 3.12Å; R321-L325 VanDerWaalsContact O-CG 3.28Å; R321-L325 WeakPolarHBondContact O-CG 3.3Å; R321-L325 PolarHBondContact O-N 2.98Å; V322-L325 PolarHBondContact O-N 3.32Å; V322-L325 VanDerWaalsContact O-N 3.15Å; L325-E328 PolarHBondContact O-N 3.05Å; L325-L329 WeakPolarHBondContact O-CB 3.4Å; L325-L329 WeakPolarHBondContact O-CG 3.36Å; L325-L329 PolarHBondContact O-N 3.49Å |
| 326 | E | 96.2 | Very high | 90 | Very high | 103 Ų | 103 | 90.1 Ų | 90.1 | 48% | 0.481 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.8 | -46.5 | 174.2 | -74.6 | 170.7 | 166.8 | 0 | 0 | 111.5 | V322 R323 E328 L329 D330 | V322-E326 HydrophobicContact CG1-CG 4.37Å; V322-E326 VanDerWaalsContact O-CG 3.31Å; V322-E326 WeakPolarHBondContact O-CG 3.34Å; V322-E326 PolarHBondContact O-N 2.7Å; R323-E326 PolarHBondContact O-N 3.08Å; E326-E328 VanDerWaalsContact C-N 3.34Å; E326-E328 PolarHBondContact O-N 3.49Å; E326-L329 PolarHBondContact O-N 3.38Å; E326-D330 PolarHBondContact O-N 2.87Å |
| 327 | L | 97.2 | Very high | 91.7 | Very high | 127 Ų | 127 | 93.7 Ų | 93.7 | 67% | 0.665 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.8 | -41.1 | 176.3 | -70.3 | 173.4 | 0 | 0 | 0 | 112.2 | R323 E324 D330 R331 | R323-L327 WeakPolarHBondContact O-CG 3.47Å; R323-L327 PolarHBondContact O-N 3.28Å; R323-L327 VanDerWaalsContact O-N 3.13Å; E324-L327 PolarHBondContact O-N 3.09Å; L327-D330 PolarHBondContact O-N 3.07Å; L327-R331 WeakPolarHBondContact O-CB 3.42Å; L327-R331 PolarHBondContact O-N 2.94Å |
| 328 | E | 97.3 | Very high | 93.2 | Very high | 80 Ų | 80 | 97.3 Ų | 97.3 | 37% | 0.374 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.3 | -38.1 | 177.9 | -173.5 | 57.7 | -153.8 | 0 | 0 | 111.9 | E324 L325 E326 D330 R331 L332 | E324-E328 PolarHBondContact O-N 2.99Å; E324-E328 VanDerWaalsContact O-N 3.12Å; L325-E328 PolarHBondContact O-N 3.05Å; E326-E328 VanDerWaalsContact C-N 3.34Å; E326-E328 PolarHBondContact O-N 3.49Å; E328-D330 VanDerWaalsContact C-N 3.34Å; E328-D330 PolarHBondContact O-N 3.35Å; E328-R331 WeakPolarHBondContact O-CB 3Å; E328-R331 PolarHBondContact O-N 3.38Å; E328-R331 IonicContact OE1-CZ 3.82Å; E328-R331 VanDerWaalsContact OE1-CZ 3.27Å; E328-R331 IonicContact OE1-NE 3.88Å; E328-R331 PolarHBondContact OE1-NE 3.4Å; E328-R331 IonicContact OE1-NH2 2.78Å; E328-R331 PolarHBondContact OE1-NH2 3.28Å; E328-R331 IonicContact OE2-NE 3.94Å; E328-R331 PolarHBondContact OE2-NE 2.96Å; E328-L332 HydrophobicContact CG-CD1 4.2Å; E328-L332 WeakPolarHBondContact O-CB 3.39Å; E328-L332 WeakPolarHBondContact O-CG 3.2Å; E328-L332 PolarHBondContact O-N 3.29Å |
| 329 | L | 98.1 | Very high | 94.6 | Very high | 91 Ų | 91 | 96.1 Ų | 96.1 | 48% | 0.476 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -60.9 | -43.2 | 172.9 | -81.4 | 172.5 | 0 | 0 | 0 | 111.6 | L325 E326 L332 R333 | L325-L329 WeakPolarHBondContact O-CB 3.4Å; L325-L329 WeakPolarHBondContact O-CG 3.36Å; L325-L329 PolarHBondContact O-N 3.49Å; E326-L329 PolarHBondContact O-N 3.38Å; L329-L332 PolarHBondContact O-N 3Å; L329-R333 WeakPolarHBondContact O-CB 3.36Å; L329-R333 VanDerWaalsContact O-CG 3.22Å; L329-R333 WeakPolarHBondContact O-CG 3.5Å; L329-R333 PolarHBondContact O-N 3.17Å |
| 330 | D | 97.9 | Very high | 95.4 | Very high | 85 Ų | 85 | 97.4 Ų | 97.4 | 46% | 0.455 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.2 | -39 | 178 | -73.7 | -17.6 | 0 | 0 | 0 | 112 | E326 L327 E328 R333 A334 | E326-D330 PolarHBondContact O-N 2.87Å; L327-D330 PolarHBondContact O-N 3.07Å; E328-D330 VanDerWaalsContact C-N 3.34Å; E328-D330 PolarHBondContact O-N 3.35Å; D330-R333 PolarHBondContact O-N 2.77Å; D330-R333 IonicContact OD1-CZ 2.79Å; D330-R333 IonicContact OD1-NH1 3.67Å; D330-R333 PolarHBondContact OD1-NH1 3.41Å; D330-A334 PolarHBondContact O-N 3.32Å |
| 331 | R | 98.3 | Very high | 95.9 | Very high | 120 Ų | 120 | 98.9 Ų | 98.9 | 45% | 0.453 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -58.1 | -49.9 | 171.8 | -167.7 | -165.9 | 74.7 | 72 | 3.2 | 111.4 | L327 E328 R333 A334 E335 | L327-R331 WeakPolarHBondContact O-CB 3.42Å; L327-R331 PolarHBondContact O-N 2.94Å; E328-R331 WeakPolarHBondContact O-CB 3Å; E328-R331 PolarHBondContact O-N 3.38Å; E328-R331 IonicContact OE1-CZ 3.82Å; E328-R331 VanDerWaalsContact OE1-CZ 3.27Å; E328-R331 IonicContact OE1-NE 3.88Å; E328-R331 PolarHBondContact OE1-NE 3.4Å; E328-R331 IonicContact OE1-NH2 2.78Å; E328-R331 PolarHBondContact OE1-NH2 3.28Å; E328-R331 IonicContact OE2-NE 3.94Å; E328-R331 PolarHBondContact OE2-NE 2.96Å; R331-R333 VanDerWaalsContact C-N 3.34Å; R331-R333 PolarHBondContact O-N 2.82Å; R331-A334 PolarHBondContact O-N 2.93Å; R331-E335 IonicContact CZ-OE2 3.8Å; R331-E335 IonicContact NH1-OE2 2.62Å; R331-E335 PolarHBondContact NH1-OE2 2.88Å; R331-E335 IonicContact NH2-OE2 3.46Å; R331-E335 PolarHBondContact O-N 3.38Å |
| 332 | L | 98.3 | Very high | 96.3 | Very high | 66 Ų | 66 | 97.4 Ų | 97.4 | 35% | 0.346 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67 | -32.7 | -179.9 | -76.4 | 169.4 | 0 | 0 | 0 | 112.9 | E328 L329 N336 | E328-L332 HydrophobicContact CG-CD1 4.2Å; E328-L332 WeakPolarHBondContact O-CB 3.39Å; E328-L332 WeakPolarHBondContact O-CG 3.2Å; E328-L332 PolarHBondContact O-N 3.29Å; L329-L332 PolarHBondContact O-N 3Å; L332-N336 WeakPolarHBondContact O-CB 3.47Å; L332-N336 PolarHBondContact O-N 3.38Å; L332-N336 PolarHBondContact O-ND2 2.91Å |
| 333 | R | 97.8 | Very high | 96.6 | Very high | 150 Ų | 150 | 99.4 Ų | 99.4 | 57% | 0.566 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -65.9 | -44.5 | 172.9 | -77.7 | 169.8 | -176.5 | 151.6 | -1.1 | 111.2 | L329 D330 R331 N336 L337 | L329-R333 WeakPolarHBondContact O-CB 3.36Å; L329-R333 VanDerWaalsContact O-CG 3.22Å; L329-R333 WeakPolarHBondContact O-CG 3.5Å; L329-R333 PolarHBondContact O-N 3.17Å; D330-R333 PolarHBondContact O-N 2.77Å; D330-R333 IonicContact OD1-CZ 2.79Å; D330-R333 IonicContact OD1-NH1 3.67Å; D330-R333 PolarHBondContact OD1-NH1 3.41Å; R331-R333 VanDerWaalsContact C-N 3.34Å; R331-R333 PolarHBondContact O-N 2.82Å; R333-N336 PolarHBondContact O-N 3.48Å; R333-L337 WeakPolarHBondContact O-CB 3.42Å; R333-L337 PolarHBondContact O-N 3.35Å |
| 334 | A | 97.8 | Very high | 96.7 | Very high | 50 Ų | 50 | 97.2 Ų | 97.2 | 41% | 0.413 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.2 | -44.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | D330 R331 L337 Q338 | D330-A334 PolarHBondContact O-N 3.32Å; R331-A334 PolarHBondContact O-N 2.93Å; A334-L337 PolarHBondContact O-N 2.71Å; A334-Q338 WeakPolarHBondContact O-CG 3.28Å; A334-Q338 PolarHBondContact O-N 2.9Å |
| 335 | E | 97.5 | Very high | 96.6 | Very high | 78 Ų | 78 | 96.6 Ų | 96.6 | 36% | 0.364 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64 | -46 | 176.9 | -171.4 | 177.3 | 168.2 | 0 | 0 | 112 | R331 L337 Q338 L339 | R331-E335 IonicContact CZ-OE2 3.8Å; R331-E335 IonicContact NH1-OE2 2.62Å; R331-E335 PolarHBondContact NH1-OE2 2.88Å; R331-E335 IonicContact NH2-OE2 3.46Å; R331-E335 PolarHBondContact O-N 3.38Å; E335-L337 VanDerWaalsContact C-N 3.3Å; E335-L337 PolarHBondContact O-N 3.5Å; E335-Q338 WeakPolarHBondContact O-CB 3.44Å; E335-Q338 PolarHBondContact O-N 3.18Å; E335-L339 HydrophobicContact CG-CD1 4.27Å; E335-L339 WeakPolarHBondContact O-CG 3.31Å; E335-L339 PolarHBondContact O-N 3.28Å |
| 336 | N | 97.7 | Very high | 96.3 | Very high | 91 Ų | 91 | 97.4 Ų | 97.4 | 49% | 0.487 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.5 | -39.9 | 174.9 | -93.7 | -74.1 | 0 | 0 | 0 | 112.2 | L332 R333 Q338 L339 L340 | L332-N336 WeakPolarHBondContact O-CB 3.47Å; L332-N336 PolarHBondContact O-N 3.38Å; L332-N336 PolarHBondContact O-ND2 2.91Å; R333-N336 PolarHBondContact O-N 3.48Å; N336-Q338 VanDerWaalsContact C-N 3.34Å; N336-L339 PolarHBondContact O-N 2.86Å; N336-L340 WeakPolarHBondContact O-CB 3.46Å; N336-L340 VanDerWaalsContact O-CG 3.22Å; N336-L340 WeakPolarHBondContact O-CG 3.34Å; N336-L340 PolarHBondContact O-N 3.25Å |
| 337 | L | 97.9 | Very high | 96 | Very high | 115 Ų | 115 | 97.6 Ų | 97.6 | 60% | 0.602 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.3 | -43.9 | 177.5 | -176.6 | 63.5 | 0 | 0 | 0 | 111.1 | R333 A334 E335 L340 T341 | R333-L337 WeakPolarHBondContact O-CB 3.42Å; R333-L337 PolarHBondContact O-N 3.35Å; A334-L337 PolarHBondContact O-N 2.71Å; E335-L337 VanDerWaalsContact C-N 3.3Å; E335-L337 PolarHBondContact O-N 3.5Å; L337-L340 PolarHBondContact O-N 2.89Å; L337-T341 WeakPolarHBondContact O-CG2 3.29Å; L337-T341 PolarHBondContact O-N 3.32Å; L337-T341 PolarHBondContact O-OG1 3.01Å |
| 338 | Q | 97.1 | Very high | 95.6 | Very high | 122 Ų | 122 | 97.2 Ų | 97.2 | 57% | 0.57 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -59.7 | -51.9 | 174.8 | -71.6 | 174.3 | -9.3 | 0 | 0 | 111.3 | A334 E335 N336 L340 T341 E342 | A334-Q338 WeakPolarHBondContact O-CG 3.28Å; A334-Q338 PolarHBondContact O-N 2.9Å; E335-Q338 WeakPolarHBondContact O-CB 3.44Å; E335-Q338 PolarHBondContact O-N 3.18Å; N336-Q338 VanDerWaalsContact C-N 3.34Å; Q338-L340 VanDerWaalsContact C-N 3.27Å; Q338-L340 PolarHBondContact O-N 2.88Å; Q338-T341 PolarHBondContact O-N 2.88Å; Q338-T341 PolarHBondContact O-OG1 2.88Å; Q338-E342 PolarHBondContact O-N 3.32Å |
| 339 | L | 97 | Very high | 94.9 | Very high | 78 Ų | 78 | 99.6 Ų | 99.6 | 41% | 0.408 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61 | -35 | 179.3 | -70.6 | 171.9 | 0 | 0 | 0 | 112.9 | E335 N336 N343 | E335-L339 HydrophobicContact CG-CD1 4.27Å; E335-L339 WeakPolarHBondContact O-CG 3.31Å; E335-L339 PolarHBondContact O-N 3.28Å; N336-L339 PolarHBondContact O-N 2.86Å; L339-N343 VanDerWaalsContact O-CB 3.29Å; L339-N343 WeakPolarHBondContact O-CB 3.44Å; L339-N343 PolarHBondContact O-N 2.79Å; L339-N343 PolarHBondContact O-ND2 2.77Å |
| 340 | L | 96.8 | Very high | 93.9 | Very high | 115 Ų | 115 | 103.2 Ų | 103.2 | 60% | 0.602 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.8 | -42.5 | 174.3 | -78.2 | 169.8 | 0 | 0 | 0 | 111.4 | N336 L337 Q338 E344 | N336-L340 WeakPolarHBondContact O-CB 3.46Å; N336-L340 VanDerWaalsContact O-CG 3.22Å; N336-L340 WeakPolarHBondContact O-CG 3.34Å; N336-L340 PolarHBondContact O-N 3.25Å; L337-L340 PolarHBondContact O-N 2.89Å; Q338-L340 VanDerWaalsContact C-N 3.27Å; Q338-L340 PolarHBondContact O-N 2.88Å; L340-E344 WeakPolarHBondContact O-CB 3.17Å; L340-E344 PolarHBondContact O-N 2.9Å |
| 341 | T | 95 | Very high | 92.7 | Very high | 85 Ų | 85 | 107.2 Ų | 107.2 | 52% | 0.521 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.2 | -42.6 | 176.8 | 59.3 | 0 | 0 | 0 | 0 | 112.1 | L337 Q338 E344 L345 | L337-T341 WeakPolarHBondContact O-CG2 3.29Å; L337-T341 PolarHBondContact O-N 3.32Å; L337-T341 PolarHBondContact O-OG1 3.01Å; Q338-T341 PolarHBondContact O-N 2.88Å; Q338-T341 PolarHBondContact O-OG1 2.88Å; T341-E344 PolarHBondContact O-N 3.26Å; T341-L345 WeakPolarHBondContact O-CB 3.48Å; T341-L345 PolarHBondContact O-N 2.93Å |
| 342 | E | 94.9 | Very high | 91 | Very high | 108 Ų | 108 | 104.3 Ų | 104.3 | 51% | 0.505 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.6 | -46.8 | 176.3 | -70.7 | 180 | 179.9 | 0 | 0 | 111.6 | Q338 E344 L345 H346 | Q338-E342 PolarHBondContact O-N 3.32Å; E342-E344 VanDerWaalsContact C-N 3.33Å; E342-E344 PolarHBondContact O-N 3.43Å; E342-L345 PolarHBondContact O-N 3.44Å; E342-H346 PolarHBondContact O-CD2 3.35Å; E342-H346 PolarHBondContact O-N 3.17Å |
| 343 | N | 94.2 | Very high | 89.1 | Confident | 107 Ų | 107 | 106.8 Ų | 106.8 | 57% | 0.572 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.2 | -40.7 | 176.6 | -88.2 | -63.8 | 0 | 0 | 0 | 112.3 | L339 L345 H346 R347 | L339-N343 VanDerWaalsContact O-CB 3.29Å; L339-N343 WeakPolarHBondContact O-CB 3.44Å; L339-N343 PolarHBondContact O-N 2.79Å; L339-N343 PolarHBondContact O-ND2 2.77Å; N343-L345 VanDerWaalsContact C-N 3.34Å; N343-H346 PolarHBondContact O-N 2.81Å; N343-R347 VanDerWaalsContact O-CB 3.27Å; N343-R347 WeakPolarHBondContact O-CB 3.4Å; N343-R347 PolarHBondContact O-N 3.44Å |
| 344 | E | 94.5 | Very high | 87.1 | Confident | 76 Ų | 76 | 107.4 Ų | 107.4 | 36% | 0.355 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.7 | -40 | 177.1 | -170.7 | 60.3 | -138.4 | 0 | 0 | 111 | L340 T341 E342 R347 Q348 | L340-E344 WeakPolarHBondContact O-CB 3.17Å; L340-E344 PolarHBondContact O-N 2.9Å; T341-E344 PolarHBondContact O-N 3.26Å; E342-E344 VanDerWaalsContact C-N 3.33Å; E342-E344 PolarHBondContact O-N 3.43Å; E344-R347 PolarHBondContact O-N 3.11Å; E344-R347 IonicContact OE1-CZ 3.49Å; E344-R347 IonicContact OE1-NE 3.67Å; E344-R347 IonicContact OE1-NH2 2.75Å; E344-R347 PolarHBondContact OE1-NH2 2.89Å; E344-R347 IonicContact OE2-CZ 2.64Å; E344-R347 IonicContact OE2-NE 3.66Å; E344-R347 IonicContact OE2-NH2 2.93Å; E344-R347 PolarHBondContact OE2-NH2 3.42Å; E344-R347 VanDerWaalsContact OE2-NH2 3.09Å; E344-Q348 WeakPolarHBondContact O-CB 3.22Å; E344-Q348 VanDerWaalsContact O-CG 3.26Å; E344-Q348 WeakPolarHBondContact O-CG 3.23Å; E344-Q348 PolarHBondContact O-N 2.87Å |
| 345 | L | 92 | Very high | 84.9 | Confident | 95 Ų | 95 | 110 Ų | 110 | 50% | 0.497 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.4 | -44.4 | 175.1 | -175.3 | 142.8 | 0 | 0 | 0 | 112 | T341 E342 N343 Q348 Q349 | T341-L345 WeakPolarHBondContact O-CB 3.48Å; T341-L345 PolarHBondContact O-N 2.93Å; E342-L345 PolarHBondContact O-N 3.44Å; N343-L345 VanDerWaalsContact C-N 3.34Å; L345-Q348 PolarHBondContact O-N 2.67Å; L345-Q349 PolarHBondContact O-N 2.88Å |
| 346 | H | 89.9 | Confident | 82.6 | Confident | 104 Ų | 104 | 115.2 Ų | 115.2 | 48% | 0.481 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.3 | -45.9 | 174 | -83.8 | -66.9 | 0 | 0 | 0 | 111.5 | E342 N343 Q348 Q349 E350 | E342-H346 PolarHBondContact O-CD2 3.35Å; E342-H346 PolarHBondContact O-N 3.17Å; N343-H346 PolarHBondContact O-N 2.81Å; H346-Q348 VanDerWaalsContact C-N 3.28Å; H346-Q348 PolarHBondContact O-N 2.97Å; H346-Q349 PolarHBondContact O-N 2.78Å; H346-Q349 VanDerWaalsContact O-N 3.14Å; H346-E350 WeakPolarHBondContact O-CG 3.46Å; H346-E350 PolarHBondContact O-N 3.46Å |
| 347 | R | 89.2 | Confident | 80.2 | Confident | 106 Ų | 106 | 121.1 Ų | 121.1 | 40% | 0.4 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -65.6 | -32.1 | 178.7 | -155.9 | -174.7 | 69.7 | 162.3 | -3.4 | 112.2 | N343 E344 R351 | N343-R347 VanDerWaalsContact O-CB 3.27Å; N343-R347 WeakPolarHBondContact O-CB 3.4Å; N343-R347 PolarHBondContact O-N 3.44Å; E344-R347 PolarHBondContact O-N 3.11Å; E344-R347 IonicContact OE1-CZ 3.49Å; E344-R347 IonicContact OE1-NE 3.67Å; E344-R347 IonicContact OE1-NH2 2.75Å; E344-R347 PolarHBondContact OE1-NH2 2.89Å; E344-R347 IonicContact OE2-CZ 2.64Å; E344-R347 IonicContact OE2-NE 3.66Å; E344-R347 IonicContact OE2-NH2 2.93Å; E344-R347 PolarHBondContact OE2-NH2 3.42Å; E344-R347 VanDerWaalsContact OE2-NH2 3.09Å; R347-R351 VanDerWaalsContact O-CB 3.3Å; R347-R351 WeakPolarHBondContact O-CB 3.14Å; R347-R351 VanDerWaalsContact O-CG 3.25Å; R347-R351 WeakPolarHBondContact O-CG 3.28Å; R347-R351 PolarHBondContact O-N 3.01Å |
| 348 | Q | 87.7 | Confident | 78.2 | Confident | 119 Ų | 119 | 118.5 Ų | 118.5 | 56% | 0.556 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.4 | -39.9 | 171.9 | -74.6 | 179.6 | 28.3 | 0 | 0 | 112.1 | E344 L345 H346 R351 A352 | E344-Q348 WeakPolarHBondContact O-CB 3.22Å; E344-Q348 VanDerWaalsContact O-CG 3.26Å; E344-Q348 WeakPolarHBondContact O-CG 3.23Å; E344-Q348 PolarHBondContact O-N 2.87Å; L345-Q348 PolarHBondContact O-N 2.67Å; H346-Q348 VanDerWaalsContact C-N 3.28Å; H346-Q348 PolarHBondContact O-N 2.97Å; Q348-R351 CarbonylContact O-C 3.59Å; Q348-R351 PolarHBondContact O-N 2.85Å; Q348-A352 WeakPolarHBondContact O-CB 3.09Å; Q348-A352 PolarHBondContact O-N 3.32Å |
| 349 | Q | 83.4 | Confident | 75.6 | Confident | 130 Ų | 130 | 124.5 Ų | 124.5 | 61% | 0.607 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -63.6 | -40.7 | 173.2 | -81.4 | -176 | 0.7 | 0 | 0 | 112.3 | L345 H346 R351 A352 | L345-Q349 PolarHBondContact O-N 2.88Å; H346-Q349 PolarHBondContact O-N 2.78Å; H346-Q349 VanDerWaalsContact O-N 3.14Å; Q349-R351 VanDerWaalsContact C-N 3.33Å; Q349-A352 PolarHBondContact O-N 2.8Å |
| 350 | E | 76.8 | Confident | 74.5 | Confident | 168 Ų | 168 | 126.8 Ų | 126.8 | 79% | 0.785 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -69.1 | -30.7 | 175.6 | -71.5 | -172.3 | 163.1 | 0 | 0 | 112.8 | H346 | H346-E350 WeakPolarHBondContact O-CG 3.46Å; H346-E350 PolarHBondContact O-N 3.46Å |
| 351 | R | 72.3 | Confident | 73.3 | Confident | 169 Ų | 169 | 127.4 Ų | 127.4 | 64% | 0.638 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -84.4 | -14.6 | 175.2 | -75.4 | 178.7 | 178.2 | 175.8 | 1 | 113.7 | R347 Q348 Q349 P353 | R347-R351 VanDerWaalsContact O-CB 3.3Å; R347-R351 WeakPolarHBondContact O-CB 3.14Å; R347-R351 VanDerWaalsContact O-CG 3.25Å; R347-R351 WeakPolarHBondContact O-CG 3.28Å; R347-R351 PolarHBondContact O-N 3.01Å; Q348-R351 CarbonylContact O-C 3.59Å; Q348-R351 PolarHBondContact O-N 2.85Å; Q349-R351 VanDerWaalsContact C-N 3.33Å; R351-P353 WeakPolarHBondContact O-CD 3.28Å |
| 352 | A | 64.3 | Low | 72.1 | Confident | 58 Ų | 58 | 129.8 Ų | 129.8 | 48% | 0.479 | 66% | 0.663 | S | S | . | * | S | Bend | trans | -69.5 | 118.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | Q348 Q349 L354 | Q348-A352 WeakPolarHBondContact O-CB 3.09Å; Q348-A352 PolarHBondContact O-N 3.32Å; Q349-A352 PolarHBondContact O-N 2.8Å; A352-L354 PolarHBondContact O-N 3.37Å |
| 353 | P | 56.5 | Low | 70.8 | Confident | 119 Ų | 119 | 131.1 Ų | 131.1 | 77% | 0.773 | 67% | 0.672 | S | S | * | * | trans | -63.6 | 127.3 | 175.4 | 13.3 | -8.7 | 0 | 0 | 0 | 107.6 | R351 S355 | R351-P353 WeakPolarHBondContact O-CD 3.28Å; P353-S355 VanDerWaalsContact C-N 3.34Å; P353-S355 PolarHBondContact O-N 2.94Å | ||
| 354 | L | 56.3 | Low | 69.3 | Low | 163 Ų | 163 | 132.6 Ų | 132.6 | 85% | 0.853 | 68% | 0.678 | S | S | * | * | trans | -40.9 | 100.5 | 168.2 | -87.4 | 155.8 | 0 | 0 | 0 | 108.5 | A352 K356 | A352-L354 PolarHBondContact O-N 3.37Å; L354-K356 VanDerWaalsContact C-N 3.26Å; L354-K356 PolarHBondContact O-N 3Å | ||
| 355 | S | 52.7 | Low | 67.7 | Low | 104 Ų | 104 | 136.3 Ų | 136.3 | 73% | 0.727 | 70% | 0.7 | S | S | * | * | trans | -59.2 | 100 | 170.8 | 176.8 | 0 | 0 | 0 | 0 | 105.4 | P353 F357 | P353-S355 VanDerWaalsContact C-N 3.34Å; P353-S355 PolarHBondContact O-N 2.94Å; S355-F357 PolarHBondContact O-N 3.49Å | ||
| 356 | K | 48.9 | Very low | 65.9 | Low | 188 Ų | 188 | 139.3 Ų | 139.3 | 82% | 0.817 | 71% | 0.714 | S | S | * | * | trans | -54.4 | 104.8 | 173.9 | -68.3 | -83.1 | -175.2 | 171.4 | 0 | 106.3 | L354 G358 | L354-K356 VanDerWaalsContact C-N 3.26Å; L354-K356 PolarHBondContact O-N 3Å; K356-G358 PolarHBondContact O-N 2.78Å | ||
| 357 | F | 46.5 | Very low | 64.1 | Low | 215 Ų | 215 | 142 Ų | 142 | 94% | 0.943 | 73% | 0.732 | S | S | * | * | trans | -63 | 97 | 151.9 | -89.1 | -85.5 | 0 | 0 | 0 | 106.2 | S355 | S355-F357 PolarHBondContact O-N 3.49Š| ||
| 358 | G | 57.1 | Low | 62 | Low | 60 Ų | 60 | 145 Ų | 145 | 62% | 0.619 | 76% | 0.76 | S | S | * | * | trans | -112.6 | 126.5 | 160.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | K356 | K356-G358 PolarHBondContact O-N 2.78Š| ||
| 359 | D | 41.5 | Very low | 59.6 | Low | 247 Ų | 247 | 147.4 Ų | 147.4 | 100% | 1.321 | 78% | 0.778 | S | S | * | * | trans | 73.3 | 0 | 174.8 | -62.4 | -20.1 | 0 | 0 | 0 | 119.9 |
Retrieved 359 of 359 residues in 52.4 ms
(Link to these results)