| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33.1 | Very low | 33 | Very low | 232 Ų | 232 | 145.5 Ų | 145.5 | 100% | 1.143 | 84% | 0.842 | S | S | * | * | 0 | 105.8 | 0 | -64.3 | 168.1 | -179.1 | 0 | 0 | 105.4 | |||||
| 2 | S | 31.3 | Very low | 32.5 | Very low | 123 Ų | 123 | 140.8 Ų | 140.8 | 86% | 0.86 | 83% | 0.834 | S | S | * | * | 80.8 | 133.2 | 78.4 | -57.4 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 3 | A | 33.1 | Very low | 32 | Very low | 88 Ų | 88 | 144 Ų | 144 | 73% | 0.727 | 84% | 0.835 | S | S | * | * | cis | -154.7 | 139.5 | -0.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 4 | T | 33.8 | Very low | 32.1 | Very low | 140 Ų | 140 | 144.7 Ų | 144.7 | 86% | 0.859 | 83% | 0.832 | S | S | * | * | 86.7 | 130.2 | 80.6 | -49.6 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 5 | F | 37.5 | Very low | 31.8 | Very low | 196 Ų | 196 | 150.3 Ų | 150.3 | 86% | 0.86 | 83% | 0.834 | S | S | * | * | trans | -62.1 | 165.4 | 172.7 | -85.7 | -92.6 | 0 | 0 | 0 | 114.2 | ||||
| 6 | P | 47.8 | Very low | 31.9 | Very low | 127 Ų | 127 | 152.6 Ų | 152.6 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | -157.4 | 158.3 | 93.8 | 39.8 | -20.1 | 0 | 0 | 0 | 119.3 | |||||
| 7 | G | 30.3 | Very low | 31.7 | Very low | 71 Ų | 71 | 151.7 Ų | 151.7 | 73% | 0.732 | 83% | 0.83 | S | S | * | * | trans | 86.7 | 154.4 | 151.3 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 8 | L | 29.4 | Very low | 31.9 | Very low | 167 Ų | 167 | 146.5 Ų | 146.5 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | cis | -154.5 | 167.7 | -7.6 | -116.9 | 169.2 | 0 | 0 | 0 | 111.3 | ||||
| 9 | V | 31 | Very low | 32 | Very low | 112 Ų | 112 | 142.9 Ų | 142.9 | 68% | 0.679 | 80% | 0.803 | S | S | * | * | trans | -66.7 | 159.8 | -164.4 | -61.9 | 0 | 0 | 0 | 0 | 118 | ||||
| 10 | H | 29.3 | Very low | 32.2 | Very low | 187 Ų | 187 | 141.7 Ų | 141.7 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | -156.9 | 154.6 | 120.7 | -107.9 | 72.2 | 0 | 0 | 0 | 112.6 | |||||
| 11 | D | 26.4 | Very low | 32.4 | Very low | 157 Ų | 157 | 138.5 Ų | 138.5 | 84% | 0.84 | 78% | 0.781 | S | S | * | * | trans | -86 | 154.6 | -178.8 | -96.1 | -79.8 | 0 | 0 | 0 | 114.1 | ||||
| 12 | A | 26.8 | Very low | 32.2 | Very low | 90 Ų | 90 | 135.4 Ų | 135.4 | 74% | 0.744 | 76% | 0.758 | S | S | * | * | trans | -176.3 | 146.6 | 135.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 13 | E | 25.9 | Very low | 32.8 | Very low | 182 Ų | 182 | 135.8 Ų | 135.8 | 85% | 0.85 | 74% | 0.741 | S | S | * | * | trans | 56.5 | 104.8 | 156.4 | -65.1 | -161.1 | 133.3 | 0 | 0 | 122.4 | ||||
| 14 | I | 33.7 | Very low | 33.2 | Very low | 154 Ų | 154 | 135.4 Ų | 135.4 | 79% | 0.79 | 73% | 0.726 | S | S | * | * | trans | -50.5 | 137.7 | 155.9 | -62.5 | 154.1 | 0 | 0 | 0 | 111.9 | ||||
| 15 | R | 28.4 | Very low | 33.3 | Very low | 228 Ų | 228 | 136.1 Ų | 136.1 | 86% | 0.86 | 72% | 0.722 | S | S | * | * | trans | -122.5 | 139 | 152.7 | -77.3 | -168.3 | 170.4 | 111.4 | 6 | 110.6 | ||||
| 16 | H | 32.1 | Very low | 33.1 | Very low | 187 Ų | 187 | 132.6 Ų | 132.6 | 87% | 0.866 | 71% | 0.708 | S | S | * | * | trans | -70.9 | 130.3 | 173.6 | -76.3 | -99.4 | 0 | 0 | 0 | 110.5 | ||||
| 17 | D | 29.6 | Very low | 32.7 | Very low | 138 Ų | 138 | 130.6 Ų | 130.6 | 74% | 0.738 | 69% | 0.69 | S | S | * | * | trans | -95.3 | 113.4 | 169.8 | -171.9 | -4.4 | 0 | 0 | 0 | 110.5 | S19 | D17-S19 PolarHBondContact O-N 3.14Å; D17-S19 WeakPolarHBondContact OD1-CB 3.41Å; D17-S19 PolarHBondContact OD1-N 3.28Å; D17-S19 PolarHBondContact OD1-OG 3.14Å | ||
| 18 | G | 34.4 | Very low | 32.8 | Very low | 58 Ų | 58 | 129.9 Ų | 129.9 | 60% | 0.598 | 68% | 0.682 | S | S | * | * | trans | -95.2 | 38.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | N20 | G18-N20 PolarHBondContact O-N 3.21Š| ||
| 19 | S | 34.2 | Very low | 32.8 | Very low | 79 Ų | 79 | 125.9 Ų | 125.9 | 55% | 0.552 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | 48.8 | -166.4 | -70.6 | 0 | 0 | 0 | 0 | 116.5 | D17 | D17-S19 PolarHBondContact O-N 3.14Å; D17-S19 WeakPolarHBondContact OD1-CB 3.41Å; D17-S19 PolarHBondContact OD1-N 3.28Å; D17-S19 PolarHBondContact OD1-OG 3.14Å |
| 20 | N | 36.8 | Very low | 33 | Very low | 118 Ų | 118 | 127 Ų | 127 | 63% | 0.631 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.1 | -21.3 | 173.3 | -123.7 | -9.2 | 0 | 0 | 0 | 114.9 | G18 | G18-N20 PolarHBondContact O-N 3.21Š|
| 21 | S | 34.8 | Very low | 33.2 | Very low | 74 Ų | 74 | 125.6 Ų | 125.6 | 52% | 0.517 | 66% | 0.663 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75 | -26.5 | -177.9 | 52 | 0 | 0 | 0 | 0 | 114.2 | R23 L24 | S21-R23 VanDerWaalsContact C-N 3.27Å; S21-R23 PolarHBondContact O-N 2.94Å; S21-R23 VanDerWaalsContact O-N 3.1Å; S21-L24 PolarHBondContact O-N 3.47Å |
| 22 | Y | 30.5 | Very low | 33.3 | Very low | 168 Ų | 168 | 122.9 Ų | 122.9 | 66% | 0.659 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -60.9 | -25 | -169.9 | -72.6 | -77 | 0 | 0 | 0 | 115.6 | Q26 | Y22-Q26 PolarHBondContact O-N 3Å |
| 23 | R | 43.8 | Very low | 33.4 | Very low | 130 Ų | 130 | 125.9 Ų | 125.9 | 49% | 0.491 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -87.1 | -20.4 | -179.3 | -78 | -150.8 | -173.5 | 170.6 | 13.9 | 115.8 | S21 M25 Q26 S360 | S21-R23 VanDerWaalsContact C-N 3.27Å; S21-R23 PolarHBondContact O-N 2.94Å; S21-R23 VanDerWaalsContact O-N 3.1Å; R23-M25 VanDerWaalsContact C-N 3.3Å; R23-Q26 PolarHBondContact O-N 3.47Å; R23-S360 PolarHBondContact NH1-O 2.93Å |
| 24 | L | 40.6 | Very low | 33.4 | Very low | 80 Ų | 80 | 121.8 Ų | 121.8 | 42% | 0.419 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -67.6 | -39.1 | 171.2 | -152.1 | 79.4 | 0 | 0 | 0 | 109.9 | S21 Q26 R309 | S21-L24 PolarHBondContact O-N 3.47Å; L24-Q26 VanDerWaalsContact C-N 3.34Å; L24-Q26 PolarHBondContact O-N 3.17Å; L24-R309 HydrophobicContact CD2-CG 4.3Å; L24-R309 HydrophobicContact CG-CG 4.39Å |
| 25 | M | 35.3 | Very low | 33 | Very low | 155 Ų | 155 | 122.5 Ų | 122.5 | 76% | 0.764 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -61 | -37.5 | 168.9 | -80.6 | -75 | 177.9 | 0 | 0 | 113 | R23 L27 G28 | R23-M25 VanDerWaalsContact C-N 3.3Å; M25-L27 PolarHBondContact O-N 3.26Å; M25-G28 WeakPolarHBondContact O-CA 3.48Å; M25-G28 PolarHBondContact O-N 3.47Å |
| 26 | Q | 35.1 | Very low | 32.9 | Very low | 123 Ų | 123 | 117.5 Ų | 117.5 | 58% | 0.575 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -72.2 | -13.9 | -173.2 | -151.4 | 161.1 | 28 | 0 | 0 | 114.2 | Y22 R23 L24 C29 | Y22-Q26 PolarHBondContact O-N 3Å; R23-Q26 PolarHBondContact O-N 3.47Å; L24-Q26 VanDerWaalsContact C-N 3.34Å; L24-Q26 PolarHBondContact O-N 3.17Å; Q26-C29 PolarHBondContact O-N 3.31Å |
| 27 | L | 39.4 | Very low | 32.8 | Very low | 84 Ų | 84 | 114.3 Ų | 114.3 | 44% | 0.44 | 67% | 0.666 | S | S | . | * | G | 310 helix | trans | -69 | -21.4 | 164.7 | -74.5 | 168.4 | 0 | 0 | 0 | 112.8 | M25 C29 | M25-L27 PolarHBondContact O-N 3.26Å; L27-C29 VanDerWaalsContact C-N 3.3Å |
| 28 | G | 31.1 | Very low | 32.8 | Very low | 56 Ų | 56 | 113.9 Ų | 113.9 | 58% | 0.577 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -73.8 | -15.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | M25 L30 | M25-G28 WeakPolarHBondContact O-CA 3.48Å; M25-G28 PolarHBondContact O-N 3.47Å; G28-L30 PolarHBondContact O-N 3.47Å |
| 29 | C | 30.1 | Very low | 32.5 | Very low | 83 Ų | 83 | 115.3 Ų | 115.3 | 56% | 0.561 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -73.1 | 6.7 | -176.3 | -61.2 | 0 | 0 | 0 | 0 | 114.9 | Q26 L27 | Q26-C29 PolarHBondContact O-N 3.31Å; L27-C29 VanDerWaalsContact C-N 3.3Å |
| 30 | L | 35.3 | Very low | 32.2 | Very low | 136 Ų | 136 | 122.1 Ų | 122.1 | 71% | 0.712 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -84.1 | -1.5 | 177 | -71.7 | 175.7 | 0 | 0 | 0 | 114.5 | G28 | G28-L30 PolarHBondContact O-N 3.47Š|
| 31 | E | 33.9 | Very low | 31.7 | Very low | 157 Ų | 157 | 121.8 Ų | 121.8 | 73% | 0.734 | 70% | 0.697 | S | S | * | * | trans | -109.2 | 84 | 174.4 | -62.3 | -152.6 | 125 | 0 | 0 | 111.8 | K235 | E31-K235 IonicContact OE1-NZ 2.87Å; E31-K235 PolarHBondContact OE1-NZ 2.89Å | ||
| 32 | S | 27.2 | Very low | 31.3 | Very low | 101 Ų | 101 | 124 Ų | 124 | 71% | 0.706 | 71% | 0.712 | S | S | * | * | trans | -149.8 | 31.5 | -178.2 | 53.3 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 33 | V | 28.3 | Very low | 31.3 | Very low | 152 Ų | 152 | 121.6 Ų | 121.6 | 92% | 0.921 | 72% | 0.72 | S | S | * | * | trans | -138.5 | 81.1 | 159.2 | -169.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 34 | A | 27 | Very low | 30.6 | Very low | 96 Ų | 96 | 120.4 Ų | 120.4 | 79% | 0.793 | 73% | 0.731 | S | S | * | * | trans | -163.3 | 88.6 | 162.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | S36 | A34-S36 PolarHBondContact O-N 3.11Š| ||
| 35 | N | 26.2 | Very low | 30.2 | Very low | 170 Ų | 170 | 122.7 Ų | 122.7 | 91% | 0.909 | 75% | 0.751 | S | S | * | * | trans | -71.6 | 116.4 | 172.6 | -84.5 | 1 | 0 | 0 | 0 | 110.6 | ||||
| 36 | S | 26.3 | Very low | 29.8 | Very low | 123 Ų | 123 | 122.9 Ų | 122.9 | 86% | 0.86 | 76% | 0.755 | S | S | * | * | trans | -157.4 | 121.8 | 158 | -81.1 | 0 | 0 | 0 | 0 | 109.5 | A34 | A34-S36 PolarHBondContact O-N 3.11Š| ||
| 37 | S | 30.1 | Very low | 29.5 | Very low | 120 Ų | 120 | 123.2 Ų | 123.2 | 84% | 0.839 | 77% | 0.765 | S | S | * | * | trans | -89.3 | 117.9 | -167.2 | 52.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 38 | V | 27.8 | Very low | 29.1 | Very low | 129 Ų | 129 | 129.3 Ų | 129.3 | 78% | 0.782 | 78% | 0.784 | S | S | * | * | trans | -136.9 | 124.1 | 151.1 | -175.6 | 0 | 0 | 0 | 0 | 107.2 | Y40 | V38-Y40 HydrophobicContact CG1-CD2 4.22Å; V38-Y40 HydrophobicContact CG1-CE2 4.26Å | ||
| 39 | A | 28.5 | Very low | 29.4 | Very low | 88 Ų | 88 | 132 Ų | 132 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -99.2 | 136.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 40 | Y | 27.6 | Very low | 29.5 | Very low | 221 Ų | 221 | 132.9 Ų | 132.9 | 87% | 0.867 | 80% | 0.804 | S | S | * | * | trans | -138.4 | 134.5 | 157.9 | -91.4 | -74.3 | 0 | 0 | 0 | 110 | V38 | V38-Y40 HydrophobicContact CG1-CD2 4.22Å; V38-Y40 HydrophobicContact CG1-CE2 4.26Å | ||
| 41 | S | 26.7 | Very low | 29.6 | Very low | 112 Ų | 112 | 132.4 Ų | 132.4 | 78% | 0.783 | 81% | 0.809 | S | S | * | * | trans | -85 | 151.8 | -167.1 | -53.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 42 | S | 27.1 | Very low | 29.6 | Very low | 120 Ų | 120 | 129.9 Ų | 129.9 | 84% | 0.839 | 82% | 0.815 | S | S | * | * | trans | -64.4 | 141.6 | 163.6 | 53.3 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 43 | S | 29.3 | Very low | 29.9 | Very low | 117 Ų | 117 | 128.4 Ų | 128.4 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | trans | -129.6 | 126.8 | 166.1 | 45.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 44 | S | 29.6 | Very low | 30.2 | Very low | 105 Ų | 105 | 128.4 Ų | 128.4 | 73% | 0.734 | 82% | 0.816 | S | S | * | * | trans | -75.6 | 155.9 | 173.9 | -58.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 45 | P | 31.5 | Very low | 30.6 | Very low | 128 Ų | 128 | 133 Ų | 133 | 83% | 0.831 | 82% | 0.821 | S | S | * | * | trans | -67.4 | 136.4 | 176.4 | 28.3 | -34.9 | 0 | 0 | 0 | 111.6 | ||||
| 46 | L | 27.4 | Very low | 31.1 | Very low | 160 Ų | 160 | 134.3 Ų | 134.3 | 84% | 0.838 | 82% | 0.819 | S | S | * | * | trans | -110.6 | 124.7 | 171.1 | -78.5 | 171.8 | 0 | 0 | 0 | 110.3 | ||||
| 47 | T | 29.7 | Very low | 31.5 | Very low | 130 Ų | 130 | 133 Ų | 133 | 80% | 0.798 | 82% | 0.816 | S | S | * | * | trans | -100.2 | 118.4 | 172 | -59.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 48 | Y | 31.2 | Very low | 31.6 | Very low | 212 Ų | 212 | 132.4 Ų | 132.4 | 83% | 0.831 | 81% | 0.812 | S | S | * | * | trans | -154.1 | 164.6 | 164 | -89.6 | -51.6 | 0 | 0 | 0 | 110.4 | ||||
| 49 | P | 36.3 | Very low | 32.3 | Very low | 112 Ų | 112 | 131.3 Ų | 131.3 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -102.5 | 171 | -145.3 | 3.9 | 19.6 | 0 | 0 | 0 | 114.1 | ||
| 50 | A | 32.5 | Very low | 32.7 | Very low | 101 Ų | 101 | 136.7 Ų | 136.7 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 138.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 51 | P | 38.1 | Very low | 33.1 | Very low | 127 Ų | 127 | 135.8 Ų | 135.8 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 169.4 | 147.7 | 35.5 | -27.4 | 0 | 0 | 0 | 111 | ||
| 52 | A | 33.6 | Very low | 33.4 | Very low | 104 Ų | 104 | 136.2 Ų | 136.2 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 154.8 | -166 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 53 | G | 32.5 | Very low | 33.7 | Very low | 69 Ų | 69 | 134.5 Ų | 134.5 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | 94.9 | 99.4 | 144 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 54 | T | 35.6 | Very low | 33.9 | Very low | 153 Ų | 153 | 135.2 Ų | 135.2 | 94% | 0.939 | 80% | 0.802 | S | S | * | * | -168.8 | 157.7 | 119.5 | 14.3 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 55 | E | 34.7 | Very low | 34.1 | Very low | 191 Ų | 191 | 139.7 Ų | 139.7 | 89% | 0.893 | 81% | 0.811 | S | S | * | * | trans | -87.8 | 137.5 | -170.8 | -61.4 | 168 | 112.5 | 0 | 0 | 112.5 | ||||
| 56 | F | 36.1 | Very low | 34 | Very low | 199 Ų | 199 | 140.7 Ų | 140.7 | 87% | 0.873 | 80% | 0.804 | S | S | * | * | trans | -146.5 | 101.3 | 152.5 | -147.9 | -91.8 | 0 | 0 | 0 | 110.4 | ||||
| 57 | A | 34.8 | Very low | 34 | Very low | 95 Ų | 95 | 142.2 Ų | 142.2 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -77.2 | 138.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 58 | S | 33.3 | Very low | 34.1 | Very low | 107 Ų | 107 | 141.8 Ų | 141.8 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | trans | -114.2 | 140.7 | 160.9 | -71.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 59 | P | 41.3 | Very low | 34.5 | Very low | 106 Ų | 106 | 136.9 Ų | 136.9 | 69% | 0.688 | 79% | 0.792 | S | S | * | * | trans | -79.3 | 176.6 | -171.2 | 32.2 | -36.4 | 0 | 0 | 0 | 113.6 | ||||
| 60 | Y | 37 | Very low | 34.1 | Very low | 202 Ų | 202 | 139 Ų | 139 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | S | Bend | trans | 93.8 | 88.3 | 174.6 | -58.2 | -72 | 0 | 0 | 0 | 117.5 | ||
| 61 | F | 36.7 | Very low | 33.9 | Very low | 201 Ų | 201 | 142.4 Ų | 142.4 | 88% | 0.882 | 80% | 0.795 | S | S | * | * | trans | 84 | 151.9 | 157 | -72.4 | -82 | 0 | 0 | 0 | 120.2 | ||||
| 62 | S | 34.1 | Very low | 33.5 | Very low | 121 Ų | 121 | 144.6 Ų | 144.6 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | -113.2 | 165.9 | -151.5 | -51.3 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 63 | A | 33 | Very low | 33.2 | Very low | 84 Ų | 84 | 148.3 Ų | 148.3 | 69% | 0.694 | 79% | 0.793 | S | S | * | * | trans | -90.4 | 166 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 64 | N | 32 | Very low | 32.8 | Very low | 133 Ų | 133 | 150 Ų | 150 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | trans | 73 | 110.6 | 157.3 | -63.1 | -25 | 0 | 0 | 0 | 120.6 | ||||
| 65 | H | 35.5 | Very low | 32.3 | Very low | 199 Ų | 199 | 152.3 Ų | 152.3 | 92% | 0.921 | 79% | 0.791 | S | S | * | * | -140.8 | 162.2 | 123 | -80.2 | -52.5 | 0 | 0 | 0 | 109.1 | |||||
| 66 | Q | 29.2 | Very low | 31.8 | Very low | 149 Ų | 149 | 151 Ų | 151 | 70% | 0.696 | 79% | 0.785 | S | S | * | * | trans | -131 | 161 | -169.3 | -69.5 | -176.5 | -25.5 | 0 | 0 | 114 | ||||
| 67 | Y | 27.8 | Very low | 31.5 | Very low | 191 Ų | 191 | 151.7 Ų | 151.7 | 75% | 0.749 | 78% | 0.783 | S | S | * | * | trans | 78.6 | 96 | 159.5 | -68.2 | -66 | 0 | 0 | 0 | 122 | ||||
| 68 | T | 30.6 | Very low | 31 | Very low | 121 Ų | 121 | 153 Ų | 153 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | 56 | 159.8 | 121.2 | 55.9 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 69 | P | 40.4 | Very low | 30.6 | Very low | 109 Ų | 109 | 157.6 Ų | 157.6 | 71% | 0.708 | 78% | 0.78 | S | S | * | * | cis | -136.1 | -163.7 | -35.6 | 39.5 | -20.9 | 0 | 0 | 0 | 113.2 | ||||
| 70 | L | 26.9 | Very low | 29.8 | Very low | 157 Ų | 157 | 158.8 Ų | 158.8 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | 72.1 | 155.9 | -177.4 | -60.3 | 165.8 | 0 | 0 | 0 | 113.8 | ||||
| 71 | H | 29.2 | Very low | 29.4 | Very low | 173 Ų | 173 | 157.5 Ų | 157.5 | 80% | 0.801 | 78% | 0.777 | S | S | * | * | cis | -145.5 | -178.2 | 16.4 | -152.3 | 174.2 | 0 | 0 | 0 | 111.7 | ||||
| 72 | H | 28.5 | Very low | 29 | Very low | 172 Ų | 172 | 153.2 Ų | 153.2 | 80% | 0.796 | 77% | 0.772 | S | S | * | * | trans | -73.6 | 138.5 | 176.3 | -121.6 | 76.6 | 0 | 0 | 0 | 111.8 | ||||
| 73 | Q | 27.3 | Very low | 28.7 | Very low | 183 Ų | 183 | 155.9 Ų | 155.9 | 86% | 0.855 | 77% | 0.771 | S | S | * | * | trans | -166.5 | 152.9 | 134.1 | -119.9 | -178.2 | 103.7 | 0 | 0 | 114.8 | ||||
| 74 | S | 25.4 | Very low | 28.9 | Very low | 105 Ų | 105 | 158.2 Ų | 158.2 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -85 | 143.2 | 172.1 | -50.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 75 | F | 25.4 | Very low | 28.9 | Very low | 201 Ų | 201 | 156.3 Ų | 156.3 | 88% | 0.882 | 78% | 0.781 | S | S | * | * | trans | -92.7 | 105.3 | 170.8 | -79.6 | -81.1 | 0 | 0 | 0 | 111.6 | ||||
| 76 | H | 24.4 | Very low | 28.6 | Very low | 163 Ų | 163 | 153.8 Ų | 153.8 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | trans | -92.4 | 141.4 | 159.8 | -163.4 | -85.1 | 0 | 0 | 0 | 107.8 | ||||
| 77 | Y | 28.3 | Very low | 28.7 | Very low | 213 Ų | 213 | 150.8 Ų | 150.8 | 84% | 0.835 | 78% | 0.78 | S | S | * | * | trans | -132.4 | 120.3 | 171.5 | -124.7 | -82.5 | 0 | 0 | 0 | 110.1 | ||||
| 78 | E | 23.8 | Very low | 29.1 | Very low | 123 Ų | 123 | 147.7 Ų | 147.7 | 58% | 0.575 | 78% | 0.783 | S | S | * | * | trans | -81.8 | 159.5 | 175 | -78.4 | -175.2 | 93.7 | 0 | 0 | 111.8 | Q80 | E78-Q80 WeakPolarHBondContact OE1-CG 3.47Å; E78-Q80 PolarHBondContact OE1-NE2 3.36Å | ||
| 79 | F | 25.2 | Very low | 29.1 | Very low | 204 Ų | 204 | 150.7 Ų | 150.7 | 90% | 0.895 | 79% | 0.789 | S | S | * | * | trans | -139.2 | 101.4 | 147.6 | -155.2 | -88.8 | 0 | 0 | 0 | 109 | ||||
| 80 | Q | 25.7 | Very low | 28.5 | Very low | 130 Ų | 130 | 148.2 Ų | 148.2 | 61% | 0.607 | 78% | 0.778 | S | S | * | * | trans | -89.2 | 145.9 | 172.8 | -65.1 | -170.3 | 14.8 | 0 | 0 | 110.9 | E78 | E78-Q80 WeakPolarHBondContact OE1-CG 3.47Å; E78-Q80 PolarHBondContact OE1-NE2 3.36Å | ||
| 81 | H | 29.2 | Very low | 28.7 | Very low | 176 Ų | 176 | 151 Ų | 151 | 82% | 0.815 | 78% | 0.779 | S | S | * | * | trans | 156.5 | 131.2 | 146.9 | -75.5 | -14.4 | 0 | 0 | 0 | 107.3 | ||||
| 82 | S | 26.3 | Very low | 28.7 | Very low | 110 Ų | 110 | 146 Ų | 146 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | cis | -161.7 | 149.8 | -15.5 | 39.8 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 83 | H | 28.1 | Very low | 28.7 | Very low | 178 Ų | 178 | 146 Ų | 146 | 82% | 0.824 | 78% | 0.78 | S | S | * | * | trans | -79.3 | 162.4 | 179.7 | -70.2 | -72.9 | 0 | 0 | 0 | 112.7 | ||||
| 84 | P | 38.1 | Very low | 28.9 | Very low | 133 Ų | 133 | 144.6 Ų | 144.6 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | -120.5 | 166.5 | 89.7 | -2.3 | 23.4 | 0 | 0 | 0 | 114.6 | |||||
| 85 | A | 32.1 | Very low | 29.1 | Very low | 92 Ų | 92 | 145.3 Ų | 145.3 | 76% | 0.76 | 78% | 0.783 | S | S | * | * | trans | -97.2 | 153.5 | -166.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 86 | V | 29.8 | Very low | 29.3 | Very low | 147 Ų | 147 | 144 Ų | 144 | 89% | 0.891 | 79% | 0.785 | S | S | * | * | trans | -138 | 151.2 | 152.4 | -177.5 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 87 | A | 29.6 | Very low | 29.7 | Very low | 86 Ų | 86 | 144.8 Ų | 144.8 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | trans | -74.9 | 159.2 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | E89 | A87-E89 PolarHBondContact O-N 2.86Š| ||
| 88 | P | 36.3 | Very low | 29.7 | Very low | 125 Ų | 125 | 139.7 Ų | 139.7 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -92.2 | 100.1 | -172.7 | 34.9 | -32.3 | 0 | 0 | 0 | 112.9 | ||||
| 89 | E | 31.3 | Very low | 30 | Very low | 184 Ų | 184 | 137.6 Ų | 137.6 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | trans | -145.7 | 157.1 | 163.9 | -94.3 | -55.8 | 166.9 | 0 | 0 | 113.2 | A87 | A87-E89 PolarHBondContact O-N 2.86Š| ||
| 90 | A | 27.1 | Very low | 30.1 | Very low | 58 Ų | 58 | 136.2 Ų | 136.2 | 48% | 0.479 | 79% | 0.791 | S | S | . | * | trans | 81.3 | 143.3 | 168.1 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 91 | Y | 31.6 | Very low | 30.2 | Very low | 214 Ų | 214 | 140.5 Ų | 140.5 | 84% | 0.839 | 80% | 0.803 | S | S | * | * | trans | 64.1 | 106.9 | 168.8 | -39.3 | -65.3 | 0 | 0 | 0 | 116.9 | ||||
| 92 | G | 28.4 | Very low | 30.1 | Very low | 70 Ų | 70 | 143.3 Ų | 143.3 | 72% | 0.722 | 81% | 0.809 | S | S | * | * | cis | 76.6 | 79.1 | 6.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 93 | L | 29.4 | Very low | 30.3 | Very low | 170 Ų | 170 | 146.5 Ų | 146.5 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | trans | -121.8 | 132.2 | 172.5 | -75.5 | 177.4 | 0 | 0 | 0 | 111.4 | ||||
| 94 | N | 30.7 | Very low | 30.3 | Very low | 155 Ų | 155 | 145.2 Ų | 145.2 | 83% | 0.829 | 81% | 0.806 | S | S | * | * | trans | -82.1 | 160.4 | -173.5 | -81.2 | -71.1 | 0 | 0 | 0 | 113.3 | ||||
| 95 | S | 31.2 | Very low | 29.8 | Very low | 120 Ų | 120 | 147 Ų | 147 | 84% | 0.839 | 81% | 0.806 | S | S | * | * | trans | -57.8 | 139.4 | 157.2 | -52.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 96 | L | 29.1 | Very low | 29.8 | Very low | 173 Ų | 173 | 149.1 Ų | 149.1 | 91% | 0.906 | 80% | 0.8 | S | S | * | * | trans | -122.5 | 149.8 | 167 | -99.3 | 168.6 | 0 | 0 | 0 | 111.2 | ||||
| 97 | H | 32.8 | Very low | 29.8 | Very low | 180 Ų | 180 | 151 Ų | 151 | 83% | 0.833 | 80% | 0.799 | S | S | * | * | trans | -76.3 | 159.1 | -161 | -105.2 | 63 | 0 | 0 | 0 | 114.8 | G99 | H97-G99 PolarHBondContact O-N 3.03Š| ||
| 98 | S | 27.9 | Very low | 29.7 | Very low | 105 Ų | 105 | 150.4 Ų | 150.4 | 73% | 0.734 | 80% | 0.802 | S | S | * | * | trans | -64.7 | 123.5 | 164.1 | 37.9 | 0 | 0 | 0 | 0 | 111.3 | Q100 | S98-Q100 PolarHBondContact O-N 2.86Š| ||
| 99 | G | 29.3 | Very low | 29.5 | Very low | 79 Ų | 79 | 153.3 Ų | 153.3 | 81% | 0.814 | 80% | 0.804 | S | S | * | * | trans | -80.6 | 112.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | H97 | H97-G99 PolarHBondContact O-N 3.03Š| ||
| 100 | Q | 28.3 | Very low | 29.9 | Very low | 175 Ų | 175 | 150 Ų | 150 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -78.4 | 141 | 166.1 | -75.8 | -72.9 | -0.9 | 0 | 0 | 110.5 | S98 | S98-Q100 PolarHBondContact O-N 2.86Š| ||
| 101 | Y | 26.8 | Very low | 30.1 | Very low | 220 Ų | 220 | 151.9 Ų | 151.9 | 86% | 0.863 | 81% | 0.814 | S | S | * | * | trans | -156.2 | 92.1 | 172.6 | -113.9 | -82.4 | 0 | 0 | 0 | 110.7 | ||||
| 102 | Y | 28.6 | Very low | 30.1 | Very low | 235 Ų | 235 | 149.1 Ų | 149.1 | 92% | 0.922 | 81% | 0.814 | S | S | * | * | trans | -166.8 | 116.9 | 151.1 | -113.3 | -67.3 | 0 | 0 | 0 | 112.9 | ||||
| 103 | Q | 29.8 | Very low | 30.2 | Very low | 177 Ų | 177 | 155.7 Ų | 155.7 | 83% | 0.827 | 82% | 0.823 | S | S | * | * | trans | -162.1 | 149 | 160.1 | -109.7 | -172.8 | 16.5 | 0 | 0 | 104.8 | ||||
| 104 | Q | 27.8 | Very low | 30.4 | Very low | 151 Ų | 151 | 155 Ų | 155 | 71% | 0.706 | 82% | 0.819 | S | S | * | * | cis | -141.2 | 156.4 | 13.4 | -50.4 | 160.7 | -47.2 | 0 | 0 | 109.5 | ||||
| 105 | I | 28.7 | Very low | 30.4 | Very low | 170 Ų | 170 | 154.6 Ų | 154.6 | 87% | 0.872 | 82% | 0.816 | S | S | * | * | -151.6 | 151.5 | 126.6 | -70.8 | -153.4 | 0 | 0 | 0 | 106 | |||||
| 106 | H | 30.5 | Very low | 30.6 | Very low | 137 Ų | 137 | 156.1 Ų | 156.1 | 63% | 0.634 | 81% | 0.814 | S | S | * | * | trans | -90.2 | 159.7 | -164.6 | -71.9 | -117.3 | 0 | 0 | 0 | 116.2 | ||||
| 107 | H | 30.6 | Very low | 30.9 | Very low | 186 Ų | 186 | 155.5 Ų | 155.5 | 86% | 0.861 | 81% | 0.807 | S | S | * | * | 133.6 | 128.9 | 125.1 | -68 | -65.8 | 0 | 0 | 0 | 114.9 | |||||
| 108 | G | 27.1 | Very low | 30.9 | Very low | 75 Ų | 75 | 154.9 Ų | 154.9 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | 132 | 49.1 | 147.5 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 109 | E | 32.6 | Very low | 31.1 | Very low | 185 Ų | 185 | 154 Ų | 154 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | 62 | 165.7 | 151 | -69.5 | -54.2 | 93.4 | 0 | 0 | 120.9 | ||||
| 110 | P | 40.1 | Very low | 31.3 | Very low | 115 Ų | 115 | 161.9 Ų | 161.9 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | trans | -114.8 | 165.6 | -148.1 | 42.2 | -36.1 | 0 | 0 | 0 | 117.2 | ||||
| 111 | A | 31.2 | Very low | 31.5 | Very low | 98 Ų | 98 | 159.5 Ų | 159.5 | 81% | 0.81 | 82% | 0.816 | S | S | * | * | trans | -148.6 | 146.7 | 153.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 112 | D | 32.1 | Very low | 31.9 | Very low | 156 Ų | 156 | 153.3 Ų | 153.3 | 83% | 0.834 | 81% | 0.811 | S | S | * | * | trans | -67.2 | 149.1 | -172.2 | -50.7 | -90.5 | 0 | 0 | 0 | 114.4 | ||||
| 113 | F | 29.2 | Very low | 32 | Very low | 207 Ų | 207 | 150 Ų | 150 | 91% | 0.908 | 81% | 0.809 | S | S | * | * | trans | -157.1 | 152.4 | 136.8 | -124.1 | -81.7 | 0 | 0 | 0 | 113.2 | ||||
| 114 | I | 34.4 | Very low | 31.9 | Very low | 155 Ų | 155 | 151.7 Ų | 151.7 | 80% | 0.795 | 81% | 0.813 | S | S | * | * | trans | -77.9 | 133.6 | -167.5 | -64.6 | 165.9 | 0 | 0 | 0 | 112.6 | L116 | I114-L116 PolarHBondContact O-N 3.47Š| ||
| 115 | N | 30 | Very low | 32 | Very low | 147 Ų | 147 | 150.6 Ų | 150.6 | 79% | 0.786 | 82% | 0.822 | S | S | * | * | trans | -87.8 | 89.9 | -174.8 | -169.5 | -6.4 | 0 | 0 | 0 | 113.2 | H117 | N115-H117 PolarHBondContact O-N 3.18Å; N115-H117 VanDerWaalsContact O-N 3.14Å | ||
| 116 | L | 35.8 | Very low | 32 | Very low | 152 Ų | 152 | 146.9 Ų | 146.9 | 80% | 0.796 | 81% | 0.811 | S | S | * | * | trans | -83.4 | 76.7 | 176.8 | -175 | 61.6 | 0 | 0 | 0 | 112.2 | I114 | I114-L116 PolarHBondContact O-N 3.47Š| ||
| 117 | H | 34.5 | Very low | 31.9 | Very low | 160 Ų | 160 | 145.5 Ų | 145.5 | 74% | 0.741 | 82% | 0.815 | S | S | * | * | trans | -140.5 | 52.9 | 174.6 | -148.7 | 77.6 | 0 | 0 | 0 | 115.2 | N115 | N115-H117 PolarHBondContact O-N 3.18Å; N115-H117 VanDerWaalsContact O-N 3.14Å | ||
| 118 | N | 33.3 | Very low | 31.8 | Very low | 167 Ų | 167 | 144.5 Ų | 144.5 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | trans | -146.6 | 43.4 | 172.8 | -108.4 | -31 | 0 | 0 | 0 | 113.4 | ||||
| 119 | A | 31.7 | Very low | 31.9 | Very low | 87 Ų | 87 | 147.9 Ų | 147.9 | 72% | 0.719 | 82% | 0.816 | S | S | * | * | trans | -131.5 | 36.3 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 120 | R | 33.4 | Very low | 31.7 | Very low | 245 Ų | 245 | 146.8 Ų | 146.8 | 93% | 0.925 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -134 | 4.1 | 179 | -102.4 | -178 | 177.9 | 147.1 | 3.3 | 116.9 | ||
| 121 | S | 33.7 | Very low | 31.1 | Very low | 124 Ų | 124 | 149.3 Ų | 149.3 | 87% | 0.867 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -121 | 50.3 | -173.1 | -52.5 | 0 | 0 | 0 | 0 | 112.6 | ||
| 122 | A | 35.4 | Very low | 30.9 | Very low | 91 Ų | 91 | 154.3 Ų | 154.3 | 75% | 0.752 | 82% | 0.819 | S | S | * | * | trans | -150.3 | 49.1 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 123 | L | 29.2 | Very low | 30.8 | Very low | 166 Ų | 166 | 155.7 Ų | 155.7 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -147.8 | 119.9 | 161.2 | -79.2 | -175.4 | 0 | 0 | 0 | 111.7 | ||
| 124 | K | 29.5 | Very low | 30.7 | Very low | 212 Ų | 212 | 155.6 Ų | 155.6 | 92% | 0.922 | 81% | 0.806 | S | S | * | * | trans | 66.8 | 125.5 | 178.3 | -48.5 | 175.7 | -176.8 | -179.4 | 0 | 113.2 | ||||
| 125 | S | 28.1 | Very low | 30.3 | Very low | 127 Ų | 127 | 156.9 Ų | 156.9 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | cis | -137.1 | 178.5 | 25 | -162.7 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 126 | S | 29.1 | Very low | 30.3 | Very low | 93 Ų | 93 | 157.8 Ų | 157.8 | 65% | 0.65 | 81% | 0.813 | S | S | * | * | trans | -96.5 | 158.6 | 179.6 | 176.5 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 127 | C | 28.2 | Very low | 29.9 | Very low | 107 Ų | 107 | 153.7 Ų | 153.7 | 72% | 0.723 | 81% | 0.808 | S | S | * | * | trans | 51.2 | 132.1 | 162.2 | 58.7 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 128 | L | 29.7 | Very low | 29.6 | Very low | 165 Ų | 165 | 152.4 Ų | 152.4 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | cis | -147.2 | 150.6 | 45.5 | -79.1 | 162.8 | 0 | 0 | 0 | 114.7 | ||||
| 129 | D | 28.8 | Very low | 29.4 | Very low | 146 Ų | 146 | 153 Ų | 153 | 78% | 0.781 | 82% | 0.817 | S | S | * | * | trans | 49.5 | 139.9 | 151.3 | -140.9 | 40.7 | 0 | 0 | 0 | 123.6 | ||||
| 130 | E | 27.3 | Very low | 29.1 | Very low | 162 Ų | 162 | 155.8 Ų | 155.8 | 76% | 0.757 | 82% | 0.82 | S | S | * | * | trans | -122.9 | 88.2 | -177.7 | -178 | -155.9 | 151.9 | 0 | 0 | 110.3 | ||||
| 131 | Q | 27.8 | Very low | 28.9 | Very low | 168 Ų | 168 | 146.5 Ų | 146.5 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -155.8 | 59.4 | -179.6 | -150.4 | 81.1 | -108 | 0 | 0 | 117.5 | ||||
| 132 | Q | 28.1 | Very low | 28.6 | Very low | 203 Ų | 203 | 150.5 Ų | 150.5 | 95% | 0.949 | 79% | 0.794 | S | S | * | * | trans | -146.8 | 103.6 | 144 | -142 | 167.5 | 6.2 | 0 | 0 | 113.5 | ||||
| 133 | R | 28.9 | Very low | 28.2 | Very low | 186 Ų | 186 | 153.5 Ų | 153.5 | 70% | 0.702 | 79% | 0.785 | S | S | * | * | trans | -101.1 | 142.8 | 178.6 | -116.5 | -172.8 | -171.9 | -177.6 | 6.3 | 110.3 | ||||
| 134 | R | 27.1 | Very low | 28.2 | Very low | 204 Ų | 204 | 156.1 Ų | 156.1 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | trans | 70 | 167.4 | 152.8 | -63.6 | 174.3 | 169.9 | 172.2 | -6.1 | 117.6 | ||||
| 135 | E | 26.9 | Very low | 28.1 | Very low | 182 Ų | 182 | 154 Ų | 154 | 85% | 0.85 | 78% | 0.777 | S | S | * | * | trans | 69.3 | 131.4 | 175.6 | -60.9 | -178.6 | -170.4 | 0 | 0 | 114.1 | ||||
| 136 | L | 30 | Very low | 28 | Very low | 166 Ų | 166 | 153.7 Ų | 153.7 | 87% | 0.869 | 77% | 0.765 | S | S | * | * | cis | -122.5 | 164.7 | -4.4 | -127.9 | 62.6 | 0 | 0 | 0 | 107.1 | ||||
| 137 | G | 27.5 | Very low | 28 | Very low | 67 Ų | 67 | 157.5 Ų | 157.5 | 69% | 0.691 | 78% | 0.777 | S | S | * | * | cis | 128.6 | 122.5 | 36.6 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 138 | C | 27.7 | Very low | 28 | Very low | 132 Ų | 132 | 156.6 Ų | 156.6 | 89% | 0.892 | 77% | 0.772 | S | S | * | * | trans | -74.6 | 152.1 | -177.4 | -56.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 139 | L | 28.4 | Very low | 28 | Very low | 180 Ų | 180 | 156.3 Ų | 156.3 | 94% | 0.942 | 77% | 0.771 | S | S | * | * | trans | -161.3 | 169.6 | 139.3 | -112.8 | 170.1 | 0 | 0 | 0 | 112 | ||||
| 140 | D | 27.2 | Very low | 27.9 | Very low | 146 Ų | 146 | 156.4 Ų | 156.4 | 78% | 0.781 | 77% | 0.768 | S | S | * | * | trans | -138.2 | 161.5 | -160 | -175.2 | 21.2 | 0 | 0 | 0 | 111.7 | ||||
| 141 | A | 28.7 | Very low | 28 | Very low | 50 Ų | 50 | 154.6 Ų | 154.6 | 41% | 0.413 | 77% | 0.769 | S | S | . | * | trans | 50.7 | 110.5 | 162.4 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 142 | Y | 27.1 | Very low | 28 | Very low | 208 Ų | 208 | 150.2 Ų | 150.2 | 82% | 0.816 | 76% | 0.757 | S | S | * | * | trans | -136.8 | 178.3 | 135.1 | -135.5 | -100.7 | 0 | 0 | 0 | 114.1 | ||||
| 143 | R | 27 | Very low | 28.3 | Very low | 153 Ų | 153 | 149.3 Ų | 149.3 | 58% | 0.577 | 75% | 0.752 | S | S | * | * | -164.6 | 151.7 | -125.4 | -159.6 | -179.1 | -66.7 | 142.5 | -0.3 | 112.3 | |||||
| 144 | R | 28.8 | Very low | 28.2 | Very low | 222 Ų | 222 | 143.9 Ų | 143.9 | 84% | 0.838 | 75% | 0.753 | S | S | * | * | trans | 79.9 | 137.2 | 172.5 | -66.1 | -160.7 | 170.3 | 163.9 | -1.4 | 115.9 | ||||
| 145 | H | 27.1 | Very low | 28.4 | Very low | 168 Ų | 168 | 139.9 Ų | 139.9 | 78% | 0.778 | 76% | 0.757 | S | S | * | * | 62 | 137.8 | 69.3 | -87.6 | -98.8 | 0 | 0 | 0 | 112.1 | |||||
| 146 | D | 26.5 | Very low | 28.6 | Very low | 119 Ų | 119 | 139.4 Ų | 139.4 | 64% | 0.636 | 75% | 0.754 | S | S | * | * | cis | -160.2 | 157.4 | 13.3 | -156 | -56.4 | 0 | 0 | 0 | 110.4 | ||||
| 147 | L | 30.2 | Very low | 28.6 | Very low | 173 Ų | 173 | 134.4 Ų | 134.4 | 91% | 0.906 | 74% | 0.737 | S | S | * | * | trans | -164.2 | 148.3 | 137.7 | -139.6 | 67.9 | 0 | 0 | 0 | 113.6 | ||||
| 148 | S | 27.7 | Very low | 28.8 | Very low | 89 Ų | 89 | 142.6 Ų | 142.6 | 62% | 0.622 | 75% | 0.749 | S | S | * | * | trans | -134.4 | 157.8 | -174.6 | 175.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 149 | L | 28.4 | Very low | 28.9 | Very low | 159 Ų | 159 | 139.4 Ų | 139.4 | 83% | 0.832 | 74% | 0.738 | S | S | * | * | trans | 172.6 | 116.1 | 152.9 | -90 | 154.9 | 0 | 0 | 0 | 106.6 | ||||
| 150 | M | 28.3 | Very low | 29 | Very low | 147 Ų | 147 | 138.1 Ų | 138.1 | 72% | 0.724 | 74% | 0.737 | S | S | * | * | 64.8 | 139.9 | 74 | -59.9 | -87.3 | 82.5 | 0 | 0 | 113.7 | |||||
| 151 | T | 27.9 | Very low | 29.1 | Very low | 125 Ų | 125 | 133.9 Ų | 133.9 | 77% | 0.767 | 73% | 0.728 | S | S | * | * | cis | -116.1 | -115.6 | 21.2 | 58.8 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 152 | S | 28.1 | Very low | 29.3 | Very low | 76 Ų | 76 | 139.3 Ų | 139.3 | 53% | 0.531 | 75% | 0.747 | S | S | . | * | trans | -172.5 | -178.8 | -151 | 41.6 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 153 | H | 34.7 | Very low | 29.5 | Very low | 184 Ų | 184 | 137.8 Ų | 137.8 | 85% | 0.852 | 75% | 0.747 | S | S | * | * | trans | 85.1 | 138.4 | 167.9 | -42.6 | -73.1 | 0 | 0 | 0 | 118.1 | ||||
| 154 | G | 27.2 | Very low | 29.6 | Very low | 71 Ų | 71 | 138.3 Ų | 138.3 | 73% | 0.732 | 76% | 0.755 | S | S | * | * | cis | -177.9 | 158.9 | -7.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 155 | S | 30.8 | Very low | 30.6 | Very low | 120 Ų | 120 | 132.8 Ų | 132.8 | 84% | 0.839 | 75% | 0.748 | S | S | * | * | trans | -4.6 | 165.1 | 149.7 | -54.3 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 156 | Q | 30.8 | Very low | 30.8 | Very low | 172 Ų | 172 | 130 Ų | 130 | 80% | 0.804 | 74% | 0.739 | S | S | * | * | cis | -176.4 | 156.1 | -14.7 | -102.4 | -89.8 | 27.6 | 0 | 0 | 110.8 | ||||
| 157 | A | 29.7 | Very low | 31 | Very low | 61 Ų | 61 | 133.8 Ų | 133.8 | 50% | 0.504 | 75% | 0.753 | S | S | . | * | trans | 67.1 | 154.8 | 146.8 | 0 | 0 | 0 | 0 | 0 | 125.4 | ||||
| 158 | Y | 32.8 | Very low | 31 | Very low | 240 Ų | 240 | 135.7 Ų | 135.7 | 94% | 0.941 | 75% | 0.748 | S | S | * | * | trans | 66.9 | 149.1 | 168 | -48.4 | -75.5 | 0 | 0 | 0 | 118.9 | ||||
| 159 | G | 28.7 | Very low | 31.1 | Very low | 64 Ų | 64 | 139.1 Ų | 139.1 | 66% | 0.66 | 76% | 0.758 | S | S | * | * | cis | 164 | 144.9 | -11.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 160 | V | 31.8 | Very low | 31.4 | Very low | 154 Ų | 154 | 138.9 Ų | 138.9 | 93% | 0.933 | 76% | 0.757 | S | S | * | * | trans | 67.9 | 147.7 | 175.7 | -167.5 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 161 | G | 29.1 | Very low | 32.7 | Very low | 56 Ų | 56 | 137.9 Ų | 137.9 | 58% | 0.577 | 76% | 0.762 | S | S | * | * | cis | 136.3 | 112.6 | -13 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 162 | M | 32.3 | Very low | 32.7 | Very low | 164 Ų | 164 | 136.3 Ų | 136.3 | 81% | 0.808 | 76% | 0.762 | S | S | * | * | trans | -165.7 | 115.6 | 167.4 | -99.3 | -56.4 | 110.3 | 0 | 0 | 115.7 | ||||
| 163 | H | 31.7 | Very low | 32.8 | Very low | 177 Ų | 177 | 137.9 Ų | 137.9 | 82% | 0.819 | 78% | 0.779 | S | S | * | * | trans | 59.1 | 160.4 | 136.7 | -78.4 | -113 | 0 | 0 | 0 | 126.2 | ||||
| 164 | H | 29.4 | Very low | 32.5 | Very low | 164 Ų | 164 | 132.5 Ų | 132.5 | 76% | 0.759 | 77% | 0.773 | S | S | * | * | trans | -106.6 | -170 | -170.8 | -133.4 | 48.6 | 0 | 0 | 0 | 110.3 | D166 | H164-D166 IonicContact CD2-OD2 3.88Š| ||
| 165 | P | 49.5 | Very low | 32.9 | Very low | 105 Ų | 105 | 138 Ų | 138 | 68% | 0.682 | 79% | 0.785 | S | S | * | * | cis | -142.9 | 174.3 | 13.9 | 43.4 | -23.1 | 0 | 0 | 0 | 119.9 | ||||
| 166 | D | 30.6 | Very low | 32.8 | Very low | 109 Ų | 109 | 135.8 Ų | 135.8 | 58% | 0.583 | 78% | 0.78 | S | S | * | * | trans | 22.4 | 136.8 | 146.6 | -69.6 | -78.1 | 0 | 0 | 0 | 124.2 | H164 | H164-D166 IonicContact CD2-OD2 3.88Š| ||
| 167 | Q | 30.4 | Very low | 32.8 | Very low | 200 Ų | 200 | 136 Ų | 136 | 94% | 0.935 | 79% | 0.786 | S | S | * | * | -151.7 | 159.2 | 109.4 | -113.6 | 175.7 | 37.5 | 0 | 0 | 113.5 | |||||
| 168 | R | 31.8 | Very low | 33.1 | Very low | 213 Ų | 213 | 138.3 Ų | 138.3 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -157.1 | 144.2 | -161.3 | 178.4 | -177.3 | -173.3 | 167.7 | 1.2 | 109.3 | ||||
| 169 | L | 28.9 | Very low | 33.8 | Very low | 160 Ų | 160 | 132.3 Ų | 132.3 | 84% | 0.838 | 79% | 0.786 | S | S | * | * | trans | 165 | 149.1 | 141.6 | -89.9 | 160.6 | 0 | 0 | 0 | 115 | ||||
| 170 | L | 35.8 | Very low | 34 | Very low | 154 Ų | 154 | 135 Ų | 135 | 81% | 0.806 | 79% | 0.793 | S | S | * | * | trans | -135 | -170.9 | 153.9 | -54.7 | 171.5 | 0 | 0 | 0 | 104.9 | ||||
| 171 | P | 54.2 | Low | 34.2 | Very low | 127 Ų | 127 | 132.7 Ų | 132.7 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | cis | -132.5 | 178 | -21.2 | 41.1 | -25.3 | 0 | 0 | 0 | 114.3 | ||||
| 172 | A | 28.7 | Very low | 34.4 | Very low | 92 Ų | 92 | 134.8 Ų | 134.8 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | trans | -171.9 | 128.7 | 153.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 173 | A | 31 | Very low | 34.4 | Very low | 109 Ų | 109 | 134.7 Ų | 134.7 | 90% | 0.901 | 80% | 0.804 | S | S | * | * | 68.3 | 126.7 | 71.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 174 | G | 28.7 | Very low | 34.4 | Very low | 70 Ų | 70 | 133.1 Ų | 133.1 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | cis | -179.5 | -155.3 | -0.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 175 | L | 34.7 | Very low | 34.9 | Very low | 188 Ų | 188 | 132.8 Ų | 132.8 | 98% | 0.984 | 80% | 0.804 | S | S | * | * | trans | 86.7 | 113.7 | 170.6 | -50.5 | 176.7 | 0 | 0 | 0 | 120.9 | ||||
| 176 | G | 28.7 | Very low | 34.2 | Very low | 72 Ų | 72 | 136.2 Ų | 136.2 | 74% | 0.742 | 81% | 0.812 | S | S | * | * | 104.2 | 71.2 | 106.5 | 0 | 0 | 0 | 0 | 0 | 124.5 | |||||
| 177 | L | 30.3 | Very low | 34.2 | Very low | 177 Ų | 177 | 134 Ų | 134 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | 73.2 | 162.2 | 144.7 | -64.4 | -179.5 | 0 | 0 | 0 | 120.7 | ||||
| 178 | P | 37.2 | Very low | 34.7 | Very low | 110 Ų | 110 | 127.1 Ų | 127.1 | 71% | 0.714 | 79% | 0.788 | S | S | * | * | trans | -129.9 | -158.3 | -147.9 | 42.2 | -24.2 | 0 | 0 | 0 | 115.5 | ||||
| 179 | P | 46.1 | Very low | 35 | Very low | 113 Ų | 113 | 122.5 Ų | 122.5 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | -117.3 | -167.2 | -69.4 | 37.9 | -20.3 | 0 | 0 | 0 | 111.4 | |||||
| 180 | P | 33.8 | Very low | 35.5 | Very low | 122 Ų | 122 | 120.1 Ų | 120.1 | 79% | 0.792 | 77% | 0.768 | S | S | * | * | -146.3 | 156.9 | 94 | 38.7 | -23.3 | 0 | 0 | 0 | 116.4 | |||||
| 181 | A | 35.5 | Very low | 35.4 | Very low | 105 Ų | 105 | 117.1 Ų | 117.1 | 87% | 0.868 | 77% | 0.765 | S | S | * | * | trans | 21.6 | 104.3 | 158.4 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 182 | A | 33.3 | Very low | 34.6 | Very low | 99 Ų | 99 | 120 Ų | 120 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | trans | -121 | 137.9 | 146.9 | 0 | 0 | 0 | 0 | 0 | 108 | D184 | A182-D184 PolarHBondContact O-N 3.37Š| ||
| 183 | D | 32.4 | Very low | 35.3 | Very low | 162 Ų | 162 | 118.7 Ų | 118.7 | 87% | 0.866 | 75% | 0.752 | S | S | * | * | trans | -85.9 | 102.6 | -169.7 | -159.7 | 9.4 | 0 | 0 | 0 | 110.5 | L185 | D183-L185 PolarHBondContact O-N 3.3Š| ||
| 184 | D | 31.8 | Very low | 35.6 | Very low | 145 Ų | 145 | 116.6 Ų | 116.6 | 78% | 0.775 | 74% | 0.742 | S | S | * | * | trans | -81.2 | 89.5 | -174.8 | -151.4 | -15.3 | 0 | 0 | 0 | 109.9 | A182 Q186 | A182-D184 PolarHBondContact O-N 3.37Å; D184-Q186 PolarHBondContact O-N 3.26Å | ||
| 185 | L | 40.2 | Very low | 36.3 | Very low | 156 Ų | 156 | 116.4 Ų | 116.4 | 82% | 0.817 | 72% | 0.724 | S | S | * | * | trans | -71.7 | 68.2 | -173.7 | -171.8 | 65.3 | 0 | 0 | 0 | 112 | D183 G187 | D183-L185 PolarHBondContact O-N 3.3Å; L185-G187 PolarHBondContact O-N 3.36Å | ||
| 186 | Q | 34.1 | Very low | 36.3 | Very low | 178 Ų | 178 | 113.7 Ų | 113.7 | 83% | 0.832 | 71% | 0.714 | S | S | * | * | trans | -74.7 | 67.7 | 171.5 | -171.4 | 148.7 | -14.1 | 0 | 0 | 110.4 | D184 S188 | D184-Q186 PolarHBondContact O-N 3.26Å; Q186-S188 PolarHBondContact O-N 3Å; Q186-S188 VanDerWaalsContact O-N 3.12Å | ||
| 187 | G | 31.7 | Very low | 36.9 | Very low | 61 Ų | 61 | 116.8 Ų | 116.8 | 63% | 0.629 | 71% | 0.713 | S | S | * | * | trans | -53.8 | 114.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L185 V189 | L185-G187 PolarHBondContact O-N 3.36Å; G187-V189 PolarHBondContact O-N 3.09Å | ||
| 188 | S | 39.5 | Very low | 37.2 | Very low | 57 Ų | 57 | 114.3 Ų | 114.3 | 40% | 0.399 | 70% | 0.701 | S | S | . | * | trans | -62.1 | 128.6 | -171.3 | -179.2 | 0 | 0 | 0 | 0 | 112.5 | Q186 E190 A191 | Q186-S188 PolarHBondContact O-N 3Å; Q186-S188 VanDerWaalsContact O-N 3.12Å; S188-E190 PolarHBondContact O-N 2.99Å; S188-E190 WeakPolarHBondContact OG-CB 3.42Å; S188-E190 VanDerWaalsContact OG-CG 3.29Å; S188-E190 WeakPolarHBondContact OG-CG 3.45Å; S188-E190 PolarHBondContact OG-N 3.37Å; S188-E190 VanDerWaalsContact OG-N 3.17Å; S188-E190 PolarHBondContact OG-OE2 3.48Å; S188-A191 PolarHBondContact O-N 2.91Å; S188-A191 VanDerWaalsContact O-N 3.16Å | ||
| 189 | V | 38.4 | Very low | 37.2 | Very low | 116 Ų | 116 | 113 Ų | 113 | 70% | 0.703 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -11.4 | 170.2 | -82.9 | 0 | 0 | 0 | 0 | 113.9 | G187 | G187-V189 PolarHBondContact O-N 3.09Š|
| 190 | E | 38.9 | Very low | 36.7 | Very low | 110 Ų | 110 | 116.3 Ų | 116.3 | 51% | 0.514 | 71% | 0.713 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.4 | -37.3 | 175.2 | -64.2 | 164.3 | 134.5 | 0 | 0 | 112.3 | S188 Q192 C193 L195 | S188-E190 PolarHBondContact O-N 2.99Å; S188-E190 WeakPolarHBondContact OG-CB 3.42Å; S188-E190 VanDerWaalsContact OG-CG 3.29Å; S188-E190 WeakPolarHBondContact OG-CG 3.45Å; S188-E190 PolarHBondContact OG-N 3.37Å; S188-E190 VanDerWaalsContact OG-N 3.17Å; S188-E190 PolarHBondContact OG-OE2 3.48Å; E190-Q192 PolarHBondContact O-N 3.27Å; E190-C193 PolarHBondContact O-N 3.39Å; E190-L195 HydrophobicContact CB-CB 4.46Å; E190-L195 HydrophobicContact CB-CD1 4.38Å; E190-L195 HydrophobicContact CG-CD1 4.34Å |
| 191 | A | 34.5 | Very low | 36.9 | Very low | 90 Ų | 90 | 113.2 Ų | 113.2 | 74% | 0.744 | 70% | 0.704 | S | S | * | * | G | 310 helix | trans | -62.4 | -41.5 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S188 C193 | S188-A191 PolarHBondContact O-N 2.91Å; S188-A191 VanDerWaalsContact O-N 3.16Å; A191-C193 VanDerWaalsContact C-N 3.27Å; A191-C193 PolarHBondContact O-N 3.23Å |
| 192 | Q | 37.9 | Very low | 36.9 | Very low | 187 Ų | 187 | 111.6 Ų | 111.6 | 87% | 0.874 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -79.1 | -7.7 | -177.7 | -149.2 | 174.9 | 33.5 | 0 | 0 | 113.6 | E190 | E190-Q192 PolarHBondContact O-N 3.27Š|
| 193 | C | 43.4 | Very low | 37.3 | Very low | 65 Ų | 65 | 112 Ų | 112 | 44% | 0.439 | 69% | 0.689 | S | S | . | * | G | 310 helix | trans | -101.7 | 4.9 | 178.1 | -69.5 | 0 | 0 | 0 | 0 | 114 | E190 A191 L195 | E190-C193 PolarHBondContact O-N 3.39Å; A191-C193 VanDerWaalsContact C-N 3.27Å; A191-C193 PolarHBondContact O-N 3.23Å; C193-L195 VanDerWaalsContact C-N 3.26Å; C193-L195 HydrophobicContact CB-CD1 3.88Å; C193-L195 HydrophobicContact CB-CG 3.98Å; C193-L195 PolarHBondContact O-N 3.07Å |
| 194 | G | 37.3 | Very low | 37.7 | Very low | 66 Ų | 66 | 110.7 Ų | 110.7 | 68% | 0.68 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 63.4 | 31 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | V196 | G194-V196 PolarHBondContact O-N 3.44Š|
| 195 | L | 43 | Very low | 38.2 | Very low | 66 Ų | 66 | 114.4 Ų | 114.4 | 35% | 0.346 | 68% | 0.684 | S | S | . | * | trans | -80.8 | 57 | -173.7 | -77.7 | 168.6 | 0 | 0 | 0 | 113 | E190 C193 L197 | E190-L195 HydrophobicContact CB-CB 4.46Å; E190-L195 HydrophobicContact CB-CD1 4.38Å; E190-L195 HydrophobicContact CG-CD1 4.34Å; C193-L195 VanDerWaalsContact C-N 3.26Å; C193-L195 HydrophobicContact CB-CD1 3.88Å; C193-L195 HydrophobicContact CB-CG 3.98Å; C193-L195 PolarHBondContact O-N 3.07Å; L195-L197 PolarHBondContact O-N 2.97Å | ||
| 196 | V | 34.3 | Very low | 37.9 | Very low | 130 Ų | 130 | 117 Ų | 117 | 79% | 0.788 | 68% | 0.683 | S | S | * | * | trans | -74.3 | 83 | 160.4 | -174.2 | 0 | 0 | 0 | 0 | 108.1 | G194 N198 | G194-V196 PolarHBondContact O-N 3.44Å; V196-N198 PolarHBondContact O-N 3.3Å | ||
| 197 | L | 41 | Very low | 38 | Very low | 137 Ų | 137 | 112.1 Ų | 112.1 | 72% | 0.717 | 68% | 0.68 | S | S | * | * | trans | -66.8 | 118.6 | 153.8 | -70.5 | 175.9 | 0 | 0 | 0 | 106.4 | L195 G199 | L195-L197 PolarHBondContact O-N 2.97Å; L197-G199 PolarHBondContact O-N 2.95Å | ||
| 198 | N | 37.1 | Very low | 38.7 | Very low | 125 Ų | 125 | 113.6 Ų | 113.6 | 67% | 0.668 | 70% | 0.695 | S | S | * | * | trans | -67.6 | 106.5 | -175 | -162.4 | 39 | 0 | 0 | 0 | 109.5 | V196 Q200 G201 | V196-N198 PolarHBondContact O-N 3.3Å; N198-Q200 PolarHBondContact O-N 2.98Å; N198-G201 PolarHBondContact O-N 2.94Å | ||
| 199 | G | 36.9 | Very low | 39 | Very low | 82 Ų | 82 | 115.9 Ų | 115.9 | 85% | 0.845 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | 20.8 | -163.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | L197 | L197-G199 PolarHBondContact O-N 2.95Š|
| 200 | Q | 35.9 | Very low | 39.9 | Very low | 183 Ų | 183 | 113.5 Ų | 113.5 | 86% | 0.855 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.6 | -5.6 | -179.9 | -67.2 | 178.7 | -22 | 0 | 0 | 112.7 | N198 G202 | N198-Q200 PolarHBondContact O-N 2.98Å; Q200-G202 PolarHBondContact O-N 2.66Å |
| 201 | G | 37.8 | Very low | 40.8 | Very low | 58 Ų | 58 | 114.8 Ų | 114.8 | 60% | 0.598 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -84.8 | 98 | 166.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | N198 V203 | N198-G201 PolarHBondContact O-N 2.94Å; G201-V203 PolarHBondContact O-N 3.4Å |
| 202 | G | 35.1 | Very low | 42.7 | Very low | 70 Ų | 70 | 112.4 Ų | 112.4 | 72% | 0.722 | 69% | 0.686 | S | S | * | * | trans | -64.9 | 97.9 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q200 I204 | Q200-G202 PolarHBondContact O-N 2.66Å; G202-I204 PolarHBondContact O-N 2.86Å | ||
| 203 | V | 42.3 | Very low | 44.9 | Very low | 109 Ų | 109 | 107.2 Ų | 107.2 | 66% | 0.661 | 66% | 0.664 | S | S | * | * | trans | -69.6 | 94 | 171.1 | -179.1 | 0 | 0 | 0 | 0 | 109.1 | G201 R205 | G201-V203 PolarHBondContact O-N 3.4Å; V203-R205 PolarHBondContact O-N 3.3Å | ||
| 204 | I | 40.5 | Very low | 46.7 | Very low | 134 Ų | 134 | 107.1 Ų | 107.1 | 69% | 0.687 | 66% | 0.662 | S | S | * | * | trans | -66.8 | 93.5 | 177.5 | -61.6 | 178.6 | 0 | 0 | 0 | 109.3 | G202 R206 | G202-I204 PolarHBondContact O-N 2.86Å; I204-R206 HydrophobicContact CG2-CG 4.32Å; I204-R206 PolarHBondContact O-N 2.71Å | ||
| 205 | R | 41.5 | Very low | 49 | Very low | 223 Ų | 223 | 107.1 Ų | 107.1 | 84% | 0.842 | 65% | 0.649 | S | S | * | * | trans | -72.3 | 72 | 168.2 | -74.5 | -174.3 | 167.7 | -167.9 | -1.7 | 110.9 | V203 | V203-R205 PolarHBondContact O-N 3.3Š| ||
| 206 | R | 34.4 | Very low | 51.3 | Low | 211 Ų | 211 | 107.3 Ų | 107.3 | 80% | 0.796 | 65% | 0.65 | S | S | * | * | trans | -71.6 | 149.9 | 147.7 | -83.2 | -170.9 | 168.5 | -162.5 | -3.1 | 108.3 | I204 | I204-R206 HydrophobicContact CG2-CG 4.32Å; I204-R206 PolarHBondContact O-N 2.71Å | ||
| 207 | G | 36.1 | Very low | 54 | Low | 75 Ų | 75 | 105.8 Ų | 105.8 | 77% | 0.773 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -56.9 | 137.8 | -161.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | T209 | G207-T209 VanDerWaalsContact C-N 3.26Å; G207-T209 PolarHBondContact O-N 3.14Å |
| 208 | G | 46.3 | Very low | 56.5 | Low | 91 Ų | 91 | 99.4 Ų | 99.4 | 94% | 0.938 | 60% | 0.604 | S | S | * | * | S | Bend | trans | 80 | -35.6 | 168.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||
| 209 | T | 47.3 | Very low | 59.2 | Low | 105 Ų | 105 | 94.4 Ų | 94.4 | 64% | 0.644 | 58% | 0.579 | S | S | * | * | trans | -125.6 | 113.5 | -172.1 | 52.7 | 0 | 0 | 0 | 0 | 113.4 | G207 V211 | G207-T209 VanDerWaalsContact C-N 3.26Å; G207-T209 PolarHBondContact O-N 3.14Å; T209-V211 PolarHBondContact O-N 3.49Å | ||
| 210 | C | 56.5 | Low | 61.9 | Low | 66 Ų | 66 | 93.7 Ų | 93.7 | 45% | 0.446 | 56% | 0.561 | S | S | . | * | trans | -64.6 | 116.4 | 163 | -64.7 | 0 | 0 | 0 | 0 | 108.9 | V212 | C210-V212 HydrophobicContact CB-CG2 4.03Å; C210-V212 PolarHBondContact O-N 3.36Å | ||
| 211 | V | 58.8 | Low | 64.6 | Low | 138 Ų | 138 | 85.2 Ų | 85.2 | 84% | 0.836 | 52% | 0.521 | S | S | * | . | trans | -75.7 | 94.7 | 169.1 | -178 | 0 | 0 | 0 | 0 | 107.8 | T209 | T209-V211 PolarHBondContact O-N 3.49Š| ||
| 212 | V | 74.4 | Confident | 67.1 | Low | 40 Ų | 40 | 85.2 Ų | 85.2 | 24% | 0.242 | 51% | 0.511 | C | S | . | . | trans | -89.8 | 122.3 | -179.2 | 179.1 | 0 | 0 | 0 | 0 | 109.5 | C210 I238 L279 | C210-V212 HydrophobicContact CB-CG2 4.03Å; C210-V212 PolarHBondContact O-N 3.36Å; V212-I238 HydrophobicContact CG1-CD1 3.34Å; V212-I238 HydrophobicContact CG1-CG1 4.49Å; V212-I238 HydrophobicContact CG1-CG2 3.94Å; V212-L279 HydrophobicContact CG1-CD2 3.99Å; V212-L279 HydrophobicContact CG2-CB 4.31Å; V212-L279 HydrophobicContact CG2-CD2 3.7Å | ||
| 213 | N | 82.4 | Confident | 69.7 | Low | 77 Ų | 77 | 82.6 Ų | 82.6 | 41% | 0.412 | 48% | 0.483 | S | S | . | . | trans | -81.1 | 127 | 175.1 | 174.7 | 5.6 | 0 | 0 | 0 | 109.3 | T215 D216 | N213-T215 VanDerWaalsContact CG-OG1 3.29Å; N213-T215 PolarHBondContact ND2-OG1 2.86Å; N213-T215 PolarHBondContact O-N 3.13Å; N213-T215 PolarHBondContact OD1-N 3.19Å; N213-T215 VanDerWaalsContact OD1-N 3.12Å; N213-T215 PolarHBondContact OD1-OG1 3.44Å; N213-D216 WeakPolarHBondContact CB-OD2 3.36Å; N213-D216 PolarHBondContact N-OD2 3.39Å; N213-D216 WeakPolarHBondContact O-CB 3.44Å; N213-D216 VanDerWaalsContact O-CG 3.25Å; N213-D216 PolarHBondContact O-N 3.03Å | ||
| 214 | P | 82.2 | Confident | 72 | Confident | 63 Ų | 63 | 81.9 Ų | 81.9 | 41% | 0.409 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.3 | -26.3 | 178.7 | -27.4 | 35.6 | 0 | 0 | 0 | 114.6 | D216 A239 | P214-D216 VanDerWaalsContact C-N 3.28Å; P214-D216 PolarHBondContact O-N 3.01Å; P214-A239 HydrophobicContact CB-CB 4.04Å; P214-A239 WeakPolarHBondContact O-CB 3.43Å; P214-A239 PolarHBondContact O-N 2.9Å |
| 215 | T | 85.9 | Confident | 74.4 | Confident | 67 Ų | 67 | 80 Ų | 80 | 41% | 0.411 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | -11.5 | -180 | 70.5 | 0 | 0 | 0 | 0 | 113.9 | N213 | N213-T215 VanDerWaalsContact CG-OG1 3.29Å; N213-T215 PolarHBondContact ND2-OG1 2.86Å; N213-T215 PolarHBondContact O-N 3.13Å; N213-T215 PolarHBondContact OD1-N 3.19Å; N213-T215 VanDerWaalsContact OD1-N 3.12Å; N213-T215 PolarHBondContact OD1-OG1 3.44Å |
| 216 | D | 90.2 | Very high | 76.4 | Confident | 69 Ų | 69 | 71 Ų | 71 | 37% | 0.369 | 43% | 0.431 | S | S | . | . | S | Bend | trans | -64 | 151.5 | -175.6 | -64.5 | -23.2 | 0 | 0 | 0 | 112.2 | N213 P214 F218 T237 I238 | N213-D216 WeakPolarHBondContact CB-OD2 3.36Å; N213-D216 PolarHBondContact N-OD2 3.39Å; N213-D216 WeakPolarHBondContact O-CB 3.44Å; N213-D216 VanDerWaalsContact O-CG 3.25Å; N213-D216 PolarHBondContact O-N 3.03Å; P214-D216 VanDerWaalsContact C-N 3.28Å; P214-D216 PolarHBondContact O-N 3.01Å; D216-F218 PolarHBondContact O-N 3.13Å; D216-T237 CarbonylContact O-C 3.57Å; D216-T237 VanDerWaalsContact O-CA 3.29Å; D216-T237 WeakPolarHBondContact O-CA 3.46Å; D216-I238 HydrophobicContact CB-CD1 3.82Å; D216-I238 HydrophobicContact CB-CG1 4.33Å; D216-I238 PolarHBondContact O-N 3.14Å |
| 217 | L | 91.9 | Very high | 78.7 | Confident | 98 Ų | 98 | 67.7 Ų | 67.7 | 51% | 0.513 | 43% | 0.428 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.7 | 113.7 | 178.7 | -176.3 | 69.5 | 0 | 0 | 0 | 110.8 | C219 K235 | L217-C219 WeakPolarHBondContact CD1-O 3.4Å; L217-K235 HydrophobicContact CD1-CB 3.77Å; L217-K235 HydrophobicContact CD1-CG 4.22Å |
| 218 | F | 93.2 | Very high | 81 | Confident | 4 Ų | 4 | 71.7 Ų | 71.7 | 2% | 0.018 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.6 | -48.2 | 169.2 | -170.6 | -75.8 | 0 | 0 | 0 | 110.7 | D216 V236 I238 V241 L260 L272 K275 L276 L279 | D216-F218 PolarHBondContact O-N 3.13Å; F218-V236 WeakPolarHBondContact CB-O 3.38Å; F218-V236 PolarHBondContact N-O 3.14Å; F218-I238 HydrophobicContact CB-CG1 4.08Å; F218-I238 HydrophobicContact CD2-CG1 4.27Å; F218-V241 HydrophobicContact CB-CG2 4.04Å; F218-V241 HydrophobicContact CD1-CG2 4.28Å; F218-V241 HydrophobicContact CD2-CB 4.34Å; F218-V241 HydrophobicContact CD2-CG1 4.27Å; F218-V241 HydrophobicContact CD2-CG2 4.04Å; F218-V241 HydrophobicContact CE2-CG1 4.29Å; F218-V241 HydrophobicContact CG-CG2 3.84Å; F218-L260 HydrophobicContact CD1-CD1 4.46Å; F218-L260 HydrophobicContact CE1-CD1 4.44Å; F218-L272 HydrophobicContact CE1-CD1 4.18Å; F218-L272 HydrophobicContact CZ-CD1 3.9Å; F218-K275 HydrophobicContact CE1-CD 3.97Å; F218-K275 HydrophobicContact CE1-CG 4.5Å; F218-K275 HydrophobicContact CE2-CD 4.3Å; F218-K275 HydrophobicContact CE2-CG 4.07Å; F218-K275 HydrophobicContact CZ-CB 4.38Å; F218-K275 HydrophobicContact CZ-CD 3.74Å; F218-K275 HydrophobicContact CZ-CG 3.77Å; F218-K275 PolarHBondContact O-NZ 2.91Å; F218-L276 HydrophobicContact CE2-CD2 3.84Å; F218-L276 HydrophobicContact CE2-CG 4.39Å; F218-L276 HydrophobicContact CZ-CD2 4.27Å; F218-L276 HydrophobicContact CZ-CG 4.45Å; F218-L279 HydrophobicContact CD2-CD1 3.76Å; F218-L279 HydrophobicContact CE2-CD1 3.67Å |
| 219 | C | 93.2 | Very high | 82 | Confident | 20 Ų | 20 | 73 Ų | 73 | 14% | 0.135 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -167 | 160.4 | 173.4 | 59.4 | 0 | 0 | 0 | 0 | 111.4 | L217 V236 R262 | L217-C219 WeakPolarHBondContact CD1-O 3.4Å; C219-V236 PolarHBondContact N-O 3.3Å; C219-V236 WeakPolarHBondContact O-CB 3.27Å; C219-V236 PolarHBondContact O-N 3.47Å; C219-R262 PolarHBondContact SG-NH1 3.49Å |
| 220 | S | 93.6 | Very high | 83.1 | Confident | 67 Ų | 67 | 71.9 Ų | 71.9 | 47% | 0.469 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 139.5 | 161.7 | -55.6 | 0 | 0 | 0 | 0 | 110.5 | Y234 | S220-Y234 CarbonylContact C-O 3.59Å; S220-Y234 VanDerWaalsContact CA-O 3.3Å; S220-Y234 WeakPolarHBondContact CA-O 3.37Å |
| 221 | V | 92.8 | Very high | 83.7 | Confident | 5 Ų | 5 | 72.5 Ų | 72.5 | 3% | 0.03 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.8 | 141.9 | 178.1 | -57.6 | 0 | 0 | 0 | 0 | 110.8 | K233 Y234 V236 L260 R261 V300 | V221-K233 CarbonylContact O-C 3.54Å; V221-K233 WeakPolarHBondContact O-CA 3.42Å; V221-Y234 PolarHBondContact N-O 3.43Å; V221-Y234 PolarHBondContact O-N 3.31Å; V221-V236 HydrophobicContact CG1-CG2 3.87Å; V221-V236 HydrophobicContact CG2-CG2 3.86Å; V221-L260 HydrophobicContact CG1-CB 4.41Å; V221-L260 HydrophobicContact CG1-CD2 4.08Å; V221-R261 HydrophobicContact CB-CG 4.36Å; V221-V300 HydrophobicContact CG2-CG1 4.05Å; V221-V300 HydrophobicContact CG2-CG2 3.77Å |
| 222 | P | 90.6 | Very high | 84.8 | Confident | 58 Ų | 58 | 68.3 Ų | 68.3 | 38% | 0.377 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 140.6 | 169.6 | 30.1 | -34.1 | 0 | 0 | 0 | 110.4 | T231 R261 | P222-T231 HydrophobicContact CB-CG2 4.34Å; P222-R261 HydrophobicContact CG-CG 4.14Å |
| 223 | G | 90.4 | Very high | 85.6 | Confident | 14 Ų | 14 | 73.9 Ų | 73.9 | 14% | 0.144 | 42% | 0.422 | C | S | . | . | trans | -53.3 | 150.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S232 E303 | G223-S232 PolarHBondContact N-O 2.95Å; G223-E303 WeakPolarHBondContact CA-OE1 3.42Å | ||
| 224 | R | 90.4 | Very high | 86.1 | Confident | 94 Ų | 94 | 71.4 Ų | 71.4 | 36% | 0.355 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -82 | -32.6 | 166.4 | -170.5 | 172.9 | -60.6 | -92.5 | 2.9 | 112.5 | S298 L299 E303 | R224-S298 WeakPolarHBondContact CD-OG 3.49Å; R224-S298 VanDerWaalsContact CZ-CB 3.47Å; R224-S298 PolarHBondContact NE-O 2.91Å; R224-S298 PolarHBondContact NE-OG 3.24Å; R224-S298 PolarHBondContact NH2-O 3.21Å; R224-L299 HydrophobicContact CB-CD2 4.46Å; R224-E303 WeakPolarHBondContact CA-OE1 3.45Å; R224-E303 PolarHBondContact N-OE1 3.37Å; R224-E303 PolarHBondContact N-OE2 2.9Å |
| 225 | L | 89.3 | Confident | 86.7 | Confident | 95 Ų | 95 | 74.7 Ų | 74.7 | 50% | 0.497 | 42% | 0.415 | S | S | . | . | S | Bend | trans | -99.5 | -3.2 | -174.4 | -53.9 | 179.9 | 0 | 0 | 0 | 113.1 | L299 E303 L307 | L225-L299 HydrophobicContact CD1-CD2 4.21Å; L225-L299 HydrophobicContact CG-CD2 4.36Å; L225-E303 PolarHBondContact N-OE1 2.87Å; L225-L307 HydrophobicContact CD1-CB 4.5Å; L225-L307 HydrophobicContact CD1-CD1 3.99Å; L225-L307 HydrophobicContact CD1-CD2 3.92Å; L225-L307 HydrophobicContact CD1-CG 4.35Å |
| 226 | S | 84.7 | Confident | 87.1 | Confident | 33 Ų | 33 | 71.5 Ų | 71.5 | 23% | 0.231 | 40% | 0.395 | C | S | . | . | trans | -67.7 | 127.7 | 176 | -69.4 | 0 | 0 | 0 | 0 | 112.6 | S230 S232 | S226-S230 WeakPolarHBondContact CB-O 3.2Å; S226-S230 PolarHBondContact OG-O 3.3Å; S226-S232 WeakPolarHBondContact OG-CB 3.25Å; S226-S232 PolarHBondContact OG-N 3.43Å; S226-S232 PolarHBondContact OG-OG 2.76Å | ||
| 227 | L | 83.4 | Confident | 87.3 | Confident | 142 Ų | 142 | 69.2 Ų | 69.2 | 74% | 0.743 | 38% | 0.384 | S | S | * | . | trans | -91.8 | 126.8 | 174.2 | -62.1 | 178.1 | 0 | 0 | 0 | 111.5 | S229 S230 | L227-S229 PolarHBondContact O-N 3.22Å; L227-S230 WeakPolarHBondContact O-CB 3.23Å; L227-S230 PolarHBondContact O-N 3.44Å | ||
| 228 | L | 82.5 | Confident | 87.3 | Confident | 160 Ų | 160 | 65.1 Ų | 65.1 | 84% | 0.838 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.7 | -119 | 169 | -58.9 | 177 | 0 | 0 | 0 | 114.1 | S230 T231 | L228-S230 PolarHBondContact O-N 3.43Å; L228-T231 PolarHBondContact O-OG1 3.14Å |
| 229 | S | 68.4 | Low | 87.3 | Confident | 119 Ų | 119 | 65.1 Ų | 65.1 | 83% | 0.832 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | -22.5 | -177.8 | 44.3 | 0 | 0 | 0 | 0 | 113.8 | L227 T231 | L227-S229 PolarHBondContact O-N 3.22Å; S229-T231 PolarHBondContact O-N 3.47Å |
| 230 | S | 69.3 | Low | 87.3 | Confident | 81 Ų | 81 | 64.4 Ų | 64.4 | 57% | 0.566 | 36% | 0.358 | S | S | * | . | trans | -76.5 | 44.8 | 174.4 | -57.8 | 0 | 0 | 0 | 0 | 112.3 | S226 L227 L228 S232 | S226-S230 WeakPolarHBondContact CB-O 3.2Å; S226-S230 PolarHBondContact OG-O 3.3Å; L227-S230 WeakPolarHBondContact O-CB 3.23Å; L227-S230 PolarHBondContact O-N 3.44Å; L228-S230 PolarHBondContact O-N 3.43Å; S230-S232 VanDerWaalsContact C-N 3.29Å; S230-S232 PolarHBondContact O-N 2.85Å; S230-S232 PolarHBondContact O-OG 2.68Å | ||
| 231 | T | 69.6 | Low | 87.3 | Confident | 79 Ų | 79 | 61.2 Ų | 61.2 | 49% | 0.485 | 34% | 0.336 | S | S | . | . | trans | -73 | 79.2 | -179.1 | -64.9 | 0 | 0 | 0 | 0 | 110.9 | P222 L228 S229 K233 | P222-T231 HydrophobicContact CB-CG2 4.34Å; L228-T231 PolarHBondContact O-OG1 3.14Å; S229-T231 PolarHBondContact O-N 3.47Å; T231-K233 PolarHBondContact O-N 2.69Å | ||
| 232 | S | 82.1 | Confident | 87.3 | Confident | 49 Ų | 49 | 67 Ų | 67 | 34% | 0.343 | 36% | 0.36 | S | S | . | . | trans | -60.4 | 131.1 | 170.6 | -46 | 0 | 0 | 0 | 0 | 110.1 | G223 S226 S230 | G223-S232 PolarHBondContact N-O 2.95Å; S226-S232 WeakPolarHBondContact OG-CB 3.25Å; S226-S232 PolarHBondContact OG-N 3.43Å; S226-S232 PolarHBondContact OG-OG 2.76Å; S230-S232 VanDerWaalsContact C-N 3.29Å; S230-S232 PolarHBondContact O-N 2.85Å; S230-S232 PolarHBondContact O-OG 2.68Å | ||
| 233 | K | 90.9 | Very high | 87.4 | Confident | 158 Ų | 158 | 65.1 Ų | 65.1 | 69% | 0.687 | 35% | 0.346 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 111.7 | 173.7 | -69.9 | 178.6 | -176 | 171.4 | 0 | 109.6 | V221 T231 | V221-K233 CarbonylContact O-C 3.54Å; V221-K233 WeakPolarHBondContact O-CA 3.42Å; T231-K233 PolarHBondContact O-N 2.69Å |
| 234 | Y | 93.7 | Very high | 87.5 | Confident | 25 Ų | 25 | 64.5 Ų | 64.5 | 10% | 0.098 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.2 | 131.1 | -177.9 | -67.8 | -76.4 | 0 | 0 | 0 | 111.4 | S220 V221 V236 V300 G302 E303 H306 | S220-Y234 CarbonylContact C-O 3.59Å; S220-Y234 VanDerWaalsContact CA-O 3.3Å; S220-Y234 WeakPolarHBondContact CA-O 3.37Å; V221-Y234 PolarHBondContact N-O 3.43Å; V221-Y234 PolarHBondContact O-N 3.31Å; Y234-V236 PolarHBondContact O-N 2.72Å; Y234-V300 HydrophobicContact CG-CG2 4.25Å; Y234-G302 VanDerWaalsContact CE1-O 3.29Å; Y234-G302 WeakPolarHBondContact CE1-O 3.36Å; Y234-E303 HydrophobicContact CD1-CB 4.22Å; Y234-E303 HydrophobicContact CD2-CB 3.85Å; Y234-E303 HydrophobicContact CD2-CG 4.35Å; Y234-E303 HydrophobicContact CE1-CB 4.13Å; Y234-E303 HydrophobicContact CE2-CB 3.75Å; Y234-E303 HydrophobicContact CE2-CG 3.86Å; Y234-E303 HydrophobicContact CG-CB 4.08Å; Y234-H306 HydrophobicContact CE1-CB 4.28Å; Y234-H306 AromaticContact CE1-CE1 4Å; Y234-H306 AromaticContact CE1-CG 3.84Å; Y234-H306 AromaticContact CE1-ND1 3.5Å; Y234-H306 WeakPolarHBondContact CE1-ND1 3.39Å; Y234-H306 AromaticContact CZ-ND1 3.82Å; Y234-H306 PolarHBondContact OH-ND1 2.83Å |
| 235 | K | 93.9 | Very high | 87.5 | Confident | 131 Ų | 131 | 60.5 Ų | 60.5 | 57% | 0.57 | 32% | 0.324 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.8 | 115.8 | 174.5 | -62.8 | 167.8 | -173.1 | 164.8 | 0 | 108.6 | E31 L217 | E31-K235 IonicContact OE1-NZ 2.87Å; E31-K235 PolarHBondContact OE1-NZ 2.89Å; L217-K235 HydrophobicContact CD1-CB 3.77Å; L217-K235 HydrophobicContact CD1-CG 4.22Å |
| 236 | V | 95.2 | Very high | 87.6 | Confident | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.9 | 120.4 | 172.5 | 178.3 | 0 | 0 | 0 | 0 | 108.8 | F218 C219 V221 Y234 E240 V241 L260 V300 | F218-V236 WeakPolarHBondContact CB-O 3.38Å; F218-V236 PolarHBondContact N-O 3.14Å; C219-V236 PolarHBondContact N-O 3.3Å; C219-V236 WeakPolarHBondContact O-CB 3.27Å; C219-V236 PolarHBondContact O-N 3.47Å; V221-V236 HydrophobicContact CG1-CG2 3.87Å; V221-V236 HydrophobicContact CG2-CG2 3.86Å; Y234-V236 PolarHBondContact O-N 2.72Å; V236-E240 HydrophobicContact CG1-CB 4.41Å; V236-E240 HydrophobicContact CG1-CG 4.34Å; V236-V241 HydrophobicContact CG1-CG2 3.78Å; V236-L260 HydrophobicContact CB-CD2 4.22Å; V236-L260 HydrophobicContact CG1-CD2 3.74Å; V236-L260 HydrophobicContact CG2-CD2 3.82Å; V236-V300 HydrophobicContact CG2-CB 4.12Å; V236-V300 HydrophobicContact CG2-CG1 3.79Å; V236-V300 HydrophobicContact CG2-CG2 4.37Å |
| 237 | T | 94.1 | Very high | 87.8 | Confident | 22 Ų | 22 | 61.1 Ų | 61.1 | 14% | 0.135 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.4 | 162 | -178.8 | 60.1 | 0 | 0 | 0 | 0 | 112.5 | D216 A239 E240 V241 | D216-T237 CarbonylContact O-C 3.57Å; D216-T237 VanDerWaalsContact O-CA 3.29Å; D216-T237 WeakPolarHBondContact O-CA 3.46Å; T237-A239 PolarHBondContact O-N 3.48Å; T237-E240 PolarHBondContact O-N 3.48Å; T237-E240 PolarHBondContact OG1-N 2.93Å; T237-E240 VanDerWaalsContact OG1-N 3.09Å; T237-V241 PolarHBondContact O-N 3.35Å; T237-V241 VanDerWaalsContact O-N 3.15Å |
| 238 | I | 92.4 | Very high | 88.1 | Confident | 12 Ų | 12 | 55.4 Ų | 55.4 | 6% | 0.062 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.9 | -32.1 | 169.8 | -61 | -178.4 | 0 | 0 | 0 | 110.5 | V212 D216 F218 V241 K242 L279 L281 | V212-I238 HydrophobicContact CG1-CD1 3.34Å; V212-I238 HydrophobicContact CG1-CG1 4.49Å; V212-I238 HydrophobicContact CG1-CG2 3.94Å; D216-I238 HydrophobicContact CB-CD1 3.82Å; D216-I238 HydrophobicContact CB-CG1 4.33Å; D216-I238 PolarHBondContact O-N 3.14Å; F218-I238 HydrophobicContact CB-CG1 4.08Å; F218-I238 HydrophobicContact CD2-CG1 4.27Å; I238-V241 PolarHBondContact O-N 3.08Å; I238-K242 VanDerWaalsContact O-CB 3.26Å; I238-K242 WeakPolarHBondContact O-CB 3.47Å; I238-K242 PolarHBondContact O-N 3.44Å; I238-L279 HydrophobicContact CD1-CD1 3.91Å; I238-L279 HydrophobicContact CD1-CD2 3.95Å; I238-L279 HydrophobicContact CD1-CG 4.49Å; I238-L279 HydrophobicContact CG1-CD1 4.36Å; I238-L281 HydrophobicContact CG2-CD1 4.07Å |
| 239 | A | 92.1 | Very high | 88.5 | Confident | 3 Ų | 3 | 48 Ų | 48 | 3% | 0.025 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.2 | -47.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | P214 T237 R243 G367 | P214-A239 HydrophobicContact CB-CB 4.04Å; P214-A239 WeakPolarHBondContact O-CB 3.43Å; P214-A239 PolarHBondContact O-N 2.9Å; T237-A239 PolarHBondContact O-N 3.48Å; A239-R243 WeakPolarHBondContact O-CB 3.49Å; A239-R243 PolarHBondContact O-N 3.12Å; A239-G367 WeakPolarHBondContact CB-O 3.29Å |
| 240 | E | 94.8 | Very high | 89.5 | Confident | 5 Ų | 5 | 43.3 Ų | 43.3 | 2% | 0.023 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -58.6 | -54.2 | 173.2 | 171 | 169.8 | -166.5 | 0 | 0 | 109.6 | V236 T237 K242 R243 R244 V300 E301 | V236-E240 HydrophobicContact CG1-CB 4.41Å; V236-E240 HydrophobicContact CG1-CG 4.34Å; T237-E240 PolarHBondContact O-N 3.48Å; T237-E240 PolarHBondContact OG1-N 2.93Å; T237-E240 VanDerWaalsContact OG1-N 3.09Å; E240-K242 VanDerWaalsContact C-N 3.31Å; E240-K242 PolarHBondContact O-N 3.41Å; E240-R243 WeakPolarHBondContact O-CB 3.48Å; E240-R243 PolarHBondContact O-N 2.97Å; E240-R243 VanDerWaalsContact O-N 3.07Å; E240-R244 HydrophobicContact CG-CG 4.2Å; E240-R244 VanDerWaalsContact O-CG 3.31Å; E240-R244 WeakPolarHBondContact O-CG 3.35Å; E240-R244 PolarHBondContact O-N 3.33Å; E240-R244 IonicContact OE1-NH1 3.58Å; E240-R244 PolarHBondContact OE1-NH1 3.08Å; E240-V300 WeakPolarHBondContact OE1-CA 3.46Å; E240-E301 HydrophobicContact CG-CG 4.29Å; E240-E301 WeakPolarHBondContact CG-OE1 3.49Å; E240-E301 PolarHBondContact OE1-N 3.39Å |
| 241 | V | 93.7 | Very high | 90.5 | Very high | 1 Ų | 1 | 39.7 Ų | 39.7 | 1% | 0.006 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -56.9 | -44.9 | -177.4 | 174.8 | 0 | 0 | 0 | 0 | 111.7 | F218 V236 T237 I238 R244 L245 L256 L260 L276 L281 | F218-V241 HydrophobicContact CB-CG2 4.04Å; F218-V241 HydrophobicContact CD1-CG2 4.28Å; F218-V241 HydrophobicContact CD2-CB 4.34Å; F218-V241 HydrophobicContact CD2-CG1 4.27Å; F218-V241 HydrophobicContact CD2-CG2 4.04Å; F218-V241 HydrophobicContact CE2-CG1 4.29Å; F218-V241 HydrophobicContact CG-CG2 3.84Å; V236-V241 HydrophobicContact CG1-CG2 3.78Å; T237-V241 PolarHBondContact O-N 3.35Å; T237-V241 VanDerWaalsContact O-N 3.15Å; I238-V241 PolarHBondContact O-N 3.08Å; V241-R244 PolarHBondContact O-N 3.02Å; V241-L245 WeakPolarHBondContact O-CG 3.25Å; V241-L245 PolarHBondContact O-N 3.36Å; V241-L256 HydrophobicContact CG1-CD2 4.15Å; V241-L260 HydrophobicContact CG2-CD1 4.15Å; V241-L276 HydrophobicContact CG1-CD2 3.56Å; V241-L281 HydrophobicContact CG1-CD1 4.22Å |
| 242 | K | 91.4 | Very high | 91.4 | Very high | 127 Ų | 127 | 38.1 Ų | 38.1 | 55% | 0.552 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -59.9 | -47 | 175.8 | -176.4 | 173.3 | -177.8 | 173.5 | 0 | 111.6 | I238 E240 R244 L245 S246 L281 | I238-K242 VanDerWaalsContact O-CB 3.26Å; I238-K242 WeakPolarHBondContact O-CB 3.47Å; I238-K242 PolarHBondContact O-N 3.44Å; E240-K242 VanDerWaalsContact C-N 3.31Å; E240-K242 PolarHBondContact O-N 3.41Å; K242-R244 VanDerWaalsContact C-N 3.31Å; K242-R244 PolarHBondContact O-N 3.33Å; K242-L245 PolarHBondContact O-N 3.29Å; K242-S246 PolarHBondContact O-N 3.47Å; K242-S246 PolarHBondContact O-OG 2.94Å; K242-L281 HydrophobicContact CB-CD1 4.35Å; K242-L281 HydrophobicContact CB-CD2 4.03Å; K242-L281 HydrophobicContact CD-CD2 4Å; K242-L281 HydrophobicContact CG-CD2 3.85Å |
| 243 | R | 93.1 | Very high | 91.5 | Very high | 17 Ų | 17 | 36.2 Ų | 36.2 | 6% | 0.064 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.3 | -41.2 | 177.5 | -177.1 | -164.7 | 59.6 | 75.2 | -9.5 | 112 | A239 E240 L245 S246 E249 E301 L388 H391 | A239-R243 WeakPolarHBondContact O-CB 3.49Å; A239-R243 PolarHBondContact O-N 3.12Å; E240-R243 WeakPolarHBondContact O-CB 3.48Å; E240-R243 PolarHBondContact O-N 2.97Å; E240-R243 VanDerWaalsContact O-N 3.07Å; R243-L245 VanDerWaalsContact C-N 3.3Å; R243-L245 PolarHBondContact O-N 3.29Å; R243-S246 WeakPolarHBondContact CA-OG 3.26Å; R243-S246 PolarHBondContact O-N 2.94Å; R243-S246 PolarHBondContact O-OG 3.28Å; R243-E249 IonicContact CZ-OE2 3.78Å; R243-E249 IonicContact NH1-OE2 2.73Å; R243-E249 PolarHBondContact NH1-OE2 2.92Å; R243-E249 IonicContact NH2-OE2 3.75Å; R243-E301 IonicContact CZ-OE1 3.52Å; R243-E301 IonicContact NE-OE1 3.37Å; R243-E301 PolarHBondContact NE-OE1 2.78Å; R243-E301 IonicContact NH2-OE1 3.39Å; R243-E301 PolarHBondContact NH2-OE1 3.02Å; R243-L388 HydrophobicContact CG-CD1 4.45Å; R243-L388 HydrophobicContact CG-CD2 4.24Å; R243-L388 PolarHBondContact NH1-O 3.48Å; R243-H391 PolarHBondContact NH2-CD2 2.83Å |
| 244 | R | 92.9 | Very high | 91.2 | Very high | 2 Ų | 2 | 33.3 Ų | 33.3 | 1% | 0.008 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -75.1 | -18.5 | -177.5 | -59 | -167.7 | 79.4 | 168.6 | -3.4 | 113.4 | E240 V241 K242 E249 L251 T297 L299 H391 | E240-R244 HydrophobicContact CG-CG 4.2Å; E240-R244 VanDerWaalsContact O-CG 3.31Å; E240-R244 WeakPolarHBondContact O-CG 3.35Å; E240-R244 PolarHBondContact O-N 3.33Å; E240-R244 IonicContact OE1-NH1 3.58Å; E240-R244 PolarHBondContact OE1-NH1 3.08Å; V241-R244 PolarHBondContact O-N 3.02Å; K242-R244 VanDerWaalsContact C-N 3.31Å; K242-R244 PolarHBondContact O-N 3.33Å; R244-E249 WeakPolarHBondContact CG-OE2 3.33Å; R244-E249 IonicContact CZ-OE1 2.77Å; R244-E249 IonicContact CZ-OE2 2.73Å; R244-E249 IonicContact NE-OE1 3.37Å; R244-E249 PolarHBondContact NE-OE1 3.36Å; R244-E249 VanDerWaalsContact NE-OE1 3.09Å; R244-E249 IonicContact NE-OE2 3.57Å; R244-E249 PolarHBondContact NE-OE2 3.44Å; R244-E249 IonicContact NH2-OE1 3.09Å; R244-E249 PolarHBondContact NH2-OE1 2.94Å; R244-E249 IonicContact NH2-OE2 2.71Å; R244-L251 HydrophobicContact CB-CD1 4.01Å; R244-L251 HydrophobicContact CB-CG 4.34Å; R244-L251 WeakPolarHBondContact O-CB 3.41Å; R244-L251 WeakPolarHBondContact O-CG 3.49Å; R244-L251 PolarHBondContact O-N 3.05Å; R244-T297 PolarHBondContact NH2-O 3.22Å; R244-L299 PolarHBondContact NH1-O 2.76Å; R244-H391 VanDerWaalsContact CZ-CD2 3.49Å; R244-H391 PolarHBondContact NE-NE2 2.92Å; R244-H391 PolarHBondContact NH2-NE2 3.05Å |
| 245 | L | 90.8 | Very high | 91 | Very high | 9 Ų | 9 | 34.6 Ų | 34.6 | 5% | 0.047 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -84.1 | -24.5 | 171.2 | -65.5 | -172.7 | 0 | 0 | 0 | 113.7 | V241 K242 R243 L251 L256 L276 L281 L283 R287 | V241-L245 WeakPolarHBondContact O-CG 3.25Å; V241-L245 PolarHBondContact O-N 3.36Å; K242-L245 PolarHBondContact O-N 3.29Å; R243-L245 VanDerWaalsContact C-N 3.3Å; R243-L245 PolarHBondContact O-N 3.29Å; L245-L251 WeakPolarHBondContact CD2-O 3.19Å; L245-L256 HydrophobicContact CD2-CD2 3.96Å; L245-L276 HydrophobicContact CD1-CD1 4.35Å; L245-L276 HydrophobicContact CD1-CD2 4.1Å; L245-L281 HydrophobicContact CD1-CB 4.43Å; L245-L283 HydrophobicContact CD1-CB 4.33Å; L245-L283 HydrophobicContact CD1-CD2 4.48Å; L245-L283 HydrophobicContact CD2-CD1 3.77Å; L245-L283 HydrophobicContact CD2-CD2 3.85Å; L245-L283 HydrophobicContact CD2-CG 4.31Å; L245-R287 PolarHBondContact O-NH1 3.05Å |
| 246 | S | 89.6 | Confident | 90.8 | Very high | 48 Ų | 48 | 28.4 Ų | 28.4 | 34% | 0.336 | 17% | 0.165 | S | C | . | . | S | Bend | trans | -85 | 172.8 | 171.3 | 51.2 | 0 | 0 | 0 | 0 | 112.4 | K242 R243 E249 C250 | K242-S246 PolarHBondContact O-N 3.47Å; K242-S246 PolarHBondContact O-OG 2.94Å; R243-S246 WeakPolarHBondContact CA-OG 3.26Å; R243-S246 PolarHBondContact O-N 2.94Å; R243-S246 PolarHBondContact O-OG 3.28Å; S246-E249 PolarHBondContact O-N 3.01Å; S246-C250 PolarHBondContact O-N 3.04Å |
| 247 | P | 89.4 | Confident | 90.6 | Very high | 94 Ų | 94 | 28.7 Ų | 28.7 | 61% | 0.61 | 17% | 0.168 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -54 | 149.2 | 162.3 | -25.1 | 35.2 | 0 | 0 | 0 | 111 | C250 | P247-C250 VanDerWaalsContact N-SG 3.38Š|
| 248 | P | 90.8 | Very high | 90.5 | Very high | 21 Ų | 21 | 29 Ų | 29 | 14% | 0.136 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | cis | -81.9 | -22.4 | 5.9 | 31.6 | -36.1 | 0 | 0 | 0 | 115.1 | A290 A291 L388 I389 | P248-A290 WeakPolarHBondContact O-CB 3.48Å; P248-A291 PolarHBondContact O-N 3.4Å; P248-L388 HydrophobicContact CG-CB 3.97Å; P248-I389 HydrophobicContact CB-CG2 3.74Å; P248-I389 HydrophobicContact CG-CG2 3.4Å; P248-I389 VanDerWaalsContact CG-CG2 3.4Å |
| 249 | E | 90.8 | Very high | 90.5 | Very high | 5 Ų | 5 | 29 Ų | 29 | 2% | 0.023 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -43.9 | -171.3 | -69.5 | -176 | 75.5 | 0 | 0 | 113.4 | R243 R244 S246 L251 A290 H391 | R243-E249 IonicContact CZ-OE2 3.78Å; R243-E249 IonicContact NH1-OE2 2.73Å; R243-E249 PolarHBondContact NH1-OE2 2.92Å; R243-E249 IonicContact NH2-OE2 3.75Å; R244-E249 WeakPolarHBondContact CG-OE2 3.33Å; R244-E249 IonicContact CZ-OE1 2.77Å; R244-E249 IonicContact CZ-OE2 2.73Å; R244-E249 IonicContact NE-OE1 3.37Å; R244-E249 PolarHBondContact NE-OE1 3.36Å; R244-E249 VanDerWaalsContact NE-OE1 3.09Å; R244-E249 IonicContact NE-OE2 3.57Å; R244-E249 PolarHBondContact NE-OE2 3.44Å; R244-E249 IonicContact NH2-OE1 3.09Å; R244-E249 PolarHBondContact NH2-OE1 2.94Å; R244-E249 IonicContact NH2-OE2 2.71Å; S246-E249 PolarHBondContact O-N 3.01Å; E249-L251 VanDerWaalsContact C-N 3.32Å; E249-L251 HydrophobicContact CB-CD2 3.92Å; E249-L251 HydrophobicContact CB-CG 3.91Å; E249-L251 PolarHBondContact O-N 2.98Å; E249-A290 PolarHBondContact O-N 3.36Å; E249-H391 IonicContact OE1-CE1 2.89Å; E249-H391 IonicContact OE1-NE2 2.77Å; E249-H391 PolarHBondContact OE1-NE2 3.18Å; E249-H391 IonicContact OE2-CD2 3.14Å; E249-H391 IonicContact OE2-CE1 2.76Å; E249-H391 IonicContact OE2-NE2 3Å; E249-H391 PolarHBondContact OE2-NE2 3.39Å |
| 250 | C | 89.9 | Confident | 90.5 | Very high | 21 Ų | 21 | 29 Ų | 29 | 14% | 0.142 | 18% | 0.176 | C | C | . | . | trans | 48.5 | 47.8 | -173 | -68.1 | 0 | 0 | 0 | 0 | 113.3 | S246 P247 A290 | S246-C250 PolarHBondContact O-N 3.04Å; P247-C250 VanDerWaalsContact N-SG 3.38Å; C250-A290 HydrophobicContact CB-CB 3.66Å | ||
| 251 | L | 89.9 | Confident | 90.1 | Very high | 4 Ų | 4 | 33.3 Ų | 33.3 | 2% | 0.021 | 19% | 0.191 | C | C | . | . | trans | -61.5 | 145.4 | -174.1 | -62.9 | -169.9 | 0 | 0 | 0 | 112.9 | R244 L245 E249 L255 I259 T297 | R244-L251 HydrophobicContact CB-CD1 4.01Å; R244-L251 HydrophobicContact CB-CG 4.34Å; R244-L251 WeakPolarHBondContact O-CB 3.41Å; R244-L251 WeakPolarHBondContact O-CG 3.49Å; R244-L251 PolarHBondContact O-N 3.05Å; L245-L251 WeakPolarHBondContact CD2-O 3.19Å; E249-L251 VanDerWaalsContact C-N 3.32Å; E249-L251 HydrophobicContact CB-CD2 3.92Å; E249-L251 HydrophobicContact CB-CG 3.91Å; E249-L251 PolarHBondContact O-N 2.98Å; L251-L255 HydrophobicContact CD2-CB 4.37Å; L251-L255 HydrophobicContact CD2-CD1 4.13Å; L251-I259 HydrophobicContact CD1-CD1 3.39Å; L251-T297 HydrophobicContact CD2-CG2 4.32Å | ||
| 252 | N | 87.2 | Confident | 89.4 | Confident | 47 Ų | 47 | 36.4 Ų | 36.4 | 25% | 0.251 | 20% | 0.203 | S | C | . | . | trans | -87.8 | 166.5 | 168.5 | 70.1 | 41.6 | 0 | 0 | 0 | 111.5 | S254 L255 L256 | N252-S254 PolarHBondContact O-N 3Å; N252-S254 PolarHBondContact OD1-N 3.46Å; N252-S254 VanDerWaalsContact OD1-N 3.11Å; N252-L255 PolarHBondContact O-N 3.35Å; N252-L255 PolarHBondContact OD1-N 2.94Å; N252-L256 WeakPolarHBondContact O-CB 3.42Å; N252-L256 PolarHBondContact O-N 3.48Å | ||
| 253 | A | 85.3 | Confident | 88.4 | Confident | 9 Ų | 9 | 33.6 Ų | 33.6 | 7% | 0.074 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.7 | -30.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114 | G257 L283 | A253-G257 PolarHBondContact O-N 2.76Å; A253-L283 HydrophobicContact CB-CD2 3.75Å; A253-L283 HydrophobicContact CB-CG 4.42Å |
| 254 | S | 84.3 | Confident | 87.3 | Confident | 96 Ų | 96 | 42.8 Ų | 42.8 | 67% | 0.671 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -73.1 | -44.9 | -179.8 | -50.7 | 0 | 0 | 0 | 0 | 111.6 | N252 G257 G258 | N252-S254 PolarHBondContact O-N 3Å; N252-S254 PolarHBondContact OD1-N 3.46Å; N252-S254 VanDerWaalsContact OD1-N 3.11Å; S254-G257 PolarHBondContact O-N 2.76Å; S254-G258 PolarHBondContact O-N 2.61Å |
| 255 | L | 89.2 | Confident | 86.5 | Confident | 53 Ų | 53 | 46 Ų | 46 | 28% | 0.277 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -63.4 | -48.8 | 174.6 | -69.7 | 172.2 | 0 | 0 | 0 | 110.8 | L251 N252 G257 G258 I259 V293 | L251-L255 HydrophobicContact CD2-CB 4.37Å; L251-L255 HydrophobicContact CD2-CD1 4.13Å; N252-L255 PolarHBondContact O-N 3.35Å; N252-L255 PolarHBondContact OD1-N 2.94Å; L255-G257 VanDerWaalsContact C-N 3.33Å; L255-G257 PolarHBondContact O-N 3.1Å; L255-G258 PolarHBondContact O-N 2.84Å; L255-G258 VanDerWaalsContact O-N 3.09Å; L255-I259 WeakPolarHBondContact O-CD1 3.33Å; L255-I259 WeakPolarHBondContact O-CG1 3.37Å; L255-I259 PolarHBondContact O-N 3.48Å; L255-V293 HydrophobicContact CD1-CG2 4.19Å; L255-V293 HydrophobicContact CD2-CG2 4.44Å |
| 256 | L | 90.9 | Very high | 85.9 | Confident | 1 Ų | 1 | 55.6 Ų | 55.6 | 1% | 0.005 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.3 | -41.6 | 176.8 | -174.4 | 65.6 | 0 | 0 | 0 | 111.7 | V241 L245 N252 G258 L260 L272 L276 L283 | V241-L256 HydrophobicContact CG1-CD2 4.15Å; L245-L256 HydrophobicContact CD2-CD2 3.96Å; N252-L256 WeakPolarHBondContact O-CB 3.42Å; N252-L256 PolarHBondContact O-N 3.48Å; L256-G258 VanDerWaalsContact C-N 3.32Å; L256-G258 PolarHBondContact O-N 2.98Å; L256-L260 HydrophobicContact CD1-CD1 3.71Å; L256-L260 HydrophobicContact CD1-CG 4.11Å; L256-L260 HydrophobicContact CG-CD1 3.85Å; L256-L260 HydrophobicContact CG-CG 4.43Å; L256-L260 VanDerWaalsContact O-CB 3.31Å; L256-L260 WeakPolarHBondContact O-CB 3.45Å; L256-L260 VanDerWaalsContact O-CG 3.24Å; L256-L260 WeakPolarHBondContact O-CG 3.38Å; L256-L260 PolarHBondContact O-N 2.73Å; L256-L272 HydrophobicContact CB-CD2 4.45Å; L256-L272 HydrophobicContact CD2-CD1 4.49Å; L256-L272 HydrophobicContact CD2-CD2 4.31Å; L256-L272 HydrophobicContact CG-CD2 4.33Å; L256-L276 HydrophobicContact CD2-CD1 4.21Å; L256-L283 HydrophobicContact CD2-CD2 4.47Å |
| 257 | G | 90.6 | Very high | 85.5 | Confident | 5 Ų | 5 | 57.8 Ų | 57.8 | 5% | 0.052 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.6 | -32.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | A253 S254 L255 R261 R262 A263 | A253-G257 PolarHBondContact O-N 2.76Å; S254-G257 PolarHBondContact O-N 2.76Å; L255-G257 VanDerWaalsContact C-N 3.33Å; L255-G257 PolarHBondContact O-N 3.1Å; G257-R261 PolarHBondContact O-N 2.89Å; G257-R262 PolarHBondContact O-N 3.01Å; G257-A263 PolarHBondContact O-N 3.28Å |
| 258 | G | 90.7 | Very high | 85.1 | Confident | 30 Ų | 30 | 53.7 Ų | 53.7 | 31% | 0.309 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -74 | -39.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | S254 L255 L256 R261 | S254-G258 PolarHBondContact O-N 2.61Å; L255-G258 PolarHBondContact O-N 2.84Å; L255-G258 VanDerWaalsContact O-N 3.09Å; L256-G258 VanDerWaalsContact C-N 3.32Å; L256-G258 PolarHBondContact O-N 2.98Å; G258-R261 PolarHBondContact O-N 3.3Å |
| 259 | I | 92.6 | Very high | 84.7 | Confident | 10 Ų | 10 | 54.8 Ų | 54.8 | 5% | 0.051 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.3 | -52.8 | 170.7 | -68.1 | 154.7 | 0 | 0 | 0 | 109.5 | L251 L255 R261 T297 V300 | L251-I259 HydrophobicContact CD1-CD1 3.39Å; L255-I259 WeakPolarHBondContact O-CD1 3.33Å; L255-I259 WeakPolarHBondContact O-CG1 3.37Å; L255-I259 PolarHBondContact O-N 3.48Å; I259-R261 WeakPolarHBondContact O-CD 3.2Å; I259-R261 PolarHBondContact O-N 3.15Å; I259-T297 WeakPolarHBondContact CD1-O 3.36Å; I259-T297 WeakPolarHBondContact CG1-O 3.3Å; I259-V300 HydrophobicContact CG2-CG1 3.66Å |
| 260 | L | 91.9 | Very high | 84.4 | Confident | 5 Ų | 5 | 62.2 Ų | 62.2 | 3% | 0.026 | 33% | 0.334 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | 18.3 | -177.2 | -54.5 | -179.2 | 0 | 0 | 0 | 113.9 | F218 V221 V236 V241 L256 R262 V300 | F218-L260 HydrophobicContact CD1-CD1 4.46Å; F218-L260 HydrophobicContact CE1-CD1 4.44Å; V221-L260 HydrophobicContact CG1-CB 4.41Å; V221-L260 HydrophobicContact CG1-CD2 4.08Å; V236-L260 HydrophobicContact CB-CD2 4.22Å; V236-L260 HydrophobicContact CG1-CD2 3.74Å; V236-L260 HydrophobicContact CG2-CD2 3.82Å; V241-L260 HydrophobicContact CG2-CD1 4.15Å; L256-L260 HydrophobicContact CD1-CD1 3.71Å; L256-L260 HydrophobicContact CD1-CG 4.11Å; L256-L260 HydrophobicContact CG-CD1 3.85Å; L256-L260 HydrophobicContact CG-CG 4.43Å; L256-L260 VanDerWaalsContact O-CB 3.31Å; L256-L260 WeakPolarHBondContact O-CB 3.45Å; L256-L260 VanDerWaalsContact O-CG 3.24Å; L256-L260 WeakPolarHBondContact O-CG 3.38Å; L256-L260 PolarHBondContact O-N 2.73Å; L260-R262 VanDerWaalsContact CB-NH2 3.33Å; L260-R262 PolarHBondContact O-N 3.43Å; L260-R262 PolarHBondContact O-NH1 2.81Å; L260-V300 HydrophobicContact CD2-CG1 4.29Å |
| 261 | R | 88.3 | Confident | 84.2 | Confident | 94 Ų | 94 | 62.7 Ų | 62.7 | 36% | 0.355 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.3 | 10.4 | 172.1 | -49.1 | -50.8 | -159.7 | 158 | 11.6 | 117 | V221 P222 G257 G258 I259 | V221-R261 HydrophobicContact CB-CG 4.36Å; P222-R261 HydrophobicContact CG-CG 4.14Å; G257-R261 PolarHBondContact O-N 2.89Å; G258-R261 PolarHBondContact O-N 3.3Å; I259-R261 WeakPolarHBondContact O-CD 3.2Å; I259-R261 PolarHBondContact O-N 3.15Å |
| 262 | R | 78.7 | Confident | 84.1 | Confident | 66 Ų | 66 | 62.7 Ų | 62.7 | 25% | 0.249 | 34% | 0.337 | C | S | . | . | trans | -94.6 | -1.7 | -178.6 | -72.4 | -175.1 | -59.8 | -79.6 | -4.4 | 114.9 | C219 G257 L260 K264 | C219-R262 PolarHBondContact SG-NH1 3.49Å; G257-R262 PolarHBondContact O-N 3.01Å; L260-R262 VanDerWaalsContact CB-NH2 3.33Å; L260-R262 PolarHBondContact O-N 3.43Å; L260-R262 PolarHBondContact O-NH1 2.81Å; R262-K264 PolarHBondContact O-N 3.43Å | ||
| 263 | A | 70.5 | Confident | 84.2 | Confident | 69 Ų | 69 | 64.1 Ų | 64.1 | 57% | 0.57 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | -9.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | G257 | G257-A263 PolarHBondContact O-N 3.28Š|
| 264 | K | 69.8 | Low | 84.4 | Confident | 210 Ų | 210 | 67.9 Ų | 67.9 | 91% | 0.913 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87 | -11.5 | -177.7 | -70.1 | -168.2 | 175.7 | -172.4 | 0 | 115.3 | R262 | R262-K264 PolarHBondContact O-N 3.43Š|
| 265 | S | 74.6 | Confident | 84.7 | Confident | 69 Ų | 69 | 65.9 Ų | 65.9 | 48% | 0.483 | 33% | 0.334 | S | S | . | . | S | Bend | trans | -95.8 | 140.2 | -178.1 | 64 | 0 | 0 | 0 | 0 | 112.7 | N267 G268 | S265-N267 PolarHBondContact O-N 2.82Å; S265-G268 PolarHBondContact O-N 3.08Å; S265-G268 VanDerWaalsContact OG-CA 3.26Å; S265-G268 WeakPolarHBondContact OG-CA 3.44Å; S265-G268 PolarHBondContact OG-N 3.12Å |
| 266 | K | 78.8 | Confident | 84.7 | Confident | 210 Ų | 210 | 63.3 Ų | 63.3 | 91% | 0.913 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.2 | -35.3 | -176.7 | -173.7 | 176.5 | 179.8 | 178.9 | 0 | 113.9 | ||
| 267 | N | 81.9 | Confident | 84.7 | Confident | 95 Ų | 95 | 67.7 Ų | 67.7 | 51% | 0.508 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.8 | 2.7 | -179.9 | -64.2 | -19.1 | 0 | 0 | 0 | 113.7 | S265 G269 R270 C271 | S265-N267 PolarHBondContact O-N 2.82Å; N267-G269 VanDerWaalsContact C-N 3.31Å; N267-G269 PolarHBondContact O-N 2.78Å; N267-R270 WeakPolarHBondContact O-CB 3.4Å; N267-R270 PolarHBondContact O-N 2.95Å; N267-C271 PolarHBondContact O-N 2.94Å |
| 268 | G | 80.3 | Confident | 84.7 | Confident | 8 Ų | 8 | 75.7 Ų | 75.7 | 8% | 0.082 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -59.5 | -36.7 | -169.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | S265 R270 L272 | S265-G268 PolarHBondContact O-N 3.08Å; S265-G268 VanDerWaalsContact OG-CA 3.26Å; S265-G268 WeakPolarHBondContact OG-CA 3.44Å; S265-G268 PolarHBondContact OG-N 3.12Å; G268-R270 VanDerWaalsContact C-N 3.33Å; G268-R270 PolarHBondContact O-N 3.08Å; G268-L272 VanDerWaalsContact O-CB 3.24Å; G268-L272 WeakPolarHBondContact O-CB 3.41Å; G268-L272 PolarHBondContact O-N 3.08Å |
| 269 | G | 82.4 | Confident | 84.6 | Confident | 43 Ų | 43 | 76.3 Ų | 76.3 | 44% | 0.443 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -71.1 | -22.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | N267 R273 | N267-G269 VanDerWaalsContact C-N 3.31Å; N267-G269 PolarHBondContact O-N 2.78Å; G269-R273 WeakPolarHBondContact O-CD 3.37Å; G269-R273 WeakPolarHBondContact O-CG 3.17Å |
| 270 | R | 85.3 | Confident | 84.3 | Confident | 162 Ų | 162 | 79.1 Ų | 79.1 | 61% | 0.611 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -83.2 | -53 | 175.2 | -166.5 | -165 | -69.8 | 176.7 | -3.6 | 110.4 | N267 G268 L272 R273 E274 | N267-R270 WeakPolarHBondContact O-CB 3.4Å; N267-R270 PolarHBondContact O-N 2.95Å; G268-R270 VanDerWaalsContact C-N 3.33Å; G268-R270 PolarHBondContact O-N 3.08Å; R270-L272 PolarHBondContact O-N 3.21Å; R270-R273 WeakPolarHBondContact O-CA 3.43Å; R270-R273 WeakPolarHBondContact O-CB 3.21Å; R270-R273 PolarHBondContact O-N 2.67Å; R270-E274 WeakPolarHBondContact CD-OE1 3.31Å; R270-E274 VanDerWaalsContact CG-OE1 3.23Å; R270-E274 WeakPolarHBondContact CG-OE1 3.5Å; R270-E274 WeakPolarHBondContact O-CG 3.32Å; R270-E274 PolarHBondContact O-N 2.96Å |
| 271 | C | 85.9 | Confident | 84.1 | Confident | 30 Ų | 30 | 79.9 Ų | 79.9 | 20% | 0.203 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -55.5 | -35.8 | 175.2 | 172.2 | 0 | 0 | 0 | 0 | 112.2 | N267 K275 | N267-C271 PolarHBondContact O-N 2.94Å; C271-K275 WeakPolarHBondContact O-CB 3.47Å; C271-K275 PolarHBondContact O-N 3.34Å |
| 272 | L | 88.3 | Confident | 83.7 | Confident | 4 Ų | 4 | 80.9 Ų | 80.9 | 2% | 0.021 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 172.6 | -179 | 54.4 | 0 | 0 | 0 | 112.8 | F218 L256 G268 R270 L276 | F218-L272 HydrophobicContact CE1-CD1 4.18Å; F218-L272 HydrophobicContact CZ-CD1 3.9Å; L256-L272 HydrophobicContact CB-CD2 4.45Å; L256-L272 HydrophobicContact CD2-CD1 4.49Å; L256-L272 HydrophobicContact CD2-CD2 4.31Å; L256-L272 HydrophobicContact CG-CD2 4.33Å; G268-L272 VanDerWaalsContact O-CB 3.24Å; G268-L272 WeakPolarHBondContact O-CB 3.41Å; G268-L272 PolarHBondContact O-N 3.08Å; R270-L272 PolarHBondContact O-N 3.21Å; L272-L276 HydrophobicContact CD1-CD1 4.09Å; L272-L276 HydrophobicContact CD1-CG 4.27Å; L272-L276 HydrophobicContact CG-CD1 4.05Å; L272-L276 WeakPolarHBondContact O-CB 3.46Å; L272-L276 WeakPolarHBondContact O-CD1 3.45Å; L272-L276 WeakPolarHBondContact O-CG 3.48Å; L272-L276 PolarHBondContact O-N 3.22Å |
| 273 | R | 88.4 | Confident | 83.7 | Confident | 78 Ų | 78 | 78.1 Ų | 78.1 | 29% | 0.294 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -67 | -52.2 | 177.1 | -67.8 | 169.1 | -177.5 | -77.6 | 1.1 | 110.4 | G269 R270 K275 L276 D277 L283 | G269-R273 WeakPolarHBondContact O-CD 3.37Å; G269-R273 WeakPolarHBondContact O-CG 3.17Å; R270-R273 WeakPolarHBondContact O-CA 3.43Å; R270-R273 WeakPolarHBondContact O-CB 3.21Å; R270-R273 PolarHBondContact O-N 2.67Å; R273-K275 PolarHBondContact O-N 3.04Å; R273-K275 VanDerWaalsContact O-N 3.14Å; R273-L276 CarbonylContact O-C 3.49Å; R273-L276 WeakPolarHBondContact O-CA 3.48Å; R273-L276 WeakPolarHBondContact O-CB 3.35Å; R273-L276 PolarHBondContact O-N 3.42Å; R273-D277 VanDerWaalsContact O-CG 3.22Å; R273-D277 PolarHBondContact O-N 3.42Å; R273-D277 VanDerWaalsContact O-OD2 3.04Å; R273-L283 PolarHBondContact NH1-O 2.98Å |
| 274 | E | 89.5 | Confident | 83.7 | Confident | 88 Ų | 88 | 77.2 Ų | 77.2 | 41% | 0.411 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -52.7 | -39.8 | 176.8 | -66.5 | 163.5 | -176.4 | 0 | 0 | 112.5 | R270 R278 | R270-E274 WeakPolarHBondContact CD-OE1 3.31Å; R270-E274 VanDerWaalsContact CG-OE1 3.23Å; R270-E274 WeakPolarHBondContact CG-OE1 3.5Å; R270-E274 WeakPolarHBondContact O-CG 3.32Å; R270-E274 PolarHBondContact O-N 2.96Å; E274-R278 WeakPolarHBondContact O-CB 3.45Å; E274-R278 WeakPolarHBondContact O-CG 3.48Å; E274-R278 PolarHBondContact O-N 2.81Å; E274-R278 VanDerWaalsContact O-N 3.12Å |
| 275 | K | 89.7 | Confident | 83.7 | Confident | 53 Ų | 53 | 71.2 Ų | 71.2 | 23% | 0.23 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -71.8 | -35.9 | 174.9 | -178.1 | 166.2 | 177.6 | 167.4 | 0 | 113.2 | F218 C271 R273 L279 | F218-K275 HydrophobicContact CE1-CD 3.97Å; F218-K275 HydrophobicContact CE1-CG 4.5Å; F218-K275 HydrophobicContact CE2-CD 4.3Å; F218-K275 HydrophobicContact CE2-CG 4.07Å; F218-K275 HydrophobicContact CZ-CB 4.38Å; F218-K275 HydrophobicContact CZ-CD 3.74Å; F218-K275 HydrophobicContact CZ-CG 3.77Å; F218-K275 PolarHBondContact O-NZ 2.91Å; C271-K275 WeakPolarHBondContact O-CB 3.47Å; C271-K275 PolarHBondContact O-N 3.34Å; R273-K275 PolarHBondContact O-N 3.04Å; R273-K275 VanDerWaalsContact O-N 3.14Å; K275-L279 HydrophobicContact CG-CD1 4.36Å; K275-L279 WeakPolarHBondContact O-CD1 3.49Å; K275-L279 VanDerWaalsContact O-CG 3.28Å; K275-L279 WeakPolarHBondContact O-CG 3.38Å |
| 276 | L | 90.8 | Very high | 83.3 | Confident | 0 Ų | 0 | 71.7 Ų | 71.7 | 0% | 0 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -68.6 | -43 | 175.1 | -74 | 166.7 | 0 | 0 | 0 | 111.4 | F218 V241 L245 L256 L272 R273 L279 G280 L281 L283 | F218-L276 HydrophobicContact CE2-CD2 3.84Å; F218-L276 HydrophobicContact CE2-CG 4.39Å; F218-L276 HydrophobicContact CZ-CD2 4.27Å; F218-L276 HydrophobicContact CZ-CG 4.45Å; V241-L276 HydrophobicContact CG1-CD2 3.56Å; L245-L276 HydrophobicContact CD1-CD1 4.35Å; L245-L276 HydrophobicContact CD1-CD2 4.1Å; L256-L276 HydrophobicContact CD2-CD1 4.21Å; L272-L276 HydrophobicContact CD1-CD1 4.09Å; L272-L276 HydrophobicContact CD1-CG 4.27Å; L272-L276 HydrophobicContact CG-CD1 4.05Å; L272-L276 WeakPolarHBondContact O-CB 3.46Å; L272-L276 WeakPolarHBondContact O-CD1 3.45Å; L272-L276 WeakPolarHBondContact O-CG 3.48Å; L272-L276 PolarHBondContact O-N 3.22Å; R273-L276 CarbonylContact O-C 3.49Å; R273-L276 WeakPolarHBondContact O-CA 3.48Å; R273-L276 WeakPolarHBondContact O-CB 3.35Å; R273-L276 PolarHBondContact O-N 3.42Å; L276-L279 CarbonylContact O-C 3.56Å; L276-L279 WeakPolarHBondContact O-CA 3.49Å; L276-L279 WeakPolarHBondContact O-CB 3.31Å; L276-L279 PolarHBondContact O-N 3.12Å; L276-G280 PolarHBondContact O-N 2.91Å; L276-L281 HydrophobicContact CB-CB 4.21Å; L276-L281 WeakPolarHBondContact CB-O 3.47Å; L276-L281 HydrophobicContact CD2-CB 3.92Å; L276-L281 HydrophobicContact CD2-CD1 3.87Å; L276-L281 PolarHBondContact O-N 3Å; L276-L283 HydrophobicContact CD1-CB 4.11Å; L276-L283 HydrophobicContact CD1-CD2 3.64Å |
| 277 | D | 89.5 | Confident | 83 | Confident | 93 Ų | 93 | 65.9 Ų | 65.9 | 50% | 0.497 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.2 | -41.8 | 179.1 | -60.6 | -38.6 | 0 | 0 | 0 | 111.2 | R273 L279 G280 | R273-D277 VanDerWaalsContact O-CG 3.22Å; R273-D277 PolarHBondContact O-N 3.42Å; R273-D277 VanDerWaalsContact O-OD2 3.04Å; D277-L279 PolarHBondContact O-N 3.47Å; D277-L279 VanDerWaalsContact O-N 3.1Å; D277-G280 PolarHBondContact O-N 3.24Å |
| 278 | R | 90.2 | Very high | 82.2 | Confident | 173 Ų | 173 | 72.1 Ų | 72.1 | 65% | 0.653 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | -18.7 | 170.5 | -75.6 | 175 | -168 | -156.7 | 6.3 | 114.2 | E274 | E274-R278 WeakPolarHBondContact O-CB 3.45Å; E274-R278 WeakPolarHBondContact O-CG 3.48Å; E274-R278 PolarHBondContact O-N 2.81Å; E274-R278 VanDerWaalsContact O-N 3.12Å |
| 279 | L | 88.5 | Confident | 81.7 | Confident | 42 Ų | 42 | 76.9 Ų | 76.9 | 22% | 0.22 | 41% | 0.407 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.2 | 8.1 | 178 | -61.9 | 170.8 | 0 | 0 | 0 | 112.8 | V212 F218 I238 K275 L276 D277 L281 | V212-L279 HydrophobicContact CG1-CD2 3.99Å; V212-L279 HydrophobicContact CG2-CB 4.31Å; V212-L279 HydrophobicContact CG2-CD2 3.7Å; F218-L279 HydrophobicContact CD2-CD1 3.76Å; F218-L279 HydrophobicContact CE2-CD1 3.67Å; I238-L279 HydrophobicContact CD1-CD1 3.91Å; I238-L279 HydrophobicContact CD1-CD2 3.95Å; I238-L279 HydrophobicContact CD1-CG 4.49Å; I238-L279 HydrophobicContact CG1-CD1 4.36Å; K275-L279 HydrophobicContact CG-CD1 4.36Å; K275-L279 WeakPolarHBondContact O-CD1 3.49Å; K275-L279 VanDerWaalsContact O-CG 3.28Å; K275-L279 WeakPolarHBondContact O-CG 3.38Å; L276-L279 CarbonylContact O-C 3.56Å; L276-L279 WeakPolarHBondContact O-CA 3.49Å; L276-L279 WeakPolarHBondContact O-CB 3.31Å; L276-L279 PolarHBondContact O-N 3.12Å; D277-L279 PolarHBondContact O-N 3.47Å; D277-L279 VanDerWaalsContact O-N 3.1Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 HydrophobicContact CB-CG 4.46Å; L279-L281 PolarHBondContact O-N 3.41Å |
| 280 | G | 87 | Confident | 81.1 | Confident | 70 Ų | 70 | 78.2 Ų | 78.2 | 72% | 0.722 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.8 | 16.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | L276 D277 | L276-G280 PolarHBondContact O-N 2.91Å; D277-G280 PolarHBondContact O-N 3.24Å |
| 281 | L | 87 | Confident | 80.6 | Confident | 20 Ų | 20 | 71.7 Ų | 71.7 | 11% | 0.105 | 40% | 0.395 | C | S | . | . | trans | -100.3 | 84 | -177.7 | -63.4 | -176.1 | 0 | 0 | 0 | 111.6 | I238 V241 K242 L245 L276 L279 L283 | I238-L281 HydrophobicContact CG2-CD1 4.07Å; V241-L281 HydrophobicContact CG1-CD1 4.22Å; K242-L281 HydrophobicContact CB-CD1 4.35Å; K242-L281 HydrophobicContact CB-CD2 4.03Å; K242-L281 HydrophobicContact CD-CD2 4Å; K242-L281 HydrophobicContact CG-CD2 3.85Å; L245-L281 HydrophobicContact CD1-CB 4.43Å; L276-L281 HydrophobicContact CB-CB 4.21Å; L276-L281 WeakPolarHBondContact CB-O 3.47Å; L276-L281 HydrophobicContact CD2-CB 3.92Å; L276-L281 HydrophobicContact CD2-CD1 3.87Å; L276-L281 PolarHBondContact O-N 3Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 HydrophobicContact CB-CG 4.46Å; L279-L281 PolarHBondContact O-N 3.41Å; L281-L283 PolarHBondContact O-N 3.23Å | ||
| 282 | N | 80.3 | Confident | 80.5 | Confident | 116 Ų | 116 | 76.7 Ų | 76.7 | 62% | 0.62 | 42% | 0.42 | S | S | * | . | trans | -62.6 | 122 | 178.9 | -175.5 | -12.6 | 0 | 0 | 0 | 112.3 | P284 | N282-P284 WeakPolarHBondContact OD1-CD 3.2Š| ||
| 283 | L | 79.3 | Confident | 80.5 | Confident | 7 Ų | 7 | 80.1 Ų | 80.1 | 4% | 0.037 | 44% | 0.441 | C | S | . | . | trans | -119.1 | 89.5 | 172.4 | -179.1 | 47.7 | 0 | 0 | 0 | 110.3 | L245 A253 L256 R273 L276 L281 | L245-L283 HydrophobicContact CD1-CB 4.33Å; L245-L283 HydrophobicContact CD1-CD2 4.48Å; L245-L283 HydrophobicContact CD2-CD1 3.77Å; L245-L283 HydrophobicContact CD2-CD2 3.85Å; L245-L283 HydrophobicContact CD2-CG 4.31Å; A253-L283 HydrophobicContact CB-CD2 3.75Å; A253-L283 HydrophobicContact CB-CG 4.42Å; L256-L283 HydrophobicContact CD2-CD2 4.47Å; R273-L283 PolarHBondContact NH1-O 2.98Å; L276-L283 HydrophobicContact CD1-CB 4.11Å; L276-L283 HydrophobicContact CD1-CD2 3.64Å; L281-L283 PolarHBondContact O-N 3.23Å | ||
| 284 | P | 70.1 | Confident | 80.6 | Confident | 51 Ų | 51 | 79.6 Ų | 79.6 | 33% | 0.331 | 45% | 0.446 | S | S | . | . | trans | -64.5 | 154 | -174.9 | 23.9 | -32.3 | 0 | 0 | 0 | 112.8 | N282 R287 | N282-P284 WeakPolarHBondContact OD1-CD 3.2Å; P284-R287 HydrophobicContact CG-CB 4.44Å | ||
| 285 | A | 69.8 | Low | 80.8 | Confident | 84 Ų | 84 | 82.7 Ų | 82.7 | 69% | 0.694 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.7 | 154.8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | R287 | A285-R287 PolarHBondContact O-N 2.95Å; A285-R287 VanDerWaalsContact O-N 3.08Å |
| 286 | G | 67.3 | Low | 81.1 | Confident | 78 Ų | 78 | 82.3 Ų | 82.3 | 80% | 0.804 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.6 | -3.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 117 | R288 | G286-R288 PolarHBondContact O-N 3.18Å; G286-R288 VanDerWaalsContact O-N 3.12Å |
| 287 | R | 71.3 | Confident | 81.2 | Confident | 88 Ų | 88 | 82.9 Ų | 82.9 | 33% | 0.332 | 47% | 0.468 | S | S | . | . | P | Polyproline II helix | trans | -55.3 | 118.2 | 176.8 | 179.7 | 173 | -72.2 | -173.7 | 3.5 | 111 | L245 P284 A285 | L245-R287 PolarHBondContact O-NH1 3.05Å; P284-R287 HydrophobicContact CG-CB 4.44Å; A285-R287 PolarHBondContact O-N 2.95Å; A285-R287 VanDerWaalsContact O-N 3.08Å |
| 288 | R | 66.2 | Low | 81.3 | Confident | 226 Ų | 226 | 79.8 Ų | 79.8 | 85% | 0.853 | 45% | 0.454 | S | S | * | . | P | Polyproline II helix | trans | -73.5 | 145.8 | 171.9 | -60.7 | -178 | -178.4 | -175.9 | 0.5 | 109.7 | G286 | G286-R288 PolarHBondContact O-N 3.18Å; G286-R288 VanDerWaalsContact O-N 3.12Å |
| 289 | K | 69.1 | Low | 81.6 | Confident | 108 Ų | 108 | 71.9 Ų | 71.9 | 47% | 0.47 | 43% | 0.425 | S | S | . | . | P | Polyproline II helix | trans | -64.2 | 149 | 169.5 | 61.8 | 173.2 | -174.4 | 166.7 | 0 | 109.9 | V293 | K289-V293 HydrophobicContact CD-CG2 4.13Š|
| 290 | A | 70.3 | Confident | 81.9 | Confident | 71 Ų | 71 | 70 Ų | 70 | 59% | 0.587 | 42% | 0.415 | S | S | * | . | trans | -100 | -45.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | P248 E249 C250 | P248-A290 WeakPolarHBondContact O-CB 3.48Å; E249-A290 PolarHBondContact O-N 3.36Å; C250-A290 HydrophobicContact CB-CB 3.66Å | ||
| 291 | A | 75.3 | Confident | 82.3 | Confident | 26 Ų | 26 | 67 Ų | 67 | 22% | 0.215 | 38% | 0.383 | C | S | . | . | S | Bend | trans | -83.5 | 158.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | P248 | P248-A291 PolarHBondContact O-N 3.4Š|
| 292 | N | 83.8 | Confident | 82.6 | Confident | 135 Ų | 135 | 67.2 Ų | 67.2 | 72% | 0.722 | 39% | 0.389 | S | S | * | . | P | Polyproline II helix | trans | -66.7 | 142.2 | 161.3 | -78.7 | -32.1 | 0 | 0 | 0 | 110.2 | ||
| 293 | V | 86.3 | Confident | 83.3 | Confident | 75 Ų | 75 | 62 Ų | 62 | 46% | 0.455 | 36% | 0.361 | S | S | . | . | P | Polyproline II helix | trans | -87 | 121.5 | 177.4 | 177.5 | 0 | 0 | 0 | 0 | 107.7 | L255 K289 T297 | L255-V293 HydrophobicContact CD1-CG2 4.19Å; L255-V293 HydrophobicContact CD2-CG2 4.44Å; K289-V293 HydrophobicContact CD-CG2 4.13Å; V293-T297 HydrophobicContact CG1-CG2 4.13Å |
| 294 | T | 91.8 | Very high | 84.1 | Confident | 67 Ų | 67 | 61.7 Ų | 61.7 | 41% | 0.411 | 36% | 0.359 | S | S | . | . | trans | -114 | 177.2 | 178.4 | 69.8 | 0 | 0 | 0 | 0 | 110.4 | L296 T297 | T294-L296 VanDerWaalsContact C-N 3.25Å; T294-L296 PolarHBondContact O-N 2.88Å; T294-L296 PolarHBondContact OG1-N 3.26Å; T294-T297 PolarHBondContact N-OG1 2.89Å; T294-T297 VanDerWaalsContact O-CB 3.31Å; T294-T297 WeakPolarHBondContact O-CB 3.27Å; T294-T297 PolarHBondContact O-N 3.38Å; T294-T297 PolarHBondContact O-OG1 2.57Å; T294-T297 PolarHBondContact OG1-N 2.87Å; T294-T297 PolarHBondContact OG1-OG1 3.3Å | ||
| 295 | L | 93.8 | Very high | 85.3 | Confident | 153 Ų | 153 | 61.5 Ų | 61.5 | 80% | 0.801 | 36% | 0.355 | S | S | * | . | S | Bend | trans | -63 | -33.2 | 170.5 | -61.9 | -179.9 | 0 | 0 | 0 | 111.9 | T297 S298 | L295-T297 PolarHBondContact O-N 3.08Å; L295-S298 VanDerWaalsContact O-CB 3.24Å; L295-S298 WeakPolarHBondContact O-CB 3.23Å; L295-S298 PolarHBondContact O-N 3.27Å; L295-S298 PolarHBondContact O-OG 3.12Å |
| 296 | L | 94.6 | Very high | 86.5 | Confident | 45 Ų | 45 | 60.8 Ų | 60.8 | 24% | 0.236 | 34% | 0.337 | C | S | . | . | G | 310 helix | trans | -65.3 | -37.2 | 175.3 | -60.7 | 177.2 | 0 | 0 | 0 | 111.8 | T294 S298 L299 T390 F393 | T294-L296 VanDerWaalsContact C-N 3.25Å; T294-L296 PolarHBondContact O-N 2.88Å; T294-L296 PolarHBondContact OG1-N 3.26Å; L296-S298 PolarHBondContact O-N 3.36Å; L296-L299 HydrophobicContact CD2-CD1 4.04Å; L296-L299 WeakPolarHBondContact O-CB 3.2Å; L296-L299 PolarHBondContact O-N 2.99Å; L296-T390 HydrophobicContact CD1-CG2 3.83Å; L296-F393 HydrophobicContact CD1-CD1 4.42Å; L296-F393 HydrophobicContact CD2-CD1 4.15Å; L296-F393 HydrophobicContact CD2-CG 4.44Å |
| 297 | T | 93.6 | Very high | 87.9 | Confident | 12 Ų | 12 | 59.9 Ų | 59.9 | 7% | 0.074 | 31% | 0.314 | C | S | . | . | G | 310 helix | trans | -54.5 | -23.2 | 171.3 | -45.6 | 0 | 0 | 0 | 0 | 112.6 | R244 L251 I259 V293 T294 L295 | R244-T297 PolarHBondContact NH2-O 3.22Å; L251-T297 HydrophobicContact CD2-CG2 4.32Å; I259-T297 WeakPolarHBondContact CD1-O 3.36Å; I259-T297 WeakPolarHBondContact CG1-O 3.3Å; V293-T297 HydrophobicContact CG1-CG2 4.13Å; T294-T297 PolarHBondContact N-OG1 2.89Å; T294-T297 VanDerWaalsContact O-CB 3.31Å; T294-T297 WeakPolarHBondContact O-CB 3.27Å; T294-T297 PolarHBondContact O-N 3.38Å; T294-T297 PolarHBondContact O-OG1 2.57Å; T294-T297 PolarHBondContact OG1-N 2.87Å; T294-T297 PolarHBondContact OG1-OG1 3.3Å; L295-T297 PolarHBondContact O-N 3.08Å |
| 298 | S | 92.6 | Very high | 89.1 | Confident | 28 Ų | 28 | 55.9 Ų | 55.9 | 20% | 0.196 | 30% | 0.3 | C | S | . | . | G | 310 helix | trans | -81.9 | -13.4 | -180 | 88.3 | 0 | 0 | 0 | 0 | 114.4 | R224 L295 L296 | R224-S298 WeakPolarHBondContact CD-OG 3.49Å; R224-S298 VanDerWaalsContact CZ-CB 3.47Å; R224-S298 PolarHBondContact NE-O 2.91Å; R224-S298 PolarHBondContact NE-OG 3.24Å; R224-S298 PolarHBondContact NH2-O 3.21Å; L295-S298 VanDerWaalsContact O-CB 3.24Å; L295-S298 WeakPolarHBondContact O-CB 3.23Å; L295-S298 PolarHBondContact O-N 3.27Å; L295-S298 PolarHBondContact O-OG 3.12Å; L296-S298 PolarHBondContact O-N 3.36Å |
| 299 | L | 94.9 | Very high | 90.6 | Very high | 7 Ų | 7 | 49.4 Ų | 49.4 | 4% | 0.037 | 28% | 0.275 | C | S | . | . | S | Bend | trans | -85.2 | 170.9 | 177 | -52.4 | -179.1 | 0 | 0 | 0 | 111.3 | R224 L225 R244 L296 E303 A304 L307 | R224-L299 HydrophobicContact CB-CD2 4.46Å; L225-L299 HydrophobicContact CD1-CD2 4.21Å; L225-L299 HydrophobicContact CG-CD2 4.36Å; R244-L299 PolarHBondContact NH1-O 2.76Å; L296-L299 HydrophobicContact CD2-CD1 4.04Å; L296-L299 WeakPolarHBondContact O-CB 3.2Å; L296-L299 PolarHBondContact O-N 2.99Å; L299-E303 HydrophobicContact CD2-CG 4.15Å; L299-A304 HydrophobicContact CB-CB 4.37Å; L299-A304 HydrophobicContact CD1-CB 4.07Å; L299-L307 HydrophobicContact CD1-CD2 4.08Å |
| 300 | V | 95.6 | Very high | 91.9 | Very high | 3 Ų | 3 | 48 Ų | 48 | 2% | 0.018 | 27% | 0.273 | C | S | . | . | trans | -112.4 | 160.1 | 161.9 | -66.4 | 0 | 0 | 0 | 0 | 109.6 | V221 Y234 V236 E240 I259 L260 G302 E303 A304 | V221-V300 HydrophobicContact CG2-CG1 4.05Å; V221-V300 HydrophobicContact CG2-CG2 3.77Å; Y234-V300 HydrophobicContact CG-CG2 4.25Å; V236-V300 HydrophobicContact CG2-CB 4.12Å; V236-V300 HydrophobicContact CG2-CG1 3.79Å; V236-V300 HydrophobicContact CG2-CG2 4.37Å; E240-V300 WeakPolarHBondContact OE1-CA 3.46Å; I259-V300 HydrophobicContact CG2-CG1 3.66Å; L260-V300 HydrophobicContact CD2-CG1 4.29Å; V300-G302 VanDerWaalsContact C-N 3.34Å; V300-G302 PolarHBondContact O-N 2.59Å; V300-E303 HydrophobicContact CG2-CB 3.98Å; V300-E303 WeakPolarHBondContact O-CA 3.23Å; V300-E303 WeakPolarHBondContact O-CB 3.39Å; V300-E303 PolarHBondContact O-N 3.49Å; V300-A304 PolarHBondContact O-N 3.09Å | ||
| 301 | E | 95.3 | Very high | 93.2 | Very high | 8 Ų | 8 | 48.5 Ų | 48.5 | 4% | 0.037 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -56.5 | -42.3 | -170.5 | -73.3 | 171.9 | -145.9 | 0 | 0 | 113.6 | E240 R243 E303 A304 L305 G367 H391 | E240-E301 HydrophobicContact CG-CG 4.29Å; E240-E301 WeakPolarHBondContact CG-OE1 3.49Å; E240-E301 PolarHBondContact OE1-N 3.39Å; R243-E301 IonicContact CZ-OE1 3.52Å; R243-E301 IonicContact NE-OE1 3.37Å; R243-E301 PolarHBondContact NE-OE1 2.78Å; R243-E301 IonicContact NH2-OE1 3.39Å; R243-E301 PolarHBondContact NH2-OE1 3.02Å; E301-E303 VanDerWaalsContact C-N 3.28Å; E301-E303 PolarHBondContact O-N 3.2Å; E301-A304 PolarHBondContact O-N 3.44Å; E301-L305 WeakPolarHBondContact O-CB 3.44Å; E301-L305 VanDerWaalsContact O-CG 3.28Å; E301-L305 WeakPolarHBondContact O-CG 3.45Å; E301-L305 PolarHBondContact O-N 3.46Å; E301-G367 WeakPolarHBondContact OE2-CA 3.19Å; E301-G367 PolarHBondContact OE2-N 2.97Å; E301-H391 HydrophobicContact CG-CB 4.11Å |
| 302 | G | 94.1 | Very high | 94.3 | Very high | 23 Ų | 23 | 47.8 Ų | 47.8 | 24% | 0.237 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63 | -31.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y234 V300 H306 | Y234-G302 VanDerWaalsContact CE1-O 3.29Å; Y234-G302 WeakPolarHBondContact CE1-O 3.36Å; V300-G302 VanDerWaalsContact C-N 3.34Å; V300-G302 PolarHBondContact O-N 2.59Å; G302-H306 WeakPolarHBondContact O-CB 3.41Å; G302-H306 PolarHBondContact O-N 3.27Å |
| 303 | E | 94.8 | Very high | 95 | Very high | 7 Ų | 7 | 47.9 Ų | 47.9 | 3% | 0.033 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -78 | -39.7 | 177.1 | -177.4 | 168.2 | -141.6 | 0 | 0 | 111.4 | G223 R224 L225 Y234 L299 V300 E301 H306 L307 | G223-E303 WeakPolarHBondContact CA-OE1 3.42Å; R224-E303 WeakPolarHBondContact CA-OE1 3.45Å; R224-E303 PolarHBondContact N-OE1 3.37Å; R224-E303 PolarHBondContact N-OE2 2.9Å; L225-E303 PolarHBondContact N-OE1 2.87Å; Y234-E303 HydrophobicContact CD1-CB 4.22Å; Y234-E303 HydrophobicContact CD2-CB 3.85Å; Y234-E303 HydrophobicContact CD2-CG 4.35Å; Y234-E303 HydrophobicContact CE1-CB 4.13Å; Y234-E303 HydrophobicContact CE2-CB 3.75Å; Y234-E303 HydrophobicContact CE2-CG 3.86Å; Y234-E303 HydrophobicContact CG-CB 4.08Å; L299-E303 HydrophobicContact CD2-CG 4.15Å; V300-E303 HydrophobicContact CG2-CB 3.98Å; V300-E303 WeakPolarHBondContact O-CA 3.23Å; V300-E303 WeakPolarHBondContact O-CB 3.39Å; V300-E303 PolarHBondContact O-N 3.49Å; E301-E303 VanDerWaalsContact C-N 3.28Å; E301-E303 PolarHBondContact O-N 3.2Å; E303-H306 PolarHBondContact O-N 3.42Å; E303-L307 WeakPolarHBondContact O-CB 3.22Å; E303-L307 PolarHBondContact O-N 3.24Å |
| 304 | A | 96.2 | Very high | 95.6 | Very high | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.2 | -39.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L299 V300 E301 L307 A308 H391 F393 | L299-A304 HydrophobicContact CB-CB 4.37Å; L299-A304 HydrophobicContact CD1-CB 4.07Å; V300-A304 PolarHBondContact O-N 3.09Å; E301-A304 PolarHBondContact O-N 3.44Å; A304-L307 PolarHBondContact O-N 3.48Å; A304-A308 WeakPolarHBondContact O-CB 3.37Å; A304-A308 PolarHBondContact O-N 2.88Å; A304-H391 HydrophobicContact CB-CB 3.69Å; A304-H391 WeakPolarHBondContact CB-O 3.45Å; A304-F393 HydrophobicContact CB-CB 4.17Å |
| 305 | L | 94.4 | Very high | 95.9 | Very high | 47 Ų | 47 | 45.5 Ų | 45.5 | 25% | 0.246 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -68.7 | -38.8 | 175 | -70.7 | 168.1 | 0 | 0 | 0 | 112.6 | E301 A308 R309 | E301-L305 WeakPolarHBondContact O-CB 3.44Å; E301-L305 VanDerWaalsContact O-CG 3.28Å; E301-L305 WeakPolarHBondContact O-CG 3.45Å; E301-L305 PolarHBondContact O-N 3.46Å; L305-A308 PolarHBondContact O-N 3.24Å; L305-R309 PolarHBondContact O-N 3.3Å; L305-R309 VanDerWaalsContact O-N 3.09Å |
| 306 | H | 95.1 | Very high | 96 | Very high | 70 Ų | 70 | 45.1 Ų | 45.1 | 32% | 0.324 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.5 | -49.9 | 171.4 | -86.8 | -155.1 | 0 | 0 | 0 | 111.5 | Y234 G302 E303 A308 R309 D310 | Y234-H306 HydrophobicContact CE1-CB 4.28Å; Y234-H306 AromaticContact CE1-CE1 4Å; Y234-H306 AromaticContact CE1-CG 3.84Å; Y234-H306 AromaticContact CE1-ND1 3.5Å; Y234-H306 WeakPolarHBondContact CE1-ND1 3.39Å; Y234-H306 AromaticContact CZ-ND1 3.82Å; Y234-H306 PolarHBondContact OH-ND1 2.83Å; G302-H306 WeakPolarHBondContact O-CB 3.41Å; G302-H306 PolarHBondContact O-N 3.27Å; E303-H306 PolarHBondContact O-N 3.42Å; H306-A308 PolarHBondContact O-N 3.02Å; H306-R309 PolarHBondContact CD2-NH1 3.39Å; H306-R309 PolarHBondContact NE2-NH1 3.29Å; H306-R309 PolarHBondContact O-N 3.45Å; H306-R309 VanDerWaalsContact O-N 3.17Å; H306-D310 WeakPolarHBondContact O-CB 2.98Å; H306-D310 PolarHBondContact O-N 3.3Å |
| 307 | L | 96.6 | Very high | 96.2 | Very high | 59 Ų | 59 | 45.9 Ų | 45.9 | 31% | 0.309 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -56.2 | -36.5 | 176.2 | -179.5 | 64.1 | 0 | 0 | 0 | 112.3 | L225 L299 E303 A304 F311 F393 | L225-L307 HydrophobicContact CD1-CB 4.5Å; L225-L307 HydrophobicContact CD1-CD1 3.99Å; L225-L307 HydrophobicContact CD1-CD2 3.92Å; L225-L307 HydrophobicContact CD1-CG 4.35Å; L299-L307 HydrophobicContact CD1-CD2 4.08Å; E303-L307 WeakPolarHBondContact O-CB 3.22Å; E303-L307 PolarHBondContact O-N 3.24Å; A304-L307 PolarHBondContact O-N 3.48Å; L307-F311 WeakPolarHBondContact O-CB 3.46Å; L307-F311 PolarHBondContact O-N 3.36Å; L307-F393 HydrophobicContact CB-CD2 4.25Å; L307-F393 HydrophobicContact CB-CE2 4.49Å; L307-F393 HydrophobicContact CD2-CD2 4.06Å; L307-F393 HydrophobicContact CD2-CE2 4.03Å; L307-F393 HydrophobicContact CG-CD2 3.98Å; L307-F393 HydrophobicContact CG-CE2 3.8Å |
| 308 | A | 97.2 | Very high | 96.4 | Very high | 4 Ų | 4 | 51.6 Ų | 51.6 | 3% | 0.033 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -69.9 | -41.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | A304 L305 H306 G312 F393 P396 | A304-A308 WeakPolarHBondContact O-CB 3.37Å; A304-A308 PolarHBondContact O-N 2.88Å; L305-A308 PolarHBondContact O-N 3.24Å; H306-A308 PolarHBondContact O-N 3.02Å; A308-G312 PolarHBondContact O-N 3.48Å; A308-F393 HydrophobicContact CB-CB 4.49Å; A308-F393 HydrophobicContact CB-CD2 3.67Å; A308-F393 HydrophobicContact CB-CE2 4.28Å; A308-F393 HydrophobicContact CB-CG 4.4Å; A308-P396 HydrophobicContact CB-CB 4.12Å |
| 309 | R | 96.2 | Very high | 96.7 | Very high | 90 Ų | 90 | 54.5 Ų | 54.5 | 34% | 0.34 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.5 | -47.9 | 173.1 | 177.5 | -163.9 | 63.7 | -135.8 | -13.2 | 110.8 | L24 L305 H306 G312 Y313 | L24-R309 HydrophobicContact CD2-CG 4.3Å; L24-R309 HydrophobicContact CG-CG 4.39Å; L305-R309 PolarHBondContact O-N 3.3Å; L305-R309 VanDerWaalsContact O-N 3.09Å; H306-R309 PolarHBondContact CD2-NH1 3.39Å; H306-R309 PolarHBondContact NE2-NH1 3.29Å; H306-R309 PolarHBondContact O-N 3.45Å; H306-R309 VanDerWaalsContact O-N 3.17Å; R309-G312 WeakPolarHBondContact O-CA 3.48Å; R309-G312 PolarHBondContact O-N 2.97Å; R309-G312 VanDerWaalsContact O-N 3.15Å; R309-Y313 PolarHBondContact O-N 3.33Å |
| 310 | D | 96.8 | Very high | 96.8 | Very high | 78 Ų | 78 | 57.8 Ų | 57.8 | 42% | 0.417 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -70.4 | -37.8 | -173.6 | -58.1 | -11.9 | 0 | 0 | 0 | 110.6 | H306 Y313 T314 | H306-D310 WeakPolarHBondContact O-CB 2.98Å; H306-D310 PolarHBondContact O-N 3.3Å; D310-Y313 PolarHBondContact O-N 3.31Å; D310-T314 PolarHBondContact O-N 2.85Å; D310-T314 VanDerWaalsContact O-N 3.1Å; D310-T314 PolarHBondContact O-OG1 2.92Å |
| 311 | F | 98.3 | Very high | 96.9 | Very high | 82 Ų | 82 | 58.3 Ų | 58.3 | 36% | 0.36 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.7 | -44 | 167.4 | 174.9 | -104.4 | 0 | 0 | 0 | 112.3 | L307 Y313 T314 C315 A397 A400 | L307-F311 WeakPolarHBondContact O-CB 3.46Å; L307-F311 PolarHBondContact O-N 3.36Å; F311-Y313 VanDerWaalsContact C-N 3.34Å; F311-Y313 PolarHBondContact O-N 3.02Å; F311-T314 PolarHBondContact O-N 2.87Å; F311-C315 WeakPolarHBondContact O-CB 3.37Å; F311-C315 PolarHBondContact O-N 3.46Å; F311-A397 HydrophobicContact CD1-CB 4.01Å; F311-A397 HydrophobicContact CE1-CB 4.06Å; F311-A400 HydrophobicContact CD1-CB 4.39Å; F311-A400 HydrophobicContact CE1-CB 4.31Å |
| 312 | G | 98.3 | Very high | 97 | Very high | 10 Ų | 10 | 63.3 Ų | 63.3 | 10% | 0.103 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -58.7 | -43.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | A308 R309 C315 E316 | A308-G312 PolarHBondContact O-N 3.48Å; R309-G312 WeakPolarHBondContact O-CA 3.48Å; R309-G312 PolarHBondContact O-N 2.97Å; R309-G312 VanDerWaalsContact O-N 3.15Å; G312-C315 WeakPolarHBondContact O-CB 3.3Å; G312-C315 PolarHBondContact O-N 2.75Å; G312-E316 PolarHBondContact O-N 3.41Å; G312-E316 VanDerWaalsContact O-N 3.15Å |
| 313 | Y | 98.3 | Very high | 97.2 | Very high | 137 Ų | 137 | 65.1 Ų | 65.1 | 54% | 0.537 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60.7 | -49.8 | 174.4 | 177.5 | -91.2 | 0 | 0 | 0 | 111.9 | R309 D310 F311 C315 E316 T317 | R309-Y313 PolarHBondContact O-N 3.33Å; D310-Y313 PolarHBondContact O-N 3.31Å; F311-Y313 VanDerWaalsContact C-N 3.34Å; F311-Y313 PolarHBondContact O-N 3.02Å; Y313-C315 VanDerWaalsContact C-N 3.26Å; Y313-C315 PolarHBondContact O-N 3Å; Y313-E316 WeakPolarHBondContact O-CA 3.28Å; Y313-E316 PolarHBondContact O-N 3.28Å; Y313-T317 HydrophobicContact CD1-CG2 4.45Å; Y313-T317 HydrophobicContact CD2-CG2 4.18Å; Y313-T317 HydrophobicContact CE1-CG2 4.01Å; Y313-T317 HydrophobicContact CE2-CG2 3.73Å; Y313-T317 PolarHBondContact O-N 3.01Å; Y313-T317 PolarHBondContact O-OG1 3.41Å |
| 314 | T | 98.5 | Very high | 97.4 | Very high | 73 Ų | 73 | 67.1 Ų | 67.1 | 45% | 0.448 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.1 | -35.5 | 175.7 | -58.5 | 0 | 0 | 0 | 0 | 112.6 | D310 F311 E316 E318 F319 | D310-T314 PolarHBondContact O-N 2.85Å; D310-T314 VanDerWaalsContact O-N 3.1Å; D310-T314 PolarHBondContact O-OG1 2.92Å; F311-T314 PolarHBondContact O-N 2.87Å; T314-E316 PolarHBondContact O-N 3.02Å; T314-E318 HydrophobicContact CG2-CB 4.02Å; T314-E318 HydrophobicContact CG2-CG 3.89Å; T314-E318 WeakPolarHBondContact O-CB 3.46Å; T314-E318 PolarHBondContact O-N 3.16Å; T314-F319 PolarHBondContact O-N 3.47Å |
| 315 | C | 98.4 | Very high | 97.4 | Very high | 20 Ų | 20 | 67.1 Ų | 67.1 | 14% | 0.135 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -66.9 | -20.2 | 173.7 | -96.2 | 0 | 0 | 0 | 0 | 114.2 | F311 G312 Y313 A400 T404 | F311-C315 WeakPolarHBondContact O-CB 3.37Å; F311-C315 PolarHBondContact O-N 3.46Å; G312-C315 WeakPolarHBondContact O-CB 3.3Å; G312-C315 PolarHBondContact O-N 2.75Å; Y313-C315 VanDerWaalsContact C-N 3.26Å; Y313-C315 PolarHBondContact O-N 3Å; C315-A400 HydrophobicContact CB-CB 4.4Å; C315-T404 WeakPolarHBondContact CB-OG1 3.48Å; C315-T404 PolarHBondContact O-OG1 3.49Å |
| 316 | E | 96.4 | Very high | 97.4 | Very high | 144 Ų | 144 | 67.1 Ų | 67.1 | 67% | 0.673 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -96.1 | -43.1 | 178.1 | -174.7 | 169.1 | -161 | 0 | 0 | 112.2 | G312 Y313 T314 | G312-E316 PolarHBondContact O-N 3.41Å; G312-E316 VanDerWaalsContact O-N 3.15Å; Y313-E316 WeakPolarHBondContact O-CA 3.28Å; Y313-E316 PolarHBondContact O-N 3.28Å; T314-E316 PolarHBondContact O-N 3.02Å |
| 317 | T | 97.9 | Very high | 97.4 | Very high | 62 Ų | 62 | 68.5 Ų | 68.5 | 38% | 0.38 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -91.7 | -40.9 | -174.4 | 64.7 | 0 | 0 | 0 | 0 | 114.6 | Y313 | Y313-T317 HydrophobicContact CD1-CG2 4.45Å; Y313-T317 HydrophobicContact CD2-CG2 4.18Å; Y313-T317 HydrophobicContact CE1-CG2 4.01Å; Y313-T317 HydrophobicContact CE2-CG2 3.73Å; Y313-T317 PolarHBondContact O-N 3.01Å; Y313-T317 PolarHBondContact O-OG1 3.41Å |
| 318 | E | 98.2 | Very high | 97.3 | Very high | 131 Ų | 131 | 68.5 Ų | 68.5 | 61% | 0.612 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.3 | -21.2 | -170.1 | -49.2 | -49.5 | 124 | 0 | 0 | 113.5 | T314 | T314-E318 HydrophobicContact CG2-CB 4.02Å; T314-E318 HydrophobicContact CG2-CG 3.89Å; T314-E318 WeakPolarHBondContact O-CB 3.46Å; T314-E318 PolarHBondContact O-N 3.16Å |
| 319 | F | 98.3 | Very high | 97 | Very high | 89 Ų | 89 | 68.3 Ų | 68.3 | 39% | 0.39 | 35% | 0.346 | S | S | . | . | S | Bend | trans | -72.7 | 126 | -176.1 | -169.4 | -83.6 | 0 | 0 | 0 | 111.4 | T314 S321 V324 T404 V408 | T314-F319 PolarHBondContact O-N 3.47Å; F319-S321 PolarHBondContact O-N 3.34Å; F319-V324 HydrophobicContact CE1-CG2 4.24Å; F319-V324 HydrophobicContact CZ-CG2 4.43Å; F319-T404 HydrophobicContact CB-CG2 3.73Å; F319-T404 HydrophobicContact CD1-CG2 3.19Å; F319-T404 HydrophobicContact CD2-CG2 3.91Å; F319-T404 HydrophobicContact CE1-CG2 3.71Å; F319-T404 HydrophobicContact CE2-CG2 4.34Å; F319-T404 HydrophobicContact CG-CG2 3.3Å; F319-T404 HydrophobicContact CZ-CG2 4.26Å; F319-V408 HydrophobicContact CE1-CG2 3.79Å |
| 320 | P | 98.3 | Very high | 96.6 | Very high | 76 Ų | 76 | 69 Ų | 69 | 49% | 0.494 | 35% | 0.349 | S | S | . | . | trans | -78.7 | 54.1 | -171.5 | 33.6 | -38 | 0 | 0 | 0 | 113.4 | K322 A323 V324 | P320-K322 VanDerWaalsContact C-N 3.26Å; P320-K322 PolarHBondContact O-N 2.97Å; P320-K322 VanDerWaalsContact O-N 3.11Å; P320-A323 HydrophobicContact CB-CB 4.38Å; P320-A323 PolarHBondContact O-N 3.1Å; P320-V324 HydrophobicContact CG-CG2 4.2Å; P320-V324 WeakPolarHBondContact O-CG2 3.5Å; P320-V324 PolarHBondContact O-N 2.81Å; P320-V324 VanDerWaalsContact O-N 3.08Å | ||
| 321 | S | 98.2 | Very high | 95.9 | Very high | 14 Ų | 14 | 70.8 Ų | 70.8 | 10% | 0.098 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -50.3 | -42.8 | -170.4 | -62.4 | 0 | 0 | 0 | 0 | 113.3 | F319 G325 | F319-S321 PolarHBondContact O-N 3.34Å; S321-G325 PolarHBondContact O-N 3.21Å |
| 322 | K | 97.4 | Very high | 94.7 | Very high | 114 Ų | 114 | 70.4 Ų | 70.4 | 50% | 0.496 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -66.6 | -49.6 | 178.5 | -179 | 179.8 | 171.5 | -173.1 | 0 | 113 | P320 V324 G325 E326 E411 | P320-K322 VanDerWaalsContact C-N 3.26Å; P320-K322 PolarHBondContact O-N 2.97Å; P320-K322 VanDerWaalsContact O-N 3.11Å; K322-V324 VanDerWaalsContact C-N 3.29Å; K322-V324 PolarHBondContact O-N 3.11Å; K322-G325 PolarHBondContact O-N 3.06Å; K322-E326 WeakPolarHBondContact CE-OE1 3.38Å; K322-E326 HydrophobicContact CG-CG 4.34Å; K322-E326 WeakPolarHBondContact O-CB 3.18Å; K322-E326 WeakPolarHBondContact O-CG 3.39Å; K322-E326 PolarHBondContact O-N 3.19Å; K322-E411 HydrophobicContact CB-CG 4.04Å; K322-E411 HydrophobicContact CG-CG 4.4Å |
| 323 | A | 97.8 | Very high | 93.1 | Very high | 61 Ų | 61 | 73.8 Ų | 73.8 | 50% | 0.504 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63 | -39.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | P320 H327 | P320-A323 HydrophobicContact CB-CB 4.38Å; P320-A323 PolarHBondContact O-N 3.1Å; A323-H327 VanDerWaalsContact O-CB 3.31Å; A323-H327 WeakPolarHBondContact O-CB 3.49Å; A323-H327 PolarHBondContact O-N 2.88Å; A323-H327 VanDerWaalsContact O-N 3.12Å |
| 324 | V | 97.8 | Very high | 91.9 | Very high | 49 Ų | 49 | 73 Ų | 73 | 30% | 0.297 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -66.3 | -49.1 | 173.9 | 177.4 | 0 | 0 | 0 | 0 | 111 | F319 P320 K322 H327 L328 V408 | F319-V324 HydrophobicContact CE1-CG2 4.24Å; F319-V324 HydrophobicContact CZ-CG2 4.43Å; P320-V324 HydrophobicContact CG-CG2 4.2Å; P320-V324 WeakPolarHBondContact O-CG2 3.5Å; P320-V324 PolarHBondContact O-N 2.81Å; P320-V324 VanDerWaalsContact O-N 3.08Å; K322-V324 VanDerWaalsContact C-N 3.29Å; K322-V324 PolarHBondContact O-N 3.11Å; V324-H327 PolarHBondContact O-N 2.75Å; V324-L328 HydrophobicContact CG1-CD1 3.85Å; V324-L328 HydrophobicContact CG1-CG 4.39Å; V324-L328 WeakPolarHBondContact O-CG 3.44Å; V324-L328 PolarHBondContact O-N 3.26Å; V324-V408 HydrophobicContact CB-CG2 4.34Å; V324-V408 HydrophobicContact CG1-CG1 3.9Å; V324-V408 HydrophobicContact CG1-CG2 4.23Å |
| 325 | G | 96.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -61.1 | -47.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | S321 K322 H327 L328 A329 M412 | S321-G325 PolarHBondContact O-N 3.21Å; K322-G325 PolarHBondContact O-N 3.06Å; G325-H327 VanDerWaalsContact C-N 3.31Å; G325-H327 PolarHBondContact O-N 3.1Å; G325-L328 PolarHBondContact O-N 3.33Å; G325-A329 WeakPolarHBondContact O-CB 3.26Å; G325-A329 PolarHBondContact O-N 2.84Å; G325-M412 WeakPolarHBondContact O-CG 3.36Å |
| 326 | E | 95 | Very high | 89.3 | Confident | 46 Ų | 46 | 81.6 Ų | 81.6 | 22% | 0.215 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -62 | -37.4 | 174.4 | -66.8 | -176.3 | -172.3 | 0 | 0 | 112.4 | K322 A329 R330 Y415 | K322-E326 WeakPolarHBondContact CE-OE1 3.38Å; K322-E326 HydrophobicContact CG-CG 4.34Å; K322-E326 WeakPolarHBondContact O-CB 3.18Å; K322-E326 WeakPolarHBondContact O-CG 3.39Å; K322-E326 PolarHBondContact O-N 3.19Å; E326-A329 PolarHBondContact O-N 2.78Å; E326-R330 WeakPolarHBondContact O-CB 3.49Å; E326-R330 WeakPolarHBondContact O-CG 3.45Å; E326-R330 PolarHBondContact O-N 2.94Å; E326-R330 PolarHBondContact O-NE 3.45Å; E326-R330 IonicContact OE2-CZ 3.74Å; E326-R330 IonicContact OE2-NH1 2.69Å; E326-R330 PolarHBondContact OE2-NH1 3.45Å; E326-R330 IonicContact OE2-NH2 3.8Å; E326-Y415 HydrophobicContact CB-CD2 4.06Å; E326-Y415 HydrophobicContact CB-CG 4.5Å; E326-Y415 HydrophobicContact CG-CD2 3.86Å; E326-Y415 HydrophobicContact CG-CG 4.44Å |
| 327 | H | 94.8 | Very high | 88.6 | Confident | 99 Ų | 99 | 80.9 Ų | 80.9 | 46% | 0.458 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -64.5 | -46.9 | 177.1 | -174.2 | 106.2 | 0 | 0 | 0 | 111.5 | A323 V324 G325 A329 R330 Q331 | A323-H327 VanDerWaalsContact O-CB 3.31Å; A323-H327 WeakPolarHBondContact O-CB 3.49Å; A323-H327 PolarHBondContact O-N 2.88Å; A323-H327 VanDerWaalsContact O-N 3.12Å; V324-H327 PolarHBondContact O-N 2.75Å; G325-H327 VanDerWaalsContact C-N 3.31Å; G325-H327 PolarHBondContact O-N 3.1Å; H327-A329 VanDerWaalsContact C-N 3.25Å; H327-A329 PolarHBondContact O-N 3.27Å; H327-R330 PolarHBondContact O-N 3.45Å; H327-Q331 PolarHBondContact CD2-NE2 2.77Å; H327-Q331 VanDerWaalsContact CD2-NE2 3.35Å; H327-Q331 PolarHBondContact NE2-NE2 3.05Å; H327-Q331 PolarHBondContact O-N 3.03Å |
| 328 | L | 93.8 | Very high | 87.9 | Confident | 59 Ų | 59 | 78.7 Ų | 78.7 | 31% | 0.309 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -66.7 | -25.4 | 177.8 | -67.8 | 172.7 | 0 | 0 | 0 | 113.2 | V324 G325 V408 M412 | V324-L328 HydrophobicContact CG1-CD1 3.85Å; V324-L328 HydrophobicContact CG1-CG 4.39Å; V324-L328 WeakPolarHBondContact O-CG 3.44Å; V324-L328 PolarHBondContact O-N 3.26Å; G325-L328 PolarHBondContact O-N 3.33Å; L328-V408 HydrophobicContact CD1-CG1 3.95Å; L328-M412 HydrophobicContact CB-CE 3.93Å; L328-M412 HydrophobicContact CB-CG 4.2Å; L328-M412 HydrophobicContact CB-SD 3.87Å; L328-M412 HydrophobicContact CD1-SD 4.19Å |
| 329 | A | 91.8 | Very high | 87.5 | Confident | 1 Ų | 1 | 77.6 Ų | 77.6 | 1% | 0.008 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -79.1 | -39.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G325 E326 H327 Q331 H332 M412 Y415 L416 | G325-A329 WeakPolarHBondContact O-CB 3.26Å; G325-A329 PolarHBondContact O-N 2.84Å; E326-A329 PolarHBondContact O-N 2.78Å; H327-A329 VanDerWaalsContact C-N 3.25Å; H327-A329 PolarHBondContact O-N 3.27Å; A329-Q331 PolarHBondContact O-N 3.47Å; A329-H332 PolarHBondContact O-N 3.15Å; A329-H332 VanDerWaalsContact O-N 3.14Å; A329-M412 HydrophobicContact CB-CB 4.41Å; A329-M412 HydrophobicContact CB-CG 4.44Å; A329-Y415 HydrophobicContact CB-CD1 3.48Å; A329-Y415 VanDerWaalsContact CB-CD1 3.48Å; A329-Y415 HydrophobicContact CB-CE1 4.36Å; A329-Y415 HydrophobicContact CB-CG 3.99Å; A329-L416 HydrophobicContact CB-CD2 4.35Å; A329-L416 HydrophobicContact CB-CG 4.18Å |
| 330 | R | 88.6 | Confident | 87.1 | Confident | 104 Ų | 104 | 76 Ų | 76 | 39% | 0.392 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -57.4 | -31.1 | 177.2 | -82.5 | -177.9 | -72.9 | -102.5 | 0.1 | 113.8 | E326 H327 H332 S333 Y415 | E326-R330 WeakPolarHBondContact O-CB 3.49Å; E326-R330 WeakPolarHBondContact O-CG 3.45Å; E326-R330 PolarHBondContact O-N 2.94Å; E326-R330 PolarHBondContact O-NE 3.45Å; E326-R330 IonicContact OE2-CZ 3.74Å; E326-R330 IonicContact OE2-NH1 2.69Å; E326-R330 PolarHBondContact OE2-NH1 3.45Å; E326-R330 IonicContact OE2-NH2 3.8Å; H327-R330 PolarHBondContact O-N 3.45Å; R330-H332 PolarHBondContact O-N 3.07Å; R330-S333 PolarHBondContact O-OG 3.23Å; R330-Y415 HydrophobicContact CG-CE1 3.75Å; R330-Y415 HydrophobicContact CG-CE2 4.25Å; R330-Y415 WeakPolarHBondContact CG-OH 3.26Å |
| 331 | Q | 82.2 | Confident | 86.8 | Confident | 116 Ų | 116 | 75 Ų | 75 | 54% | 0.542 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | -12.4 | 179.2 | -67.5 | -179 | 0.6 | 0 | 0 | 114.6 | H327 A329 | H327-Q331 PolarHBondContact CD2-NE2 2.77Å; H327-Q331 VanDerWaalsContact CD2-NE2 3.35Å; H327-Q331 PolarHBondContact NE2-NE2 3.05Å; H327-Q331 PolarHBondContact O-N 3.03Å; A329-Q331 PolarHBondContact O-N 3.47Å |
| 332 | H | 72.6 | Confident | 86.5 | Confident | 74 Ų | 74 | 75.5 Ų | 75.5 | 34% | 0.343 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -129.1 | 52.8 | -177.9 | -61.5 | -80.6 | 0 | 0 | 0 | 111.2 | A329 R330 E334 R341 | A329-H332 PolarHBondContact O-N 3.15Å; A329-H332 VanDerWaalsContact O-N 3.14Å; R330-H332 PolarHBondContact O-N 3.07Å; H332-E334 VanDerWaalsContact C-N 3.31Å; H332-E334 PolarHBondContact O-N 3.39Å; H332-R341 HydrophobicContact CB-CG 4.39Å; H332-R341 PolarHBondContact CD2-NH1 2.92Å; H332-R341 PolarHBondContact CD2-NH2 2.96Å; H332-R341 PolarHBondContact CE1-NH1 3.39Å; H332-R341 PolarHBondContact NE2-NH1 3.15Å; H332-R341 VanDerWaalsContact NE2-NH1 3.13Å; H332-R341 PolarHBondContact NE2-NH2 3.38Å; H332-R341 VanDerWaalsContact NE2-NH2 3.13Å |
| 333 | S | 64.9 | Low | 86.4 | Confident | 81 Ų | 81 | 77.5 Ų | 77.5 | 57% | 0.566 | 39% | 0.394 | S | S | * | . | trans | -82.6 | 5.1 | -170.2 | 47.9 | 0 | 0 | 0 | 0 | 115.4 | R330 P335 | R330-S333 PolarHBondContact O-OG 3.23Å; S333-P335 WeakPolarHBondContact O-CD 3.38Å | ||
| 334 | E | 71.8 | Confident | 86.3 | Confident | 120 Ų | 120 | 80 Ų | 80 | 56% | 0.561 | 40% | 0.397 | S | S | * | . | trans | -67.3 | 121.8 | -178.8 | -84 | -57.5 | 143.1 | 0 | 0 | 112.6 | H332 K336 E337 T338 | H332-E334 VanDerWaalsContact C-N 3.31Å; H332-E334 PolarHBondContact O-N 3.39Å; E334-K336 VanDerWaalsContact C-N 3.27Å; E334-K336 PolarHBondContact O-N 2.81Å; E334-E337 HydrophobicContact CB-CB 4.44Å; E334-E337 HydrophobicContact CB-CG 4.49Å; E334-E337 PolarHBondContact O-N 3Å; E334-E337 VanDerWaalsContact O-N 3.14Å; E334-T338 PolarHBondContact O-N 3.32Å; E334-T338 PolarHBondContact O-OG1 3.05Å | ||
| 335 | P | 69.8 | Low | 86.2 | Confident | 75 Ų | 75 | 78 Ų | 78 | 49% | 0.487 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -32.7 | -173.9 | -25.8 | 34.9 | 0 | 0 | 0 | 114.1 | S333 E337 | S333-P335 WeakPolarHBondContact O-CD 3.38Å; P335-E337 VanDerWaalsContact C-N 3.35Å |
| 336 | K | 73.2 | Confident | 86.3 | Confident | 199 Ų | 199 | 82.6 Ų | 82.6 | 87% | 0.865 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.9 | -32.1 | -180 | -66.6 | -179.8 | -180 | 175.8 | 0 | 112.3 | E334 | E334-K336 VanDerWaalsContact C-N 3.27Å; E334-K336 PolarHBondContact O-N 2.81Å |
| 337 | E | 81.7 | Confident | 86.5 | Confident | 128 Ų | 128 | 82.9 Ų | 82.9 | 60% | 0.598 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.8 | -16.3 | -176.8 | -59.6 | -166.8 | 165.9 | 0 | 0 | 113.2 | E334 P335 N339 A340 R341 | E334-E337 HydrophobicContact CB-CB 4.44Å; E334-E337 HydrophobicContact CB-CG 4.49Å; E334-E337 PolarHBondContact O-N 3Å; E334-E337 VanDerWaalsContact O-N 3.14Å; P335-E337 VanDerWaalsContact C-N 3.35Å; E337-N339 VanDerWaalsContact C-N 3.26Å; E337-N339 PolarHBondContact O-N 2.94Å; E337-N339 VanDerWaalsContact O-N 3.11Å; E337-A340 CarbonylContact O-C 3.41Å; E337-A340 WeakPolarHBondContact O-CA 3.37Å; E337-A340 WeakPolarHBondContact O-CB 3.17Å; E337-A340 PolarHBondContact O-N 3.14Å; E337-R341 PolarHBondContact O-N 3.45Å |
| 338 | T | 84.5 | Confident | 86.6 | Confident | 16 Ų | 16 | 80.8 Ų | 80.8 | 10% | 0.098 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -47.6 | -44.2 | -178 | -67.5 | 0 | 0 | 0 | 0 | 113.1 | E334 R341 K342 L416 | E334-T338 PolarHBondContact O-N 3.32Å; E334-T338 PolarHBondContact O-OG1 3.05Å; T338-R341 PolarHBondContact O-N 3.3Å; T338-K342 WeakPolarHBondContact O-CG 3.42Å; T338-K342 PolarHBondContact O-N 3.28Å; T338-L416 HydrophobicContact CG2-CD2 4.46Å |
| 339 | N | 88.3 | Confident | 86.8 | Confident | 109 Ų | 109 | 80.6 Ų | 80.6 | 58% | 0.583 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -71.6 | -31.8 | 178.5 | -77.8 | -25.4 | 0 | 0 | 0 | 113.7 | E337 K343 | E337-N339 VanDerWaalsContact C-N 3.26Å; E337-N339 PolarHBondContact O-N 2.94Å; E337-N339 VanDerWaalsContact O-N 3.11Å; N339-K343 WeakPolarHBondContact O-CG 3.38Å; N339-K343 PolarHBondContact O-N 3.12Å |
| 340 | A | 90.8 | Very high | 87.1 | Confident | 56 Ų | 56 | 85.3 Ų | 85.3 | 46% | 0.463 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -69.3 | -42.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | E337 K342 K343 M344 | E337-A340 CarbonylContact O-C 3.41Å; E337-A340 WeakPolarHBondContact O-CA 3.37Å; E337-A340 WeakPolarHBondContact O-CB 3.17Å; E337-A340 PolarHBondContact O-N 3.14Å; A340-K342 PolarHBondContact O-N 3.15Å; A340-K343 WeakPolarHBondContact O-CB 3.31Å; A340-K343 PolarHBondContact O-N 2.99Å; A340-M344 WeakPolarHBondContact O-CG 3.4Å; A340-M344 PolarHBondContact O-N 3.25Å |
| 341 | R | 91.3 | Very high | 87.6 | Confident | 54 Ų | 54 | 85.6 Ų | 85.6 | 20% | 0.204 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -61.5 | -42.9 | 177 | -173.8 | 59.4 | 175.4 | -145.3 | -5.5 | 112.4 | H332 E337 T338 K343 M344 V345 L416 | H332-R341 HydrophobicContact CB-CG 4.39Å; H332-R341 PolarHBondContact CD2-NH1 2.92Å; H332-R341 PolarHBondContact CD2-NH2 2.96Å; H332-R341 PolarHBondContact CE1-NH1 3.39Å; H332-R341 PolarHBondContact NE2-NH1 3.15Å; H332-R341 VanDerWaalsContact NE2-NH1 3.13Å; H332-R341 PolarHBondContact NE2-NH2 3.38Å; H332-R341 VanDerWaalsContact NE2-NH2 3.13Å; E337-R341 PolarHBondContact O-N 3.45Å; T338-R341 PolarHBondContact O-N 3.3Å; R341-K343 PolarHBondContact O-N 3.5Å; R341-M344 PolarHBondContact O-N 3.44Å; R341-V345 WeakPolarHBondContact O-CG2 3.28Å; R341-V345 PolarHBondContact O-N 2.7Å; R341-L416 HydrophobicContact CG-CD1 3.96Å |
| 342 | K | 93.1 | Very high | 88.3 | Confident | 24 Ų | 24 | 80.8 Ų | 80.8 | 10% | 0.104 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -57.3 | -46.1 | 172.6 | -72.7 | -178.7 | -172.5 | -175.7 | 0 | 111.8 | T338 A340 M344 V345 L346 L413 L416 D417 S420 | T338-K342 WeakPolarHBondContact O-CG 3.42Å; T338-K342 PolarHBondContact O-N 3.28Å; A340-K342 PolarHBondContact O-N 3.15Å; K342-M344 PolarHBondContact O-N 3.28Å; K342-V345 PolarHBondContact O-N 2.94Å; K342-L346 WeakPolarHBondContact O-CG 3.41Å; K342-L346 PolarHBondContact O-N 3.29Å; K342-L413 HydrophobicContact CB-CD2 4.26Å; K342-L413 HydrophobicContact CG-CD2 4.29Å; K342-L416 HydrophobicContact CD-CB 4.47Å; K342-L416 VanDerWaalsContact CE-C 3.47Å; K342-L416 VanDerWaalsContact CE-O 3.23Å; K342-L416 WeakPolarHBondContact CE-O 3.41Å; K342-L416 HydrophobicContact CG-CB 4.01Å; K342-L416 HydrophobicContact CG-CD1 4.08Å; K342-L416 PolarHBondContact NZ-O 3.3Å; K342-D417 WeakPolarHBondContact CE-OD1 3.29Å; K342-D417 IonicContact NZ-OD1 3.81Å; K342-D417 PolarHBondContact NZ-OD1 3.36Å; K342-S420 PolarHBondContact NZ-OG 2.9Å |
| 343 | K | 95 | Very high | 89.5 | Confident | 157 Ų | 157 | 81.3 Ų | 81.3 | 68% | 0.683 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -61 | -41.8 | 176.2 | -72.4 | 178.9 | 178.2 | -175.2 | 0 | 112.5 | N339 A340 R341 L346 A347 | N339-K343 WeakPolarHBondContact O-CG 3.38Å; N339-K343 PolarHBondContact O-N 3.12Å; A340-K343 WeakPolarHBondContact O-CB 3.31Å; A340-K343 PolarHBondContact O-N 2.99Å; R341-K343 PolarHBondContact O-N 3.5Å; K343-L346 PolarHBondContact O-N 2.94Å; K343-A347 WeakPolarHBondContact O-CB 3.36Å; K343-A347 PolarHBondContact O-N 3.25Å |
| 344 | M | 95.3 | Very high | 91.1 | Very high | 114 Ų | 114 | 82.4 Ų | 82.4 | 56% | 0.562 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -60.9 | -47.8 | 174.7 | -67.3 | 174.4 | 74.4 | 0 | 0 | 111.8 | A340 R341 K342 L346 A347 T348 | A340-M344 WeakPolarHBondContact O-CG 3.4Å; A340-M344 PolarHBondContact O-N 3.25Å; R341-M344 PolarHBondContact O-N 3.44Å; K342-M344 PolarHBondContact O-N 3.28Å; M344-L346 VanDerWaalsContact C-N 3.34Å; M344-L346 PolarHBondContact O-N 3.05Å; M344-A347 PolarHBondContact O-N 3.46Å; M344-T348 PolarHBondContact O-N 2.78Å; M344-T348 PolarHBondContact O-OG1 3.41Å; M344-T348 VanDerWaalsContact O-OG1 3.07Å |
| 345 | V | 96.3 | Very high | 92.4 | Very high | 6 Ų | 6 | 81.6 Ų | 81.6 | 4% | 0.036 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -63.2 | -39.9 | -179.7 | 173.4 | 0 | 0 | 0 | 0 | 111.5 | R341 K342 T348 K349 L409 M412 L413 | R341-V345 WeakPolarHBondContact O-CG2 3.28Å; R341-V345 PolarHBondContact O-N 2.7Å; K342-V345 PolarHBondContact O-N 2.94Å; V345-T348 PolarHBondContact O-N 2.74Å; V345-K349 PolarHBondContact O-N 3.38Å; V345-L409 HydrophobicContact CG1-CB 4.07Å; V345-L409 HydrophobicContact CG1-CD2 4.05Å; V345-L409 WeakPolarHBondContact CG1-O 3.24Å; V345-M412 HydrophobicContact CG1-CB 4.41Å; V345-M412 HydrophobicContact CG2-CE 3.89Å; V345-L413 HydrophobicContact CB-CD2 4.05Å; V345-L413 HydrophobicContact CB-CG 4.44Å; V345-L413 HydrophobicContact CG1-CD1 4.1Å; V345-L413 HydrophobicContact CG1-CD2 3.85Å; V345-L413 HydrophobicContact CG1-CG 3.69Å |
| 346 | L | 97.8 | Very high | 93.7 | Very high | 96 Ų | 96 | 78.7 Ų | 78.7 | 50% | 0.503 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 173.5 | -72.8 | 167.8 | 0 | 0 | 0 | 112.2 | K342 K343 M344 T348 K349 Q350 L413 | K342-L346 WeakPolarHBondContact O-CG 3.41Å; K342-L346 PolarHBondContact O-N 3.29Å; K343-L346 PolarHBondContact O-N 2.94Å; M344-L346 VanDerWaalsContact C-N 3.34Å; M344-L346 PolarHBondContact O-N 3.05Å; L346-T348 PolarHBondContact O-N 3.5Å; L346-K349 PolarHBondContact O-N 3.22Å; L346-Q350 PolarHBondContact O-N 2.98Å; L346-L413 HydrophobicContact CD2-CD1 3.69Å; L346-L413 HydrophobicContact CG-CD1 4.2Å; L346-L413 HydrophobicContact CG-CD2 4.24Å |
| 347 | A | 98.2 | Very high | 94.9 | Very high | 52 Ų | 52 | 72.1 Ų | 72.1 | 43% | 0.43 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.7 | -40.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | K343 M344 Q350 I351 | K343-A347 WeakPolarHBondContact O-CB 3.36Å; K343-A347 PolarHBondContact O-N 3.25Å; M344-A347 PolarHBondContact O-N 3.46Å; A347-Q350 PolarHBondContact O-N 3.24Å; A347-I351 WeakPolarHBondContact O-CG1 3.46Å; A347-I351 PolarHBondContact O-N 2.95Å; A347-I351 VanDerWaalsContact O-N 3.09Å |
| 348 | T | 98.3 | Very high | 95.6 | Very high | 56 Ų | 56 | 69 Ų | 69 | 34% | 0.344 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 173.5 | -52.8 | 0 | 0 | 0 | 0 | 111.8 | M344 V345 L346 Q350 I351 C352 F405 L409 | M344-T348 PolarHBondContact O-N 2.78Å; M344-T348 PolarHBondContact O-OG1 3.41Å; M344-T348 VanDerWaalsContact O-OG1 3.07Å; V345-T348 PolarHBondContact O-N 2.74Å; L346-T348 PolarHBondContact O-N 3.5Å; T348-Q350 VanDerWaalsContact C-N 3.31Å; T348-Q350 PolarHBondContact O-N 3.39Å; T348-I351 PolarHBondContact O-N 3.07Å; T348-C352 WeakPolarHBondContact O-CB 3.45Å; T348-C352 PolarHBondContact O-N 3.27Å; T348-C352 PolarHBondContact O-SG 2.73Å; T348-F405 HydrophobicContact CG2-CE1 4Å; T348-F405 HydrophobicContact CG2-CZ 4.26Å; T348-L409 HydrophobicContact CG2-CD1 3.83Å; T348-L409 HydrophobicContact CG2-CD2 4.37Å |
| 349 | K | 97.8 | Very high | 96.2 | Very high | 54 Ų | 54 | 68.8 Ų | 68.8 | 24% | 0.235 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -57.4 | -44.1 | 175.1 | -76.9 | -172.4 | 64.1 | 175.1 | 0 | 111.9 | V345 L346 C352 K353 L409 S410 L413 | V345-K349 PolarHBondContact O-N 3.38Å; L346-K349 PolarHBondContact O-N 3.22Å; K349-C352 PolarHBondContact O-N 3.36Å; K349-K353 PolarHBondContact O-N 2.71Å; K349-L409 HydrophobicContact CD-CB 3.88Å; K349-L409 HydrophobicContact CG-CB 3.51Å; K349-L409 HydrophobicContact CG-CD1 3.67Å; K349-L409 HydrophobicContact CG-CG 4.23Å; K349-S410 PolarHBondContact NZ-OG 3.28Å; K349-L413 HydrophobicContact CD-CD1 3.97Å |
| 350 | Q | 98.3 | Very high | 96.5 | Very high | 100 Ų | 100 | 65.4 Ų | 65.4 | 47% | 0.467 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.9 | -49.3 | 179.5 | -179.3 | 57.8 | 28.3 | 0 | 0 | 111.8 | L346 A347 T348 C352 K353 E354 | L346-Q350 PolarHBondContact O-N 2.98Å; A347-Q350 PolarHBondContact O-N 3.24Å; T348-Q350 VanDerWaalsContact C-N 3.31Å; T348-Q350 PolarHBondContact O-N 3.39Å; Q350-C352 VanDerWaalsContact C-N 3.33Å; Q350-C352 PolarHBondContact O-N 3.22Å; Q350-K353 PolarHBondContact O-N 3.13Å; Q350-K353 VanDerWaalsContact O-N 3.12Å; Q350-E354 WeakPolarHBondContact CG-OE1 3.44Å; Q350-E354 PolarHBondContact NE2-OE1 3.31Å; Q350-E354 WeakPolarHBondContact O-CG 3.42Å; Q350-E354 PolarHBondContact O-N 3.33Å |
| 351 | I | 98.4 | Very high | 96.8 | Very high | 111 Ų | 111 | 66.3 Ų | 66.3 | 57% | 0.569 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -62.3 | -39.8 | 177.5 | -65.5 | 164.8 | 0 | 0 | 0 | 111.4 | A347 T348 K353 E354 F355 | A347-I351 WeakPolarHBondContact O-CG1 3.46Å; A347-I351 PolarHBondContact O-N 2.95Å; A347-I351 VanDerWaalsContact O-N 3.09Å; T348-I351 PolarHBondContact O-N 3.07Å; I351-K353 VanDerWaalsContact C-N 3.33Å; I351-K353 PolarHBondContact O-N 3.33Å; I351-E354 PolarHBondContact O-N 2.94Å; I351-F355 PolarHBondContact O-N 3.35Å; I351-F355 VanDerWaalsContact O-N 3.14Å |
| 352 | C | 98.1 | Very high | 97 | Very high | 15 Ų | 15 | 64.9 Ų | 64.9 | 10% | 0.101 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.1 | -38.3 | 174.6 | -70.8 | 0 | 0 | 0 | 0 | 112.5 | T348 K349 Q350 Q356 Q406 | T348-C352 WeakPolarHBondContact O-CB 3.45Å; T348-C352 PolarHBondContact O-N 3.27Å; T348-C352 PolarHBondContact O-SG 2.73Å; K349-C352 PolarHBondContact O-N 3.36Å; Q350-C352 VanDerWaalsContact C-N 3.33Å; Q350-C352 PolarHBondContact O-N 3.22Å; C352-Q356 PolarHBondContact O-N 3.39Å; C352-Q356 VanDerWaalsContact O-N 3.08Å; C352-Q406 HydrophobicContact CB-CG 3.95Å |
| 353 | K | 97.3 | Very high | 97.1 | Very high | 85 Ų | 85 | 66.8 Ų | 66.8 | 37% | 0.37 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -69.8 | -44.4 | 176.3 | 176.7 | 155.8 | 173 | 48 | 0 | 112.2 | K349 Q350 I351 F355 Q356 D357 | K349-K353 PolarHBondContact O-N 2.71Å; Q350-K353 PolarHBondContact O-N 3.13Å; Q350-K353 VanDerWaalsContact O-N 3.12Å; I351-K353 VanDerWaalsContact C-N 3.33Å; I351-K353 PolarHBondContact O-N 3.33Å; K353-F355 VanDerWaalsContact C-N 3.25Å; K353-F355 PolarHBondContact O-N 2.88Å; K353-Q356 WeakPolarHBondContact O-CB 3.47Å; K353-Q356 PolarHBondContact O-N 3.08Å; K353-Q356 VanDerWaalsContact O-N 3.12Å; K353-D357 WeakPolarHBondContact CE-OD2 3.31Å; K353-D357 VanDerWaalsContact CG-OD2 3.32Å; K353-D357 WeakPolarHBondContact CG-OD2 3.43Å; K353-D357 IonicContact NZ-OD1 3.84Å; K353-D357 PolarHBondContact NZ-OD1 3.37Å; K353-D357 IonicContact NZ-OD2 2.81Å; K353-D357 PolarHBondContact NZ-OD2 3.02Å; K353-D357 WeakPolarHBondContact O-CB 3.4Å; K353-D357 VanDerWaalsContact O-CG 3.26Å; K353-D357 PolarHBondContact O-N 2.76Å |
| 354 | E | 98.3 | Very high | 97.1 | Very high | 104 Ų | 104 | 59.8 Ų | 59.8 | 49% | 0.486 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -55.9 | -41.6 | 175.6 | -73.9 | 166.5 | -167.5 | 0 | 0 | 111.8 | Q350 I351 D357 L358 | Q350-E354 WeakPolarHBondContact CG-OE1 3.44Å; Q350-E354 PolarHBondContact NE2-OE1 3.31Å; Q350-E354 WeakPolarHBondContact O-CG 3.42Å; Q350-E354 PolarHBondContact O-N 3.33Å; I351-E354 PolarHBondContact O-N 2.94Å; E354-D357 PolarHBondContact O-N 3.09Å; E354-L358 PolarHBondContact O-N 3.17Å; E354-L358 VanDerWaalsContact O-N 3.08Å |
| 355 | F | 98.3 | Very high | 96.8 | Very high | 102 Ų | 102 | 56.4 Ų | 56.4 | 45% | 0.447 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -68.1 | -42.2 | 175.6 | -176.4 | -144.2 | 0 | 0 | 0 | 112.7 | I351 K353 D357 L358 L359 V398 L402 | I351-F355 PolarHBondContact O-N 3.35Å; I351-F355 VanDerWaalsContact O-N 3.14Å; K353-F355 VanDerWaalsContact C-N 3.25Å; K353-F355 PolarHBondContact O-N 2.88Å; F355-D357 PolarHBondContact O-N 2.77Å; F355-L358 PolarHBondContact O-N 3.5Å; F355-L359 HydrophobicContact CD2-CD1 4.31Å; F355-L359 HydrophobicContact CD2-CG 4.16Å; F355-L359 HydrophobicContact CE1-CD1 4.22Å; F355-L359 HydrophobicContact CE2-CD1 3.93Å; F355-L359 HydrophobicContact CE2-CD2 3.98Å; F355-L359 HydrophobicContact CE2-CG 3.88Å; F355-L359 HydrophobicContact CZ-CD1 3.88Å; F355-L359 HydrophobicContact CZ-CD2 4.42Å; F355-L359 HydrophobicContact CZ-CG 4.33Å; F355-L359 WeakPolarHBondContact O-CG 3.42Å; F355-L359 PolarHBondContact O-N 2.94Å; F355-V398 HydrophobicContact CE1-CG1 4.27Å; F355-L402 HydrophobicContact CD1-CD1 3.55Å; F355-L402 HydrophobicContact CD1-CD2 4.39Å; F355-L402 HydrophobicContact CE1-CD1 3.85Å; F355-L402 HydrophobicContact CG-CD1 4.41Å |
| 356 | Q | 97.7 | Very high | 96.4 | Very high | 14 Ų | 14 | 57.7 Ų | 57.7 | 7% | 0.065 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60.5 | -43 | 172.4 | -79.5 | -169.8 | -22 | 0 | 0 | 112.7 | C352 K353 L358 L359 S360 C399 L402 S403 | C352-Q356 PolarHBondContact O-N 3.39Å; C352-Q356 VanDerWaalsContact O-N 3.08Å; K353-Q356 WeakPolarHBondContact O-CB 3.47Å; K353-Q356 PolarHBondContact O-N 3.08Å; K353-Q356 VanDerWaalsContact O-N 3.12Å; Q356-L358 VanDerWaalsContact C-N 3.3Å; Q356-L358 PolarHBondContact O-N 2.96Å; Q356-L359 CarbonylContact O-C 3.6Å; Q356-L359 PolarHBondContact O-N 2.94Å; Q356-L359 VanDerWaalsContact O-N 3.15Å; Q356-S360 WeakPolarHBondContact O-CB 3.44Å; Q356-S360 PolarHBondContact O-N 3.36Å; Q356-C399 PolarHBondContact NE2-O 2.8Å; Q356-L402 HydrophobicContact CG-CB 3.81Å; Q356-L402 HydrophobicContact CG-CD1 3.9Å; Q356-L402 VanDerWaalsContact NE2-C 3.34Å; Q356-S403 PolarHBondContact NE2-OG 3.42Å |
| 357 | D | 97.4 | Very high | 95.6 | Very high | 61 Ų | 61 | 54 Ų | 54 | 33% | 0.326 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66.3 | -35 | -177.4 | -70.6 | -20.3 | 0 | 0 | 0 | 110.9 | K353 E354 F355 S360 Q361 | K353-D357 WeakPolarHBondContact CE-OD2 3.31Å; K353-D357 VanDerWaalsContact CG-OD2 3.32Å; K353-D357 WeakPolarHBondContact CG-OD2 3.43Å; K353-D357 IonicContact NZ-OD1 3.84Å; K353-D357 PolarHBondContact NZ-OD1 3.37Å; K353-D357 IonicContact NZ-OD2 2.81Å; K353-D357 PolarHBondContact NZ-OD2 3.02Å; K353-D357 WeakPolarHBondContact O-CB 3.4Å; K353-D357 VanDerWaalsContact O-CG 3.26Å; K353-D357 PolarHBondContact O-N 2.76Å; E354-D357 PolarHBondContact O-N 3.09Å; F355-D357 PolarHBondContact O-N 2.77Å; D357-S360 PolarHBondContact O-N 3.09Å; D357-S360 PolarHBondContact O-OG 2.77Å; D357-Q361 WeakPolarHBondContact O-CG 3.24Å; D357-Q361 PolarHBondContact O-NE2 3.26Å |
| 358 | L | 97.7 | Very high | 94.6 | Very high | 63 Ų | 63 | 54.1 Ų | 54.1 | 33% | 0.33 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -64.8 | -47.4 | 168.4 | -178.6 | 150.5 | 0 | 0 | 0 | 112.1 | E354 F355 Q356 S360 Q361 L383 | E354-L358 PolarHBondContact O-N 3.17Å; E354-L358 VanDerWaalsContact O-N 3.08Å; F355-L358 PolarHBondContact O-N 3.5Å; Q356-L358 VanDerWaalsContact C-N 3.3Å; Q356-L358 PolarHBondContact O-N 2.96Å; L358-S360 PolarHBondContact O-N 3.21Å; L358-Q361 WeakPolarHBondContact O-CB 3.45Å; L358-Q361 PolarHBondContact O-N 3.41Å; L358-L383 HydrophobicContact CD2-CD1 4.25Å |
| 359 | L | 97.3 | Very high | 93.8 | Very high | 11 Ų | 11 | 53.9 Ų | 53.9 | 6% | 0.058 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.7 | -31 | 177.1 | -68 | 177.5 | 0 | 0 | 0 | 112.1 | F355 Q356 Q361 D362 L383 T395 V398 L402 | F355-L359 HydrophobicContact CD2-CD1 4.31Å; F355-L359 HydrophobicContact CD2-CG 4.16Å; F355-L359 HydrophobicContact CE1-CD1 4.22Å; F355-L359 HydrophobicContact CE2-CD1 3.93Å; F355-L359 HydrophobicContact CE2-CD2 3.98Å; F355-L359 HydrophobicContact CE2-CG 3.88Å; F355-L359 HydrophobicContact CZ-CD1 3.88Å; F355-L359 HydrophobicContact CZ-CD2 4.42Å; F355-L359 HydrophobicContact CZ-CG 4.33Å; F355-L359 WeakPolarHBondContact O-CG 3.42Å; F355-L359 PolarHBondContact O-N 2.94Å; Q356-L359 CarbonylContact O-C 3.6Å; Q356-L359 PolarHBondContact O-N 2.94Å; Q356-L359 VanDerWaalsContact O-N 3.15Å; L359-Q361 PolarHBondContact O-N 2.93Å; L359-D362 WeakPolarHBondContact O-CB 3.18Å; L359-D362 PolarHBondContact O-N 3.1Å; L359-L383 HydrophobicContact CD2-CD2 3.75Å; L359-T395 HydrophobicContact CB-CG2 4.01Å; L359-T395 HydrophobicContact CD2-CG2 4.26Å; L359-V398 HydrophobicContact CD1-CB 4.33Å; L359-V398 HydrophobicContact CD1-CG1 3.64Å; L359-L402 HydrophobicContact CD1-CD1 4.31Å |
| 360 | S | 94.9 | Very high | 93.2 | Very high | 38 Ų | 38 | 57.9 Ų | 57.9 | 27% | 0.266 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -18 | 173.7 | 94.7 | 0 | 0 | 0 | 0 | 113.5 | R23 Q356 D357 L358 R363 | R23-S360 PolarHBondContact NH1-O 2.93Å; Q356-S360 WeakPolarHBondContact O-CB 3.44Å; Q356-S360 PolarHBondContact O-N 3.36Å; D357-S360 PolarHBondContact O-N 3.09Å; D357-S360 PolarHBondContact O-OG 2.77Å; L358-S360 PolarHBondContact O-N 3.21Å; S360-R363 PolarHBondContact O-NH1 2.94Å |
| 361 | Q | 95.5 | Very high | 92.9 | Very high | 75 Ų | 75 | 55.6 Ų | 55.6 | 35% | 0.35 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.6 | -1.1 | 179 | -69.1 | 169.9 | 78.8 | 0 | 0 | 112.9 | D357 L358 L359 R363 I374 L375 | D357-Q361 WeakPolarHBondContact O-CG 3.24Å; D357-Q361 PolarHBondContact O-NE2 3.26Å; L358-Q361 WeakPolarHBondContact O-CB 3.45Å; L358-Q361 PolarHBondContact O-N 3.41Å; L359-Q361 PolarHBondContact O-N 2.93Å; Q361-R363 VanDerWaalsContact C-NH1 3.3Å; Q361-R363 PolarHBondContact O-N 3.08Å; Q361-R363 PolarHBondContact O-NH1 3.11Å; Q361-I374 HydrophobicContact CB-CD1 3.98Å; Q361-I374 HydrophobicContact CB-CG1 4.3Å; Q361-I374 HydrophobicContact CG-CD1 4.1Å; Q361-L375 HydrophobicContact CB-CD1 3.94Å; Q361-L375 HydrophobicContact CB-CD2 3.74Å; Q361-L375 HydrophobicContact CB-CG 3.8Å |
| 362 | D | 95.6 | Very high | 92.6 | Very high | 24 Ų | 24 | 55.8 Ų | 55.8 | 13% | 0.128 | 30% | 0.295 | C | S | . | . | trans | -55.2 | 125.2 | 172.5 | -174.2 | 9.2 | 0 | 0 | 0 | 111.3 | L359 S364 Q380 L383 S387 | L359-D362 WeakPolarHBondContact O-CB 3.18Å; L359-D362 PolarHBondContact O-N 3.1Å; D362-S364 VanDerWaalsContact OD1-CB 3.3Å; D362-S364 WeakPolarHBondContact OD1-CB 3.36Å; D362-S364 PolarHBondContact OD1-N 3.31Å; D362-S364 PolarHBondContact OD1-OG 3.22Å; D362-S364 PolarHBondContact OD2-OG 3Å; D362-Q380 PolarHBondContact OD1-NE2 2.91Å; D362-L383 HydrophobicContact CB-CD1 4.2Å; D362-S387 PolarHBondContact OD2-OG 3.3Å | ||
| 363 | R | 95.2 | Very high | 92.4 | Very high | 65 Ų | 65 | 58 Ų | 58 | 25% | 0.245 | 31% | 0.309 | C | S | . | . | trans | -117.1 | 38.7 | 173.8 | -60.8 | -59.3 | 174.2 | -95.8 | -2.5 | 111.6 | S360 Q361 P371 T372 I374 | S360-R363 PolarHBondContact O-NH1 2.94Å; Q361-R363 VanDerWaalsContact C-NH1 3.3Å; Q361-R363 PolarHBondContact O-N 3.08Å; Q361-R363 PolarHBondContact O-NH1 3.11Å; R363-P371 HydrophobicContact CB-CB 4.13Å; R363-P371 HydrophobicContact CB-CG 3.85Å; R363-P371 HydrophobicContact CG-CB 4.42Å; R363-T372 WeakPolarHBondContact CG-O 3.29Å; R363-I374 HydrophobicContact CG-CD1 4.38Å; R363-I374 HydrophobicContact CG-CG1 3.96Å | ||
| 364 | S | 94.7 | Very high | 92.3 | Very high | 9 Ų | 9 | 58.6 Ų | 58.6 | 6% | 0.063 | 32% | 0.315 | C | S | . | . | trans | -55.7 | 130 | 172.2 | -71.8 | 0 | 0 | 0 | 0 | 112.3 | D362 L366 T384 S387 | D362-S364 VanDerWaalsContact OD1-CB 3.3Å; D362-S364 WeakPolarHBondContact OD1-CB 3.36Å; D362-S364 PolarHBondContact OD1-N 3.31Å; D362-S364 PolarHBondContact OD1-OG 3.22Å; D362-S364 PolarHBondContact OD2-OG 3Å; S364-L366 VanDerWaalsContact C-N 3.33Å; S364-L366 PolarHBondContact O-N 3.28Å; S364-T384 VanDerWaalsContact OG-CA 3.23Å; S364-T384 WeakPolarHBondContact OG-CA 3.46Å; S364-T384 PolarHBondContact OG-N 3.23Å; S364-S387 VanDerWaalsContact CB-CB 3.49Å; S364-S387 VanDerWaalsContact OG-CB 3.27Å; S364-S387 WeakPolarHBondContact OG-CB 3.43Å; S364-S387 PolarHBondContact OG-OG 2.97Å | ||
| 365 | P | 90.5 | Very high | 92.2 | Very high | 44 Ų | 44 | 55 Ų | 55 | 29% | 0.286 | 30% | 0.299 | S | S | . | . | trans | -76.9 | 76.6 | -178.7 | 30.8 | -36.3 | 0 | 0 | 0 | 112.6 | S369 R370 T384 | P365-S369 WeakPolarHBondContact CA-O 3.18Å; P365-R370 PolarHBondContact O-NH1 3.04Å; P365-T384 HydrophobicContact CG-CG2 4.49Å | ||
| 366 | L | 86.8 | Confident | 92.1 | Very high | 32 Ų | 32 | 56.1 Ų | 56.1 | 17% | 0.168 | 31% | 0.31 | C | S | . | . | trans | -89.8 | 146 | 177 | -68.9 | 168.8 | 0 | 0 | 0 | 112 | S364 S368 S369 L388 | S364-L366 VanDerWaalsContact C-N 3.33Å; S364-L366 PolarHBondContact O-N 3.28Å; L366-S368 PolarHBondContact O-N 3.5Å; L366-S369 WeakPolarHBondContact O-CB 3.41Å; L366-S369 PolarHBondContact O-N 2.64Å; L366-S369 PolarHBondContact O-OG 3.05Å; L366-L388 HydrophobicContact CD2-CD2 4.2Å | ||
| 367 | G | 82.1 | Confident | 92 | Very high | 20 Ų | 20 | 61.8 Ų | 61.8 | 21% | 0.206 | 34% | 0.34 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 51.6 | -129.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A239 E301 R370 | A239-G367 WeakPolarHBondContact CB-O 3.29Å; E301-G367 WeakPolarHBondContact OE2-CA 3.19Å; E301-G367 PolarHBondContact OE2-N 2.97Å; G367-R370 PolarHBondContact O-NH1 2.75Å; G367-R370 PolarHBondContact O-NH2 3.2Å |
| 368 | S | 77.6 | Confident | 91.9 | Very high | 54 Ų | 54 | 63.3 Ų | 63.3 | 38% | 0.378 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.9 | -13.8 | 174.2 | -62.2 | 0 | 0 | 0 | 0 | 114.1 | L366 | L366-S368 PolarHBondContact O-N 3.5Š|
| 369 | S | 81.3 | Confident | 91.9 | Very high | 51 Ų | 51 | 63.8 Ų | 63.8 | 36% | 0.357 | 35% | 0.35 | S | S | . | . | trans | -76.9 | 134 | -171.7 | 75.9 | 0 | 0 | 0 | 0 | 112.2 | P365 L366 P371 | P365-S369 WeakPolarHBondContact CA-O 3.18Å; L366-S369 WeakPolarHBondContact O-CB 3.41Å; L366-S369 PolarHBondContact O-N 2.64Å; L366-S369 PolarHBondContact O-OG 3.05Å; S369-P371 VanDerWaalsContact C-CD 3.45Å | ||
| 370 | R | 85.3 | Confident | 91.9 | Very high | 138 Ų | 138 | 63.6 Ų | 63.6 | 52% | 0.521 | 35% | 0.349 | S | S | . | . | trans | -131.6 | 62.3 | 175.6 | -63.2 | -63.6 | 178.6 | -88.1 | 1.7 | 110.6 | P365 G367 | P365-R370 PolarHBondContact O-NH1 3.04Å; G367-R370 PolarHBondContact O-NH1 2.75Å; G367-R370 PolarHBondContact O-NH2 3.2Å | ||
| 371 | P | 90.8 | Very high | 92 | Very high | 52 Ų | 52 | 68.2 Ų | 68.2 | 34% | 0.338 | 36% | 0.361 | S | S | . | . | P | Polyproline II helix | trans | -67.6 | 151.6 | 178.3 | 30.6 | -35.9 | 0 | 0 | 0 | 111.6 | R363 S369 | R363-P371 HydrophobicContact CB-CB 4.13Å; R363-P371 HydrophobicContact CB-CG 3.85Å; R363-P371 HydrophobicContact CG-CB 4.42Å; S369-P371 VanDerWaalsContact C-CD 3.45Å |
| 372 | T | 92.5 | Very high | 92.1 | Very high | 115 Ų | 115 | 70 Ų | 70 | 71% | 0.706 | 37% | 0.369 | S | S | * | . | P | Polyproline II helix | trans | -68.2 | 134.9 | 169.5 | -46.9 | 0 | 0 | 0 | 0 | 109.9 | R363 | R363-T372 WeakPolarHBondContact CG-O 3.29Š|
| 373 | P | 93 | Very high | 92.2 | Very high | 62 Ų | 62 | 69.8 Ų | 69.8 | 40% | 0.403 | 37% | 0.368 | S | S | . | . | P | Polyproline II helix | trans | -52.6 | 138.3 | 167.1 | -29.7 | 38 | 0 | 0 | 0 | 112.7 | L377 Q380 | P373-L377 HydrophobicContact CB-CD2 4.19Å; P373-L377 HydrophobicContact CG-CD2 4.44Å; P373-Q380 HydrophobicContact CB-CG 4.15Å; P373-Q380 HydrophobicContact CG-CG 4.37Å |
| 374 | I | 95.8 | Very high | 92.2 | Very high | 97 Ų | 97 | 68 Ų | 68 | 50% | 0.497 | 36% | 0.364 | S | S | . | . | trans | -121.1 | -15.3 | 172.1 | 65.4 | 174.4 | 0 | 0 | 0 | 113.1 | Q361 R363 | Q361-I374 HydrophobicContact CB-CD1 3.98Å; Q361-I374 HydrophobicContact CB-CG1 4.3Å; Q361-I374 HydrophobicContact CG-CD1 4.1Å; R363-I374 HydrophobicContact CG-CD1 4.38Å; R363-I374 HydrophobicContact CG-CG1 3.96Å | ||
| 375 | L | 96.2 | Very high | 92.3 | Very high | 27 Ų | 27 | 72.6 Ų | 72.6 | 14% | 0.141 | 38% | 0.384 | C | S | . | . | S | Bend | trans | -91 | 158.7 | 171.7 | -68.7 | 172.4 | 0 | 0 | 0 | 110.2 | Q361 L377 I379 Q380 L383 | Q361-L375 HydrophobicContact CB-CD1 3.94Å; Q361-L375 HydrophobicContact CB-CD2 3.74Å; Q361-L375 HydrophobicContact CB-CG 3.8Å; L375-L377 PolarHBondContact O-N 3.02Å; L375-I379 HydrophobicContact CD1-CG2 4.36Å; L375-Q380 HydrophobicContact CB-CB 4.34Å; L375-L383 HydrophobicContact CD1-CD1 3.55Å |
| 376 | D | 96.7 | Very high | 92.6 | Very high | 127 Ų | 127 | 74.2 Ų | 74.2 | 68% | 0.679 | 39% | 0.387 | S | S | * | . | trans | -48.6 | 135.8 | 171.1 | -66.6 | -41.7 | 0 | 0 | 0 | 111.4 | D378 I379 Q380 | D376-D378 PolarHBondContact O-N 2.86Å; D376-D378 VanDerWaalsContact O-N 3.14Å; D376-I379 HydrophobicContact CB-CG1 4.33Å; D376-I379 PolarHBondContact O-N 3.12Å; D376-Q380 PolarHBondContact O-N 3.07Å | ||
| 377 | L | 94.9 | Very high | 93.1 | Very high | 133 Ų | 133 | 72.8 Ų | 72.8 | 70% | 0.696 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -60 | -32.1 | -170 | -64.6 | 178.5 | 0 | 0 | 0 | 113.1 | P373 L375 R381 | P373-L377 HydrophobicContact CB-CD2 4.19Å; P373-L377 HydrophobicContact CG-CD2 4.44Å; L375-L377 PolarHBondContact O-N 3.02Å; L377-R381 WeakPolarHBondContact O-CB 3.42Å; L377-R381 PolarHBondContact O-N 3.09Å |
| 378 | D | 96.7 | Very high | 93.7 | Very high | 92 Ų | 92 | 72.7 Ų | 72.7 | 49% | 0.492 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -65.5 | -45.2 | 172.7 | -77.4 | -65.9 | 0 | 0 | 0 | 112.3 | D376 R381 H382 | D376-D378 PolarHBondContact O-N 2.86Å; D376-D378 VanDerWaalsContact O-N 3.14Å; D378-R381 PolarHBondContact O-N 3.24Å; D378-R381 IonicContact OD1-CZ 2.66Å; D378-R381 IonicContact OD1-NH1 3.1Å; D378-R381 PolarHBondContact OD1-NH1 3.15Å; D378-R381 IonicContact OD1-NH2 2.68Å; D378-R381 PolarHBondContact OD1-NH2 3.24Å; D378-H382 PolarHBondContact O-CE1 2.82Å; D378-H382 PolarHBondContact O-N 2.9Å; D378-H382 PolarHBondContact O-ND1 3.41Å |
| 379 | I | 97.2 | Very high | 94.5 | Very high | 73 Ų | 73 | 72.7 Ų | 72.7 | 37% | 0.374 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -67.1 | -47.6 | 177.1 | -58.7 | -58.3 | 0 | 0 | 0 | 110.3 | L375 D376 R381 H382 L383 | L375-I379 HydrophobicContact CD1-CG2 4.36Å; D376-I379 HydrophobicContact CB-CG1 4.33Å; D376-I379 PolarHBondContact O-N 3.12Å; I379-R381 VanDerWaalsContact C-N 3.25Å; I379-R381 PolarHBondContact O-N 3.36Å; I379-H382 PolarHBondContact O-N 3.2Å; I379-H382 VanDerWaalsContact O-N 3.1Å; I379-L383 HydrophobicContact CG2-CD1 4Å; I379-L383 HydrophobicContact CG2-CG 4.36Å; I379-L383 PolarHBondContact O-N 3.44Å |
| 380 | Q | 97 | Very high | 95.3 | Very high | 8 Ų | 8 | 70.5 Ų | 70.5 | 4% | 0.037 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.7 | -33.6 | 177.5 | -173.2 | 59.1 | 73.7 | 0 | 0 | 111.9 | D362 P373 L375 D376 T384 | D362-Q380 PolarHBondContact OD1-NE2 2.91Å; P373-Q380 HydrophobicContact CB-CG 4.15Å; P373-Q380 HydrophobicContact CG-CG 4.37Å; L375-Q380 HydrophobicContact CB-CB 4.34Å; D376-Q380 PolarHBondContact O-N 3.07Å; Q380-T384 PolarHBondContact NE2-OG1 2.86Å; Q380-T384 WeakPolarHBondContact O-CB 3.49Å; Q380-T384 PolarHBondContact O-N 2.84Å; Q380-T384 PolarHBondContact O-OG1 3.39Å |
| 381 | R | 96.4 | Very high | 95.8 | Very high | 134 Ų | 134 | 64 Ų | 64 | 51% | 0.506 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.8 | -43.7 | 173.9 | -177.4 | -178.9 | 67.4 | -120.4 | -6.3 | 112.1 | L377 D378 I379 H385 | L377-R381 WeakPolarHBondContact O-CB 3.42Å; L377-R381 PolarHBondContact O-N 3.09Å; D378-R381 PolarHBondContact O-N 3.24Å; D378-R381 IonicContact OD1-CZ 2.66Å; D378-R381 IonicContact OD1-NH1 3.1Å; D378-R381 PolarHBondContact OD1-NH1 3.15Å; D378-R381 IonicContact OD1-NH2 2.68Å; D378-R381 PolarHBondContact OD1-NH2 3.24Å; I379-R381 VanDerWaalsContact C-N 3.25Å; I379-R381 PolarHBondContact O-N 3.36Å; R381-H385 PolarHBondContact O-N 3.24Å |
| 382 | H | 97.4 | Very high | 96 | Very high | 112 Ų | 112 | 61.6 Ų | 61.6 | 52% | 0.519 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -70.2 | -44.2 | 179.3 | -63.7 | 109 | 0 | 0 | 0 | 112.1 | D378 I379 T384 H385 F386 | D378-H382 PolarHBondContact O-CE1 2.82Å; D378-H382 PolarHBondContact O-N 2.9Å; D378-H382 PolarHBondContact O-ND1 3.41Å; I379-H382 PolarHBondContact O-N 3.2Å; I379-H382 VanDerWaalsContact O-N 3.1Å; H382-T384 VanDerWaalsContact C-N 3.32Å; H382-T384 PolarHBondContact O-N 2.69Å; H382-H385 PolarHBondContact O-N 3.42Å; H382-F386 PolarHBondContact O-N 3.2Å; H382-F386 VanDerWaalsContact O-N 3.08Å |
| 383 | L | 97.4 | Very high | 96.2 | Very high | 21 Ų | 21 | 58 Ų | 58 | 11% | 0.11 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.7 | -41.8 | 173.5 | -66 | 176.8 | 0 | 0 | 0 | 111.3 | L358 L359 D362 L375 I379 H385 F386 S387 | L358-L383 HydrophobicContact CD2-CD1 4.25Å; L359-L383 HydrophobicContact CD2-CD2 3.75Å; D362-L383 HydrophobicContact CB-CD1 4.2Å; L375-L383 HydrophobicContact CD1-CD1 3.55Å; I379-L383 HydrophobicContact CG2-CD1 4Å; I379-L383 HydrophobicContact CG2-CG 4.36Å; I379-L383 PolarHBondContact O-N 3.44Å; L383-H385 PolarHBondContact O-N 3.45Å; L383-F386 PolarHBondContact O-N 2.95Å; L383-S387 WeakPolarHBondContact O-CB 3.4Å; L383-S387 PolarHBondContact O-N 2.95Å; L383-S387 PolarHBondContact O-OG 3.35Å |
| 384 | T | 96.6 | Very high | 96.4 | Very high | 27 Ų | 27 | 55.3 Ų | 55.3 | 17% | 0.166 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -58.3 | -49.7 | 172.7 | -57.3 | 0 | 0 | 0 | 0 | 111.2 | S364 P365 Q380 H382 F386 S387 L388 | S364-T384 VanDerWaalsContact OG-CA 3.23Å; S364-T384 WeakPolarHBondContact OG-CA 3.46Å; S364-T384 PolarHBondContact OG-N 3.23Å; P365-T384 HydrophobicContact CG-CG2 4.49Å; Q380-T384 PolarHBondContact NE2-OG1 2.86Å; Q380-T384 WeakPolarHBondContact O-CB 3.49Å; Q380-T384 PolarHBondContact O-N 2.84Å; Q380-T384 PolarHBondContact O-OG1 3.39Å; H382-T384 VanDerWaalsContact C-N 3.32Å; H382-T384 PolarHBondContact O-N 2.69Å; T384-F386 VanDerWaalsContact C-N 3.28Å; T384-F386 PolarHBondContact O-N 3.22Å; T384-S387 PolarHBondContact O-N 2.93Å; T384-L388 HydrophobicContact CG2-CD1 3.66Å; T384-L388 HydrophobicContact CG2-CD2 4.36Å; T384-L388 HydrophobicContact CG2-CG 3.84Å; T384-L388 VanDerWaalsContact O-CG 3.23Å; T384-L388 WeakPolarHBondContact O-CG 3.36Å; T384-L388 PolarHBondContact O-N 3.22Å |
| 385 | H | 96.2 | Very high | 96.5 | Very high | 106 Ų | 106 | 51.2 Ų | 51.2 | 49% | 0.491 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -54.8 | -45.5 | 178.1 | -175.5 | -157.3 | 0 | 0 | 0 | 111.8 | R381 H382 L383 I389 | R381-H385 PolarHBondContact O-N 3.24Å; H382-H385 PolarHBondContact O-N 3.42Å; L383-H385 PolarHBondContact O-N 3.45Å; H385-I389 WeakPolarHBondContact O-CG1 3.46Å; H385-I389 WeakPolarHBondContact O-CG2 3.49Å; H385-I389 PolarHBondContact O-N 3.09Å; H385-I389 VanDerWaalsContact O-N 3.09Å |
| 386 | F | 97.1 | Very high | 96.6 | Very high | 78 Ų | 78 | 52 Ų | 52 | 34% | 0.342 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.4 | -47.2 | 177.1 | -178.9 | -118.9 | 0 | 0 | 0 | 113.2 | H382 L383 T384 L388 I389 T390 V398 | H382-F386 PolarHBondContact O-N 3.2Å; H382-F386 VanDerWaalsContact O-N 3.08Å; L383-F386 PolarHBondContact O-N 2.95Å; T384-F386 VanDerWaalsContact C-N 3.28Å; T384-F386 PolarHBondContact O-N 3.22Å; F386-L388 PolarHBondContact O-N 2.75Å; F386-I389 HydrophobicContact CD2-CD1 4.48Å; F386-I389 PolarHBondContact O-N 3.41Å; F386-T390 HydrophobicContact CD2-CG2 3.92Å; F386-T390 HydrophobicContact CE2-CG2 3.68Å; F386-T390 HydrophobicContact CZ-CG2 4.17Å; F386-T390 WeakPolarHBondContact O-CB 3.5Å; F386-T390 WeakPolarHBondContact O-CG2 3.42Å; F386-T390 PolarHBondContact O-N 3.43Å; F386-T390 PolarHBondContact O-OG1 2.92Å; F386-V398 HydrophobicContact CE1-CG2 4.47Å; F386-V398 HydrophobicContact CZ-CG2 4.32Å |
| 387 | S | 96.6 | Very high | 96.6 | Very high | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.014 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.4 | -39.9 | 177.9 | -78.6 | 0 | 0 | 0 | 0 | 112.2 | D362 S364 L383 T384 H391 G392 T395 | D362-S387 PolarHBondContact OD2-OG 3.3Å; S364-S387 VanDerWaalsContact CB-CB 3.49Å; S364-S387 VanDerWaalsContact OG-CB 3.27Å; S364-S387 WeakPolarHBondContact OG-CB 3.43Å; S364-S387 PolarHBondContact OG-OG 2.97Å; L383-S387 WeakPolarHBondContact O-CB 3.4Å; L383-S387 PolarHBondContact O-N 2.95Å; L383-S387 PolarHBondContact O-OG 3.35Å; T384-S387 PolarHBondContact O-N 2.93Å; S387-H391 PolarHBondContact O-N 3.5Å; S387-G392 PolarHBondContact O-N 3.04Å; S387-T395 PolarHBondContact OG-OG1 2.89Å |
| 388 | L | 95.3 | Very high | 96.8 | Very high | 18 Ų | 18 | 42.5 Ų | 42.5 | 9% | 0.094 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -74 | -32.8 | 178.7 | -55.3 | -178.7 | 0 | 0 | 0 | 113.3 | R243 P248 L366 T384 F386 | R243-L388 HydrophobicContact CG-CD1 4.45Å; R243-L388 HydrophobicContact CG-CD2 4.24Å; R243-L388 PolarHBondContact NH1-O 3.48Å; P248-L388 HydrophobicContact CG-CB 3.97Å; L366-L388 HydrophobicContact CD2-CD2 4.2Å; T384-L388 HydrophobicContact CG2-CD1 3.66Å; T384-L388 HydrophobicContact CG2-CD2 4.36Å; T384-L388 HydrophobicContact CG2-CG 3.84Å; T384-L388 VanDerWaalsContact O-CG 3.23Å; T384-L388 WeakPolarHBondContact O-CG 3.36Å; T384-L388 PolarHBondContact O-N 3.22Å; F386-L388 PolarHBondContact O-N 2.75Å |
| 389 | I | 95.1 | Very high | 96.9 | Very high | 53 Ų | 53 | 39.6 Ų | 39.6 | 27% | 0.272 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -83.9 | -16.1 | 176.4 | 64.8 | 94.8 | 0 | 0 | 0 | 114.1 | P248 H385 F386 H391 | P248-I389 HydrophobicContact CB-CG2 3.74Å; P248-I389 HydrophobicContact CG-CG2 3.4Å; P248-I389 VanDerWaalsContact CG-CG2 3.4Å; H385-I389 WeakPolarHBondContact O-CG1 3.46Å; H385-I389 WeakPolarHBondContact O-CG2 3.49Å; H385-I389 PolarHBondContact O-N 3.09Å; H385-I389 VanDerWaalsContact O-N 3.09Å; F386-I389 HydrophobicContact CD2-CD1 4.48Å; F386-I389 PolarHBondContact O-N 3.41Å; I389-H391 PolarHBondContact O-CE1 3.22Å; I389-H391 PolarHBondContact O-ND1 3.04Å |
| 390 | T | 96.4 | Very high | 96.9 | Very high | 6 Ų | 6 | 36.8 Ų | 36.8 | 4% | 0.037 | 19% | 0.186 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | 2.6 | 172 | 62.2 | 0 | 0 | 0 | 0 | 113.5 | L296 F386 G392 F393 G394 | L296-T390 HydrophobicContact CD1-CG2 3.83Å; F386-T390 HydrophobicContact CD2-CG2 3.92Å; F386-T390 HydrophobicContact CE2-CG2 3.68Å; F386-T390 HydrophobicContact CZ-CG2 4.17Å; F386-T390 WeakPolarHBondContact O-CB 3.5Å; F386-T390 WeakPolarHBondContact O-CG2 3.42Å; F386-T390 PolarHBondContact O-N 3.43Å; F386-T390 PolarHBondContact O-OG1 2.92Å; T390-G392 PolarHBondContact O-N 3.45Å; T390-G392 VanDerWaalsContact O-N 3.15Å; T390-F393 VanDerWaalsContact O-CB 3.3Å; T390-F393 WeakPolarHBondContact O-CB 3.4Å; T390-F393 PolarHBondContact O-N 2.9Å; T390-G394 WeakPolarHBondContact OG1-CA 3.43Å; T390-G394 PolarHBondContact OG1-N 2.67Å |
| 391 | H | 95.8 | Very high | 97 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 20% | 0.204 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 59.9 | 27.5 | 175.2 | -53.2 | 70.7 | 0 | 0 | 0 | 113 | R243 R244 E249 E301 A304 S387 I389 | R243-H391 PolarHBondContact NH2-CD2 2.83Å; R244-H391 VanDerWaalsContact CZ-CD2 3.49Å; R244-H391 PolarHBondContact NE-NE2 2.92Å; R244-H391 PolarHBondContact NH2-NE2 3.05Å; E249-H391 IonicContact OE1-CE1 2.89Å; E249-H391 IonicContact OE1-NE2 2.77Å; E249-H391 PolarHBondContact OE1-NE2 3.18Å; E249-H391 IonicContact OE2-CD2 3.14Å; E249-H391 IonicContact OE2-CE1 2.76Å; E249-H391 IonicContact OE2-NE2 3Å; E249-H391 PolarHBondContact OE2-NE2 3.39Å; E301-H391 HydrophobicContact CG-CB 4.11Å; A304-H391 HydrophobicContact CB-CB 3.69Å; A304-H391 WeakPolarHBondContact CB-O 3.45Å; S387-H391 PolarHBondContact O-N 3.5Å; I389-H391 PolarHBondContact O-CE1 3.22Å; I389-H391 PolarHBondContact O-ND1 3.04Å |
| 392 | G | 95.4 | Very high | 97.1 | Very high | 3 Ų | 3 | 33.8 Ų | 33.8 | 3% | 0.031 | 19% | 0.187 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 88.9 | -5.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | S387 T390 P396 | S387-G392 PolarHBondContact O-N 3.04Å; T390-G392 PolarHBondContact O-N 3.45Å; T390-G392 VanDerWaalsContact O-N 3.15Å; G392-P396 VanDerWaalsContact O-CD 3.22Å; G392-P396 WeakPolarHBondContact O-CD 3.41Å; G392-P396 WeakPolarHBondContact O-CG 3.35Å |
| 393 | F | 97.8 | Very high | 97.1 | Very high | 40 Ų | 40 | 30.3 Ų | 30.3 | 18% | 0.175 | 18% | 0.175 | C | C | . | . | trans | -72 | -37.4 | 178.5 | 171.9 | -94 | 0 | 0 | 0 | 113.5 | L296 A304 L307 A308 T390 P396 A397 | L296-F393 HydrophobicContact CD1-CD1 4.42Å; L296-F393 HydrophobicContact CD2-CD1 4.15Å; L296-F393 HydrophobicContact CD2-CG 4.44Å; A304-F393 HydrophobicContact CB-CB 4.17Å; L307-F393 HydrophobicContact CB-CD2 4.25Å; L307-F393 HydrophobicContact CB-CE2 4.49Å; L307-F393 HydrophobicContact CD2-CD2 4.06Å; L307-F393 HydrophobicContact CD2-CE2 4.03Å; L307-F393 HydrophobicContact CG-CD2 3.98Å; L307-F393 HydrophobicContact CG-CE2 3.8Å; A308-F393 HydrophobicContact CB-CB 4.49Å; A308-F393 HydrophobicContact CB-CD2 3.67Å; A308-F393 HydrophobicContact CB-CE2 4.28Å; A308-F393 HydrophobicContact CB-CG 4.4Å; T390-F393 VanDerWaalsContact O-CB 3.3Å; T390-F393 WeakPolarHBondContact O-CB 3.4Å; T390-F393 PolarHBondContact O-N 2.9Å; F393-P396 WeakPolarHBondContact O-CD 3.45Å; F393-A397 HydrophobicContact CD1-CB 4.15Å; F393-A397 HydrophobicContact CD2-CB 4.49Å; F393-A397 HydrophobicContact CE1-CB 3.64Å; F393-A397 HydrophobicContact CE2-CB 4Å; F393-A397 HydrophobicContact CZ-CB 3.55Å; F393-A397 VanDerWaalsContact O-CB 3.28Å; F393-A397 WeakPolarHBondContact O-CB 3.41Å; F393-A397 PolarHBondContact O-N 3Å; F393-A397 VanDerWaalsContact O-N 3.14Å | ||
| 394 | G | 97.4 | Very high | 97.2 | Very high | 4 Ų | 4 | 29.9 Ų | 29.9 | 4% | 0.041 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.2 | -57.9 | -164 | 0 | 0 | 0 | 0 | 0 | 114.3 | T390 A397 V398 | T390-G394 WeakPolarHBondContact OG1-CA 3.43Å; T390-G394 PolarHBondContact OG1-N 2.67Å; G394-A397 PolarHBondContact O-N 3.21Å; G394-V398 WeakPolarHBondContact O-CG2 3.28Å; G394-V398 PolarHBondContact O-N 3.1Å |
| 395 | T | 97.3 | Very high | 97.3 | Very high | 12 Ų | 12 | 32.7 Ų | 32.7 | 7% | 0.074 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.6 | -47.2 | -175 | -53.4 | 0 | 0 | 0 | 0 | 112.4 | L359 S387 A397 V398 C399 | L359-T395 HydrophobicContact CB-CG2 4.01Å; L359-T395 HydrophobicContact CD2-CG2 4.26Å; S387-T395 PolarHBondContact OG-OG1 2.89Å; T395-A397 PolarHBondContact O-N 2.99Å; T395-V398 PolarHBondContact O-N 3.32Å; T395-C399 PolarHBondContact O-N 3.05Å; T395-C399 PolarHBondContact O-SG 2.87Å; T395-C399 VanDerWaalsContact O-SG 3.36Å |
| 396 | P | 97.4 | Very high | 97.4 | Very high | 44 Ų | 44 | 28.9 Ų | 28.9 | 29% | 0.286 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.7 | -38.3 | 175 | -21.8 | 33.4 | 0 | 0 | 0 | 113.8 | A308 G392 F393 C399 A400 | A308-P396 HydrophobicContact CB-CB 4.12Å; G392-P396 VanDerWaalsContact O-CD 3.22Å; G392-P396 WeakPolarHBondContact O-CD 3.41Å; G392-P396 WeakPolarHBondContact O-CG 3.35Å; F393-P396 WeakPolarHBondContact O-CD 3.45Å; P396-C399 PolarHBondContact O-N 2.89Å; P396-A400 WeakPolarHBondContact O-CB 3.5Å; P396-A400 PolarHBondContact O-N 3.46Å |
| 397 | A | 98.3 | Very high | 97.5 | Very high | 10 Ų | 10 | 28.3 Ų | 28.3 | 8% | 0.083 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -66.2 | -38.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | F311 F393 G394 T395 A400 A401 | F311-A397 HydrophobicContact CD1-CB 4.01Å; F311-A397 HydrophobicContact CE1-CB 4.06Å; F393-A397 HydrophobicContact CD1-CB 4.15Å; F393-A397 HydrophobicContact CD2-CB 4.49Å; F393-A397 HydrophobicContact CE1-CB 3.64Å; F393-A397 HydrophobicContact CE2-CB 4Å; F393-A397 HydrophobicContact CZ-CB 3.55Å; F393-A397 VanDerWaalsContact O-CB 3.28Å; F393-A397 WeakPolarHBondContact O-CB 3.41Å; F393-A397 PolarHBondContact O-N 3Å; F393-A397 VanDerWaalsContact O-N 3.14Å; G394-A397 PolarHBondContact O-N 3.21Å; T395-A397 PolarHBondContact O-N 2.99Å; A397-A400 PolarHBondContact O-N 2.91Å; A397-A401 PolarHBondContact O-N 2.87Å; A397-A401 VanDerWaalsContact O-N 3.1Å |
| 398 | V | 98.4 | Very high | 97.6 | Very high | 49 Ų | 49 | 28.4 Ų | 28.4 | 30% | 0.297 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -64.9 | -44.5 | 172.4 | 173.5 | 0 | 0 | 0 | 0 | 110.7 | F355 L359 F386 G394 T395 A400 A401 L402 | F355-V398 HydrophobicContact CE1-CG1 4.27Å; L359-V398 HydrophobicContact CD1-CB 4.33Å; L359-V398 HydrophobicContact CD1-CG1 3.64Å; F386-V398 HydrophobicContact CE1-CG2 4.47Å; F386-V398 HydrophobicContact CZ-CG2 4.32Å; G394-V398 WeakPolarHBondContact O-CG2 3.28Å; G394-V398 PolarHBondContact O-N 3.1Å; T395-V398 PolarHBondContact O-N 3.32Å; V398-A400 PolarHBondContact O-N 2.96Å; V398-A401 PolarHBondContact O-N 3.12Å; V398-L402 HydrophobicContact CG1-CD1 3.85Å; V398-L402 HydrophobicContact CG1-CG 4.44Å; V398-L402 WeakPolarHBondContact O-CB 3.42Å; V398-L402 VanDerWaalsContact O-CG 3.31Å; V398-L402 WeakPolarHBondContact O-CG 3.47Å; V398-L402 PolarHBondContact O-N 2.81Å |
| 399 | C | 98.2 | Very high | 97.7 | Very high | 31 Ų | 31 | 27.9 Ų | 27.9 | 21% | 0.209 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.1 | -43.7 | 175.9 | -70.8 | 0 | 0 | 0 | 0 | 112.3 | Q356 T395 P396 L402 S403 | Q356-C399 PolarHBondContact NE2-O 2.8Å; T395-C399 PolarHBondContact O-N 3.05Å; T395-C399 PolarHBondContact O-SG 2.87Å; T395-C399 VanDerWaalsContact O-SG 3.36Å; P396-C399 PolarHBondContact O-N 2.89Å; C399-L402 PolarHBondContact O-N 3.31Å; C399-S403 PolarHBondContact O-N 3.36Å; C399-S403 PolarHBondContact O-OG 2.93Å |
| 400 | A | 98.4 | Very high | 97.8 | Very high | 15 Ų | 15 | 27 Ų | 27 | 12% | 0.124 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59 | -51.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | F311 C315 P396 A397 V398 L402 S403 T404 | F311-A400 HydrophobicContact CD1-CB 4.39Å; F311-A400 HydrophobicContact CE1-CB 4.31Å; C315-A400 HydrophobicContact CB-CB 4.4Å; P396-A400 WeakPolarHBondContact O-CB 3.5Å; P396-A400 PolarHBondContact O-N 3.46Å; A397-A400 PolarHBondContact O-N 2.91Å; V398-A400 PolarHBondContact O-N 2.96Å; A400-L402 VanDerWaalsContact C-N 3.31Å; A400-L402 PolarHBondContact O-N 3.02Å; A400-S403 WeakPolarHBondContact O-CB 3.32Å; A400-S403 PolarHBondContact O-N 3.21Å; A400-T404 PolarHBondContact O-N 2.92Å; A400-T404 PolarHBondContact O-OG1 3.21Å |
| 401 | A | 98.4 | Very high | 97.9 | Very high | 50 Ų | 50 | 28.8 Ų | 28.8 | 41% | 0.413 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -60.1 | -38.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | A397 V398 S403 F405 | A397-A401 PolarHBondContact O-N 2.87Å; A397-A401 VanDerWaalsContact O-N 3.1Å; V398-A401 PolarHBondContact O-N 3.12Å; A401-S403 VanDerWaalsContact C-N 3.35Å; A401-F405 WeakPolarHBondContact O-CB 3.3Å; A401-F405 PolarHBondContact O-N 3.23Å |
| 402 | L | 98.4 | Very high | 97.9 | Very high | 28 Ų | 28 | 29.1 Ų | 29.1 | 15% | 0.147 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -67.3 | -32 | 173.8 | -71.6 | 169.2 | 0 | 0 | 0 | 112.8 | F355 Q356 L359 V398 C399 A400 Q406 | F355-L402 HydrophobicContact CD1-CD1 3.55Å; F355-L402 HydrophobicContact CD1-CD2 4.39Å; F355-L402 HydrophobicContact CE1-CD1 3.85Å; F355-L402 HydrophobicContact CG-CD1 4.41Å; Q356-L402 HydrophobicContact CG-CB 3.81Å; Q356-L402 HydrophobicContact CG-CD1 3.9Å; Q356-L402 VanDerWaalsContact NE2-C 3.34Å; L359-L402 HydrophobicContact CD1-CD1 4.31Å; V398-L402 HydrophobicContact CG1-CD1 3.85Å; V398-L402 HydrophobicContact CG1-CG 4.44Å; V398-L402 WeakPolarHBondContact O-CB 3.42Å; V398-L402 VanDerWaalsContact O-CG 3.31Å; V398-L402 WeakPolarHBondContact O-CG 3.47Å; V398-L402 PolarHBondContact O-N 2.81Å; C399-L402 PolarHBondContact O-N 3.31Å; A400-L402 VanDerWaalsContact C-N 3.31Å; A400-L402 PolarHBondContact O-N 3.02Å; L402-Q406 WeakPolarHBondContact O-CG 3.44Å; L402-Q406 PolarHBondContact O-N 3.06Å |
| 403 | S | 98.3 | Very high | 97.9 | Very high | 39 Ų | 39 | 29.8 Ų | 29.8 | 27% | 0.273 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -70.7 | -47.9 | 176.1 | -74 | 0 | 0 | 0 | 0 | 110.7 | Q356 C399 A400 A401 F405 Q406 T407 | Q356-S403 PolarHBondContact NE2-OG 3.42Å; C399-S403 PolarHBondContact O-N 3.36Å; C399-S403 PolarHBondContact O-OG 2.93Å; A400-S403 WeakPolarHBondContact O-CB 3.32Å; A400-S403 PolarHBondContact O-N 3.21Å; A401-S403 VanDerWaalsContact C-N 3.35Å; S403-F405 VanDerWaalsContact C-N 3.26Å; S403-F405 PolarHBondContact O-N 2.8Å; S403-Q406 PolarHBondContact O-N 3.2Å; S403-Q406 VanDerWaalsContact O-N 3.08Å; S403-T407 PolarHBondContact O-N 3.03Å; S403-T407 PolarHBondContact O-OG1 3.49Å |
| 404 | T | 98.6 | Very high | 97.7 | Very high | 12 Ų | 12 | 31 Ų | 31 | 7% | 0.074 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -54.4 | -43.2 | 172 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | C315 F319 A400 T407 V408 | C315-T404 WeakPolarHBondContact CB-OG1 3.48Å; C315-T404 PolarHBondContact O-OG1 3.49Å; F319-T404 HydrophobicContact CB-CG2 3.73Å; F319-T404 HydrophobicContact CD1-CG2 3.19Å; F319-T404 HydrophobicContact CD2-CG2 3.91Å; F319-T404 HydrophobicContact CE1-CG2 3.71Å; F319-T404 HydrophobicContact CE2-CG2 4.34Å; F319-T404 HydrophobicContact CG-CG2 3.3Å; F319-T404 HydrophobicContact CZ-CG2 4.26Å; A400-T404 PolarHBondContact O-N 2.92Å; A400-T404 PolarHBondContact O-OG1 3.21Å; T404-T407 WeakPolarHBondContact O-CB 3.48Å; T404-T407 PolarHBondContact O-N 3.23Å; T404-V408 WeakPolarHBondContact O-CG2 3.48Å; T404-V408 PolarHBondContact O-N 2.95Å |
| 405 | F | 98.6 | Very high | 97.5 | Very high | 86 Ų | 86 | 33.1 Ų | 33.1 | 38% | 0.377 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -65.9 | -39.5 | 175.9 | -176 | -124.9 | 0 | 0 | 0 | 113 | T348 A401 S403 T407 V408 L409 | T348-F405 HydrophobicContact CG2-CE1 4Å; T348-F405 HydrophobicContact CG2-CZ 4.26Å; A401-F405 WeakPolarHBondContact O-CB 3.3Å; A401-F405 PolarHBondContact O-N 3.23Å; S403-F405 VanDerWaalsContact C-N 3.26Å; S403-F405 PolarHBondContact O-N 2.8Å; F405-T407 VanDerWaalsContact C-N 3.3Å; F405-T407 PolarHBondContact O-N 2.91Å; F405-V408 WeakPolarHBondContact O-CB 3.38Å; F405-V408 PolarHBondContact O-N 2.91Å; F405-L409 HydrophobicContact CD1-CD1 3.95Å; F405-L409 HydrophobicContact CD2-CG 4.46Å; F405-L409 HydrophobicContact CE1-CD1 3.66Å; F405-L409 HydrophobicContact CE1-CG 4.26Å; F405-L409 HydrophobicContact CE2-CD1 4.44Å; F405-L409 HydrophobicContact CE2-CD2 4.18Å; F405-L409 HydrophobicContact CE2-CG 4.16Å; F405-L409 HydrophobicContact CG-CD1 4.47Å; F405-L409 HydrophobicContact CZ-CD1 3.93Å; F405-L409 HydrophobicContact CZ-CD2 3.96Å; F405-L409 HydrophobicContact CZ-CG 4.06Å; F405-L409 WeakPolarHBondContact O-CG 3.31Å; F405-L409 PolarHBondContact O-N 2.97Å |
| 406 | Q | 98.3 | Very high | 97.3 | Very high | 26 Ų | 26 | 32.8 Ų | 32.8 | 12% | 0.121 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.3 | -32.1 | 172.1 | -79.8 | -176.8 | 85.9 | 0 | 0 | 113 | C352 L402 S403 S410 | C352-Q406 HydrophobicContact CB-CG 3.95Å; L402-Q406 WeakPolarHBondContact O-CG 3.44Å; L402-Q406 PolarHBondContact O-N 3.06Å; S403-Q406 PolarHBondContact O-N 3.2Å; S403-Q406 VanDerWaalsContact O-N 3.08Å; Q406-S410 WeakPolarHBondContact O-CB 3.48Å; Q406-S410 PolarHBondContact O-N 2.71Å; Q406-S410 PolarHBondContact O-OG 3.02Å |
| 407 | T | 98.4 | Very high | 96.9 | Very high | 66 Ų | 66 | 34.4 Ų | 34.4 | 41% | 0.405 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -66.1 | -46 | 171.3 | -53.3 | 0 | 0 | 0 | 0 | 110.8 | S403 T404 F405 L409 S410 E411 | S403-T407 PolarHBondContact O-N 3.03Å; S403-T407 PolarHBondContact O-OG1 3.49Å; T404-T407 WeakPolarHBondContact O-CB 3.48Å; T404-T407 PolarHBondContact O-N 3.23Å; F405-T407 VanDerWaalsContact C-N 3.3Å; F405-T407 PolarHBondContact O-N 2.91Å; T407-L409 PolarHBondContact O-N 3.14Å; T407-S410 WeakPolarHBondContact O-CA 3.32Å; T407-S410 WeakPolarHBondContact O-CB 3.48Å; T407-S410 PolarHBondContact O-N 3.46Å; T407-E411 PolarHBondContact O-N 2.86Å |
| 408 | V | 98.5 | Very high | 96.3 | Very high | 5 Ų | 5 | 40.3 Ų | 40.3 | 3% | 0.03 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -55.1 | -48.1 | 172.5 | 170.5 | 0 | 0 | 0 | 0 | 111.6 | F319 V324 L328 T404 F405 S410 E411 M412 | F319-V408 HydrophobicContact CE1-CG2 3.79Å; V324-V408 HydrophobicContact CB-CG2 4.34Å; V324-V408 HydrophobicContact CG1-CG1 3.9Å; V324-V408 HydrophobicContact CG1-CG2 4.23Å; L328-V408 HydrophobicContact CD1-CG1 3.95Å; T404-V408 WeakPolarHBondContact O-CG2 3.48Å; T404-V408 PolarHBondContact O-N 2.95Å; F405-V408 WeakPolarHBondContact O-CB 3.38Å; F405-V408 PolarHBondContact O-N 2.91Å; V408-S410 PolarHBondContact O-N 2.94Å; V408-E411 PolarHBondContact O-N 3.3Å; V408-M412 WeakPolarHBondContact O-CG 3.21Å; V408-M412 PolarHBondContact O-N 3.32Å |
| 409 | L | 98.1 | Very high | 95.4 | Very high | 7 Ų | 7 | 41.9 Ų | 41.9 | 4% | 0.037 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64.7 | -28 | 177.2 | -66.4 | 170.7 | 0 | 0 | 0 | 112.7 | V345 T348 K349 F405 T407 M412 L413 | V345-L409 HydrophobicContact CG1-CB 4.07Å; V345-L409 HydrophobicContact CG1-CD2 4.05Å; V345-L409 WeakPolarHBondContact CG1-O 3.24Å; T348-L409 HydrophobicContact CG2-CD1 3.83Å; T348-L409 HydrophobicContact CG2-CD2 4.37Å; K349-L409 HydrophobicContact CD-CB 3.88Å; K349-L409 HydrophobicContact CG-CB 3.51Å; K349-L409 HydrophobicContact CG-CD1 3.67Å; K349-L409 HydrophobicContact CG-CG 4.23Å; F405-L409 HydrophobicContact CD1-CD1 3.95Å; F405-L409 HydrophobicContact CD2-CG 4.46Å; F405-L409 HydrophobicContact CE1-CD1 3.66Å; F405-L409 HydrophobicContact CE1-CG 4.26Å; F405-L409 HydrophobicContact CE2-CD1 4.44Å; F405-L409 HydrophobicContact CE2-CD2 4.18Å; F405-L409 HydrophobicContact CE2-CG 4.16Å; F405-L409 HydrophobicContact CG-CD1 4.47Å; F405-L409 HydrophobicContact CZ-CD1 3.93Å; F405-L409 HydrophobicContact CZ-CD2 3.96Å; F405-L409 HydrophobicContact CZ-CG 4.06Å; F405-L409 WeakPolarHBondContact O-CG 3.31Å; F405-L409 PolarHBondContact O-N 2.97Å; T407-L409 PolarHBondContact O-N 3.14Å; L409-M412 HydrophobicContact CD2-SD 3.96Å; L409-L413 WeakPolarHBondContact O-CG 3.24Å; L409-L413 PolarHBondContact O-N 2.95Å |
| 410 | S | 98.1 | Very high | 94 | Very high | 33 Ų | 33 | 43.2 Ų | 43.2 | 23% | 0.231 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -72 | -42.3 | 174.1 | -55.3 | 0 | 0 | 0 | 0 | 111.2 | K349 Q406 T407 V408 M412 L413 N414 | K349-S410 PolarHBondContact NZ-OG 3.28Å; Q406-S410 WeakPolarHBondContact O-CB 3.48Å; Q406-S410 PolarHBondContact O-N 2.71Å; Q406-S410 PolarHBondContact O-OG 3.02Å; T407-S410 WeakPolarHBondContact O-CA 3.32Å; T407-S410 WeakPolarHBondContact O-CB 3.48Å; T407-S410 PolarHBondContact O-N 3.46Å; V408-S410 PolarHBondContact O-N 2.94Å; S410-M412 VanDerWaalsContact C-N 3.32Å; S410-M412 PolarHBondContact O-N 3.31Å; S410-L413 WeakPolarHBondContact O-CB 3.45Å; S410-L413 PolarHBondContact O-N 2.86Å; S410-L413 VanDerWaalsContact O-N 3.12Å; S410-N414 VanDerWaalsContact O-CG 3.24Å; S410-N414 PolarHBondContact O-N 3.31Å; S410-N414 PolarHBondContact O-OD1 3.26Å |
| 411 | E | 97.5 | Very high | 92.1 | Very high | 44 Ų | 44 | 46.2 Ų | 46.2 | 21% | 0.206 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -70.1 | -28.8 | 176.6 | -65.7 | -69.4 | -176.2 | 0 | 0 | 112.6 | K322 T407 V408 N414 Y415 | K322-E411 HydrophobicContact CB-CG 4.04Å; K322-E411 HydrophobicContact CG-CG 4.4Å; T407-E411 PolarHBondContact O-N 2.86Å; V408-E411 PolarHBondContact O-N 3.3Å; E411-N414 VanDerWaalsContact CD-ND2 3.32Å; E411-N414 PolarHBondContact O-N 2.97Å; E411-N414 PolarHBondContact OE2-ND2 3.05Å; E411-Y415 WeakPolarHBondContact O-CB 3.23Å; E411-Y415 PolarHBondContact O-N 2.97Å |
| 412 | M | 95.8 | Very high | 90 | Very high | 7 Ų | 7 | 46.5 Ų | 46.5 | 3% | 0.034 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 166.2 | -72.6 | 176.3 | 71.8 | 0 | 0 | 112.1 | G325 L328 A329 V345 V408 L409 S410 Y415 L416 | G325-M412 WeakPolarHBondContact O-CG 3.36Å; L328-M412 HydrophobicContact CB-CE 3.93Å; L328-M412 HydrophobicContact CB-CG 4.2Å; L328-M412 HydrophobicContact CB-SD 3.87Å; L328-M412 HydrophobicContact CD1-SD 4.19Å; A329-M412 HydrophobicContact CB-CB 4.41Å; A329-M412 HydrophobicContact CB-CG 4.44Å; V345-M412 HydrophobicContact CG1-CB 4.41Å; V345-M412 HydrophobicContact CG2-CE 3.89Å; V408-M412 WeakPolarHBondContact O-CG 3.21Å; V408-M412 PolarHBondContact O-N 3.32Å; L409-M412 HydrophobicContact CD2-SD 3.96Å; S410-M412 VanDerWaalsContact C-N 3.32Å; S410-M412 PolarHBondContact O-N 3.31Å; M412-Y415 PolarHBondContact O-N 2.91Å; M412-L416 VanDerWaalsContact O-CG 3.27Å; M412-L416 WeakPolarHBondContact O-CG 3.36Å; M412-L416 PolarHBondContact O-N 3.06Å |
| 413 | L | 95.3 | Very high | 87.8 | Confident | 17 Ų | 17 | 52.8 Ų | 52.8 | 9% | 0.089 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.2 | -48.9 | 176.4 | -67.5 | 167.3 | 0 | 0 | 0 | 110.8 | K342 V345 L346 K349 L409 S410 Y415 L416 D417 | K342-L413 HydrophobicContact CB-CD2 4.26Å; K342-L413 HydrophobicContact CG-CD2 4.29Å; V345-L413 HydrophobicContact CB-CD2 4.05Å; V345-L413 HydrophobicContact CB-CG 4.44Å; V345-L413 HydrophobicContact CG1-CD1 4.1Å; V345-L413 HydrophobicContact CG1-CD2 3.85Å; V345-L413 HydrophobicContact CG1-CG 3.69Å; L346-L413 HydrophobicContact CD2-CD1 3.69Å; L346-L413 HydrophobicContact CG-CD1 4.2Å; L346-L413 HydrophobicContact CG-CD2 4.24Å; K349-L413 HydrophobicContact CD-CD1 3.97Å; L409-L413 WeakPolarHBondContact O-CG 3.24Å; L409-L413 PolarHBondContact O-N 2.95Å; S410-L413 WeakPolarHBondContact O-CB 3.45Å; S410-L413 PolarHBondContact O-N 2.86Å; S410-L413 VanDerWaalsContact O-N 3.12Å; L413-Y415 PolarHBondContact O-N 2.83Å; L413-Y415 VanDerWaalsContact O-N 3.08Å; L413-L416 PolarHBondContact O-N 2.86Å; L413-D417 PolarHBondContact O-N 3.4Å |
| 414 | N | 95 | Very high | 85 | Confident | 67 Ų | 67 | 57.4 Ų | 57.4 | 36% | 0.358 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -51.5 | -36 | 176.4 | -66.5 | -17.3 | 0 | 0 | 0 | 112.9 | S410 E411 K418 | S410-N414 VanDerWaalsContact O-CG 3.24Å; S410-N414 PolarHBondContact O-N 3.31Å; S410-N414 PolarHBondContact O-OD1 3.26Å; E411-N414 VanDerWaalsContact CD-ND2 3.32Å; E411-N414 PolarHBondContact O-N 2.97Å; E411-N414 PolarHBondContact OE2-ND2 3.05Å; N414-K418 VanDerWaalsContact O-CD 3.25Å; N414-K418 WeakPolarHBondContact O-CD 3.34Å; N414-K418 WeakPolarHBondContact O-CE 3.15Å; N414-K418 VanDerWaalsContact O-CG 3.26Å; N414-K418 WeakPolarHBondContact O-CG 3.21Å |
| 415 | Y | 93.4 | Very high | 82.1 | Confident | 48 Ų | 48 | 61.8 Ų | 61.8 | 19% | 0.188 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -75 | -48.7 | 175.3 | -171.5 | -91.9 | 0 | 0 | 0 | 112.5 | E326 A329 R330 E411 M412 L413 D417 K418 N419 | E326-Y415 HydrophobicContact CB-CD2 4.06Å; E326-Y415 HydrophobicContact CB-CG 4.5Å; E326-Y415 HydrophobicContact CG-CD2 3.86Å; E326-Y415 HydrophobicContact CG-CG 4.44Å; A329-Y415 HydrophobicContact CB-CD1 3.48Å; A329-Y415 VanDerWaalsContact CB-CD1 3.48Å; A329-Y415 HydrophobicContact CB-CE1 4.36Å; A329-Y415 HydrophobicContact CB-CG 3.99Å; R330-Y415 HydrophobicContact CG-CE1 3.75Å; R330-Y415 HydrophobicContact CG-CE2 4.25Å; R330-Y415 WeakPolarHBondContact CG-OH 3.26Å; E411-Y415 WeakPolarHBondContact O-CB 3.23Å; E411-Y415 PolarHBondContact O-N 2.97Å; M412-Y415 PolarHBondContact O-N 2.91Å; L413-Y415 PolarHBondContact O-N 2.83Å; L413-Y415 VanDerWaalsContact O-N 3.08Å; Y415-D417 VanDerWaalsContact C-N 3.26Å; Y415-D417 PolarHBondContact O-N 2.99Å; Y415-K418 PolarHBondContact O-N 3.37Å; Y415-N419 WeakPolarHBondContact CE1-ND2 3.47Å; Y415-N419 VanDerWaalsContact CZ-ND2 3.28Å; Y415-N419 PolarHBondContact O-N 3.41Å; Y415-N419 PolarHBondContact OH-ND2 3.21Å |
| 416 | L | 91.1 | Very high | 78.9 | Confident | 5 Ų | 5 | 60.8 Ų | 60.8 | 3% | 0.026 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64 | -29 | 179.5 | -68.4 | 171.5 | 0 | 0 | 0 | 112.9 | A329 T338 R341 K342 M412 L413 S420 | A329-L416 HydrophobicContact CB-CD2 4.35Å; A329-L416 HydrophobicContact CB-CG 4.18Å; T338-L416 HydrophobicContact CG2-CD2 4.46Å; R341-L416 HydrophobicContact CG-CD1 3.96Å; K342-L416 HydrophobicContact CD-CB 4.47Å; K342-L416 VanDerWaalsContact CE-C 3.47Å; K342-L416 VanDerWaalsContact CE-O 3.23Å; K342-L416 WeakPolarHBondContact CE-O 3.41Å; K342-L416 HydrophobicContact CG-CB 4.01Å; K342-L416 HydrophobicContact CG-CD1 4.08Å; K342-L416 PolarHBondContact NZ-O 3.3Å; M412-L416 VanDerWaalsContact O-CG 3.27Å; M412-L416 WeakPolarHBondContact O-CG 3.36Å; M412-L416 PolarHBondContact O-N 3.06Å; L413-L416 PolarHBondContact O-N 2.86Å; L416-S420 VanDerWaalsContact O-CB 3.25Å; L416-S420 WeakPolarHBondContact O-CB 3.34Å; L416-S420 PolarHBondContact O-N 2.77Å; L416-S420 PolarHBondContact O-OG 3.32Å |
| 417 | D | 89.4 | Confident | 76.1 | Confident | 78 Ų | 78 | 65.9 Ų | 65.9 | 42% | 0.417 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -69.9 | -52 | 174.5 | -71.4 | -40 | 0 | 0 | 0 | 111.4 | K342 L413 Y415 N419 S420 S421 | K342-D417 WeakPolarHBondContact CE-OD1 3.29Å; K342-D417 IonicContact NZ-OD1 3.81Å; K342-D417 PolarHBondContact NZ-OD1 3.36Å; L413-D417 PolarHBondContact O-N 3.4Å; Y415-D417 VanDerWaalsContact C-N 3.26Å; Y415-D417 PolarHBondContact O-N 2.99Å; D417-N419 VanDerWaalsContact C-N 3.33Å; D417-N419 PolarHBondContact O-N 2.94Å; D417-S420 PolarHBondContact O-N 2.94Å; D417-S420 PolarHBondContact O-OG 3.17Å; D417-S421 PolarHBondContact O-N 3.16Å; D417-S421 PolarHBondContact O-OG 3.23Å |
| 418 | K | 86.8 | Confident | 73 | Confident | 134 Ų | 134 | 70.5 Ų | 70.5 | 58% | 0.583 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -57.3 | -42.4 | 176.4 | -69 | 166.8 | -169.1 | 168.4 | 0 | 112.7 | N414 Y415 S420 S421 | N414-K418 VanDerWaalsContact O-CD 3.25Å; N414-K418 WeakPolarHBondContact O-CD 3.34Å; N414-K418 WeakPolarHBondContact O-CE 3.15Å; N414-K418 VanDerWaalsContact O-CG 3.26Å; N414-K418 WeakPolarHBondContact O-CG 3.21Å; Y415-K418 PolarHBondContact O-N 3.37Å; K418-S420 VanDerWaalsContact C-N 3.29Å; K418-S420 PolarHBondContact O-N 2.66Å; K418-S421 PolarHBondContact O-OG 3Å |
| 419 | N | 78.9 | Confident | 70 | Confident | 82 Ų | 82 | 77.7 Ų | 77.7 | 44% | 0.439 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -73.5 | -20 | 178.4 | -77.2 | 32.7 | 0 | 0 | 0 | 113.2 | Y415 D417 | Y415-N419 WeakPolarHBondContact CE1-ND2 3.47Å; Y415-N419 VanDerWaalsContact CZ-ND2 3.28Å; Y415-N419 PolarHBondContact O-N 3.41Å; Y415-N419 PolarHBondContact OH-ND2 3.21Å; D417-N419 VanDerWaalsContact C-N 3.33Å; D417-N419 PolarHBondContact O-N 2.94Å |
| 420 | S | 68.5 | Low | 67.1 | Low | 58 Ų | 58 | 86.9 Ų | 86.9 | 41% | 0.406 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -82.6 | -26 | 178.3 | 65.8 | 0 | 0 | 0 | 0 | 114.3 | K342 L416 D417 K418 | K342-S420 PolarHBondContact NZ-OG 2.9Å; L416-S420 VanDerWaalsContact O-CB 3.25Å; L416-S420 WeakPolarHBondContact O-CB 3.34Å; L416-S420 PolarHBondContact O-N 2.77Å; L416-S420 PolarHBondContact O-OG 3.32Å; D417-S420 PolarHBondContact O-N 2.94Å; D417-S420 PolarHBondContact O-OG 3.17Å; K418-S420 VanDerWaalsContact C-N 3.29Å; K418-S420 PolarHBondContact O-N 2.66Å |
| 421 | S | 59.4 | Low | 64.2 | Low | 79 Ų | 79 | 92.3 Ų | 92.3 | 55% | 0.552 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -86.6 | -16.6 | 177.1 | 50.8 | 0 | 0 | 0 | 0 | 114 | D417 K418 K423 | D417-S421 PolarHBondContact O-N 3.16Å; D417-S421 PolarHBondContact O-OG 3.23Å; K418-S421 PolarHBondContact O-OG 3Å; S421-K423 PolarHBondContact O-N 3.42Å |
| 422 | G | 53.8 | Low | 61.4 | Low | 56 Ų | 56 | 97.8 Ų | 97.8 | 58% | 0.577 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | 26.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 423 | K | 51.2 | Low | 58.3 | Low | 159 Ų | 159 | 104.8 Ų | 104.8 | 69% | 0.691 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.8 | 13.1 | -179.5 | -71 | -166.3 | 175.3 | -175.7 | 0 | 115.4 | S421 | S421-K423 PolarHBondContact O-N 3.42Š|
| 424 | T | 40.4 | Very low | 55.1 | Low | 137 Ų | 137 | 108.2 Ų | 108.2 | 84% | 0.84 | 61% | 0.611 | S | S | * | * | trans | -118.1 | 24.3 | 174.7 | 56 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 425 | S | 38.3 | Very low | 52.1 | Low | 103 Ų | 103 | 110.1 Ų | 110.1 | 72% | 0.72 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -93.6 | 120.9 | 155.1 | 54 | 0 | 0 | 0 | 0 | 108.2 | ||
| 426 | G | 30.6 | Very low | 49.1 | Very low | 66 Ų | 66 | 113 Ų | 113 | 68% | 0.68 | 66% | 0.656 | S | S | * | * | trans | -66.2 | 163.9 | -169.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | N428 | G426-N428 PolarHBondContact O-N 3.12Š| ||
| 427 | P | 40.2 | Very low | 46.3 | Very low | 132 Ų | 132 | 122.5 Ų | 122.5 | 86% | 0.857 | 70% | 0.701 | S | S | * | * | trans | -68.8 | 111.9 | 174.3 | 29.6 | -32.6 | 0 | 0 | 0 | 109.5 | ||||
| 428 | N | 33 | Very low | 43.5 | Very low | 163 Ų | 163 | 127.9 Ų | 127.9 | 87% | 0.872 | 72% | 0.72 | S | S | * | * | trans | -90.3 | 123.8 | 166.3 | -154.3 | 30.2 | 0 | 0 | 0 | 108.2 | G426 Q430 | G426-N428 PolarHBondContact O-N 3.12Å; N428-Q430 PolarHBondContact O-N 2.76Å | ||
| 429 | E | 35 | Very low | 40.7 | Very low | 157 Ų | 157 | 126.9 Ų | 126.9 | 73% | 0.734 | 73% | 0.726 | S | S | * | * | trans | -76.4 | 113.9 | -162.4 | -64 | 168.3 | 114.6 | 0 | 0 | 112.3 | Q431 | E429-Q431 HydrophobicContact CB-CB 4.4Å; E429-Q431 PolarHBondContact O-N 2.81Å | ||
| 430 | Q | 37.2 | Very low | 38.5 | Very low | 199 Ų | 199 | 131.9 Ų | 131.9 | 93% | 0.93 | 75% | 0.746 | S | S | * | * | trans | -87.4 | 64.2 | 153.7 | -76.5 | -169.8 | -27.6 | 0 | 0 | 109.3 | N428 I432 | N428-Q430 PolarHBondContact O-N 2.76Å; Q430-I432 PolarHBondContact O-N 3.05Å | ||
| 431 | Q | 37.2 | Very low | 36.7 | Very low | 147 Ų | 147 | 137.8 Ų | 137.8 | 69% | 0.687 | 77% | 0.772 | S | S | * | * | trans | -70.5 | 121.5 | 172.8 | -166.6 | 175.9 | 35.9 | 0 | 0 | 109.2 | E429 N433 | E429-Q431 HydrophobicContact CB-CB 4.4Å; E429-Q431 PolarHBondContact O-N 2.81Å; Q431-N433 PolarHBondContact O-N 3.35Å | ||
| 432 | I | 38.6 | Very low | 35.3 | Very low | 160 Ų | 160 | 145.6 Ų | 145.6 | 82% | 0.821 | 79% | 0.79 | S | S | * | * | trans | -64.1 | 103.8 | 173.1 | -60.6 | 166.3 | 0 | 0 | 0 | 107.5 | Q430 | Q430-I432 PolarHBondContact O-N 3.05Š| ||
| 433 | N | 30 | Very low | 34.3 | Very low | 153 Ų | 153 | 152.5 Ų | 152.5 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -105.1 | 102 | -179.8 | -157.3 | 3.9 | 0 | 0 | 0 | 110.5 | Q431 | Q431-N433 PolarHBondContact O-N 3.35Š| ||
| 434 | S | 29.9 | Very low | 33.3 | Very low | 90 Ų | 90 | 151.3 Ų | 151.3 | 63% | 0.629 | 81% | 0.81 | S | S | * | * | trans | -98.9 | 135.4 | -177.4 | 58.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 435 | S | 30.4 | Very low | 32.8 | Very low | 107 Ų | 107 | 148.9 Ų | 148.9 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | 95.2 | 147.6 | 161.9 | 87.5 | 0 | 0 | 0 | 0 | 119 | ||||
| 436 | S | 31.7 | Very low | 32.4 | Very low | 108 Ų | 108 | 153 Ų | 153 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | trans | 83.4 | 56.8 | 145.5 | -49.1 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 437 | E | 30.8 | Very low | 32.4 | Very low | 205 Ų | 205 | 155.9 Ų | 155.9 | 96% | 0.958 | 82% | 0.822 | S | S | * | * | trans | -124 | 162.3 | 134.3 | -82.2 | -135.5 | 101.4 | 0 | 0 | 110.9 | ||||
| 438 | K | 32 | Very low | 31.9 | Very low | 190 Ų | 190 | 158.9 Ų | 158.9 | 83% | 0.826 | 82% | 0.824 | S | S | * | * | trans | -137 | 150.1 | -147.3 | -167.8 | -172 | 178.3 | -179.4 | 0 | 112 | ||||
| 439 | T | 28.2 | Very low | 31.9 | Very low | 114 Ų | 114 | 158.6 Ų | 158.6 | 70% | 0.699 | 82% | 0.823 | S | S | * | * | trans | 80.6 | 93.8 | 164.9 | -31.4 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 440 | Q | 31.8 | Very low | 31.9 | Very low | 186 Ų | 186 | 158.7 Ų | 158.7 | 87% | 0.869 | 82% | 0.821 | S | S | * | * | -175.3 | 108.6 | 116.4 | -102.9 | 177.9 | 87.4 | 0 | 0 | 111.7 | |||||
| 441 | L | 30.6 | Very low | 31.9 | Very low | 182 Ų | 182 | 155.5 Ų | 155.5 | 95% | 0.953 | 81% | 0.81 | S | S | * | * | trans | -161.6 | 121.2 | 151.2 | -113.4 | 162.5 | 0 | 0 | 0 | 109.1 | ||||
| 442 | R | 30.5 | Very low | 31.8 | Very low | 243 Ų | 243 | 152.1 Ų | 152.1 | 92% | 0.917 | 81% | 0.814 | S | S | * | * | trans | -94 | 116 | -168.1 | -178.1 | 179.2 | -179.5 | 175.7 | -0.1 | 109.9 | ||||
| 443 | K | 32.7 | Very low | 31.7 | Very low | 201 Ų | 201 | 153.8 Ų | 153.8 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | trans | -106.1 | 103.1 | -179.8 | -175.2 | -168.4 | 178.3 | -174.6 | 0 | 112 | ||||
| 444 | T | 29.8 | Very low | 32.1 | Very low | 134 Ų | 134 | 151.5 Ų | 151.5 | 82% | 0.822 | 81% | 0.812 | S | S | * | * | trans | -157.5 | 127.6 | 144.5 | 8.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 445 | A | 29.8 | Very low | 32.7 | Very low | 87 Ų | 87 | 156.5 Ų | 156.5 | 72% | 0.719 | 83% | 0.825 | S | S | * | * | trans | -105.7 | -175.6 | 156.8 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 446 | E | 30.5 | Very low | 33.4 | Very low | 190 Ų | 190 | 160.3 Ų | 160.3 | 89% | 0.888 | 83% | 0.828 | S | S | * | * | trans | 67.3 | 103.3 | 172.4 | -55 | -171.7 | 123.3 | 0 | 0 | 116.8 | ||||
| 447 | S | 30.7 | Very low | 33.9 | Very low | 126 Ų | 126 | 161.5 Ų | 161.5 | 88% | 0.881 | 83% | 0.831 | S | S | * | * | -168.3 | 102.1 | 122.1 | -81.2 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 448 | Q | 30.5 | Very low | 34.5 | Very low | 194 Ų | 194 | 164 Ų | 164 | 91% | 0.907 | 84% | 0.843 | S | S | * | * | trans | -110.7 | 112.1 | 157.6 | -87.7 | -168.4 | -22 | 0 | 0 | 108.3 | ||||
| 449 | N | 31.6 | Very low | 34.6 | Very low | 157 Ų | 157 | 162.7 Ų | 162.7 | 84% | 0.84 | 84% | 0.844 | S | S | * | * | -167.2 | 161.7 | 128.7 | -130.4 | -47.3 | 0 | 0 | 0 | 114.4 | |||||
| 450 | K | 35.6 | Very low | 35 | Very low | 159 Ų | 159 | 165.3 Ų | 165.3 | 69% | 0.691 | 85% | 0.851 | S | S | * | * | trans | 74 | 115.8 | 158.1 | -71.7 | -172.5 | 154 | -86 | 0 | 121.3 | ||||
| 451 | D | 36.9 | Very low | 35.2 | Very low | 133 Ų | 133 | 164.1 Ų | 164.1 | 71% | 0.711 | 85% | 0.85 | S | S | * | * | 60.1 | 126.4 | 121.1 | -49.9 | -26.3 | 0 | 0 | 0 | 119.1 | |||||
| 452 | G | 34.3 | Very low | 35.4 | Very low | 75 Ų | 75 | 163.1 Ų | 163.1 | 77% | 0.773 | 84% | 0.844 | S | S | * | * | trans | 177.6 | 5.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 124.9 | ||||
| 453 | K | 38 | Very low | 35.7 | Very low | 195 Ų | 195 | 158.1 Ų | 158.1 | 85% | 0.848 | 84% | 0.84 | S | S | * | * | trans | 37.1 | 96.4 | 154.9 | -170.4 | -177.9 | 177.7 | -175.2 | 0 | 119.3 | ||||
| 454 | S | 38.1 | Very low | 35.9 | Very low | 105 Ų | 105 | 155.2 Ų | 155.2 | 73% | 0.734 | 84% | 0.837 | S | S | * | * | trans | 26.9 | 132.9 | 137.8 | 65.7 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 455 | E | 41.7 | Very low | 36.4 | Very low | 195 Ų | 195 | 156.7 Ų | 156.7 | 91% | 0.911 | 84% | 0.838 | S | S | * | * | trans | -143.6 | 162.5 | 138.5 | -153.3 | 161.4 | 175.3 | 0 | 0 | 111.6 | ||||
| 456 | K | 45.2 | Very low | 36.9 | Very low | 187 Ų | 187 | 162.1 Ų | 162.1 | 81% | 0.813 | 85% | 0.848 | S | S | * | * | trans | -81 | 171.4 | 166.4 | -65.6 | 178.9 | 176.5 | -179 | 0 | 108.1 | ||||
| 457 | T | 42.2 | Very low | 37.4 | Very low | 133 Ų | 133 | 159.8 Ų | 159.8 | 82% | 0.816 | 84% | 0.844 | S | S | * | * | cis | -161.2 | 159.5 | 39.5 | -38.5 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 458 | E | 44.2 | Very low | 38 | Very low | 258 Ų | 258 | 162.8 Ų | 162.8 | 100% | 1.206 | 84% | 0.841 | S | S | * | * | cis | -153.5 | 0 | 43.8 | -176.4 | 173.8 | -176.1 | 0 | 0 | 111.1 |
Retrieved 458 of 458 residues in 392 ms
(Link to these results)