| 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 | V | 34.4 | Very low | 33.2 | Very low | 189 Ų | 189 | 144.1 Ų | 144.1 | 100% | 1.145 | 83% | 0.83 | S | S | * | * | 0 | 128.4 | 0 | -168.5 | 0 | 0 | 0 | 0 | 105.7 | |||||
| 2 | E | 33.9 | Very low | 32.8 | Very low | 170 Ų | 170 | 137.9 Ų | 137.9 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -64.3 | 146.3 | -159.9 | -63.3 | 91.2 | 122.8 | 0 | 0 | 112.3 | ||||
| 3 | D | 34.9 | Very low | 32.6 | Very low | 148 Ų | 148 | 137.3 Ų | 137.3 | 79% | 0.791 | 81% | 0.809 | S | S | * | * | cis | 76.3 | 154 | 42.4 | -138.2 | 41.6 | 0 | 0 | 0 | 112.3 | ||||
| 4 | P | 57.2 | Low | 32.3 | Very low | 108 Ų | 108 | 144.1 Ų | 144.1 | 70% | 0.701 | 81% | 0.814 | S | S | * | * | -135.5 | 174.7 | -83.5 | 41.4 | -26.6 | 0 | 0 | 0 | 115.8 | |||||
| 5 | G | 30 | Very low | 32.2 | Very low | 83 Ų | 83 | 145.9 Ų | 145.9 | 86% | 0.856 | 81% | 0.812 | S | S | * | * | trans | 80.6 | 173.4 | 161.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 6 | G | 28.6 | Very low | 32.3 | Very low | 80 Ų | 80 | 148.9 Ų | 148.9 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | cis | -165.3 | 175.8 | 0.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 7 | L | 31.4 | Very low | 32.3 | Very low | 172 Ų | 172 | 148.4 Ų | 148.4 | 90% | 0.901 | 81% | 0.813 | S | S | * | * | trans | -94.9 | 161.9 | -171.2 | -144.4 | 76.3 | 0 | 0 | 0 | 113.3 | ||||
| 8 | S | 30.8 | Very low | 32.2 | Very low | 108 Ų | 108 | 151 Ų | 151 | 76% | 0.755 | 82% | 0.815 | S | S | * | * | trans | 106.3 | 137.2 | 138.7 | 81.9 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 9 | H | 29.3 | Very low | 32.1 | Very low | 169 Ų | 169 | 155.5 Ų | 155.5 | 78% | 0.782 | 82% | 0.819 | S | S | * | * | trans | 80.2 | 155.7 | 140.1 | -124.6 | -92.3 | 0 | 0 | 0 | 124.3 | ||||
| 10 | W | 28.6 | Very low | 32 | Very low | 212 Ų | 212 | 154.7 Ų | 154.7 | 80% | 0.803 | 81% | 0.814 | S | S | * | * | trans | -71 | 166.7 | 176.3 | -60.1 | 36.3 | 0 | 0 | 0 | 110.4 | ||||
| 11 | D | 26.5 | Very low | 31.8 | Very low | 146 Ų | 146 | 157.4 Ų | 157.4 | 78% | 0.781 | 82% | 0.819 | S | S | * | * | cis | -175.8 | -175.1 | 48.7 | -157.4 | -8.2 | 0 | 0 | 0 | 112.8 | ||||
| 12 | A | 27.7 | Very low | 31.8 | Very low | 70 Ų | 70 | 154.9 Ų | 154.9 | 58% | 0.579 | 80% | 0.799 | S | S | * | * | trans | 77.3 | 99.5 | 148.8 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 13 | T | 30 | Very low | 31.6 | Very low | 130 Ų | 130 | 154.5 Ų | 154.5 | 80% | 0.798 | 80% | 0.802 | S | S | * | * | trans | 43.4 | 121.8 | 130.6 | 54.6 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 14 | R | 28.6 | Very low | 31.2 | Very low | 233 Ų | 233 | 150.8 Ų | 150.8 | 88% | 0.879 | 80% | 0.798 | S | S | * | * | trans | -163.8 | 117.7 | 136.1 | -119.7 | 162.9 | -76.1 | -166.1 | -1.7 | 110.4 | ||||
| 15 | H | 30.7 | Very low | 29.9 | Very low | 171 Ų | 171 | 150.9 Ų | 150.9 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | 51.4 | 116.7 | 79.8 | -100.8 | -62.9 | 0 | 0 | 0 | 116.1 | |||||
| 16 | H | 34.4 | Very low | 29.8 | Very low | 194 Ų | 194 | 150.8 Ų | 150.8 | 90% | 0.898 | 81% | 0.807 | S | S | * | * | trans | -146.8 | 160.8 | 147.2 | -122.6 | -83.7 | 0 | 0 | 0 | 112.1 | ||||
| 17 | N | 31.7 | Very low | 30 | Very low | 139 Ų | 139 | 153.4 Ų | 153.4 | 74% | 0.743 | 81% | 0.808 | S | S | * | * | trans | -135 | 144.9 | -150.8 | -159.3 | -7.7 | 0 | 0 | 0 | 113.4 | ||||
| 18 | K | 31.1 | Very low | 30.5 | Very low | 196 Ų | 196 | 150.8 Ų | 150.8 | 85% | 0.852 | 80% | 0.801 | S | S | * | * | trans | 174.8 | 141.4 | 162.6 | -101.5 | 160.5 | -176.3 | 178.5 | 0 | 110.2 | ||||
| 19 | R | 29.2 | Very low | 30.5 | Very low | 236 Ų | 236 | 150.6 Ų | 150.6 | 89% | 0.891 | 81% | 0.806 | S | S | * | * | cis | -160 | 147.4 | -23.5 | -179 | 179.7 | -107.5 | -166.8 | -4.1 | 108.1 | ||||
| 20 | I | 31.6 | Very low | 30.3 | Very low | 139 Ų | 139 | 146.3 Ų | 146.3 | 71% | 0.713 | 81% | 0.807 | S | S | * | * | trans | -75.2 | 150.1 | -176.1 | -61.8 | 161.5 | 0 | 0 | 0 | 113.4 | L22 | I20-L22 HydrophobicContact CG2-CD1 3.58Å; I20-L22 HydrophobicContact CG2-CG 3.96Å | ||
| 21 | K | 27.4 | Very low | 30.2 | Very low | 213 Ų | 213 | 139.9 Ų | 139.9 | 93% | 0.926 | 81% | 0.807 | S | S | * | * | trans | -142.2 | 143.6 | 143.5 | -125.7 | -177.7 | -179.2 | -173.9 | 0 | 109.7 | ||||
| 22 | L | 33.1 | Very low | 30.3 | Very low | 136 Ų | 136 | 140.8 Ų | 140.8 | 71% | 0.712 | 81% | 0.807 | S | S | * | * | trans | -114.9 | 153.6 | -174.5 | -53 | 90.7 | 0 | 0 | 0 | 112.6 | I20 | I20-L22 HydrophobicContact CG2-CD1 3.58Å; I20-L22 HydrophobicContact CG2-CG 3.96Å | ||
| 23 | N | 30.4 | Very low | 30.4 | Very low | 161 Ų | 161 | 147.2 Ų | 147.2 | 86% | 0.861 | 82% | 0.817 | S | S | * | * | 152 | 155.9 | 114.7 | -88.7 | -16.6 | 0 | 0 | 0 | 114.2 | |||||
| 24 | G | 27.4 | Very low | 30.4 | Very low | 70 Ų | 70 | 147.7 Ų | 147.7 | 72% | 0.722 | 82% | 0.815 | S | S | * | * | trans | 93.3 | 84.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 25 | A | 29.5 | Very low | 30.4 | Very low | 110 Ų | 110 | 141.4 Ų | 141.4 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | 69.6 | 109.3 | 54.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 26 | G | 28.2 | Very low | 30.3 | Very low | 81 Ų | 81 | 138.4 Ų | 138.4 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | 170.5 | 53 | -174.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 27 | T | 32.1 | Very low | 29.9 | Very low | 135 Ų | 135 | 138.3 Ų | 138.3 | 83% | 0.828 | 81% | 0.814 | S | S | * | * | trans | -130.7 | 150.2 | 167.5 | -6.7 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 28 | P | 42.4 | Very low | 29.7 | Very low | 117 Ų | 117 | 139.9 Ų | 139.9 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | -151.1 | 165.1 | 80.2 | 40.5 | -22.9 | 0 | 0 | 0 | 117.1 | |||||
| 29 | A | 29.6 | Very low | 29.5 | Very low | 104 Ų | 104 | 135.6 Ų | 135.6 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | trans | 54.6 | 148.7 | 149.2 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 30 | G | 26.7 | Very low | 29.3 | Very low | 79 Ų | 79 | 129.6 Ų | 129.6 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | cis | 157.8 | 170.1 | -4.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 31 | G | 26.7 | Very low | 29.1 | Very low | 78 Ų | 78 | 131.7 Ų | 131.7 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | trans | 125.9 | 121.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 32 | H | 28.8 | Very low | 29.1 | Very low | 165 Ų | 165 | 125.6 Ų | 125.6 | 76% | 0.764 | 81% | 0.809 | S | S | * | * | trans | -94.6 | 159.4 | 163.2 | -81.9 | -126.8 | 0 | 0 | 0 | 110 | ||||
| 33 | Y | 29.7 | Very low | 28.8 | Very low | 205 Ų | 205 | 128.5 Ų | 128.5 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | 157.3 | 126.7 | 113.4 | -78.7 | -59.9 | 0 | 0 | 0 | 114.6 | |||||
| 34 | N | 29.4 | Very low | 28.6 | Very low | 140 Ų | 140 | 127.2 Ų | 127.2 | 75% | 0.749 | 80% | 0.799 | S | S | * | * | trans | 54.2 | 106.2 | 137.8 | -55.9 | -9.1 | 0 | 0 | 0 | 123.6 | ||||
| 35 | A | 28.8 | Very low | 28.6 | Very low | 100 Ų | 100 | 131.4 Ų | 131.4 | 83% | 0.826 | 81% | 0.805 | S | S | * | * | 76.7 | 166.1 | 114.1 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 36 | A | 28.3 | Very low | 28.4 | Very low | 108 Ų | 108 | 129.1 Ų | 129.1 | 89% | 0.893 | 79% | 0.792 | S | S | * | * | trans | 87.3 | 168.1 | 164.9 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 37 | K | 26.6 | Very low | 28.2 | Very low | 193 Ų | 193 | 129.5 Ų | 129.5 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | trans | -162.7 | 122.7 | -154.7 | 163.7 | -160.1 | 174.9 | -175.2 | 0 | 111.3 | ||||
| 38 | L | 26.4 | Very low | 27.9 | Very low | 171 Ų | 171 | 126.6 Ų | 126.6 | 90% | 0.895 | 79% | 0.793 | S | S | * | * | trans | -169.1 | 167.1 | 149.7 | -134.1 | 70.4 | 0 | 0 | 0 | 115.8 | ||||
| 39 | S | 26.6 | Very low | 27.2 | Very low | 107 Ų | 107 | 127.3 Ų | 127.3 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | -92.1 | 161 | -167.5 | 64.1 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 40 | S | 25.6 | Very low | 27.1 | Very low | 109 Ų | 109 | 126.8 Ų | 126.8 | 76% | 0.762 | 79% | 0.785 | S | S | * | * | trans | -157.3 | 148.6 | 132.8 | 53.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 41 | M | 27.4 | Very low | 27.4 | Very low | 183 Ų | 183 | 131.1 Ų | 131.1 | 90% | 0.901 | 78% | 0.784 | S | S | * | * | 62.8 | 135.5 | 54 | -96.4 | -177.2 | 169 | 0 | 0 | 113.4 | |||||
| 42 | A | 26.9 | Very low | 27.5 | Very low | 85 Ų | 85 | 135.7 Ų | 135.7 | 70% | 0.702 | 79% | 0.785 | S | S | * | * | cis | -156.1 | -171 | 3 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 43 | R | 27.4 | Very low | 27.5 | Very low | 197 Ų | 197 | 130.8 Ų | 130.8 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | cis | 177.4 | 153.1 | 0.1 | -124.3 | 165.2 | 106.4 | 132.7 | 16.6 | 106.5 | ||||
| 44 | E | 27.3 | Very low | 27.6 | Very low | 134 Ų | 134 | 126.4 Ų | 126.4 | 63% | 0.626 | 77% | 0.77 | S | S | * | * | trans | 54.8 | 165.5 | 143.6 | -70.7 | 161 | 172.8 | 0 | 0 | 122.5 | ||||
| 45 | D | 26.2 | Very low | 27.7 | Very low | 158 Ų | 158 | 127 Ų | 127 | 85% | 0.845 | 77% | 0.766 | S | S | * | * | cis | -175.1 | 176.9 | -45.7 | -114.2 | -76.4 | 0 | 0 | 0 | 107.2 | ||||
| 46 | G | 24.8 | Very low | 27.8 | Very low | 62 Ų | 62 | 128.4 Ų | 128.4 | 64% | 0.639 | 76% | 0.755 | S | S | * | * | cis | 169.9 | 138.9 | -1.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 47 | G | 24.1 | Very low | 28.1 | Very low | 90 Ų | 90 | 128.8 Ų | 128.8 | 93% | 0.928 | 74% | 0.738 | S | S | * | * | trans | 84.6 | 150.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 48 | G | 26.2 | Very low | 28.3 | Very low | 73 Ų | 73 | 130.3 Ų | 130.3 | 75% | 0.753 | 74% | 0.739 | S | S | * | * | cis | -167.7 | -148.6 | -2.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 49 | V | 28.1 | Very low | 28.3 | Very low | 132 Ų | 132 | 125.5 Ų | 125.5 | 80% | 0.8 | 73% | 0.73 | S | S | * | * | cis | -159.4 | 155.7 | -6.2 | -164.1 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 50 | S | 27.2 | Very low | 28.2 | Very low | 94 Ų | 94 | 125.9 Ų | 125.9 | 66% | 0.657 | 73% | 0.733 | S | S | * | * | trans | 64.7 | 149.6 | 164.7 | -63.5 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 51 | E | 32.5 | Very low | 28.4 | Very low | 169 Ų | 169 | 130.1 Ų | 130.1 | 79% | 0.79 | 74% | 0.738 | S | S | * | * | cis | 177.4 | 170.8 | -31.7 | -115.6 | 125.8 | -158.6 | 0 | 0 | 106.9 | ||||
| 52 | E | 30.1 | Very low | 28.4 | Very low | 174 Ų | 174 | 125.9 Ų | 125.9 | 81% | 0.813 | 73% | 0.731 | S | S | * | * | cis | -152.1 | 158.5 | -1.6 | 178.2 | 174.1 | -141.2 | 0 | 0 | 105.7 | ||||
| 53 | G | 27.6 | Very low | 28.4 | Very low | 63 Ų | 63 | 128.3 Ų | 128.3 | 65% | 0.649 | 74% | 0.737 | S | S | * | * | cis | 162.8 | -155.6 | -1.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 54 | D | 32.3 | Very low | 28.3 | Very low | 113 Ų | 113 | 129 Ų | 129 | 60% | 0.604 | 75% | 0.746 | S | S | * | * | trans | 61.1 | 149.1 | 167.7 | -78.5 | -8.4 | 0 | 0 | 0 | 120.6 | ||||
| 55 | K | 32.3 | Very low | 28.2 | Very low | 153 Ų | 153 | 133.6 Ų | 133.6 | 67% | 0.665 | 76% | 0.757 | S | S | * | * | cis | -165.8 | 154.9 | -11.6 | -114.9 | 166.9 | -179 | 79.2 | 0 | 106.1 | ||||
| 56 | H | 30.7 | Very low | 28.1 | Very low | 128 Ų | 128 | 138.3 Ų | 138.3 | 59% | 0.593 | 76% | 0.763 | S | S | * | * | cis | -161.9 | 152.5 | -11 | -130.3 | 40.4 | 0 | 0 | 0 | 108.4 | ||||
| 57 | Q | 33.3 | Very low | 28.1 | Very low | 117 Ų | 117 | 145.4 Ų | 145.4 | 55% | 0.547 | 77% | 0.771 | S | S | . | * | 51.3 | 145.5 | 110.9 | -64.2 | -166.9 | 18.2 | 0 | 0 | 119.1 | |||||
| 58 | R | 30.3 | Very low | 28.2 | Very low | 225 Ų | 225 | 147.7 Ų | 147.7 | 85% | 0.849 | 76% | 0.762 | S | S | * | * | cis | -159 | 175.6 | 3.3 | -116.9 | 170.1 | -168.6 | 176.5 | 11.7 | 107.8 | ||||
| 59 | G | 27 | Very low | 28.2 | Very low | 70 Ų | 70 | 154.5 Ų | 154.5 | 72% | 0.722 | 77% | 0.771 | S | S | * | * | cis | -176.9 | 177.8 | 5.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 60 | S | 25.6 | Very low | 28.1 | Very low | 115 Ų | 115 | 156 Ų | 156 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -159.8 | 168.2 | -165.7 | -171.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 61 | K | 29.1 | Very low | 27.9 | Very low | 198 Ų | 198 | 157.7 Ų | 157.7 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | trans | 114.2 | 131.1 | 148.7 | -64.7 | 179.1 | 178 | 176.9 | 0 | 122 | ||||
| 62 | A | 26.4 | Very low | 27.6 | Very low | 93 Ų | 93 | 160.2 Ų | 160.2 | 77% | 0.769 | 77% | 0.773 | S | S | * | * | 81.6 | 99.2 | 128.2 | 0 | 0 | 0 | 0 | 0 | 124.8 | |||||
| 63 | V | 27.8 | Very low | 27.4 | Very low | 136 Ų | 136 | 156.7 Ų | 156.7 | 82% | 0.824 | 77% | 0.768 | S | S | * | * | 20.2 | 124.6 | 122 | -176.7 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 64 | K | 26.2 | Very low | 27.2 | Very low | 212 Ų | 212 | 158.2 Ų | 158.2 | 92% | 0.922 | 77% | 0.774 | S | S | * | * | trans | -160.8 | 147.5 | 132.2 | -113.6 | 166.7 | -173.6 | 175.5 | 0 | 115.7 | ||||
| 65 | R | 24.3 | Very low | 26.8 | Very low | 230 Ų | 230 | 158.7 Ų | 158.7 | 87% | 0.868 | 78% | 0.78 | S | S | * | * | trans | -85.7 | 143.2 | -171.7 | 166.3 | -158.1 | -160.4 | 178.2 | 8.1 | 113.9 | ||||
| 66 | W | 24.1 | Very low | 26.4 | Very low | 257 Ų | 257 | 157.7 Ų | 157.7 | 97% | 0.973 | 79% | 0.787 | S | S | * | * | trans | -157.7 | 176.6 | 151.1 | -101.9 | 97.7 | 0 | 0 | 0 | 111.8 | ||||
| 67 | R | 25.8 | Very low | 26.1 | Very low | 212 Ų | 212 | 159.9 Ų | 159.9 | 80% | 0.8 | 80% | 0.8 | S | S | * | * | trans | -144.3 | 143.5 | -155.8 | -165.9 | -169 | -168.1 | -163.1 | 6.8 | 115.3 | ||||
| 68 | N | 26.2 | Very low | 26.1 | Very low | 137 Ų | 137 | 159.6 Ų | 159.6 | 73% | 0.733 | 81% | 0.808 | S | S | * | * | trans | 48.8 | 130.9 | 158.7 | -79.4 | 23.5 | 0 | 0 | 0 | 122.7 | ||||
| 69 | K | 24.9 | Very low | 26.1 | Very low | 217 Ų | 217 | 153.7 Ų | 153.7 | 94% | 0.943 | 80% | 0.799 | S | S | * | * | -153.1 | 179.5 | 121.8 | -136.6 | 172.6 | -179.2 | 178.4 | 0 | 111.5 | |||||
| 70 | Q | 25.7 | Very low | 26 | Very low | 162 Ų | 162 | 160.8 Ų | 160.8 | 76% | 0.757 | 80% | 0.804 | S | S | * | * | trans | -147.2 | 167.8 | -148.6 | -156 | 179.6 | 5.9 | 0 | 0 | 113.8 | ||||
| 71 | N | 24.6 | Very low | 25.9 | Very low | 131 Ų | 131 | 163.4 Ų | 163.4 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | trans | 73.8 | 153.9 | 167.4 | -66.2 | -17.7 | 0 | 0 | 0 | 118.5 | ||||
| 72 | R | 25.9 | Very low | 26 | Very low | 222 Ų | 222 | 159.6 Ų | 159.6 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | cis | -179.9 | 174.6 | -17.4 | -99.8 | -164 | 171.4 | -171.8 | -5.7 | 106.1 | ||||
| 73 | S | 24.6 | Very low | 26.1 | Very low | 100 Ų | 100 | 162.1 Ų | 162.1 | 70% | 0.699 | 80% | 0.804 | S | S | * | * | cis | -178.5 | 162.4 | -22.2 | -86.7 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 74 | A | 24.1 | Very low | 26.4 | Very low | 94 Ų | 94 | 161 Ų | 161 | 78% | 0.777 | 80% | 0.8 | S | S | * | * | cis | -128.2 | -98.6 | -5.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 75 | V | 23.5 | Very low | 26.3 | Very low | 123 Ų | 123 | 160.3 Ų | 160.3 | 75% | 0.745 | 80% | 0.797 | S | S | * | * | cis | -149.4 | 145.9 | -1.6 | 161.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 76 | V | 24.7 | Very low | 27.3 | Very low | 132 Ų | 132 | 155.2 Ų | 155.2 | 80% | 0.8 | 79% | 0.794 | S | S | * | * | trans | 72.1 | 135.9 | 166.4 | 161.2 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 77 | M | 24.3 | Very low | 27.5 | Very low | 175 Ų | 175 | 149.7 Ų | 149.7 | 86% | 0.862 | 79% | 0.788 | S | S | * | * | trans | -131.5 | 160.3 | 155.6 | -60.2 | -164.3 | 77.6 | 0 | 0 | 107.9 | ||||
| 78 | P | 32.8 | Very low | 27.7 | Very low | 111 Ų | 111 | 143.5 Ų | 143.5 | 72% | 0.721 | 78% | 0.782 | S | S | * | * | -155.5 | -161.8 | 89.5 | 43.1 | -23.7 | 0 | 0 | 0 | 113.1 | |||||
| 79 | P | 31.3 | Very low | 27.8 | Very low | 101 Ų | 101 | 144.3 Ų | 144.3 | 66% | 0.656 | 79% | 0.786 | S | S | * | * | cis | -124.6 | 178.1 | -32.5 | 18.6 | 4.9 | 0 | 0 | 0 | 113.3 | ||||
| 80 | W | 23.6 | Very low | 27.8 | Very low | 219 Ų | 219 | 139.2 Ų | 139.2 | 83% | 0.83 | 77% | 0.773 | S | S | * | * | trans | 44.7 | 140 | 148.2 | 91.7 | -63.4 | 0 | 0 | 0 | 121.6 | ||||
| 81 | E | 24.2 | Very low | 27.9 | Very low | 169 Ų | 169 | 136.2 Ų | 136.2 | 79% | 0.79 | 77% | 0.77 | S | S | * | * | cis | -160.4 | 138.9 | -10.3 | -144.1 | 171.8 | -135.7 | 0 | 0 | 109.5 | ||||
| 82 | P | 30.2 | Very low | 28.3 | Very low | 118 Ų | 118 | 135.8 Ų | 135.8 | 77% | 0.766 | 77% | 0.772 | S | S | * | * | trans | -119 | 136.8 | 176.4 | 37.1 | -26.3 | 0 | 0 | 0 | 114.5 | P84 | P82-P84 WeakPolarHBondContact O-CD 3.48Š| ||
| 83 | V | 30.4 | Very low | 28.3 | Very low | 146 Ų | 146 | 131.9 Ų | 131.9 | 89% | 0.885 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 117.9 | 166.7 | 179.4 | 0 | 0 | 0 | 0 | 110 | ||
| 84 | P | 32.2 | Very low | 28.4 | Very low | 114 Ų | 114 | 134.9 Ų | 134.9 | 74% | 0.74 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 151.1 | 176.8 | 33.9 | -33.6 | 0 | 0 | 0 | 113.2 | P82 | P82-P84 WeakPolarHBondContact O-CD 3.48Š|
| 85 | K | 25.3 | Very low | 28.8 | Very low | 197 Ų | 197 | 135.7 Ų | 135.7 | 86% | 0.857 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 162 | 165.2 | -95.2 | -177.4 | 177.4 | 179.6 | 0 | 111.1 | ||
| 86 | P | 45.2 | Very low | 29.2 | Very low | 123 Ų | 123 | 139.2 Ų | 139.2 | 80% | 0.799 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 150.3 | -171 | 32 | -37.2 | 0 | 0 | 0 | 113.6 | ||
| 87 | V | 28 | Very low | 29.5 | Very low | 141 Ų | 141 | 140.2 Ų | 140.2 | 86% | 0.855 | 78% | 0.779 | S | S | * | * | trans | -143.2 | 141 | 161.8 | -164.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 88 | A | 30.5 | Very low | 29.7 | Very low | 82 Ų | 82 | 139.6 Ų | 139.6 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | trans | -86.4 | 159.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 89 | L | 27.9 | Very low | 29.6 | Very low | 154 Ų | 154 | 144.6 Ų | 144.6 | 81% | 0.806 | 79% | 0.789 | S | S | * | * | 178.4 | 137.5 | 128.6 | -96.8 | 166.4 | 0 | 0 | 0 | 113.5 | |||||
| 90 | T | 24.5 | Very low | 29.8 | Very low | 110 Ų | 110 | 146 Ų | 146 | 68% | 0.675 | 80% | 0.796 | S | S | * | * | trans | 21.4 | 120.8 | 148.4 | 55.1 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 91 | S | 29 | Very low | 29.8 | Very low | 99 Ų | 99 | 145.2 Ų | 145.2 | 69% | 0.692 | 80% | 0.799 | S | S | * | * | 69.3 | 148.2 | 127.8 | 66.6 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 92 | T | 32.3 | Very low | 30.3 | Very low | 121 Ų | 121 | 146.9 Ų | 146.9 | 74% | 0.742 | 80% | 0.798 | S | S | * | * | trans | 58.1 | 106 | 164.5 | 43.8 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 93 | D | 25.8 | Very low | 30.4 | Very low | 141 Ų | 141 | 146 Ų | 146 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | -163.3 | 175.2 | 59.9 | -83.7 | -34 | 0 | 0 | 0 | 113.8 | |||||
| 94 | L | 27 | Very low | 30.5 | Very low | 162 Ų | 162 | 144.9 Ų | 144.9 | 85% | 0.848 | 78% | 0.777 | S | S | * | * | trans | 68 | 155.2 | 172.6 | -84.8 | 70.3 | 0 | 0 | 0 | 117 | ||||
| 95 | P | 31.6 | Very low | 30.2 | Very low | 112 Ų | 112 | 148.2 Ų | 148.2 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | cis | -131.8 | 178.5 | -46.3 | 36.8 | -20.4 | 0 | 0 | 0 | 112.4 | ||||
| 96 | F | 32.3 | Very low | 30.4 | Very low | 197 Ų | 197 | 148 Ų | 148 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | trans | -66.6 | 168.4 | 158.3 | -92.7 | -116 | 0 | 0 | 0 | 110.8 | ||||
| 97 | D | 31.1 | Very low | 29.4 | Very low | 152 Ų | 152 | 148.2 Ų | 148.2 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | trans | 84.3 | 74.8 | 174.9 | -57.2 | -21.6 | 0 | 0 | 0 | 118.3 | ||||
| 98 | L | 29.4 | Very low | 29.4 | Very low | 163 Ų | 163 | 151.4 Ų | 151.4 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | trans | -154.2 | 27.6 | 154.2 | -119.2 | 162.9 | 0 | 0 | 0 | 115.9 | ||||
| 99 | F | 29.3 | Very low | 29.2 | Very low | 215 Ų | 215 | 158.3 Ų | 158.3 | 94% | 0.943 | 79% | 0.79 | S | S | * | * | trans | -100.9 | 41.1 | 178.5 | -102.4 | -77.5 | 0 | 0 | 0 | 114 | ||||
| 100 | T | 35.3 | Very low | 29.3 | Very low | 132 Ų | 132 | 159 Ų | 159 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | -135.7 | 47 | -175.5 | 46.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 101 | K | 25.5 | Very low | 29.6 | Very low | 201 Ų | 201 | 162.3 Ų | 162.3 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -157.6 | 111.1 | 158.4 | -118.9 | 163.3 | -172.6 | 175.8 | 0 | 114.7 | ||||
| 102 | R | 33.6 | Very low | 29.7 | Very low | 205 Ų | 205 | 164.4 Ų | 164.4 | 77% | 0.774 | 80% | 0.801 | S | S | * | * | trans | -75.5 | 138.8 | 152.8 | -169.8 | -166.6 | -68.2 | -172 | -5.6 | 108 | E104 | R102-E104 WeakPolarHBondContact CD-OE1 3.38Å; R102-E104 HydrophobicContact CG-CG 4.48Å; R102-E104 IonicContact CZ-OE1 3.57Å; R102-E104 IonicContact NE-OE1 2.67Å; R102-E104 IonicContact NH1-OE1 2.68Å; R102-E104 PolarHBondContact NH1-OE1 3.45Å | ||
| 103 | P | 31.9 | Very low | 29.9 | Very low | 99 Ų | 99 | 163.1 Ų | 163.1 | 64% | 0.643 | 79% | 0.794 | S | S | * | * | trans | -125.5 | 119.7 | 145.2 | 33.4 | -23.1 | 0 | 0 | 0 | 110.4 | ||||
| 104 | E | 32.6 | Very low | 30.4 | Very low | 122 Ų | 122 | 167.9 Ų | 167.9 | 57% | 0.57 | 80% | 0.802 | S | S | * | * | trans | -74.3 | 144.4 | 164.6 | -75 | 149.8 | -141.4 | 0 | 0 | 109.8 | R102 | R102-E104 WeakPolarHBondContact CD-OE1 3.38Å; R102-E104 HydrophobicContact CG-CG 4.48Å; R102-E104 IonicContact CZ-OE1 3.57Å; R102-E104 IonicContact NE-OE1 2.67Å; R102-E104 IonicContact NH1-OE1 2.68Å; R102-E104 PolarHBondContact NH1-OE1 3.45Å | ||
| 105 | F | 26.5 | Very low | 30.7 | Very low | 185 Ų | 185 | 168.3 Ų | 168.3 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | -135.5 | 79.9 | 167.7 | -95.7 | -80.1 | 0 | 0 | 0 | 109.9 | ||||
| 106 | F | 28.7 | Very low | 30.9 | Very low | 192 Ų | 192 | 167.4 Ų | 167.4 | 84% | 0.842 | 81% | 0.807 | S | S | * | * | trans | -75.9 | 123.4 | 157.2 | -79.2 | -87.9 | 0 | 0 | 0 | 108.7 | ||||
| 107 | T | 26 | Very low | 31.2 | Very low | 128 Ų | 128 | 164.3 Ų | 164.3 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -103.9 | 101.2 | 171.1 | 49.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 108 | F | 27 | Very low | 32.1 | Very low | 208 Ų | 208 | 162.3 Ų | 162.3 | 91% | 0.912 | 80% | 0.8 | S | S | * | * | trans | -67.7 | 135.3 | 167.6 | -131.4 | -94.7 | 0 | 0 | 0 | 109.1 | ||||
| 109 | R | 26.8 | Very low | 32.6 | Very low | 227 Ų | 227 | 161.8 Ų | 161.8 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | trans | -106.7 | 117.9 | 172.4 | -167 | 174 | -167.8 | 160.7 | 4.1 | 109.1 | ||||
| 110 | E | 29.9 | Very low | 32.9 | Very low | 169 Ų | 169 | 158 Ų | 158 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 122 | -179.3 | -167.9 | 168 | -149.9 | 0 | 0 | 109.7 | ||
| 111 | E | 30 | Very low | 33.1 | Very low | 178 Ų | 178 | 157.1 Ų | 157.1 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 117.8 | 176.5 | -67.2 | -167 | 152.5 | 0 | 0 | 110.4 | ||
| 112 | N | 30.5 | Very low | 33.7 | Very low | 144 Ų | 144 | 153.7 Ų | 153.7 | 77% | 0.77 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 124.6 | 167.1 | -81.8 | -62.3 | 0 | 0 | 0 | 109.3 | ||
| 113 | P | 38 | Very low | 33.8 | Very low | 94 Ų | 94 | 147.1 Ų | 147.1 | 61% | 0.61 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 165.8 | 176.9 | 32.6 | -35.1 | 0 | 0 | 0 | 112.3 | ||
| 114 | W | 36.5 | Very low | 34.1 | Very low | 240 Ų | 240 | 146.9 Ų | 146.9 | 91% | 0.909 | 78% | 0.782 | S | S | * | * | trans | 76.6 | 89.8 | 178.8 | -43.8 | 106.5 | 0 | 0 | 0 | 116.1 | ||||
| 115 | D | 31.5 | Very low | 34.6 | Very low | 171 Ų | 171 | 145.9 Ų | 145.9 | 91% | 0.914 | 79% | 0.787 | S | S | * | * | -157.5 | 172.8 | 120.3 | -115 | -30.8 | 0 | 0 | 0 | 111.9 | |||||
| 116 | A | 37.2 | Very low | 35.2 | Very low | 94 Ų | 94 | 144.3 Ų | 144.3 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | trans | -85.8 | 159.4 | -156.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 117 | T | 38.3 | Very low | 35.7 | Very low | 131 Ų | 131 | 143.4 Ų | 143.4 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -80.6 | 175.3 | 166.8 | 57.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 118 | P | 49.4 | Very low | 36.5 | Very low | 110 Ų | 110 | 140.3 Ų | 140.3 | 71% | 0.714 | 78% | 0.776 | S | S | * | * | cis | -141.7 | -163.4 | 13.7 | 31.6 | -5 | 0 | 0 | 0 | 116.5 | ||||
| 119 | I | 40.4 | Very low | 37.4 | Very low | 153 Ų | 153 | 137 Ų | 137 | 79% | 0.785 | 77% | 0.768 | S | S | * | * | trans | 86.6 | 86.1 | 160.1 | -39 | 179.1 | 0 | 0 | 0 | 118.3 | ||||
| 120 | T | 36.2 | Very low | 38.4 | Very low | 136 Ų | 136 | 132.8 Ų | 132.8 | 83% | 0.834 | 76% | 0.758 | S | S | * | * | trans | -142.7 | 144.4 | 136.9 | 20.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 121 | P | 38 | Very low | 39.1 | Very low | 112 Ų | 112 | 132.1 Ų | 132.1 | 73% | 0.727 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 155.4 | 178.6 | 31.9 | -35 | 0 | 0 | 0 | 111.4 | G123 | P121-G123 PolarHBondContact O-N 3.07Š|
| 122 | P | 39.6 | Very low | 39.8 | Very low | 130 Ų | 130 | 131.3 Ų | 131.3 | 84% | 0.844 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 116.3 | 176.5 | 27.8 | -33.5 | 0 | 0 | 0 | 110.5 | ||
| 123 | G | 35.3 | Very low | 40.8 | Very low | 67 Ų | 67 | 128.2 Ų | 128.2 | 69% | 0.691 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 151.2 | 158.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | P121 | P121-G123 PolarHBondContact O-N 3.07Š|
| 124 | S | 36.7 | Very low | 41.8 | Very low | 93 Ų | 93 | 129.1 Ų | 129.1 | 65% | 0.65 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 140.7 | 176.2 | 42.2 | 0 | 0 | 0 | 0 | 111.1 | D126 | S124-D126 PolarHBondContact O-N 3.38Š|
| 125 | P | 43.3 | Very low | 42.5 | Very low | 102 Ų | 102 | 121.7 Ų | 121.7 | 66% | 0.662 | 72% | 0.715 | S | S | * | * | trans | -65.4 | 109.2 | 163.6 | 28.4 | -31.4 | 0 | 0 | 0 | 107.5 | F127 | P125-F127 HydrophobicContact CB-CD2 4.12Å; P125-F127 HydrophobicContact CB-CE2 4.12Å; P125-F127 HydrophobicContact CG-CD2 4.25Å; P125-F127 HydrophobicContact CG-CE2 4.2Å; P125-F127 PolarHBondContact O-N 3.4Å | ||
| 126 | D | 38.9 | Very low | 42.8 | Very low | 152 Ų | 152 | 122.1 Ų | 122.1 | 81% | 0.813 | 71% | 0.705 | S | S | * | * | trans | -65 | 92.5 | 165.3 | -85.5 | -33.2 | 0 | 0 | 0 | 107.8 | S124 G128 | S124-D126 PolarHBondContact O-N 3.38Å; D126-G128 PolarHBondContact O-N 3.4Å | ||
| 127 | F | 41.1 | Very low | 43.4 | Very low | 173 Ų | 173 | 121.8 Ų | 121.8 | 76% | 0.759 | 70% | 0.695 | S | S | * | * | trans | -69.6 | 60.4 | 157.6 | -84.5 | -89.1 | 0 | 0 | 0 | 109.2 | P125 D129 | P125-F127 HydrophobicContact CB-CD2 4.12Å; P125-F127 HydrophobicContact CB-CE2 4.12Å; P125-F127 HydrophobicContact CG-CD2 4.25Å; P125-F127 HydrophobicContact CG-CE2 4.2Å; P125-F127 PolarHBondContact O-N 3.4Å; F127-D129 PolarHBondContact O-N 2.91Å; F127-D129 VanDerWaalsContact O-N 3.09Å | ||
| 128 | G | 41 | Very low | 44.1 | Very low | 62 Ų | 62 | 120.3 Ų | 120.3 | 64% | 0.639 | 69% | 0.686 | S | S | * | * | trans | -66.8 | 94.4 | 147.4 | 0 | 0 | 0 | 0 | 0 | 106.6 | D126 E130 | D126-G128 PolarHBondContact O-N 3.4Å; G128-E130 PolarHBondContact O-N 3.45Å | ||
| 129 | D | 46 | Very low | 44.8 | Very low | 138 Ų | 138 | 118.5 Ų | 118.5 | 74% | 0.738 | 67% | 0.673 | S | S | * | * | trans | -61.9 | 83 | 159.8 | -80 | -33.1 | 0 | 0 | 0 | 107 | F127 I131 | F127-D129 PolarHBondContact O-N 2.91Å; F127-D129 VanDerWaalsContact O-N 3.09Å; D129-I131 PolarHBondContact O-N 3.26Å | ||
| 130 | E | 49.4 | Very low | 45.8 | Very low | 140 Ų | 140 | 117.1 Ų | 117.1 | 65% | 0.654 | 67% | 0.672 | S | S | * | * | trans | -65.2 | 88.7 | 166.7 | -173.3 | -173.9 | 116.9 | 0 | 0 | 105.8 | G128 K132 | G128-E130 PolarHBondContact O-N 3.45Å; E130-K132 PolarHBondContact O-N 3.43Å; E130-K132 IonicContact OE1-NZ 3.83Å; E130-K132 PolarHBondContact OE1-NZ 3.18Å | ||
| 131 | I | 44 | Very low | 47.2 | Very low | 154 Ų | 154 | 117.7 Ų | 117.7 | 79% | 0.79 | 67% | 0.665 | S | S | * | * | trans | -60.5 | 88.5 | 170.8 | -60 | 176.4 | 0 | 0 | 0 | 105.8 | D129 N133 | D129-I131 PolarHBondContact O-N 3.26Å; I131-N133 PolarHBondContact O-N 2.96Å | ||
| 132 | K | 44.6 | Very low | 48.8 | Very low | 162 Ų | 162 | 113.1 Ų | 113.1 | 70% | 0.704 | 64% | 0.635 | S | S | * | * | trans | -72.8 | 86.5 | -170.4 | -144.7 | 179 | -165.7 | 81.3 | 0 | 107.2 | E130 P134 | E130-K132 PolarHBondContact O-N 3.43Å; E130-K132 IonicContact OE1-NZ 3.83Å; E130-K132 PolarHBondContact OE1-NZ 3.18Å; K132-P134 WeakPolarHBondContact O-CD 3.42Å; K132-P134 VanDerWaalsContact O-N 3.09Å | ||
| 133 | N | 51.8 | Low | 50.7 | Low | 78 Ų | 78 | 114.2 Ų | 114.2 | 42% | 0.417 | 63% | 0.627 | S | S | . | * | trans | -51.8 | 117 | -174.8 | 179.5 | -0.5 | 0 | 0 | 0 | 108.3 | I131 F135 Y136 | I131-N133 PolarHBondContact O-N 2.96Å; N133-F135 PolarHBondContact O-N 2.73Å; N133-F135 VanDerWaalsContact OD1-CD2 3.29Å; N133-F135 WeakPolarHBondContact OD1-CD2 3.27Å; N133-F135 PolarHBondContact OD1-N 3.25Å; N133-Y136 PolarHBondContact O-N 2.7Å | ||
| 134 | P | 57.7 | Low | 52.8 | Low | 113 Ų | 113 | 112.4 Ų | 112.4 | 73% | 0.734 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | -9.3 | -172.3 | 24.5 | -34.7 | 0 | 0 | 0 | 113.4 | K132 | K132-P134 WeakPolarHBondContact O-CD 3.42Å; K132-P134 VanDerWaalsContact O-N 3.09Å |
| 135 | F | 52.2 | Low | 54.9 | Low | 84 Ų | 84 | 109 Ų | 109 | 37% | 0.368 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.5 | 16.9 | 174.7 | -50.2 | -64.3 | 0 | 0 | 0 | 114.2 | N133 Y146 | N133-F135 PolarHBondContact O-N 2.73Å; N133-F135 VanDerWaalsContact OD1-CD2 3.29Å; N133-F135 WeakPolarHBondContact OD1-CD2 3.27Å; N133-F135 PolarHBondContact OD1-N 3.25Å; F135-Y146 HydrophobicContact CB-CE2 4.22Å; F135-Y146 VanDerWaalsContact CB-OH 3.23Å; F135-Y146 WeakPolarHBondContact CB-OH 3.46Å |
| 136 | Y | 36.7 | Very low | 56.8 | Low | 180 Ų | 180 | 109 Ų | 109 | 71% | 0.706 | 57% | 0.573 | S | S | * | * | trans | -129.1 | 134.4 | 175.7 | -159.8 | -95.7 | 0 | 0 | 0 | 111 | N133 V138 | N133-Y136 PolarHBondContact O-N 2.7Å; Y136-V138 HydrophobicContact CD2-CG2 4Å; Y136-V138 HydrophobicContact CE2-CG2 4.17Å | ||
| 137 | P | 50.7 | Low | 59.1 | Low | 88 Ų | 88 | 103.9 Ų | 103.9 | 57% | 0.571 | 55% | 0.552 | S | S | * | * | S | Bend | cis | -78.2 | 155.7 | 10.5 | 32.8 | -37.3 | 0 | 0 | 0 | 114.6 | T139 T142 | P137-T139 PolarHBondContact O-N 3.08Å; P137-T142 WeakPolarHBondContact O-CG2 3.35Å |
| 138 | V | 52.9 | Low | 61.2 | Low | 100 Ų | 100 | 97.5 Ų | 97.5 | 61% | 0.606 | 53% | 0.525 | S | S | * | . | trans | -75.8 | 86.7 | -179.2 | -174.9 | 0 | 0 | 0 | 0 | 110.8 | Y136 T142 | Y136-V138 HydrophobicContact CD2-CG2 4Å; Y136-V138 HydrophobicContact CE2-CG2 4.17Å; V138-T142 VanDerWaalsContact CA-OG1 3.31Å; V138-T142 WeakPolarHBondContact CA-OG1 3.44Å; V138-T142 WeakPolarHBondContact CG1-OG1 3.47Å | ||
| 139 | T | 63.7 | Low | 63.5 | Low | 72 Ų | 72 | 97.4 Ų | 97.4 | 44% | 0.442 | 51% | 0.512 | S | S | . | . | trans | -87.8 | 170.8 | 169.8 | 66.2 | 0 | 0 | 0 | 0 | 111.3 | P137 E141 T142 F143 | P137-T139 PolarHBondContact O-N 3.08Å; T139-E141 PolarHBondContact O-N 3.32Å; T139-T142 PolarHBondContact N-OG1 3.48Å; T139-T142 PolarHBondContact O-N 3.45Å; T139-T142 PolarHBondContact O-OG1 3.38Å; T139-F143 PolarHBondContact O-N 3.36Å | ||
| 140 | T | 62.4 | Low | 65.6 | Low | 123 Ų | 123 | 94.9 Ų | 94.9 | 76% | 0.755 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -53.1 | -38.8 | 175.6 | -22.3 | 0 | 0 | 0 | 0 | 112.4 | T142 F143 G144 | T140-T142 VanDerWaalsContact C-N 3.35Å; T140-T142 PolarHBondContact O-N 3.07Å; T140-F143 PolarHBondContact O-N 3.42Å; T140-G144 PolarHBondContact O-N 2.82Å |
| 141 | E | 65.9 | Low | 67.6 | Low | 148 Ų | 148 | 91.5 Ų | 91.5 | 69% | 0.692 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.5 | -39.9 | 176.9 | -52.7 | -48.3 | 119.1 | 0 | 0 | 112.2 | T139 F143 G144 A145 | T139-E141 PolarHBondContact O-N 3.32Å; E141-F143 VanDerWaalsContact C-N 3.32Å; E141-F143 PolarHBondContact O-N 2.98Å; E141-G144 WeakPolarHBondContact O-CA 3.5Å; E141-G144 PolarHBondContact O-N 2.85Å; E141-G144 VanDerWaalsContact O-N 3.16Å; E141-A145 PolarHBondContact O-N 3.3Å |
| 142 | T | 71.4 | Confident | 69.8 | Low | 17 Ų | 17 | 84.6 Ų | 84.6 | 10% | 0.104 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.9 | -34.9 | 178 | 68 | 0 | 0 | 0 | 0 | 112.4 | P137 V138 T139 T140 G144 A145 Y146 | P137-T142 WeakPolarHBondContact O-CG2 3.35Å; V138-T142 VanDerWaalsContact CA-OG1 3.31Å; V138-T142 WeakPolarHBondContact CA-OG1 3.44Å; V138-T142 WeakPolarHBondContact CG1-OG1 3.47Å; T139-T142 PolarHBondContact N-OG1 3.48Å; T139-T142 PolarHBondContact O-N 3.45Å; T139-T142 PolarHBondContact O-OG1 3.38Å; T140-T142 VanDerWaalsContact C-N 3.35Å; T140-T142 PolarHBondContact O-N 3.07Å; T142-G144 VanDerWaalsContact C-N 3.32Å; T142-A145 PolarHBondContact O-N 2.81Å; T142-Y146 WeakPolarHBondContact O-CD2 3.22Å; T142-Y146 PolarHBondContact O-N 3.41Å |
| 143 | F | 78.6 | Confident | 72.1 | Confident | 153 Ų | 153 | 78.4 Ų | 78.4 | 67% | 0.671 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.9 | -38.3 | 174.9 | -175 | -93.9 | 0 | 0 | 0 | 111.2 | T139 T140 E141 A147 | T139-F143 PolarHBondContact O-N 3.36Å; T140-F143 PolarHBondContact O-N 3.42Å; E141-F143 VanDerWaalsContact C-N 3.32Å; E141-F143 PolarHBondContact O-N 2.98Å; F143-A147 WeakPolarHBondContact O-CB 3.24Å; F143-A147 PolarHBondContact O-N 3.02Å |
| 144 | G | 79.4 | Confident | 74.1 | Confident | 28 Ų | 28 | 79.1 Ų | 79.1 | 29% | 0.289 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -58.2 | -52.8 | 169 | 0 | 0 | 0 | 0 | 0 | 111.9 | T140 E141 T142 Y146 A147 I148 | T140-G144 PolarHBondContact O-N 2.82Å; E141-G144 WeakPolarHBondContact O-CA 3.5Å; E141-G144 PolarHBondContact O-N 2.85Å; E141-G144 VanDerWaalsContact O-N 3.16Å; T142-G144 VanDerWaalsContact C-N 3.32Å; G144-Y146 PolarHBondContact O-N 3.29Å; G144-A147 PolarHBondContact O-N 3.31Å; G144-A147 VanDerWaalsContact O-N 3.13Å; G144-I148 WeakPolarHBondContact O-CD1 3.23Å; G144-I148 VanDerWaalsContact O-CG1 3.23Å; G144-I148 WeakPolarHBondContact O-CG1 3.37Å; G144-I148 PolarHBondContact O-N 3.37Å |
| 145 | A | 80.6 | Confident | 75.8 | Confident | 23 Ų | 23 | 74.3 Ų | 74.3 | 19% | 0.19 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -56.1 | -44.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | E141 T142 T149 L207 | E141-A145 PolarHBondContact O-N 3.3Å; T142-A145 PolarHBondContact O-N 2.81Å; A145-T149 WeakPolarHBondContact O-CB 3.41Å; A145-T149 PolarHBondContact O-N 3.24Å; A145-T149 PolarHBondContact O-OG1 2.89Å; A145-L207 HydrophobicContact CB-CD2 3.62Å |
| 146 | Y | 84 | Confident | 77.8 | Confident | 101 Ų | 101 | 73.4 Ų | 73.4 | 40% | 0.396 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 174.5 | -79.5 | -60.3 | 0 | 0 | 0 | 112.2 | F135 T142 G144 T149 C150 | F135-Y146 HydrophobicContact CB-CE2 4.22Å; F135-Y146 VanDerWaalsContact CB-OH 3.23Å; F135-Y146 WeakPolarHBondContact CB-OH 3.46Å; T142-Y146 WeakPolarHBondContact O-CD2 3.22Å; T142-Y146 PolarHBondContact O-N 3.41Å; G144-Y146 PolarHBondContact O-N 3.29Å; Y146-T149 PolarHBondContact O-N 3.41Å; Y146-C150 WeakPolarHBondContact O-CB 3.11Å; Y146-C150 PolarHBondContact O-N 3.3Å; Y146-C150 PolarHBondContact O-SG 3.33Å; Y146-C150 VanDerWaalsContact O-SG 3.35Å |
| 147 | A | 86.8 | Confident | 80.5 | Confident | 44 Ų | 44 | 70.7 Ų | 70.7 | 36% | 0.364 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.8 | -46 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | F143 G144 T149 C150 V151 | F143-A147 WeakPolarHBondContact O-CB 3.24Å; F143-A147 PolarHBondContact O-N 3.02Å; G144-A147 PolarHBondContact O-N 3.31Å; G144-A147 VanDerWaalsContact O-N 3.13Å; A147-T149 VanDerWaalsContact C-N 3.35Å; A147-T149 PolarHBondContact O-N 2.97Å; A147-C150 PolarHBondContact O-N 3.49Å; A147-V151 WeakPolarHBondContact O-CB 3.44Å; A147-V151 VanDerWaalsContact O-CG2 3.31Å; A147-V151 WeakPolarHBondContact O-CG2 3.11Å; A147-V151 PolarHBondContact O-N 2.83Å |
| 148 | I | 86.1 | Confident | 82.5 | Confident | 40 Ų | 40 | 69.8 Ų | 69.8 | 21% | 0.205 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.3 | -46.3 | 176.2 | -65.7 | 157.5 | 0 | 0 | 0 | 110.4 | G144 S152 L416 | G144-I148 WeakPolarHBondContact O-CD1 3.23Å; G144-I148 VanDerWaalsContact O-CG1 3.23Å; G144-I148 WeakPolarHBondContact O-CG1 3.37Å; G144-I148 PolarHBondContact O-N 3.37Å; I148-S152 WeakPolarHBondContact O-CB 3.28Å; I148-S152 PolarHBondContact O-N 3.28Å; I148-S152 PolarHBondContact O-OG 3.35Å; I148-L416 HydrophobicContact CD1-CD1 3.5Å; I148-L416 HydrophobicContact CG1-CD1 3.94Å; I148-L416 HydrophobicContact CG1-CD2 4.26Å |
| 149 | T | 88.1 | Confident | 84.4 | Confident | 59 Ų | 59 | 65 Ų | 65 | 36% | 0.362 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.1 | -47 | -179.9 | -57.1 | 0 | 0 | 0 | 0 | 111.3 | A145 Y146 A147 G153 | A145-T149 WeakPolarHBondContact O-CB 3.41Å; A145-T149 PolarHBondContact O-N 3.24Å; A145-T149 PolarHBondContact O-OG1 2.89Å; Y146-T149 PolarHBondContact O-N 3.41Å; A147-T149 VanDerWaalsContact C-N 3.35Å; A147-T149 PolarHBondContact O-N 2.97Å; T149-G153 PolarHBondContact O-N 2.88Å |
| 150 | C | 90.3 | Very high | 85.8 | Confident | 85 Ų | 85 | 62.9 Ų | 62.9 | 57% | 0.574 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -65.4 | -46.8 | 179.7 | -72.4 | 0 | 0 | 0 | 0 | 112.4 | Y146 A147 G153 V154 | Y146-C150 WeakPolarHBondContact O-CB 3.11Å; Y146-C150 PolarHBondContact O-N 3.3Å; Y146-C150 PolarHBondContact O-SG 3.33Å; Y146-C150 VanDerWaalsContact O-SG 3.35Å; A147-C150 PolarHBondContact O-N 3.49Å; C150-G153 PolarHBondContact O-N 3.06Å; C150-V154 WeakPolarHBondContact O-CG2 3.43Å; C150-V154 PolarHBondContact O-N 3.25Å; C150-V154 VanDerWaalsContact O-N 3.09Å |
| 151 | V | 90.9 | Very high | 87.2 | Confident | 70 Ų | 70 | 60 Ų | 60 | 42% | 0.424 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -66.4 | -44.3 | -180 | 177.3 | 0 | 0 | 0 | 0 | 110.8 | A147 G153 V154 I155 L420 | A147-V151 WeakPolarHBondContact O-CB 3.44Å; A147-V151 VanDerWaalsContact O-CG2 3.31Å; A147-V151 WeakPolarHBondContact O-CG2 3.11Å; A147-V151 PolarHBondContact O-N 2.83Å; V151-G153 VanDerWaalsContact C-N 3.32Å; V151-G153 PolarHBondContact O-N 2.61Å; V151-V154 PolarHBondContact O-N 3.22Å; V151-I155 HydrophobicContact CG1-CD1 3.87Å; V151-I155 HydrophobicContact CG1-CG1 4.49Å; V151-I155 WeakPolarHBondContact O-CG1 3.48Å; V151-I155 PolarHBondContact O-N 3.22Å; V151-L420 HydrophobicContact CG1-CD1 4.06Å; V151-L420 HydrophobicContact CG1-CD2 4.3Å |
| 152 | S | 90.3 | Very high | 88.4 | Confident | 9 Ų | 9 | 53.4 Ų | 53.4 | 6% | 0.063 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.4 | -37.1 | 176.2 | -58.9 | 0 | 0 | 0 | 0 | 112.4 | I148 I155 F156 V203 | I148-S152 WeakPolarHBondContact O-CB 3.28Å; I148-S152 PolarHBondContact O-N 3.28Å; I148-S152 PolarHBondContact O-OG 3.35Å; S152-I155 PolarHBondContact O-N 3.43Å; S152-F156 VanDerWaalsContact O-CB 3.32Å; S152-F156 WeakPolarHBondContact O-CB 3.45Å; S152-F156 PolarHBondContact O-N 3.41Å; S152-V203 WeakPolarHBondContact OG-CG2 3.41Å |
| 153 | G | 93 | Very high | 89.4 | Confident | 32 Ų | 32 | 52.7 Ų | 52.7 | 33% | 0.33 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62.3 | -40.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | T149 C150 V151 F156 L157 | T149-G153 PolarHBondContact O-N 2.88Å; C150-G153 PolarHBondContact O-N 3.06Å; V151-G153 VanDerWaalsContact C-N 3.32Å; V151-G153 PolarHBondContact O-N 2.61Å; G153-F156 PolarHBondContact O-N 3.12Å; G153-L157 WeakPolarHBondContact O-CG 3.22Å; G153-L157 PolarHBondContact O-N 3.37Å |
| 154 | V | 93.6 | Very high | 89.9 | Confident | 92 Ų | 92 | 49 Ų | 49 | 56% | 0.558 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -65.7 | -45.2 | 173.7 | 172.4 | 0 | 0 | 0 | 0 | 111.2 | C150 V151 F156 L157 V158 | C150-V154 WeakPolarHBondContact O-CG2 3.43Å; C150-V154 PolarHBondContact O-N 3.25Å; C150-V154 VanDerWaalsContact O-N 3.09Å; V151-V154 PolarHBondContact O-N 3.22Å; V154-F156 VanDerWaalsContact C-N 3.32Å; V154-F156 PolarHBondContact O-N 3.29Å; V154-L157 PolarHBondContact O-N 3.18Å; V154-V158 HydrophobicContact CG1-CG2 4.27Å; V154-V158 WeakPolarHBondContact O-CB 3.44Å; V154-V158 VanDerWaalsContact O-CG2 3.32Å; V154-V158 WeakPolarHBondContact O-CG2 3.36Å; V154-V158 PolarHBondContact O-N 3.49Å |
| 155 | I | 93.7 | Very high | 90.4 | Very high | 13 Ų | 13 | 48.1 Ų | 48.1 | 7% | 0.067 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.5 | -42.6 | 176.7 | -67.8 | 166.7 | 0 | 0 | 0 | 110.8 | V151 S152 G159 L199 L420 F423 C424 A427 | V151-I155 HydrophobicContact CG1-CD1 3.87Å; V151-I155 HydrophobicContact CG1-CG1 4.49Å; V151-I155 WeakPolarHBondContact O-CG1 3.48Å; V151-I155 PolarHBondContact O-N 3.22Å; S152-I155 PolarHBondContact O-N 3.43Å; I155-G159 WeakPolarHBondContact O-CA 3.37Å; I155-G159 PolarHBondContact O-N 3.31Å; I155-L199 HydrophobicContact CB-CD2 4.34Å; I155-L199 HydrophobicContact CG2-CD2 3.91Å; I155-L420 HydrophobicContact CD1-CD1 3.48Å; I155-L420 VanDerWaalsContact CD1-CD1 3.48Å; I155-L420 HydrophobicContact CD1-CG 4.32Å; I155-F423 HydrophobicContact CG2-CB 3.91Å; I155-C424 VanDerWaalsContact CD1-SG 3.51Å; I155-A427 HydrophobicContact CG2-CB 3.92Å |
| 156 | F | 94.4 | Very high | 90.7 | Very high | 65 Ų | 65 | 47 Ų | 47 | 29% | 0.285 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.8 | -53.3 | 176.4 | -174.2 | -91.3 | 0 | 0 | 0 | 111.4 | S152 G153 V154 V158 G159 I160 I195 F196 L199 P200 | S152-F156 VanDerWaalsContact O-CB 3.32Å; S152-F156 WeakPolarHBondContact O-CB 3.45Å; S152-F156 PolarHBondContact O-N 3.41Å; G153-F156 PolarHBondContact O-N 3.12Å; V154-F156 VanDerWaalsContact C-N 3.32Å; V154-F156 PolarHBondContact O-N 3.29Å; F156-V158 PolarHBondContact O-N 3.31Å; F156-G159 PolarHBondContact O-N 3.22Å; F156-I160 HydrophobicContact CD1-CG1 4.19Å; F156-I160 HydrophobicContact CD2-CG1 4.25Å; F156-I160 HydrophobicContact CE1-CG1 4.01Å; F156-I160 HydrophobicContact CE2-CD1 4.36Å; F156-I160 HydrophobicContact CE2-CG1 4.09Å; F156-I160 HydrophobicContact CG-CG1 4.3Å; F156-I160 HydrophobicContact CZ-CD1 4.43Å; F156-I160 HydrophobicContact CZ-CG1 3.96Å; F156-I160 VanDerWaalsContact O-CB 3.31Å; F156-I160 WeakPolarHBondContact O-CB 3.32Å; F156-I160 WeakPolarHBondContact O-CG1 3.26Å; F156-I160 PolarHBondContact O-N 2.77Å; F156-I195 HydrophobicContact CB-CG2 4.46Å; F156-I195 HydrophobicContact CD2-CG2 3.97Å; F156-I195 VanDerWaalsContact CD2-O 3.24Å; F156-I195 WeakPolarHBondContact CD2-O 3.28Å; F156-I195 VanDerWaalsContact CE2-O 3.3Å; F156-I195 WeakPolarHBondContact CE2-O 3.41Å; F156-I195 HydrophobicContact CG-CG2 4.43Å; F156-F196 HydrophobicContact CZ-CD2 4.45Å; F156-L199 HydrophobicContact CB-CD2 3.99Å; F156-L199 HydrophobicContact CD2-CD2 4.38Å; F156-P200 HydrophobicContact CD2-CG 4.29Å; F156-P200 HydrophobicContact CE2-CG 3.96Å |
| 157 | L | 93.8 | Very high | 90.9 | Very high | 123 Ų | 123 | 44.1 Ų | 44.1 | 64% | 0.644 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -61.9 | -47.3 | -178.8 | -70.7 | 171 | 0 | 0 | 0 | 112.4 | G153 V154 A161 | G153-L157 WeakPolarHBondContact O-CG 3.22Å; G153-L157 PolarHBondContact O-N 3.37Å; V154-L157 PolarHBondContact O-N 3.18Å; L157-A161 VanDerWaalsContact O-CB 3.22Å; L157-A161 WeakPolarHBondContact O-CB 3.21Å; L157-A161 PolarHBondContact O-N 3.26Å; L157-A161 VanDerWaalsContact O-N 3.09Å |
| 158 | V | 92.4 | Very high | 90.8 | Very high | 69 Ų | 69 | 44.9 Ų | 44.9 | 42% | 0.418 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -66 | -43 | 179 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | V154 F156 G162 A427 | V154-V158 HydrophobicContact CG1-CG2 4.27Å; V154-V158 WeakPolarHBondContact O-CB 3.44Å; V154-V158 VanDerWaalsContact O-CG2 3.32Å; V154-V158 WeakPolarHBondContact O-CG2 3.36Å; V154-V158 PolarHBondContact O-N 3.49Å; F156-V158 PolarHBondContact O-N 3.31Å; V158-G162 WeakPolarHBondContact O-CA 3.48Å; V158-G162 PolarHBondContact O-N 3.21Å; V158-A427 HydrophobicContact CG1-CB 4.47Å |
| 159 | G | 92.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -70.5 | -42.3 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | I155 F156 N163 | I155-G159 WeakPolarHBondContact O-CA 3.37Å; I155-G159 PolarHBondContact O-N 3.31Å; F156-G159 PolarHBondContact O-N 3.22Å; G159-N163 VanDerWaalsContact O-CB 3.26Å; G159-N163 WeakPolarHBondContact O-CB 3.49Å; G159-N163 PolarHBondContact O-N 3.3Å; G159-N163 PolarHBondContact O-ND2 3.5Å |
| 160 | I | 94.1 | Very high | 90.1 | Very high | 27 Ų | 27 | 41.4 Ų | 41.4 | 14% | 0.138 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66.2 | -50.5 | 175.6 | -65.7 | -64.2 | 0 | 0 | 0 | 110.2 | F156 G162 I164 F192 I195 F196 | F156-I160 HydrophobicContact CD1-CG1 4.19Å; F156-I160 HydrophobicContact CD2-CG1 4.25Å; F156-I160 HydrophobicContact CE1-CG1 4.01Å; F156-I160 HydrophobicContact CE2-CD1 4.36Å; F156-I160 HydrophobicContact CE2-CG1 4.09Å; F156-I160 HydrophobicContact CG-CG1 4.3Å; F156-I160 HydrophobicContact CZ-CD1 4.43Å; F156-I160 HydrophobicContact CZ-CG1 3.96Å; F156-I160 VanDerWaalsContact O-CB 3.31Å; F156-I160 WeakPolarHBondContact O-CB 3.32Å; F156-I160 WeakPolarHBondContact O-CG1 3.26Å; F156-I160 PolarHBondContact O-N 2.77Å; I160-G162 PolarHBondContact O-N 3.35Å; I160-I164 HydrophobicContact CG2-CD1 3.64Å; I160-I164 HydrophobicContact CG2-CG1 4.46Å; I160-I164 WeakPolarHBondContact O-CB 3.46Å; I160-I164 VanDerWaalsContact O-CG1 3.25Å; I160-I164 WeakPolarHBondContact O-CG1 3.4Å; I160-I164 PolarHBondContact O-N 2.88Å; I160-F192 HydrophobicContact CD1-CD2 3.72Å; I160-F192 HydrophobicContact CD1-CE2 3.67Å; I160-F192 HydrophobicContact CG2-CE2 4.37Å; I160-I195 HydrophobicContact CD1-CB 4.39Å; I160-I195 HydrophobicContact CD1-CG2 4Å; I160-I195 HydrophobicContact CG1-CG2 3.94Å; I160-F196 HydrophobicContact CD1-CB 3.9Å; I160-F196 HydrophobicContact CD1-CD2 4.09Å |
| 161 | A | 91.1 | Very high | 89.5 | Confident | 62 Ų | 62 | 42.1 Ų | 42.1 | 51% | 0.512 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62 | -44.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L157 A165 | L157-A161 VanDerWaalsContact O-CB 3.22Å; L157-A161 WeakPolarHBondContact O-CB 3.21Å; L157-A161 PolarHBondContact O-N 3.26Å; L157-A161 VanDerWaalsContact O-N 3.09Å; A161-A165 VanDerWaalsContact O-CB 3.26Å; A161-A165 WeakPolarHBondContact O-CB 3.2Å; A161-A165 PolarHBondContact O-N 3.09Å |
| 162 | G | 90.1 | Very high | 88.6 | Confident | 9 Ų | 9 | 45.9 Ų | 45.9 | 9% | 0.093 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.6 | -49.6 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | V158 I160 A165 I166 P430 | V158-G162 WeakPolarHBondContact O-CA 3.48Å; V158-G162 PolarHBondContact O-N 3.21Å; I160-G162 PolarHBondContact O-N 3.35Å; G162-A165 PolarHBondContact O-N 3.45Å; G162-I166 WeakPolarHBondContact O-CG1 3.18Å; G162-I166 PolarHBondContact O-N 3.48Å; G162-I166 VanDerWaalsContact O-N 3.09Å; G162-P430 VanDerWaalsContact C-CB 3.41Å |
| 163 | N | 92.6 | Very high | 87.5 | Confident | 2 Ų | 2 | 48.4 Ų | 48.4 | 1% | 0.011 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -69.4 | -39.5 | -178.1 | -73.2 | -53.3 | 0 | 0 | 0 | 111.9 | G159 A165 I166 L167 A188 F192 A426 P430 | G159-N163 VanDerWaalsContact O-CB 3.26Å; G159-N163 WeakPolarHBondContact O-CB 3.49Å; G159-N163 PolarHBondContact O-N 3.3Å; G159-N163 PolarHBondContact O-ND2 3.5Å; N163-A165 VanDerWaalsContact C-N 3.34Å; N163-A165 PolarHBondContact O-N 2.79Å; N163-I166 PolarHBondContact O-N 3.09Å; N163-L167 VanDerWaalsContact O-CG 3.3Å; N163-L167 WeakPolarHBondContact O-CG 3.5Å; N163-L167 PolarHBondContact O-N 2.94Å; N163-L167 VanDerWaalsContact O-N 3.08Å; N163-A188 HydrophobicContact CB-CB 4.35Å; N163-A188 WeakPolarHBondContact OD1-CA 3.2Å; N163-F192 HydrophobicContact CB-CB 4Å; N163-A426 PolarHBondContact ND2-O 3.03Å; N163-P430 WeakPolarHBondContact OD1-CG 3.08Å |
| 164 | I | 90.9 | Very high | 85.5 | Confident | 75 Ų | 75 | 52.9 Ų | 52.9 | 39% | 0.385 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60 | -44.8 | 172.3 | -68.5 | 173.7 | 0 | 0 | 0 | 110.7 | I160 I166 L167 C168 F192 | I160-I164 HydrophobicContact CG2-CD1 3.64Å; I160-I164 HydrophobicContact CG2-CG1 4.46Å; I160-I164 WeakPolarHBondContact O-CB 3.46Å; I160-I164 VanDerWaalsContact O-CG1 3.25Å; I160-I164 WeakPolarHBondContact O-CG1 3.4Å; I160-I164 PolarHBondContact O-N 2.88Å; I164-I166 PolarHBondContact O-N 2.7Å; I164-L167 PolarHBondContact O-N 3.33Å; I164-L167 VanDerWaalsContact O-N 3.17Å; I164-C168 PolarHBondContact O-N 3.49Å; I164-C168 PolarHBondContact O-SG 3.23Å; I164-C168 VanDerWaalsContact O-SG 3.35Å; I164-F192 HydrophobicContact CD1-CD2 4.5Å; I164-F192 HydrophobicContact CD1-CE2 4.01Å; I164-F192 HydrophobicContact CG1-CD2 4.05Å; I164-F192 HydrophobicContact CG1-CE2 4Å |
| 165 | A | 88.5 | Confident | 83.3 | Confident | 11 Ų | 11 | 56.3 Ų | 56.3 | 9% | 0.091 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.6 | -47.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A161 G162 N163 L167 C168 I169 L434 F444 | A161-A165 VanDerWaalsContact O-CB 3.26Å; A161-A165 WeakPolarHBondContact O-CB 3.2Å; A161-A165 PolarHBondContact O-N 3.09Å; G162-A165 PolarHBondContact O-N 3.45Å; N163-A165 VanDerWaalsContact C-N 3.34Å; N163-A165 PolarHBondContact O-N 2.79Å; A165-L167 VanDerWaalsContact C-N 3.32Å; A165-L167 PolarHBondContact O-N 3.07Å; A165-C168 PolarHBondContact O-N 2.88Å; A165-I169 WeakPolarHBondContact O-CD1 3.4Å; A165-I169 WeakPolarHBondContact O-CG1 3.47Å; A165-I169 PolarHBondContact O-N 3.42Å; A165-L434 HydrophobicContact CB-CD1 4.36Å; A165-F444 HydrophobicContact CB-CD2 3.68Å; A165-F444 HydrophobicContact CB-CE2 3.63Å |
| 166 | I | 87.6 | Confident | 81.3 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.4 | -44.4 | 176.1 | -64.2 | -68.8 | 0 | 0 | 0 | 111.1 | G162 N163 I164 I169 V170 A188 P430 L433 L434 L440 | G162-I166 WeakPolarHBondContact O-CG1 3.18Å; G162-I166 PolarHBondContact O-N 3.48Å; G162-I166 VanDerWaalsContact O-N 3.09Å; N163-I166 PolarHBondContact O-N 3.09Å; I164-I166 PolarHBondContact O-N 2.7Å; I166-I169 PolarHBondContact O-N 3.06Å; I166-V170 WeakPolarHBondContact O-CG2 3.41Å; I166-V170 PolarHBondContact O-N 3.19Å; I166-V170 VanDerWaalsContact O-N 3.12Å; I166-A188 HydrophobicContact CB-CB 3.9Å; I166-A188 HydrophobicContact CG2-CB 3.64Å; I166-P430 HydrophobicContact CG1-CB 3.8Å; I166-L433 HydrophobicContact CD1-CB 3.74Å; I166-L433 HydrophobicContact CD1-CD1 4.17Å; I166-L434 HydrophobicContact CD1-CD2 3.76Å; I166-L434 HydrophobicContact CD1-CG 3.97Å; I166-L440 HydrophobicContact CD1-CD2 3.43Å; I166-L440 VanDerWaalsContact CD1-CD2 3.43Å; I166-L440 HydrophobicContact CD1-CG 4.4Å |
| 167 | L | 87.7 | Confident | 79.6 | Confident | 39 Ų | 39 | 60.3 Ų | 60.3 | 20% | 0.204 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.4 | -48.5 | 178.5 | -66.6 | 171.7 | 0 | 0 | 0 | 111.8 | N163 I164 A165 I169 V170 C171 A185 A188 V189 | N163-L167 VanDerWaalsContact O-CG 3.3Å; N163-L167 WeakPolarHBondContact O-CG 3.5Å; N163-L167 PolarHBondContact O-N 2.94Å; N163-L167 VanDerWaalsContact O-N 3.08Å; I164-L167 PolarHBondContact O-N 3.33Å; I164-L167 VanDerWaalsContact O-N 3.17Å; A165-L167 VanDerWaalsContact C-N 3.32Å; A165-L167 PolarHBondContact O-N 3.07Å; L167-I169 VanDerWaalsContact C-N 3.34Å; L167-I169 PolarHBondContact O-N 3.36Å; L167-V170 PolarHBondContact O-N 3.5Å; L167-C171 VanDerWaalsContact O-CB 3.29Å; L167-C171 WeakPolarHBondContact O-CB 3.29Å; L167-C171 PolarHBondContact O-N 3.18Å; L167-C171 PolarHBondContact O-SG 3.25Å; L167-C171 VanDerWaalsContact O-SG 3.32Å; L167-A185 HydrophobicContact CD2-CB 4.26Å; L167-A188 HydrophobicContact CD2-CB 3.9Å; L167-A188 HydrophobicContact CG-CB 3.9Å; L167-V189 HydrophobicContact CD1-CG2 4.36Å; L167-V189 HydrophobicContact CD2-CG2 3.54Å |
| 168 | C | 84.6 | Confident | 78.6 | Confident | 60 Ų | 60 | 55.6 Ų | 55.6 | 41% | 0.405 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -55.8 | -46.8 | 176.9 | -69.8 | 0 | 0 | 0 | 0 | 111.9 | I164 A165 V170 C171 Q172 | I164-C168 PolarHBondContact O-N 3.49Å; I164-C168 PolarHBondContact O-SG 3.23Å; I164-C168 VanDerWaalsContact O-SG 3.35Å; A165-C168 PolarHBondContact O-N 2.88Å; C168-V170 PolarHBondContact O-N 3.39Å; C168-C171 PolarHBondContact O-N 2.9Å; C168-Q172 WeakPolarHBondContact O-CB 3.29Å; C168-Q172 PolarHBondContact O-N 3.27Å |
| 169 | I | 81.4 | Confident | 77.9 | Confident | 14 Ų | 14 | 53.4 Ų | 53.4 | 7% | 0.072 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.5 | -42.3 | -177.9 | -63.9 | 156.8 | 0 | 0 | 0 | 111.6 | A165 I166 L167 N173 L434 L440 A443 F444 | A165-I169 WeakPolarHBondContact O-CD1 3.4Å; A165-I169 WeakPolarHBondContact O-CG1 3.47Å; A165-I169 PolarHBondContact O-N 3.42Å; I166-I169 PolarHBondContact O-N 3.06Å; L167-I169 VanDerWaalsContact C-N 3.34Å; L167-I169 PolarHBondContact O-N 3.36Å; I169-N173 PolarHBondContact O-N 2.95Å; I169-L434 HydrophobicContact CD1-CD2 3.85Å; I169-L440 HydrophobicContact CB-CD1 4.48Å; I169-L440 HydrophobicContact CD1-CG 4.38Å; I169-L440 HydrophobicContact CG2-CD1 3.53Å; I169-L440 HydrophobicContact CG2-CG 3.91Å; I169-A443 HydrophobicContact CG1-CB 4.4Å; I169-A443 HydrophobicContact CG2-CB 3.79Å; I169-F444 HydrophobicContact CD1-CB 3.81Å; I169-F444 HydrophobicContact CD1-CD2 4.46Å |
| 170 | V | 78.9 | Confident | 77.1 | Confident | 13 Ų | 13 | 53.6 Ų | 53.6 | 8% | 0.079 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -74.6 | -33 | 179.2 | 179.3 | 0 | 0 | 0 | 0 | 112 | I166 L167 C168 A185 | I166-V170 WeakPolarHBondContact O-CG2 3.41Å; I166-V170 PolarHBondContact O-N 3.19Å; I166-V170 VanDerWaalsContact O-N 3.12Å; L167-V170 PolarHBondContact O-N 3.5Å; C168-V170 PolarHBondContact O-N 3.39Å; V170-A185 HydrophobicContact CB-CB 4.22Å; V170-A185 HydrophobicContact CG1-CB 3.93Å; V170-A185 HydrophobicContact CG2-CB 4.44Å |
| 171 | C | 76.6 | Confident | 76.4 | Confident | 99 Ų | 99 | 53 Ų | 53 | 67% | 0.669 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -69.9 | -44.4 | 174.8 | -74.8 | 0 | 0 | 0 | 0 | 112.5 | L167 C168 | L167-C171 VanDerWaalsContact O-CB 3.29Å; L167-C171 WeakPolarHBondContact O-CB 3.29Å; L167-C171 PolarHBondContact O-N 3.18Å; L167-C171 PolarHBondContact O-SG 3.25Å; L167-C171 VanDerWaalsContact O-SG 3.32Å; C168-C171 PolarHBondContact O-N 2.9Å |
| 172 | Q | 72.6 | Confident | 76 | Confident | 150 Ų | 150 | 51.2 Ų | 51.2 | 70% | 0.701 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -72.7 | -36.1 | -174.7 | -173.9 | 172.8 | -5.6 | 0 | 0 | 112.6 | C168 Y174 | C168-Q172 WeakPolarHBondContact O-CB 3.29Å; C168-Q172 PolarHBondContact O-N 3.27Å; Q172-Y174 PolarHBondContact O-N 3.42Å |
| 173 | N | 66.4 | Low | 75.9 | Confident | 62 Ų | 62 | 51.2 Ų | 51.2 | 33% | 0.332 | 26% | 0.258 | S | S | . | . | trans | -92.8 | 88.9 | -176.6 | -166.5 | -30.3 | 0 | 0 | 0 | 112.2 | I169 Y175 M176 | I169-N173 PolarHBondContact O-N 2.95Å; N173-Y175 PolarHBondContact O-N 3.01Å; N173-Y175 PolarHBondContact OD1-N 2.82Å; N173-M176 HydrophobicContact CB-CB 3.95Å; N173-M176 HydrophobicContact CB-CG 4.03Å; N173-M176 WeakPolarHBondContact ND2-CG 3.5Å; N173-M176 WeakPolarHBondContact O-CB 3.4Å; N173-M176 PolarHBondContact O-N 3.26Å; N173-M176 WeakPolarHBondContact OD1-CG 3.21Å; N173-M176 PolarHBondContact OD1-N 3.48Å | ||
| 174 | Y | 51.7 | Low | 75.6 | Confident | 126 Ų | 126 | 51.6 Ų | 51.6 | 49% | 0.494 | 26% | 0.26 | S | S | . | . | G | 310 helix | trans | -52.2 | -37.8 | 178.7 | -172.2 | -91.2 | 0 | 0 | 0 | 113.9 | Q172 M176 K177 C496 | Q172-Y174 PolarHBondContact O-N 3.42Å; Y174-M176 VanDerWaalsContact C-N 3.28Å; Y174-M176 PolarHBondContact O-N 3.5Å; Y174-K177 PolarHBondContact O-N 3.33Å; Y174-C496 HydrophobicContact CE2-CB 4.07Å |
| 175 | Y | 46.8 | Very low | 75.5 | Confident | 164 Ų | 164 | 48.8 Ų | 48.8 | 64% | 0.643 | 25% | 0.249 | S | C | * | . | G | 310 helix | trans | -74.5 | -16.3 | 179.7 | -76.7 | -96.4 | 0 | 0 | 0 | 113.4 | N173 K177 | N173-Y175 PolarHBondContact O-N 3.01Å; N173-Y175 PolarHBondContact OD1-N 2.82Å; Y175-K177 VanDerWaalsContact C-N 3.35Å |
| 176 | M | 53.3 | Low | 75.6 | Confident | 45 Ų | 45 | 48.8 Ų | 48.8 | 22% | 0.222 | 25% | 0.247 | C | C | . | . | G | 310 helix | trans | -89.5 | 10.6 | 177.3 | -73.5 | -77 | -86.4 | 0 | 0 | 113.7 | N173 Y174 S178 N181 P439 L440 | N173-M176 HydrophobicContact CB-CB 3.95Å; N173-M176 HydrophobicContact CB-CG 4.03Å; N173-M176 WeakPolarHBondContact ND2-CG 3.5Å; N173-M176 WeakPolarHBondContact O-CB 3.4Å; N173-M176 PolarHBondContact O-N 3.26Å; N173-M176 WeakPolarHBondContact OD1-CG 3.21Å; N173-M176 PolarHBondContact OD1-N 3.48Å; Y174-M176 VanDerWaalsContact C-N 3.28Å; Y174-M176 PolarHBondContact O-N 3.5Å; M176-S178 PolarHBondContact O-N 3.46Å; M176-N181 WeakPolarHBondContact O-CB 3.43Å; M176-N181 PolarHBondContact O-ND2 2.87Å; M176-P439 HydrophobicContact CE-CB 4.19Å; M176-P439 HydrophobicContact CE-CG 4.42Å; M176-L440 HydrophobicContact CE-CD1 4.41Å |
| 177 | K | 58.4 | Low | 75.7 | Confident | 117 Ų | 117 | 49 Ų | 49 | 51% | 0.509 | 25% | 0.248 | S | C | . | . | trans | -73.3 | 48.6 | 175.4 | -68.4 | 178.5 | 178.4 | 174.6 | 0 | 113.8 | Y174 Y175 | Y174-K177 PolarHBondContact O-N 3.33Å; Y175-K177 VanDerWaalsContact C-N 3.35Å | ||
| 178 | S | 71.6 | Confident | 75.9 | Confident | 24 Ų | 24 | 47.2 Ų | 47.2 | 17% | 0.168 | 24% | 0.239 | C | C | . | . | trans | -72.7 | 151.2 | 167.7 | -179.7 | 0 | 0 | 0 | 0 | 110.8 | M176 S180 N181 S182 | M176-S178 PolarHBondContact O-N 3.46Å; S178-S180 VanDerWaalsContact C-N 3.29Å; S178-S180 PolarHBondContact O-N 3.36Å; S178-N181 WeakPolarHBondContact O-CA 3.33Å; S178-N181 PolarHBondContact O-N 3.3Å; S178-S182 PolarHBondContact O-N 3.14Å; S178-S182 PolarHBondContact O-OG 3.04Å | ||
| 179 | I | 77.4 | Confident | 76.3 | Confident | 23 Ų | 23 | 47 Ų | 47 | 12% | 0.118 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -49.1 | -48.5 | 178.4 | -58.6 | 162 | 0 | 0 | 0 | 111.3 | N181 S182 L183 D242 E258 | I179-N181 VanDerWaalsContact C-N 3.34Å; I179-N181 PolarHBondContact O-N 3.32Å; I179-S182 PolarHBondContact O-N 3.41Å; I179-L183 HydrophobicContact CG2-CD1 4.13Å; I179-L183 WeakPolarHBondContact O-CG 3.22Å; I179-L183 PolarHBondContact O-N 2.92Å; I179-D242 HydrophobicContact CG2-CB 4.42Å; I179-E258 HydrophobicContact CD1-CB 4.21Å; I179-E258 WeakPolarHBondContact CD1-OE2 3.31Å; I179-E258 HydrophobicContact CG1-CB 4.49Å |
| 180 | S | 76.9 | Confident | 77 | Confident | 4 Ų | 4 | 47 Ų | 47 | 3% | 0.028 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60 | -39.5 | 175.9 | -84.9 | 0 | 0 | 0 | 0 | 113.1 | S178 L183 L184 D242 R243 | S178-S180 VanDerWaalsContact C-N 3.29Å; S178-S180 PolarHBondContact O-N 3.36Å; S180-L183 CarbonylContact O-C 3.53Å; S180-L183 WeakPolarHBondContact O-CB 3.25Å; S180-L183 PolarHBondContact O-N 2.99Å; S180-L184 WeakPolarHBondContact O-CG 3.45Å; S180-L184 PolarHBondContact O-N 2.84Å; S180-D242 WeakPolarHBondContact CB-OD2 3.18Å; S180-D242 PolarHBondContact N-OD2 3.42Å; S180-D242 PolarHBondContact OG-OD2 3.33Å; S180-R243 PolarHBondContact OG-NE 2.76Å; S180-R243 PolarHBondContact OG-NH2 3.21Å; S180-R243 VanDerWaalsContact OG-NH2 3.12Å |
| 181 | N | 79.9 | Confident | 77.7 | Confident | 13 Ų | 13 | 46.3 Ų | 46.3 | 7% | 0.07 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -73.1 | -33.9 | -177.8 | -65.5 | -7.8 | 0 | 0 | 0 | 111.6 | M176 S178 I179 L183 L184 A185 | M176-N181 WeakPolarHBondContact O-CB 3.43Å; M176-N181 PolarHBondContact O-ND2 2.87Å; S178-N181 WeakPolarHBondContact O-CA 3.33Å; S178-N181 PolarHBondContact O-N 3.3Å; I179-N181 VanDerWaalsContact C-N 3.34Å; I179-N181 PolarHBondContact O-N 3.32Å; N181-L183 VanDerWaalsContact C-N 3.32Å; N181-L184 PolarHBondContact O-N 3.13Å; N181-A185 PolarHBondContact O-N 2.68Å |
| 182 | S | 83.3 | Confident | 78.5 | Confident | 26 Ų | 26 | 44.2 Ų | 44.2 | 18% | 0.182 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.7 | -36.2 | 168.9 | -57.5 | 0 | 0 | 0 | 0 | 112.2 | S178 I179 N186 | S178-S182 PolarHBondContact O-N 3.14Å; S178-S182 PolarHBondContact O-OG 3.04Å; I179-S182 PolarHBondContact O-N 3.41Å; S182-N186 WeakPolarHBondContact O-CB 3.31Å; S182-N186 PolarHBondContact O-N 3.08Å |
| 183 | L | 86.9 | Confident | 79.4 | Confident | 8 Ų | 8 | 39.2 Ų | 39.2 | 4% | 0.042 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -70.4 | -34.9 | 172.7 | -69.3 | 168.8 | 0 | 0 | 0 | 112.2 | I179 S180 N181 N186 L187 T235 A238 L239 L267 I270 | I179-L183 HydrophobicContact CG2-CD1 4.13Å; I179-L183 WeakPolarHBondContact O-CG 3.22Å; I179-L183 PolarHBondContact O-N 2.92Å; S180-L183 CarbonylContact O-C 3.53Å; S180-L183 WeakPolarHBondContact O-CB 3.25Å; S180-L183 PolarHBondContact O-N 2.99Å; N181-L183 VanDerWaalsContact C-N 3.32Å; L183-N186 WeakPolarHBondContact O-CB 3.38Å; L183-N186 PolarHBondContact O-N 3.32Å; L183-L187 PolarHBondContact O-N 3.47Å; L183-T235 HydrophobicContact CB-CG2 3.83Å; L183-T235 HydrophobicContact CD2-CG2 4.05Å; L183-T235 VanDerWaalsContact O-CG2 3.24Å; L183-T235 WeakPolarHBondContact O-CG2 3.38Å; L183-A238 HydrophobicContact CD1-CB 3.78Å; L183-A238 HydrophobicContact CD2-CB 3.96Å; L183-L239 HydrophobicContact CB-CD2 3.78Å; L183-L239 HydrophobicContact CB-CG 3.99Å; L183-L239 HydrophobicContact CD1-CD2 4.06Å; L183-L239 HydrophobicContact CD1-CG 4.13Å; L183-L267 HydrophobicContact CD2-CD2 4.04Å; L183-I270 HydrophobicContact CD2-CD1 3.6Å |
| 184 | L | 86.7 | Confident | 80.7 | Confident | 10 Ų | 10 | 36.3 Ų | 36.3 | 5% | 0.052 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -68.6 | -39.7 | 172.4 | -66.9 | -178.5 | 0 | 0 | 0 | 112.2 | S180 N181 N186 L187 A188 L239 L381 L433 | S180-L184 WeakPolarHBondContact O-CG 3.45Å; S180-L184 PolarHBondContact O-N 2.84Å; N181-L184 PolarHBondContact O-N 3.13Å; L184-N186 VanDerWaalsContact C-N 3.29Å; L184-N186 PolarHBondContact O-N 3.12Å; L184-L187 HydrophobicContact CD2-CD1 4.27Å; L184-L187 PolarHBondContact O-N 2.88Å; L184-A188 PolarHBondContact O-N 3.32Å; L184-A188 VanDerWaalsContact O-N 3.07Å; L184-L239 HydrophobicContact CD2-CD1 4.03Å; L184-L239 HydrophobicContact CD2-CD2 4.43Å; L184-L381 HydrophobicContact CD2-CD1 3.92Å; L184-L433 HydrophobicContact CB-CD1 4.42Å; L184-L433 HydrophobicContact CD1-CD2 3.97Å; L184-L433 HydrophobicContact CD2-CD1 3.95Å; L184-L433 HydrophobicContact CD2-CD2 3.69Å; L184-L433 HydrophobicContact CD2-CG 4.49Å; L184-L433 HydrophobicContact CG-CD2 4.43Å |
| 185 | A | 87.6 | Confident | 82.7 | Confident | 17 Ų | 17 | 30.3 Ų | 30.3 | 14% | 0.14 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -63.3 | -36.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L167 V170 N181 L187 A188 V189 | L167-A185 HydrophobicContact CD2-CB 4.26Å; V170-A185 HydrophobicContact CB-CB 4.22Å; V170-A185 HydrophobicContact CG1-CB 3.93Å; V170-A185 HydrophobicContact CG2-CB 4.44Å; N181-A185 PolarHBondContact O-N 2.68Å; A185-L187 PolarHBondContact O-N 3.35Å; A185-A188 PolarHBondContact O-N 2.88Å; A185-A188 VanDerWaalsContact O-N 3.14Å; A185-V189 WeakPolarHBondContact O-CG2 3.35Å; A185-V189 PolarHBondContact O-N 3.17Å |
| 186 | N | 91 | Very high | 84.9 | Confident | 10 Ų | 10 | 27 Ų | 27 | 5% | 0.053 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.2 | -43.7 | 173.9 | -172.7 | 68.4 | 0 | 0 | 0 | 112.8 | S182 L183 L184 W190 T235 L267 W271 | S182-N186 WeakPolarHBondContact O-CB 3.31Å; S182-N186 PolarHBondContact O-N 3.08Å; L183-N186 WeakPolarHBondContact O-CB 3.38Å; L183-N186 PolarHBondContact O-N 3.32Å; L184-N186 VanDerWaalsContact C-N 3.29Å; L184-N186 PolarHBondContact O-N 3.12Å; N186-W190 PolarHBondContact O-N 2.81Å; N186-T235 PolarHBondContact ND2-OG1 3.37Å; N186-L267 HydrophobicContact CB-CD2 3.69Å; N186-W271 PolarHBondContact OD1-NE1 2.69Å |
| 187 | L | 90.6 | Very high | 86.6 | Confident | 5 Ų | 5 | 29.9 Ų | 29.9 | 3% | 0.026 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -59.9 | -47 | 171.8 | -68.8 | 171.4 | 0 | 0 | 0 | 110.9 | L183 L184 A185 V189 W190 D191 T232 T235 L239 | L183-L187 PolarHBondContact O-N 3.47Å; L184-L187 HydrophobicContact CD2-CD1 4.27Å; L184-L187 PolarHBondContact O-N 2.88Å; A185-L187 PolarHBondContact O-N 3.35Å; L187-V189 PolarHBondContact O-N 2.78Å; L187-W190 PolarHBondContact O-N 3.48Å; L187-D191 WeakPolarHBondContact O-CB 3.22Å; L187-D191 PolarHBondContact O-N 2.82Å; L187-T232 HydrophobicContact CD2-CG2 3.93Å; L187-T235 HydrophobicContact CD1-CG2 4.18Å; L187-T235 HydrophobicContact CD2-CG2 4Å; L187-T235 HydrophobicContact CG-CG2 3.74Å; L187-L239 HydrophobicContact CD1-CD1 4.36Å |
| 188 | A | 92.4 | Very high | 88.1 | Confident | 2 Ų | 2 | 24.6 Ų | 24.6 | 2% | 0.017 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -66.2 | -35.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | N163 I166 L167 L184 A185 F192 | N163-A188 HydrophobicContact CB-CB 4.35Å; N163-A188 WeakPolarHBondContact OD1-CA 3.2Å; I166-A188 HydrophobicContact CB-CB 3.9Å; I166-A188 HydrophobicContact CG2-CB 3.64Å; L167-A188 HydrophobicContact CD2-CB 3.9Å; L167-A188 HydrophobicContact CG-CB 3.9Å; L184-A188 PolarHBondContact O-N 3.32Å; L184-A188 VanDerWaalsContact O-N 3.07Å; A185-A188 PolarHBondContact O-N 2.88Å; A185-A188 VanDerWaalsContact O-N 3.14Å; A188-F192 WeakPolarHBondContact O-CB 3.45Å; A188-F192 PolarHBondContact O-N 3.47Å |
| 189 | V | 92.9 | Very high | 89 | Confident | 55 Ų | 55 | 23.7 Ų | 23.7 | 33% | 0.333 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -61.6 | -48 | 170.9 | 173.4 | 0 | 0 | 0 | 0 | 110.2 | L167 A185 L187 V193 W271 | L167-V189 HydrophobicContact CD1-CG2 4.36Å; L167-V189 HydrophobicContact CD2-CG2 3.54Å; A185-V189 WeakPolarHBondContact O-CG2 3.35Å; A185-V189 PolarHBondContact O-N 3.17Å; L187-V189 PolarHBondContact O-N 2.78Å; V189-V193 WeakPolarHBondContact O-CG2 3.44Å; V189-V193 PolarHBondContact O-N 3.06Å; V189-V193 VanDerWaalsContact O-N 3.08Å; V189-W271 HydrophobicContact CG1-CH2 4.47Å; V189-W271 HydrophobicContact CG1-CZ2 4.29Å |
| 190 | W | 94.2 | Very high | 89.5 | Confident | 13 Ų | 13 | 25.3 Ų | 25.3 | 5% | 0.049 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -71.6 | -44.6 | -174.8 | -168.4 | -79.3 | 0 | 0 | 0 | 112.5 | N186 L187 F192 V193 L194 V224 A227 S228 V231 W271 L275 | N186-W190 PolarHBondContact O-N 2.81Å; L187-W190 PolarHBondContact O-N 3.48Å; W190-F192 VanDerWaalsContact C-N 3.3Å; W190-F192 PolarHBondContact O-N 3.43Å; W190-V193 PolarHBondContact O-N 2.9Å; W190-V193 VanDerWaalsContact O-N 3.15Å; W190-L194 WeakPolarHBondContact O-CG 3.11Å; W190-L194 PolarHBondContact O-N 3.31Å; W190-V224 HydrophobicContact CZ2-CG1 4.23Å; W190-A227 HydrophobicContact CH2-CB 3.89Å; W190-A227 HydrophobicContact CZ2-CB 3.61Å; W190-S228 VanDerWaalsContact NE1-CA 3.27Å; W190-V231 HydrophobicContact CB-CG1 4.04Å; W190-V231 HydrophobicContact CD2-CB 4.09Å; W190-V231 HydrophobicContact CD2-CG1 4.11Å; W190-V231 HydrophobicContact CD2-CG2 3.85Å; W190-V231 HydrophobicContact CE3-CB 4.44Å; W190-V231 HydrophobicContact CE3-CG1 4.36Å; W190-V231 HydrophobicContact CE3-CG2 3.79Å; W190-V231 HydrophobicContact CG-CB 4.19Å; W190-V231 HydrophobicContact CG-CG1 3.93Å; W190-V231 HydrophobicContact CG-CG2 4.47Å; W190-V231 HydrophobicContact CH2-CG2 4.29Å; W190-V231 HydrophobicContact CZ2-CG2 4.37Å; W190-V231 HydrophobicContact CZ3-CG2 4.01Å; W190-W271 HydrophobicContact CE3-CE3 4.48Å; W190-W271 AromaticContact CE3-CH2 3.98Å; W190-W271 HydrophobicContact CE3-CH2 3.98Å; W190-W271 HydrophobicContact CE3-CZ2 4.06Å; W190-W271 HydrophobicContact CE3-CZ3 4.19Å; W190-W271 HydrophobicContact CZ3-CD2 4.46Å; W190-W271 HydrophobicContact CZ3-CE3 4.05Å; W190-W271 HydrophobicContact CZ3-CH2 4.15Å; W190-W271 AromaticContact CZ3-CZ3 3.89Å; W190-W271 HydrophobicContact CZ3-CZ3 3.89Å; W190-L275 HydrophobicContact CH2-CD2 3.99Å |
| 191 | D | 94 | Very high | 90 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -68.1 | -28.3 | 177 | -76.8 | -14.9 | 0 | 0 | 0 | 112.1 | L187 L194 I195 R425 A426 | L187-D191 WeakPolarHBondContact O-CB 3.22Å; L187-D191 PolarHBondContact O-N 2.82Å; D191-L194 WeakPolarHBondContact OD1-CD1 3.3Å; D191-I195 WeakPolarHBondContact O-CB 3.43Å; D191-I195 WeakPolarHBondContact O-CG1 3.33Å; D191-I195 PolarHBondContact O-N 3.25Å; D191-R425 IonicContact OD1-CZ 2.61Å; D191-R425 IonicContact OD1-NH1 3.51Å; D191-R425 PolarHBondContact OD1-NH1 3.39Å; D191-R425 IonicContact OD1-NH2 3.79Å; D191-R425 PolarHBondContact OD1-NH2 3.36Å; D191-R425 IonicContact OD2-CZ 2.94Å; D191-R425 IonicContact OD2-NH1 3.31Å; D191-R425 PolarHBondContact OD2-NH1 3.04Å; D191-R425 IonicContact OD2-NH2 2.72Å; D191-A426 HydrophobicContact CB-CB 3.82Å |
| 192 | F | 93.6 | Very high | 90.2 | Very high | 54 Ų | 54 | 27.8 Ų | 27.8 | 24% | 0.237 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63.6 | -48.4 | 165.9 | 172.6 | -95.2 | 0 | 0 | 0 | 112.1 | I160 N163 I164 A188 W190 L194 I195 F196 | I160-F192 HydrophobicContact CD1-CD2 3.72Å; I160-F192 HydrophobicContact CD1-CE2 3.67Å; I160-F192 HydrophobicContact CG2-CE2 4.37Å; N163-F192 HydrophobicContact CB-CB 4Å; I164-F192 HydrophobicContact CD1-CD2 4.5Å; I164-F192 HydrophobicContact CD1-CE2 4.01Å; I164-F192 HydrophobicContact CG1-CD2 4.05Å; I164-F192 HydrophobicContact CG1-CE2 4Å; A188-F192 WeakPolarHBondContact O-CB 3.45Å; A188-F192 PolarHBondContact O-N 3.47Å; W190-F192 VanDerWaalsContact C-N 3.3Å; W190-F192 PolarHBondContact O-N 3.43Å; F192-L194 VanDerWaalsContact C-N 3.32Å; F192-L194 PolarHBondContact O-N 2.77Å; F192-I195 PolarHBondContact O-N 2.94Å; F192-F196 HydrophobicContact CE1-CB 4.31Å; F192-F196 HydrophobicContact CE1-CG 4.5Å; F192-F196 HydrophobicContact CE2-CB 4.43Å; F192-F196 HydrophobicContact CE2-CD2 4.48Å; F192-F196 HydrophobicContact CZ-CB 4.18Å; F192-F196 HydrophobicContact CZ-CD2 4.18Å; F192-F196 HydrophobicContact CZ-CG 4.14Å; F192-F196 VanDerWaalsContact O-CB 3.25Å; F192-F196 WeakPolarHBondContact O-CB 3.34Å; F192-F196 PolarHBondContact O-N 3.09Å |
| 193 | V | 92.4 | Very high | 90.3 | Very high | 46 Ų | 46 | 27.7 Ų | 27.7 | 28% | 0.279 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -59.4 | -42.1 | 179.8 | 166.3 | 0 | 0 | 0 | 0 | 111.4 | V189 W190 F197 | V189-V193 WeakPolarHBondContact O-CG2 3.44Å; V189-V193 PolarHBondContact O-N 3.06Å; V189-V193 VanDerWaalsContact O-N 3.08Å; W190-V193 PolarHBondContact O-N 2.9Å; W190-V193 VanDerWaalsContact O-N 3.15Å; V193-F197 HydrophobicContact CG1-CD2 4.06Å; V193-F197 WeakPolarHBondContact O-CB 3.5Å; V193-F197 WeakPolarHBondContact O-CD2 3.25Å; V193-F197 PolarHBondContact O-N 3.42Å |
| 194 | L | 92.6 | Very high | 90.1 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | I | π-helix | trans | -60.8 | -49.4 | 175.6 | -70.2 | 167.2 | 0 | 0 | 0 | 112.8 | W190 D191 F192 C198 L199 V224 S228 | W190-L194 WeakPolarHBondContact O-CG 3.11Å; W190-L194 PolarHBondContact O-N 3.31Å; D191-L194 WeakPolarHBondContact OD1-CD1 3.3Å; F192-L194 VanDerWaalsContact C-N 3.32Å; F192-L194 PolarHBondContact O-N 2.77Å; L194-C198 WeakPolarHBondContact O-CA 3.35Å; L194-C198 VanDerWaalsContact O-CB 3.29Å; L194-C198 WeakPolarHBondContact O-CB 3.36Å; L194-C198 PolarHBondContact O-N 3.41Å; L194-L199 PolarHBondContact O-N 3.1Å; L194-L199 VanDerWaalsContact O-N 3.07Å; L194-V224 HydrophobicContact CD2-CG1 3.7Å; L194-S228 WeakPolarHBondContact CD1-OG 3.41Å |
| 195 | I | 93.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 16% | 0.163 | C | C | . | . | I | π-helix | trans | -74.9 | -30.8 | -174.4 | -65.8 | -178.5 | 0 | 0 | 0 | 111 | F156 I160 D191 F192 L199 P200 A426 A427 | F156-I195 HydrophobicContact CB-CG2 4.46Å; F156-I195 HydrophobicContact CD2-CG2 3.97Å; F156-I195 VanDerWaalsContact CD2-O 3.24Å; F156-I195 WeakPolarHBondContact CD2-O 3.28Å; F156-I195 VanDerWaalsContact CE2-O 3.3Å; F156-I195 WeakPolarHBondContact CE2-O 3.41Å; F156-I195 HydrophobicContact CG-CG2 4.43Å; I160-I195 HydrophobicContact CD1-CB 4.39Å; I160-I195 HydrophobicContact CD1-CG2 4Å; I160-I195 HydrophobicContact CG1-CG2 3.94Å; D191-I195 WeakPolarHBondContact O-CB 3.43Å; D191-I195 WeakPolarHBondContact O-CG1 3.33Å; D191-I195 PolarHBondContact O-N 3.25Å; F192-I195 PolarHBondContact O-N 2.94Å; I195-L199 HydrophobicContact CG2-CD2 4.13Å; I195-P200 WeakPolarHBondContact O-CD 3.5Å; I195-A426 HydrophobicContact CD1-CB 3.69Å; I195-A426 HydrophobicContact CG1-CB 3.96Å; I195-A427 HydrophobicContact CD1-CB 4.01Å |
| 196 | F | 92.9 | Very high | 89.3 | Confident | 96 Ų | 96 | 32.9 Ų | 32.9 | 42% | 0.421 | 17% | 0.165 | S | C | . | . | I | π-helix | trans | -77.1 | -42.1 | 177.7 | -170.1 | -97.4 | 0 | 0 | 0 | 113.2 | F156 I160 F192 P200 | F156-F196 HydrophobicContact CZ-CD2 4.45Å; I160-F196 HydrophobicContact CD1-CB 3.9Å; I160-F196 HydrophobicContact CD1-CD2 4.09Å; F192-F196 HydrophobicContact CE1-CB 4.31Å; F192-F196 HydrophobicContact CE1-CG 4.5Å; F192-F196 HydrophobicContact CE2-CB 4.43Å; F192-F196 HydrophobicContact CE2-CD2 4.48Å; F192-F196 HydrophobicContact CZ-CB 4.18Å; F192-F196 HydrophobicContact CZ-CD2 4.18Å; F192-F196 HydrophobicContact CZ-CG 4.14Å; F192-F196 VanDerWaalsContact O-CB 3.25Å; F192-F196 WeakPolarHBondContact O-CB 3.34Å; F192-F196 PolarHBondContact O-N 3.09Å; F196-P200 WeakPolarHBondContact O-CG 3.17Å |
| 197 | F | 90 | Very high | 88.5 | Confident | 104 Ų | 104 | 35.4 Ų | 35.4 | 46% | 0.456 | 18% | 0.178 | S | C | . | . | I | π-helix | trans | -101.9 | -49.8 | -175.4 | -65.1 | -74.4 | 0 | 0 | 0 | 113.9 | V193 M201 | V193-F197 HydrophobicContact CG1-CD2 4.06Å; V193-F197 WeakPolarHBondContact O-CB 3.5Å; V193-F197 WeakPolarHBondContact O-CD2 3.25Å; V193-F197 PolarHBondContact O-N 3.42Å; F197-M201 VanDerWaalsContact O-CG 3.26Å; F197-M201 WeakPolarHBondContact O-CG 3.24Å |
| 198 | C | 89.8 | Confident | 87.7 | Confident | 7 Ų | 7 | 38.5 Ų | 38.5 | 5% | 0.047 | 20% | 0.197 | C | C | . | . | I | π-helix | trans | -77.7 | -43.8 | -170.9 | -58 | 0 | 0 | 0 | 0 | 112.5 | L194 M201 V202 V224 F423 | L194-C198 WeakPolarHBondContact O-CA 3.35Å; L194-C198 VanDerWaalsContact O-CB 3.29Å; L194-C198 WeakPolarHBondContact O-CB 3.36Å; L194-C198 PolarHBondContact O-N 3.41Å; C198-M201 PolarHBondContact O-N 3Å; C198-M201 VanDerWaalsContact O-N 3.15Å; C198-V202 WeakPolarHBondContact O-CG2 3.32Å; C198-V202 PolarHBondContact O-N 3.46Å; C198-V224 VanDerWaalsContact SG-CG1 3.6Å; C198-F423 HydrophobicContact CB-CE1 3.98Å; C198-F423 HydrophobicContact CB-CZ 4.21Å |
| 199 | L | 90 | Very high | 86.6 | Confident | 5 Ų | 5 | 44.1 Ų | 44.1 | 3% | 0.026 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.6 | -46.9 | -178.2 | 175.7 | 63.9 | 0 | 0 | 0 | 112.8 | I155 F156 L194 I195 M201 V202 V203 F423 | I155-L199 HydrophobicContact CB-CD2 4.34Å; I155-L199 HydrophobicContact CG2-CD2 3.91Å; F156-L199 HydrophobicContact CB-CD2 3.99Å; F156-L199 HydrophobicContact CD2-CD2 4.38Å; L194-L199 PolarHBondContact O-N 3.1Å; L194-L199 VanDerWaalsContact O-N 3.07Å; I195-L199 HydrophobicContact CG2-CD2 4.13Å; L199-M201 VanDerWaalsContact C-N 3.33Å; L199-M201 PolarHBondContact O-N 3.01Å; L199-V202 PolarHBondContact O-N 2.81Å; L199-V203 HydrophobicContact CD1-CG2 3.95Å; L199-V203 WeakPolarHBondContact O-CB 3.4Å; L199-V203 VanDerWaalsContact O-CG2 3.28Å; L199-V203 WeakPolarHBondContact O-CG2 3.49Å; L199-V203 PolarHBondContact O-N 3.36Å; L199-F423 HydrophobicContact CB-CD1 3.86Å; L199-F423 HydrophobicContact CB-CE1 3.88Å; L199-F423 HydrophobicContact CB-CG 4.25Å; L199-F423 HydrophobicContact CB-CZ 4.27Å; L199-F423 HydrophobicContact CD1-CB 4.18Å; L199-F423 HydrophobicContact CD1-CD1 4.27Å; L199-F423 HydrophobicContact CD1-CD2 3.63Å; L199-F423 HydrophobicContact CD1-CE2 4.04Å; L199-F423 HydrophobicContact CD1-CG 3.77Å; L199-F423 HydrophobicContact CG-CG 4.46Å |
| 200 | P | 89 | Confident | 85.3 | Confident | 56 Ų | 56 | 43.5 Ų | 43.5 | 36% | 0.364 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -64.4 | -33.8 | 175.6 | -24.3 | 36.5 | 0 | 0 | 0 | 113.7 | F156 I195 F196 F204 | F156-P200 HydrophobicContact CD2-CG 4.29Å; F156-P200 HydrophobicContact CE2-CG 3.96Å; I195-P200 WeakPolarHBondContact O-CD 3.5Å; F196-P200 WeakPolarHBondContact O-CG 3.17Å; P200-F204 VanDerWaalsContact O-CB 3.3Å; P200-F204 WeakPolarHBondContact O-CB 3.29Å; P200-F204 PolarHBondContact O-N 2.89Å |
| 201 | M | 85.8 | Confident | 84.1 | Confident | 56 Ų | 56 | 44.9 Ų | 44.9 | 28% | 0.276 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -68.4 | -43.3 | 176.9 | -70.2 | 177.4 | -173 | 0 | 0 | 112 | F197 C198 L199 F204 H205 T217 V221 | F197-M201 VanDerWaalsContact O-CG 3.26Å; F197-M201 WeakPolarHBondContact O-CG 3.24Å; C198-M201 PolarHBondContact O-N 3Å; C198-M201 VanDerWaalsContact O-N 3.15Å; L199-M201 VanDerWaalsContact C-N 3.33Å; L199-M201 PolarHBondContact O-N 3.01Å; M201-F204 PolarHBondContact O-N 3.3Å; M201-H205 PolarHBondContact O-N 3.28Å; M201-T217 HydrophobicContact CG-CG2 4.33Å; M201-T217 HydrophobicContact SD-CG2 3.76Å; M201-V221 HydrophobicContact CB-CG2 4.25Å; M201-V221 HydrophobicContact SD-CG2 4.24Å |
| 202 | V | 84.1 | Confident | 82.7 | Confident | 14 Ų | 14 | 49.9 Ų | 49.9 | 9% | 0.085 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.4 | -46 | 175.7 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | C198 L199 F204 H205 E206 V221 F423 | C198-V202 WeakPolarHBondContact O-CG2 3.32Å; C198-V202 PolarHBondContact O-N 3.46Å; L199-V202 PolarHBondContact O-N 2.81Å; V202-F204 PolarHBondContact O-N 3.4Å; V202-H205 PolarHBondContact O-N 2.96Å; V202-E206 HydrophobicContact CG1-CG 4.49Å; V202-E206 WeakPolarHBondContact O-CB 3.33Å; V202-E206 PolarHBondContact O-N 3.09Å; V202-V221 HydrophobicContact CG2-CG1 3.68Å; V202-F423 HydrophobicContact CB-CE2 4.23Å; V202-F423 HydrophobicContact CB-CZ 4.39Å; V202-F423 HydrophobicContact CG1-CE2 4.28Å; V202-F423 HydrophobicContact CG2-CE2 4.18Å; V202-F423 HydrophobicContact CG2-CZ 4Å |
| 203 | V | 85.3 | Confident | 81.5 | Confident | 23 Ų | 23 | 51.6 Ų | 51.6 | 14% | 0.139 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63 | -41.3 | 177.5 | 173.5 | 0 | 0 | 0 | 0 | 111.6 | S152 L199 E206 L207 | S152-V203 WeakPolarHBondContact OG-CG2 3.41Å; L199-V203 HydrophobicContact CD1-CG2 3.95Å; L199-V203 WeakPolarHBondContact O-CB 3.4Å; L199-V203 VanDerWaalsContact O-CG2 3.28Å; L199-V203 WeakPolarHBondContact O-CG2 3.49Å; L199-V203 PolarHBondContact O-N 3.36Å; V203-E206 PolarHBondContact O-N 3.42Å; V203-L207 HydrophobicContact CG1-CD1 3.71Å; V203-L207 HydrophobicContact CG1-CG 4.3Å; V203-L207 WeakPolarHBondContact O-CB 3.21Å; V203-L207 VanDerWaalsContact O-CG 3.24Å; V203-L207 WeakPolarHBondContact O-CG 3.44Å; V203-L207 PolarHBondContact O-N 2.98Å |
| 204 | F | 83.8 | Confident | 80.7 | Confident | 74 Ų | 74 | 50.2 Ų | 50.2 | 33% | 0.325 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62 | -44 | 175.1 | -178.7 | -86.4 | 0 | 0 | 0 | 111.8 | P200 M201 V202 L207 T208 L212 | P200-F204 VanDerWaalsContact O-CB 3.3Å; P200-F204 WeakPolarHBondContact O-CB 3.29Å; P200-F204 PolarHBondContact O-N 2.89Å; M201-F204 PolarHBondContact O-N 3.3Å; V202-F204 PolarHBondContact O-N 3.4Å; F204-L207 PolarHBondContact O-N 3.13Å; F204-T208 HydrophobicContact CE1-CG2 4.28Å; F204-T208 HydrophobicContact CZ-CG2 3.96Å; F204-T208 WeakPolarHBondContact CZ-OG1 3.4Å; F204-T208 VanDerWaalsContact O-CB 3.28Å; F204-T208 WeakPolarHBondContact O-CB 3.39Å; F204-T208 PolarHBondContact O-N 3.4Å; F204-T208 PolarHBondContact O-OG1 3.01Å; F204-L212 HydrophobicContact CD1-CB 3.83Å; F204-L212 HydrophobicContact CD1-CD1 4.21Å; F204-L212 HydrophobicContact CD1-CG 4.47Å; F204-L212 HydrophobicContact CE1-CB 3.89Å; F204-L212 HydrophobicContact CE1-CD1 3.75Å; F204-L212 HydrophobicContact CE1-CG 4.39Å; F204-L212 HydrophobicContact CE2-CD1 4.15Å; F204-L212 HydrophobicContact CZ-CD1 3.72Å |
| 205 | H | 78.8 | Confident | 79.7 | Confident | 34 Ų | 34 | 54.3 Ų | 54.3 | 16% | 0.157 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.6 | -46 | 176.8 | -178.2 | 57.7 | 0 | 0 | 0 | 111.5 | M201 V202 L207 T208 K209 S210 W211 | M201-H205 PolarHBondContact O-N 3.28Å; V202-H205 PolarHBondContact O-N 2.96Å; H205-L207 VanDerWaalsContact C-N 3.33Å; H205-L207 PolarHBondContact O-N 3.27Å; H205-T208 PolarHBondContact O-N 2.75Å; H205-K209 WeakPolarHBondContact O-CA 3.26Å; H205-K209 PolarHBondContact O-N 3.31Å; H205-S210 PolarHBondContact ND1-O 3.29Å; H205-W211 AromaticContact CD2-CH2 3.91Å; H205-W211 AromaticContact CD2-CZ2 3.74Å; H205-W211 AromaticContact CE1-CD1 3.87Å; H205-W211 AromaticContact CE1-CD2 3.92Å; H205-W211 AromaticContact CE1-CE2 3.21Å; H205-W211 AromaticContact CE1-CZ2 3.39Å; H205-W211 WeakPolarHBondContact CE1-CZ2 3.4Å; H205-W211 AromaticContact CE1-NE1 3.22Å; H205-W211 PolarHBondContact CE1-NE1 2.93Å; H205-W211 AromaticContact ND1-CD2 3.75Å; H205-W211 AromaticContact ND1-CE2 3.53Å; H205-W211 AromaticContact ND1-CZ2 3.85Å; H205-W211 AromaticContact ND1-NE1 3.74Å; H205-W211 AromaticContact NE2-CE2 3.66Å; H205-W211 AromaticContact NE2-CH2 3.94Å; H205-W211 AromaticContact NE2-CZ2 3.28Å; H205-W211 VanDerWaalsContact NE2-CZ2 3.28Å; H205-W211 WeakPolarHBondContact NE2-CZ2 3.3Å; H205-W211 AromaticContact NE2-NE1 3.98Å |
| 206 | E | 77.4 | Confident | 78.8 | Confident | 37 Ų | 37 | 60.3 Ų | 60.3 | 17% | 0.173 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66 | -32.4 | -179.1 | -79.6 | -56.5 | 129.2 | 0 | 0 | 113.7 | V202 V203 K209 L416 | V202-E206 HydrophobicContact CG1-CG 4.49Å; V202-E206 WeakPolarHBondContact O-CB 3.33Å; V202-E206 PolarHBondContact O-N 3.09Å; V203-E206 PolarHBondContact O-N 3.42Å; E206-K209 VanDerWaalsContact O-CE 3.25Å; E206-K209 WeakPolarHBondContact O-CE 3.24Å; E206-K209 PolarHBondContact O-NZ 2.91Å; E206-K209 IonicContact OE1-NZ 3.8Å; E206-K209 IonicContact OE2-NZ 3.62Å; E206-K209 PolarHBondContact OE2-NZ 3.09Å; E206-L416 HydrophobicContact CG-CD1 4.09Å |
| 207 | L | 76 | Confident | 78.1 | Confident | 63 Ų | 63 | 56 Ų | 56 | 33% | 0.33 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -81 | -36.9 | 176.7 | -67.8 | 173.5 | 0 | 0 | 0 | 113.5 | A145 V203 F204 H205 | A145-L207 HydrophobicContact CB-CD2 3.62Å; V203-L207 HydrophobicContact CG1-CD1 3.71Å; V203-L207 HydrophobicContact CG1-CG 4.3Å; V203-L207 WeakPolarHBondContact O-CB 3.21Å; V203-L207 VanDerWaalsContact O-CG 3.24Å; V203-L207 WeakPolarHBondContact O-CG 3.44Å; V203-L207 PolarHBondContact O-N 2.98Å; F204-L207 PolarHBondContact O-N 3.13Å; H205-L207 VanDerWaalsContact C-N 3.33Å; H205-L207 PolarHBondContact O-N 3.27Å |
| 208 | T | 72.6 | Confident | 77.5 | Confident | 70 Ų | 70 | 51 Ų | 51 | 43% | 0.429 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -101.8 | -14.7 | -170.7 | -33.1 | 0 | 0 | 0 | 0 | 113.1 | F204 H205 S210 | F204-T208 HydrophobicContact CE1-CG2 4.28Å; F204-T208 HydrophobicContact CZ-CG2 3.96Å; F204-T208 WeakPolarHBondContact CZ-OG1 3.4Å; F204-T208 VanDerWaalsContact O-CB 3.28Å; F204-T208 WeakPolarHBondContact O-CB 3.39Å; F204-T208 PolarHBondContact O-N 3.4Å; F204-T208 PolarHBondContact O-OG1 3.01Å; H205-T208 PolarHBondContact O-N 2.75Å; T208-S210 WeakPolarHBondContact CG2-OG 3.41Å; T208-S210 PolarHBondContact O-N 3.08Å; T208-S210 VanDerWaalsContact O-N 3.09Å |
| 209 | K | 69.3 | Low | 77.1 | Confident | 120 Ų | 120 | 54.2 Ų | 54.2 | 52% | 0.522 | 27% | 0.274 | S | S | . | . | S | Bend | trans | 52.5 | 21.9 | -172.1 | -55.8 | -49.9 | -169.1 | -161.7 | 0 | 115 | H205 E206 | H205-K209 WeakPolarHBondContact O-CA 3.26Å; H205-K209 PolarHBondContact O-N 3.31Å; E206-K209 VanDerWaalsContact O-CE 3.25Å; E206-K209 WeakPolarHBondContact O-CE 3.24Å; E206-K209 PolarHBondContact O-NZ 2.91Å; E206-K209 IonicContact OE1-NZ 3.8Å; E206-K209 IonicContact OE2-NZ 3.62Å; E206-K209 PolarHBondContact OE2-NZ 3.09Å |
| 210 | S | 66.4 | Low | 76.8 | Confident | 42 Ų | 42 | 56 Ų | 56 | 29% | 0.294 | 28% | 0.284 | S | S | . | . | S | Bend | trans | -125.7 | 162.1 | 177.8 | 63.1 | 0 | 0 | 0 | 0 | 110.9 | H205 T208 | H205-S210 PolarHBondContact ND1-O 3.29Å; T208-S210 WeakPolarHBondContact CG2-OG 3.41Å; T208-S210 PolarHBondContact O-N 3.08Å; T208-S210 VanDerWaalsContact O-N 3.09Å |
| 211 | W | 68.8 | Low | 76.5 | Confident | 42 Ų | 42 | 53.8 Ų | 53.8 | 16% | 0.159 | 27% | 0.27 | C | S | . | . | trans | -103.3 | 111.9 | -178.7 | -65.2 | 85.7 | 0 | 0 | 0 | 111.4 | H205 L213 G214 C218 L287 E301 C303 | H205-W211 AromaticContact CD2-CH2 3.91Å; H205-W211 AromaticContact CD2-CZ2 3.74Å; H205-W211 AromaticContact CE1-CD1 3.87Å; H205-W211 AromaticContact CE1-CD2 3.92Å; H205-W211 AromaticContact CE1-CE2 3.21Å; H205-W211 AromaticContact CE1-CZ2 3.39Å; H205-W211 WeakPolarHBondContact CE1-CZ2 3.4Å; H205-W211 AromaticContact CE1-NE1 3.22Å; H205-W211 PolarHBondContact CE1-NE1 2.93Å; H205-W211 AromaticContact ND1-CD2 3.75Å; H205-W211 AromaticContact ND1-CE2 3.53Å; H205-W211 AromaticContact ND1-CZ2 3.85Å; H205-W211 AromaticContact ND1-NE1 3.74Å; H205-W211 AromaticContact NE2-CE2 3.66Å; H205-W211 AromaticContact NE2-CH2 3.94Å; H205-W211 AromaticContact NE2-CZ2 3.28Å; H205-W211 VanDerWaalsContact NE2-CZ2 3.28Å; H205-W211 WeakPolarHBondContact NE2-CZ2 3.3Å; H205-W211 AromaticContact NE2-NE1 3.98Å; W211-L213 PolarHBondContact O-N 2.98Å; W211-G214 PolarHBondContact O-N 3.14Å; W211-C218 HydrophobicContact CD2-CB 4.3Å; W211-C218 HydrophobicContact CE3-CB 4.05Å; W211-C218 HydrophobicContact CZ3-CB 4.15Å; W211-L287 HydrophobicContact CD2-CD1 4.43Å; W211-L287 HydrophobicContact CG-CD1 4.19Å; W211-L287 HydrophobicContact CG-CD2 4.43Å; W211-E301 PolarHBondContact N-OE2 3.04Å; W211-E301 PolarHBondContact NE1-O 3.47Å; W211-C303 HydrophobicContact CH2-CB 3.57Å; W211-C303 HydrophobicContact CZ2-CB 3.2Å; W211-C303 HydrophobicContact CZ3-CB 4.45Å | ||
| 212 | L | 63.4 | Low | 76.3 | Confident | 105 Ų | 105 | 51.7 Ų | 51.7 | 55% | 0.55 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | -30.4 | -174.4 | -170.2 | 71.2 | 0 | 0 | 0 | 114.2 | F204 | F204-L212 HydrophobicContact CD1-CB 3.83Å; F204-L212 HydrophobicContact CD1-CD1 4.21Å; F204-L212 HydrophobicContact CD1-CG 4.47Å; F204-L212 HydrophobicContact CE1-CB 3.89Å; F204-L212 HydrophobicContact CE1-CD1 3.75Å; F204-L212 HydrophobicContact CE1-CG 4.39Å; F204-L212 HydrophobicContact CE2-CD1 4.15Å; F204-L212 HydrophobicContact CZ-CD1 3.72Å |
| 213 | L | 68.5 | Low | 76.4 | Confident | 89 Ų | 89 | 52.7 Ų | 52.7 | 47% | 0.466 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -124.3 | 27.1 | 172 | -66.5 | 86.7 | 0 | 0 | 0 | 111.5 | W211 E215 F216 T217 | W211-L213 PolarHBondContact O-N 2.98Å; L213-E215 PolarHBondContact O-N 3.33Å; L213-F216 HydrophobicContact CB-CB 4.23Å; L213-F216 HydrophobicContact CB-CD1 4.35Å; L213-F216 HydrophobicContact CD2-CD1 4.06Å; L213-F216 PolarHBondContact O-N 3.37Å; L213-T217 HydrophobicContact CB-CG2 4.08Å; L213-T217 HydrophobicContact CD1-CG2 4Å; L213-T217 PolarHBondContact N-OG1 2.89Å |
| 214 | G | 75.8 | Confident | 76.6 | Confident | 18 Ų | 18 | 52.7 Ų | 52.7 | 19% | 0.186 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 52.2 | -128.5 | 180 | 0 | 0 | 0 | 0 | 0 | 112.9 | W211 F216 T217 C218 | W211-G214 PolarHBondContact O-N 3.14Å; G214-F216 VanDerWaalsContact C-N 3.26Å; G214-F216 PolarHBondContact O-N 3.47Å; G214-T217 PolarHBondContact N-OG1 2.85Å; G214-T217 PolarHBondContact O-N 2.87Å; G214-T217 PolarHBondContact O-OG1 3.24Å; G214-C218 PolarHBondContact O-N 2.89Å |
| 215 | E | 72.4 | Confident | 76.8 | Confident | 85 Ų | 85 | 50.4 Ų | 50.4 | 40% | 0.397 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -57.3 | -33.3 | -178.1 | -177.7 | 170.6 | -138.4 | 0 | 0 | 113.9 | L213 C218 R219 L287 | L213-E215 PolarHBondContact O-N 3.33Å; E215-C218 PolarHBondContact O-N 3.38Å; E215-R219 HydrophobicContact CG-CG 4.23Å; E215-R219 WeakPolarHBondContact O-CG 3.45Å; E215-R219 PolarHBondContact O-N 3.12Å; E215-R219 IonicContact OE1-CZ 2.7Å; E215-R219 VanDerWaalsContact OE1-CZ 3.28Å; E215-R219 IonicContact OE1-NE 2.73Å; E215-R219 PolarHBondContact OE1-NE 3.21Å; E215-R219 VanDerWaalsContact OE1-NE 3.08Å; E215-R219 IonicContact OE1-NH2 3.98Å; E215-R219 PolarHBondContact OE1-NH2 3.03Å; E215-R219 IonicContact OE2-NH2 3.13Å; E215-L287 HydrophobicContact CB-CB 4.09Å; E215-L287 HydrophobicContact CG-CB 4.34Å |
| 216 | F | 74.8 | Confident | 77.1 | Confident | 126 Ų | 126 | 50.3 Ų | 50.3 | 55% | 0.553 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -61.9 | -49.3 | -179.6 | -179.9 | -93.7 | 0 | 0 | 0 | 111.1 | L213 G214 C218 R219 V220 | L213-F216 HydrophobicContact CB-CB 4.23Å; L213-F216 HydrophobicContact CB-CD1 4.35Å; L213-F216 HydrophobicContact CD2-CD1 4.06Å; L213-F216 PolarHBondContact O-N 3.37Å; G214-F216 VanDerWaalsContact C-N 3.26Å; G214-F216 PolarHBondContact O-N 3.47Å; F216-C218 PolarHBondContact O-N 3.43Å; F216-R219 PolarHBondContact O-N 3Å; F216-V220 HydrophobicContact CD1-CG2 4.33Å; F216-V220 HydrophobicContact CD2-CG2 4.08Å; F216-V220 HydrophobicContact CE1-CB 4.39Å; F216-V220 HydrophobicContact CE1-CG2 4.07Å; F216-V220 HydrophobicContact CE2-CG2 3.81Å; F216-V220 HydrophobicContact CG-CG2 4.34Å; F216-V220 HydrophobicContact CZ-CG2 3.81Å; F216-V220 VanDerWaalsContact O-CB 3.29Å; F216-V220 WeakPolarHBondContact O-CB 3.2Å; F216-V220 VanDerWaalsContact O-CG2 3.3Å; F216-V220 WeakPolarHBondContact O-CG2 3.41Å; F216-V220 PolarHBondContact O-N 3.25Å |
| 217 | T | 78.5 | Confident | 77.7 | Confident | 6 Ų | 6 | 48.5 Ų | 48.5 | 4% | 0.037 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62 | -41.8 | 176.2 | 22.2 | 0 | 0 | 0 | 0 | 112.3 | M201 L213 G214 R219 V221 | M201-T217 HydrophobicContact CG-CG2 4.33Å; M201-T217 HydrophobicContact SD-CG2 3.76Å; L213-T217 HydrophobicContact CB-CG2 4.08Å; L213-T217 HydrophobicContact CD1-CG2 4Å; L213-T217 PolarHBondContact N-OG1 2.89Å; G214-T217 PolarHBondContact N-OG1 2.85Å; G214-T217 PolarHBondContact O-N 2.87Å; G214-T217 PolarHBondContact O-OG1 3.24Å; T217-R219 PolarHBondContact O-N 3.27Å; T217-V221 WeakPolarHBondContact O-CB 3.45Å; T217-V221 WeakPolarHBondContact O-CG2 3.38Å; T217-V221 PolarHBondContact O-N 3.4Å; T217-V221 VanDerWaalsContact O-N 3.1Å |
| 218 | C | 77.9 | Confident | 78.4 | Confident | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.7 | -41.8 | 177.2 | 164.2 | 0 | 0 | 0 | 0 | 112.9 | W211 G214 E215 F216 P222 R285 Q286 L287 C303 | W211-C218 HydrophobicContact CD2-CB 4.3Å; W211-C218 HydrophobicContact CE3-CB 4.05Å; W211-C218 HydrophobicContact CZ3-CB 4.15Å; G214-C218 PolarHBondContact O-N 2.89Å; E215-C218 PolarHBondContact O-N 3.38Å; F216-C218 PolarHBondContact O-N 3.43Å; C218-P222 WeakPolarHBondContact O-CD 3.42Å; C218-R285 WeakPolarHBondContact O-CD 3.34Å; C218-Q286 VanDerWaalsContact SG-C 3.57Å; C218-Q286 PolarHBondContact SG-O 2.88Å; C218-Q286 VanDerWaalsContact SG-O 3.4Å; C218-L287 HydrophobicContact CB-CB 4.23Å; C218-L287 HydrophobicContact CB-CD1 4.21Å; C218-C303 VanDerWaalsContact C-SG 3.54Å; C218-C303 WeakPolarHBondContact CA-SG 3.44Å; C218-C303 HydrophobicContact CB-CB 3.75Å; C218-C303 WeakPolarHBondContact CB-SG 3.32Å; C218-C303 PolarHBondContact O-SG 2.93Å; C218-C303 VanDerWaalsContact SG-CA 3.55Å; C218-C303 WeakPolarHBondContact SG-CB 3.31Å; C218-C303 CovalentContact SG-SG 2.03Å; C218-C303 PolarHBondContact SG-SG 2.71Å |
| 219 | R | 81 | Confident | 79.1 | Confident | 74 Ų | 74 | 42.7 Ų | 42.7 | 28% | 0.279 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -80.6 | -40.5 | 179.1 | -63.5 | -175.1 | -174 | -152.4 | 12 | 113.2 | E215 F216 T217 Y223 L282 | E215-R219 HydrophobicContact CG-CG 4.23Å; E215-R219 WeakPolarHBondContact O-CG 3.45Å; E215-R219 PolarHBondContact O-N 3.12Å; E215-R219 IonicContact OE1-CZ 2.7Å; E215-R219 VanDerWaalsContact OE1-CZ 3.28Å; E215-R219 IonicContact OE1-NE 2.73Å; E215-R219 PolarHBondContact OE1-NE 3.21Å; E215-R219 VanDerWaalsContact OE1-NE 3.08Å; E215-R219 IonicContact OE1-NH2 3.98Å; E215-R219 PolarHBondContact OE1-NH2 3.03Å; E215-R219 IonicContact OE2-NH2 3.13Å; F216-R219 PolarHBondContact O-N 3Å; T217-R219 PolarHBondContact O-N 3.27Å; R219-Y223 WeakPolarHBondContact O-CB 3.47Å; R219-L282 HydrophobicContact CB-CD1 4.19Å |
| 220 | V | 82.4 | Confident | 80 | Confident | 41 Ų | 41 | 37 Ų | 37 | 25% | 0.248 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -80.1 | -37.6 | -169.9 | 173.2 | 0 | 0 | 0 | 0 | 112.9 | F216 Y223 V224 L282 | F216-V220 HydrophobicContact CD1-CG2 4.33Å; F216-V220 HydrophobicContact CD2-CG2 4.08Å; F216-V220 HydrophobicContact CE1-CB 4.39Å; F216-V220 HydrophobicContact CE1-CG2 4.07Å; F216-V220 HydrophobicContact CE2-CG2 3.81Å; F216-V220 HydrophobicContact CG-CG2 4.34Å; F216-V220 HydrophobicContact CZ-CG2 3.81Å; F216-V220 VanDerWaalsContact O-CB 3.29Å; F216-V220 WeakPolarHBondContact O-CB 3.2Å; F216-V220 VanDerWaalsContact O-CG2 3.3Å; F216-V220 WeakPolarHBondContact O-CG2 3.41Å; F216-V220 PolarHBondContact O-N 3.25Å; V220-Y223 PolarHBondContact O-N 2.72Å; V220-V224 HydrophobicContact CG1-CG2 4.03Å; V220-V224 WeakPolarHBondContact O-CG2 3.45Å; V220-V224 PolarHBondContact O-N 3.13Å; V220-L282 HydrophobicContact CG2-CD1 4.4Å |
| 221 | V | 84.3 | Confident | 81.2 | Confident | 10 Ų | 10 | 35 Ų | 35 | 6% | 0.061 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.2 | -54.1 | -177.9 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | M201 V202 T217 Y223 V224 E225 | M201-V221 HydrophobicContact CB-CG2 4.25Å; M201-V221 HydrophobicContact SD-CG2 4.24Å; V202-V221 HydrophobicContact CG2-CG1 3.68Å; T217-V221 WeakPolarHBondContact O-CB 3.45Å; T217-V221 WeakPolarHBondContact O-CG2 3.38Å; T217-V221 PolarHBondContact O-N 3.4Å; T217-V221 VanDerWaalsContact O-N 3.1Å; V221-Y223 VanDerWaalsContact C-N 3.31Å; V221-Y223 PolarHBondContact O-N 3.25Å; V221-V224 PolarHBondContact O-N 3.11Å; V221-V224 VanDerWaalsContact O-N 3.09Å; V221-E225 HydrophobicContact CG1-CG 4.34Å; V221-E225 WeakPolarHBondContact O-CG 3.44Å; V221-E225 PolarHBondContact O-N 2.83Å |
| 222 | P | 81.4 | Confident | 82.2 | Confident | 12 Ų | 12 | 33.2 Ų | 33.2 | 8% | 0.078 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -67.7 | -29 | -179.4 | -24.1 | 39.2 | 0 | 0 | 0 | 113.7 | C218 E225 V226 | C218-P222 WeakPolarHBondContact O-CD 3.42Å; P222-E225 PolarHBondContact O-N 3.4Å; P222-V226 WeakPolarHBondContact O-CG2 3.49Å; P222-V226 PolarHBondContact O-N 3.35Å |
| 223 | Y | 86.3 | Confident | 83.4 | Confident | 36 Ų | 36 | 28.3 Ų | 28.3 | 14% | 0.141 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.7 | -44.5 | 170.7 | 170.3 | -105.9 | 0 | 0 | 0 | 111.8 | R219 V220 V221 A227 L275 A278 L279 L282 | R219-Y223 WeakPolarHBondContact O-CB 3.47Å; V220-Y223 PolarHBondContact O-N 2.72Å; V221-Y223 VanDerWaalsContact C-N 3.31Å; V221-Y223 PolarHBondContact O-N 3.25Å; Y223-A227 VanDerWaalsContact O-CB 3.25Å; Y223-A227 WeakPolarHBondContact O-CB 3.12Å; Y223-A227 PolarHBondContact O-N 3.34Å; Y223-L275 HydrophobicContact CE1-CD2 4.19Å; Y223-L275 WeakPolarHBondContact OH-CD2 3.28Å; Y223-L275 PolarHBondContact OH-O 3.5Å; Y223-A278 HydrophobicContact CD2-CB 3.69Å; Y223-A278 WeakPolarHBondContact CD2-O 3.25Å; Y223-A278 HydrophobicContact CE2-CB 3.59Å; Y223-L279 HydrophobicContact CE2-CD2 4.03Å; Y223-L282 HydrophobicContact CD1-CD1 4.31Å; Y223-L282 HydrophobicContact CD2-CB 3.8Å; Y223-L282 HydrophobicContact CD2-CD2 4.49Å; Y223-L282 HydrophobicContact CE2-CB 4.4Å; Y223-L282 HydrophobicContact CE2-CD2 4.48Å; Y223-L282 HydrophobicContact CG-CB 4.1Å; Y223-L282 HydrophobicContact CG-CD1 4.05Å; Y223-L282 HydrophobicContact CG-CG 4.49Å |
| 224 | V | 89 | Confident | 84.4 | Confident | 22 Ų | 22 | 27 Ų | 27 | 13% | 0.133 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -74 | -32.2 | 179.1 | 177.2 | 0 | 0 | 0 | 0 | 111.7 | W190 L194 C198 V220 V221 A227 S228 | W190-V224 HydrophobicContact CZ2-CG1 4.23Å; L194-V224 HydrophobicContact CD2-CG1 3.7Å; C198-V224 VanDerWaalsContact SG-CG1 3.6Å; V220-V224 HydrophobicContact CG1-CG2 4.03Å; V220-V224 WeakPolarHBondContact O-CG2 3.45Å; V220-V224 PolarHBondContact O-N 3.13Å; V221-V224 PolarHBondContact O-N 3.11Å; V221-V224 VanDerWaalsContact O-N 3.09Å; V224-A227 PolarHBondContact O-N 3.02Å; V224-S228 PolarHBondContact O-N 3.18Å |
| 225 | E | 87.8 | Confident | 85.1 | Confident | 26 Ų | 26 | 26.2 Ų | 26.2 | 12% | 0.121 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61.6 | -50.7 | 170.5 | -69.4 | 174 | 162.1 | 0 | 0 | 111.5 | V221 P222 A227 S228 L229 L422 | V221-E225 HydrophobicContact CG1-CG 4.34Å; V221-E225 WeakPolarHBondContact O-CG 3.44Å; V221-E225 PolarHBondContact O-N 2.83Å; P222-E225 PolarHBondContact O-N 3.4Å; E225-A227 PolarHBondContact O-N 3.04Å; E225-S228 WeakPolarHBondContact O-CB 3.32Å; E225-S228 PolarHBondContact O-N 2.89Å; E225-S228 VanDerWaalsContact O-N 3.12Å; E225-L229 PolarHBondContact O-N 3.49Å; E225-L422 HydrophobicContact CB-CD2 3.71Å; E225-L422 HydrophobicContact CG-CD2 3.7Å |
| 226 | V | 85.4 | Confident | 85.8 | Confident | 32 Ų | 32 | 22.6 Ų | 22.6 | 19% | 0.194 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -67.3 | -36.2 | 177 | 173.4 | 0 | 0 | 0 | 0 | 111.9 | P222 S228 L229 G230 A278 E281 Y334 | P222-V226 WeakPolarHBondContact O-CG2 3.49Å; P222-V226 PolarHBondContact O-N 3.35Å; V226-S228 VanDerWaalsContact C-N 3.28Å; V226-S228 PolarHBondContact O-N 3.09Å; V226-L229 WeakPolarHBondContact O-CB 3.38Å; V226-L229 PolarHBondContact O-N 3.39Å; V226-G230 PolarHBondContact O-N 2.61Å; V226-G230 VanDerWaalsContact O-N 3.12Å; V226-A278 HydrophobicContact CB-CB 4.35Å; V226-A278 HydrophobicContact CG1-CB 4.04Å; V226-E281 HydrophobicContact CG2-CG 4.11Å; V226-Y334 HydrophobicContact CG1-CE2 4.15Å |
| 227 | A | 89.8 | Confident | 86.4 | Confident | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -64.1 | -30.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | W190 Y223 V224 E225 G230 V231 L275 A278 | W190-A227 HydrophobicContact CH2-CB 3.89Å; W190-A227 HydrophobicContact CZ2-CB 3.61Å; Y223-A227 VanDerWaalsContact O-CB 3.25Å; Y223-A227 WeakPolarHBondContact O-CB 3.12Å; Y223-A227 PolarHBondContact O-N 3.34Å; V224-A227 PolarHBondContact O-N 3.02Å; E225-A227 PolarHBondContact O-N 3.04Å; A227-G230 PolarHBondContact O-N 2.72Å; A227-V231 WeakPolarHBondContact O-CG2 3.35Å; A227-V231 PolarHBondContact O-N 3.33Å; A227-L275 HydrophobicContact CB-CD2 4.34Å; A227-A278 HydrophobicContact CB-CB 3.95Å |
| 228 | S | 90.6 | Very high | 86.9 | Confident | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.6 | -48.9 | 170 | -179.3 | 0 | 0 | 0 | 0 | 112.1 | W190 L194 V224 E225 V226 G230 V231 T232 R425 | W190-S228 VanDerWaalsContact NE1-CA 3.27Å; L194-S228 WeakPolarHBondContact CD1-OG 3.41Å; V224-S228 PolarHBondContact O-N 3.18Å; E225-S228 WeakPolarHBondContact O-CB 3.32Å; E225-S228 PolarHBondContact O-N 2.89Å; E225-S228 VanDerWaalsContact O-N 3.12Å; V226-S228 VanDerWaalsContact C-N 3.28Å; V226-S228 PolarHBondContact O-N 3.09Å; S228-G230 PolarHBondContact O-N 3.47Å; S228-V231 PolarHBondContact O-N 3Å; S228-T232 WeakPolarHBondContact O-CB 3.1Å; S228-T232 VanDerWaalsContact O-CG2 3.28Å; S228-T232 WeakPolarHBondContact O-CG2 3.24Å; S228-T232 PolarHBondContact O-N 2.9Å; S228-T232 PolarHBondContact O-OG1 2.96Å; S228-R425 PolarHBondContact OG-NH2 3.15Å |
| 229 | L | 86.4 | Confident | 87.3 | Confident | 11 Ų | 11 | 18.7 Ų | 18.7 | 6% | 0.058 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -59.2 | -38.7 | 179.3 | -167.6 | 68.9 | 0 | 0 | 0 | 110.5 | E225 V226 T232 T233 Y334 Y385 V389 | E225-L229 PolarHBondContact O-N 3.49Å; V226-L229 WeakPolarHBondContact O-CB 3.38Å; V226-L229 PolarHBondContact O-N 3.39Å; L229-T232 PolarHBondContact O-OG1 3.41Å; L229-T233 WeakPolarHBondContact O-CB 3.46Å; L229-T233 PolarHBondContact O-N 3Å; L229-T233 PolarHBondContact O-OG1 2.85Å; L229-Y334 HydrophobicContact CD2-CD2 3.95Å; L229-Y334 HydrophobicContact CD2-CG 3.89Å; L229-Y334 HydrophobicContact CG-CG 4.14Å; L229-Y385 HydrophobicContact CD1-CE2 4.21Å; L229-Y385 WeakPolarHBondContact CD1-OH 3.1Å; L229-V389 HydrophobicContact CD1-CG1 3.76Å; L229-V389 HydrophobicContact CD1-CG2 4Å |
| 230 | G | 88.9 | Confident | 87.4 | Confident | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -66 | -52.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | V226 A227 S228 T232 T233 F234 | V226-G230 PolarHBondContact O-N 2.61Å; V226-G230 VanDerWaalsContact O-N 3.12Å; A227-G230 PolarHBondContact O-N 2.72Å; S228-G230 PolarHBondContact O-N 3.47Å; G230-T232 VanDerWaalsContact C-N 3.35Å; G230-T232 PolarHBondContact O-N 3.44Å; G230-T233 WeakPolarHBondContact O-CB 3.35Å; G230-T233 PolarHBondContact O-N 3.48Å; G230-F234 WeakPolarHBondContact O-CD2 3.43Å; G230-F234 WeakPolarHBondContact O-CG 3.39Å; G230-F234 PolarHBondContact O-N 3.45Å |
| 231 | V | 91.3 | Very high | 87.5 | Confident | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -62.4 | -43 | -178.2 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | W190 A227 S228 T235 I270 A274 | W190-V231 HydrophobicContact CB-CG1 4.04Å; W190-V231 HydrophobicContact CD2-CB 4.09Å; W190-V231 HydrophobicContact CD2-CG1 4.11Å; W190-V231 HydrophobicContact CD2-CG2 3.85Å; W190-V231 HydrophobicContact CE3-CB 4.44Å; W190-V231 HydrophobicContact CE3-CG1 4.36Å; W190-V231 HydrophobicContact CE3-CG2 3.79Å; W190-V231 HydrophobicContact CG-CB 4.19Å; W190-V231 HydrophobicContact CG-CG1 3.93Å; W190-V231 HydrophobicContact CG-CG2 4.47Å; W190-V231 HydrophobicContact CH2-CG2 4.29Å; W190-V231 HydrophobicContact CZ2-CG2 4.37Å; W190-V231 HydrophobicContact CZ3-CG2 4.01Å; A227-V231 WeakPolarHBondContact O-CG2 3.35Å; A227-V231 PolarHBondContact O-N 3.33Å; S228-V231 PolarHBondContact O-N 3Å; V231-T235 VanDerWaalsContact O-CB 3.23Å; V231-T235 WeakPolarHBondContact O-CB 3.48Å; V231-T235 PolarHBondContact O-N 2.88Å; V231-T235 PolarHBondContact O-OG1 3.15Å; V231-I270 HydrophobicContact CG1-CG2 4.16Å; V231-A274 HydrophobicContact CB-CB 4.35Å; V231-A274 HydrophobicContact CG2-CB 3.47Å; V231-A274 VanDerWaalsContact CG2-CB 3.47Å |
| 232 | T | 89.8 | Confident | 87.3 | Confident | 4 Ų | 4 | 17 Ų | 17 | 3% | 0.025 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -66 | -47.8 | 177.5 | 56.8 | 0 | 0 | 0 | 0 | 111.2 | L187 S228 L229 G230 F234 T235 L236 | L187-T232 HydrophobicContact CD2-CG2 3.93Å; S228-T232 WeakPolarHBondContact O-CB 3.1Å; S228-T232 VanDerWaalsContact O-CG2 3.28Å; S228-T232 WeakPolarHBondContact O-CG2 3.24Å; S228-T232 PolarHBondContact O-N 2.9Å; S228-T232 PolarHBondContact O-OG1 2.96Å; L229-T232 PolarHBondContact O-OG1 3.41Å; G230-T232 VanDerWaalsContact C-N 3.35Å; G230-T232 PolarHBondContact O-N 3.44Å; T232-F234 PolarHBondContact O-N 3.39Å; T232-T235 PolarHBondContact O-N 3.49Å; T232-L236 WeakPolarHBondContact O-CB 3.46Å; T232-L236 VanDerWaalsContact O-CG 3.28Å; T232-L236 WeakPolarHBondContact O-CG 3.28Å; T232-L236 PolarHBondContact O-N 3.38Å |
| 233 | T | 88.1 | Confident | 87.1 | Confident | 2 Ų | 2 | 17 Ų | 17 | 1% | 0.012 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -48.6 | -59 | 171.7 | -78.1 | 0 | 0 | 0 | 0 | 112.4 | L229 G230 T235 L236 C237 Y334 P338 Y385 | L229-T233 WeakPolarHBondContact O-CB 3.46Å; L229-T233 PolarHBondContact O-N 3Å; L229-T233 PolarHBondContact O-OG1 2.85Å; G230-T233 WeakPolarHBondContact O-CB 3.35Å; G230-T233 PolarHBondContact O-N 3.48Å; T233-T235 VanDerWaalsContact C-N 3.31Å; T233-T235 PolarHBondContact O-N 2.87Å; T233-L236 PolarHBondContact O-N 3.44Å; T233-C237 PolarHBondContact O-N 3.12Å; T233-C237 PolarHBondContact O-SG 3.41Å; T233-Y334 PolarHBondContact OG1-O 2.92Å; T233-P338 HydrophobicContact CG2-CB 3.75Å; T233-P338 HydrophobicContact CG2-CG 3.36Å; T233-Y385 PolarHBondContact OG1-OH 3.48Å |
| 234 | F | 90.4 | Very high | 86.7 | Confident | 63 Ų | 63 | 18.8 Ų | 18.8 | 28% | 0.276 | 10% | 0.099 | S | C | . | . | H | α-helix | trans | -70.5 | -31.2 | -173.2 | -61.3 | -44.8 | 0 | 0 | 0 | 111.8 | G230 T232 A238 I270 A274 L277 | G230-F234 WeakPolarHBondContact O-CD2 3.43Å; G230-F234 WeakPolarHBondContact O-CG 3.39Å; G230-F234 PolarHBondContact O-N 3.45Å; T232-F234 PolarHBondContact O-N 3.39Å; F234-A238 WeakPolarHBondContact O-CB 3.35Å; F234-A238 PolarHBondContact O-N 3.29Å; F234-I270 HydrophobicContact CB-CB 4.42Å; F234-I270 HydrophobicContact CB-CG1 3.98Å; F234-I270 HydrophobicContact CB-CG2 4.19Å; F234-A274 HydrophobicContact CD2-CB 4.21Å; F234-A274 HydrophobicContact CE2-CB 4.3Å; F234-L277 HydrophobicContact CE2-CD1 4.07Å; F234-L277 HydrophobicContact CZ-CD1 3.67Å |
| 235 | T | 90.4 | Very high | 86.1 | Confident | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -68.8 | -40.2 | 174 | -53.2 | 0 | 0 | 0 | 0 | 111.9 | L183 N186 L187 V231 T232 T233 A238 L239 | L183-T235 HydrophobicContact CB-CG2 3.83Å; L183-T235 HydrophobicContact CD2-CG2 4.05Å; L183-T235 VanDerWaalsContact O-CG2 3.24Å; L183-T235 WeakPolarHBondContact O-CG2 3.38Å; N186-T235 PolarHBondContact ND2-OG1 3.37Å; L187-T235 HydrophobicContact CD1-CG2 4.18Å; L187-T235 HydrophobicContact CD2-CG2 4Å; L187-T235 HydrophobicContact CG-CG2 3.74Å; V231-T235 VanDerWaalsContact O-CB 3.23Å; V231-T235 WeakPolarHBondContact O-CB 3.48Å; V231-T235 PolarHBondContact O-N 2.88Å; V231-T235 PolarHBondContact O-OG1 3.15Å; T232-T235 PolarHBondContact O-N 3.49Å; T233-T235 VanDerWaalsContact C-N 3.31Å; T233-T235 PolarHBondContact O-N 2.87Å; T235-A238 PolarHBondContact O-N 3.18Å; T235-L239 HydrophobicContact CG2-CD1 4.25Å; T235-L239 WeakPolarHBondContact O-CB 3.36Å; T235-L239 VanDerWaalsContact O-CG 3.28Å; T235-L239 WeakPolarHBondContact O-CG 3.38Å; T235-L239 PolarHBondContact O-N 3.13Å |
| 236 | L | 87.5 | Confident | 85.3 | Confident | 10 Ų | 10 | 22 Ų | 22 | 5% | 0.052 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.1 | -42.7 | 173.8 | -70.9 | 170.3 | 0 | 0 | 0 | 111.9 | T232 T233 L239 C240 T342 L381 Y385 | T232-L236 WeakPolarHBondContact O-CB 3.46Å; T232-L236 VanDerWaalsContact O-CG 3.28Å; T232-L236 WeakPolarHBondContact O-CG 3.28Å; T232-L236 PolarHBondContact O-N 3.38Å; T233-L236 PolarHBondContact O-N 3.44Å; L236-L239 PolarHBondContact O-N 3.29Å; L236-C240 PolarHBondContact O-N 2.85Å; L236-C240 PolarHBondContact O-SG 3.39Å; L236-T342 HydrophobicContact CB-CG2 4.12Å; L236-L381 HydrophobicContact CD2-CB 3.78Å; L236-L381 HydrophobicContact CD2-CD1 4.34Å; L236-Y385 HydrophobicContact CD1-CD1 4.1Å; L236-Y385 HydrophobicContact CD1-CD2 3.54Å; L236-Y385 HydrophobicContact CD1-CE2 4.19Å; L236-Y385 HydrophobicContact CD1-CG 3.49Å; L236-Y385 VanDerWaalsContact CD1-CG 3.49Å |
| 237 | C | 88.3 | Confident | 84.5 | Confident | 22 Ų | 22 | 21.4 Ų | 21.4 | 15% | 0.149 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.9 | -44 | 173.2 | -70.9 | 0 | 0 | 0 | 0 | 111.9 | T233 C240 I241 F341 | T233-C237 PolarHBondContact O-N 3.12Å; T233-C237 PolarHBondContact O-SG 3.41Å; C237-C240 PolarHBondContact O-N 3.27Å; C237-I241 VanDerWaalsContact O-CG1 3.31Å; C237-I241 WeakPolarHBondContact O-CG1 3.24Å; C237-I241 PolarHBondContact O-N 3.21Å; C237-F341 HydrophobicContact CB-CD1 4.06Å; C237-F341 HydrophobicContact CB-CE1 4.02Å |
| 238 | A | 88 | Confident | 83.5 | Confident | 26 Ų | 26 | 23.9 Ų | 23.9 | 22% | 0.215 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -63.3 | -41.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L183 F234 T235 I241 D242 I270 | L183-A238 HydrophobicContact CD1-CB 3.78Å; L183-A238 HydrophobicContact CD2-CB 3.96Å; F234-A238 WeakPolarHBondContact O-CB 3.35Å; F234-A238 PolarHBondContact O-N 3.29Å; T235-A238 PolarHBondContact O-N 3.18Å; A238-I241 PolarHBondContact O-N 2.89Å; A238-D242 WeakPolarHBondContact O-CB 3.36Å; A238-D242 PolarHBondContact O-N 3.32Å; A238-I270 HydrophobicContact CB-CD1 4.2Å |
| 239 | L | 85.6 | Confident | 82.2 | Confident | 2 Ų | 2 | 27.9 Ų | 27.9 | 1% | 0.01 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.8 | -45 | 173.6 | -75.8 | 165.9 | 0 | 0 | 0 | 111.5 | L183 L184 L187 T235 L236 I241 D242 R243 V378 L381 | L183-L239 HydrophobicContact CB-CD2 3.78Å; L183-L239 HydrophobicContact CB-CG 3.99Å; L183-L239 HydrophobicContact CD1-CD2 4.06Å; L183-L239 HydrophobicContact CD1-CG 4.13Å; L184-L239 HydrophobicContact CD2-CD1 4.03Å; L184-L239 HydrophobicContact CD2-CD2 4.43Å; L187-L239 HydrophobicContact CD1-CD1 4.36Å; T235-L239 HydrophobicContact CG2-CD1 4.25Å; T235-L239 WeakPolarHBondContact O-CB 3.36Å; T235-L239 VanDerWaalsContact O-CG 3.28Å; T235-L239 WeakPolarHBondContact O-CG 3.38Å; T235-L239 PolarHBondContact O-N 3.13Å; L236-L239 PolarHBondContact O-N 3.29Å; L239-I241 PolarHBondContact O-N 2.98Å; L239-D242 PolarHBondContact O-N 3.4Å; L239-R243 WeakPolarHBondContact O-CB 3.49Å; L239-R243 WeakPolarHBondContact O-CG 3.43Å; L239-R243 PolarHBondContact O-N 3Å; L239-V378 HydrophobicContact CB-CG2 4.25Å; L239-L381 HydrophobicContact CD1-CD1 4.15Å |
| 240 | C | 83.5 | Confident | 80.7 | Confident | 4 Ų | 4 | 30.6 Ų | 30.6 | 3% | 0.027 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62 | -40 | 175.8 | -76.7 | 0 | 0 | 0 | 0 | 112.8 | L236 C237 F244 F341 C345 V378 | L236-C240 PolarHBondContact O-N 2.85Å; L236-C240 PolarHBondContact O-SG 3.39Å; C237-C240 PolarHBondContact O-N 3.27Å; C240-F244 VanDerWaalsContact O-CB 3.23Å; C240-F244 WeakPolarHBondContact O-CB 3.35Å; C240-F244 PolarHBondContact O-N 2.82Å; C240-F341 HydrophobicContact CB-CE1 4.37Å; C240-C345 HydrophobicContact CB-CB 3.84Å; C240-V378 VanDerWaalsContact SG-CG1 3.57Å |
| 241 | I | 85 | Confident | 78.6 | Confident | 80 Ų | 80 | 37.6 Ų | 37.6 | 41% | 0.41 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -66.2 | -45 | 175.5 | -68.1 | 162.8 | 0 | 0 | 0 | 110.9 | C237 A238 L239 F244 R245 F341 | C237-I241 VanDerWaalsContact O-CG1 3.31Å; C237-I241 WeakPolarHBondContact O-CG1 3.24Å; C237-I241 PolarHBondContact O-N 3.21Å; A238-I241 PolarHBondContact O-N 2.89Å; L239-I241 PolarHBondContact O-N 2.98Å; I241-F244 PolarHBondContact O-N 3.17Å; I241-R245 HydrophobicContact CG2-CG 4.5Å; I241-R245 WeakPolarHBondContact O-CG 3.47Å; I241-R245 PolarHBondContact O-N 3.18Å; I241-F341 HydrophobicContact CD1-CE1 4.17Å; I241-F341 HydrophobicContact CD1-CZ 3.91Å; I241-F341 HydrophobicContact CG1-CE1 3.93Å; I241-F341 HydrophobicContact CG1-CZ 3.64Å |
| 242 | D | 79.8 | Confident | 76.4 | Confident | 6 Ų | 6 | 43.3 Ų | 43.3 | 3% | 0.032 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.7 | -46.4 | 179.4 | -179.9 | 56.7 | 0 | 0 | 0 | 111.8 | I179 S180 A238 L239 R245 A246 Y253 | I179-D242 HydrophobicContact CG2-CB 4.42Å; S180-D242 WeakPolarHBondContact CB-OD2 3.18Å; S180-D242 PolarHBondContact N-OD2 3.42Å; S180-D242 PolarHBondContact OG-OD2 3.33Å; A238-D242 WeakPolarHBondContact O-CB 3.36Å; A238-D242 PolarHBondContact O-N 3.32Å; L239-D242 PolarHBondContact O-N 3.4Å; D242-R245 PolarHBondContact O-N 3Å; D242-A246 PolarHBondContact O-N 3.44Å; D242-Y253 VanDerWaalsContact CG-OH 3.22Å; D242-Y253 VanDerWaalsContact OD1-CE2 3.25Å; D242-Y253 WeakPolarHBondContact OD1-CE2 3.46Å; D242-Y253 PolarHBondContact OD1-OH 3.31Å; D242-Y253 PolarHBondContact OD2-OH 3.29Å |
| 243 | R | 76.7 | Confident | 74.4 | Confident | 12 Ų | 12 | 44.9 Ų | 44.9 | 5% | 0.045 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.3 | -40.5 | 173.7 | -67.3 | -54.4 | 89.6 | -157.3 | -0 | 112.7 | S180 L239 A246 A247 Y253 M374 V378 | S180-R243 PolarHBondContact OG-NE 2.76Å; S180-R243 PolarHBondContact OG-NH2 3.21Å; S180-R243 VanDerWaalsContact OG-NH2 3.12Å; L239-R243 WeakPolarHBondContact O-CB 3.49Å; L239-R243 WeakPolarHBondContact O-CG 3.43Å; L239-R243 PolarHBondContact O-N 3Å; R243-A246 PolarHBondContact O-N 2.78Å; R243-A247 WeakPolarHBondContact O-CB 3.37Å; R243-A247 PolarHBondContact O-N 2.91Å; R243-Y253 PolarHBondContact NH2-OH 3.38Å; R243-M374 PolarHBondContact NH1-SD 3.33Å; R243-V378 HydrophobicContact CG-CB 4.47Å; R243-V378 HydrophobicContact CG-CG2 3.73Å |
| 244 | F | 77.6 | Confident | 72.4 | Confident | 73 Ų | 73 | 49.2 Ų | 49.2 | 32% | 0.32 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -64.8 | -39.5 | 176.2 | 175 | -107.3 | 0 | 0 | 0 | 112.2 | C240 I241 T248 V348 | C240-F244 VanDerWaalsContact O-CB 3.23Å; C240-F244 WeakPolarHBondContact O-CB 3.35Å; C240-F244 PolarHBondContact O-N 2.82Å; I241-F244 PolarHBondContact O-N 3.17Å; F244-T248 HydrophobicContact CD2-CG2 4.11Å; F244-T248 HydrophobicContact CE1-CG2 4.4Å; F244-T248 HydrophobicContact CE2-CG2 3.65Å; F244-T248 HydrophobicContact CZ-CG2 3.83Å; F244-T248 WeakPolarHBondContact O-CB 3.37Å; F244-T248 WeakPolarHBondContact O-CG2 3.44Å; F244-T248 PolarHBondContact O-N 3.08Å; F244-T248 VanDerWaalsContact O-N 3.12Å; F244-T248 PolarHBondContact O-OG1 2.81Å; F244-V348 HydrophobicContact CD2-CG1 4.17Å; F244-V348 HydrophobicContact CE2-CG1 3.65Å |
| 245 | R | 76.7 | Confident | 70 | Confident | 101 Ų | 101 | 52.8 Ų | 52.8 | 38% | 0.381 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.6 | -45.9 | 173.6 | -74.6 | 178.7 | 73 | -126.7 | 5.7 | 111.6 | I241 D242 A247 T248 N249 | I241-R245 HydrophobicContact CG2-CG 4.5Å; I241-R245 WeakPolarHBondContact O-CG 3.47Å; I241-R245 PolarHBondContact O-N 3.18Å; D242-R245 PolarHBondContact O-N 3Å; R245-A247 PolarHBondContact O-N 3.15Å; R245-T248 PolarHBondContact O-N 3.04Å; R245-T248 PolarHBondContact O-OG1 3.19Å; R245-N249 PolarHBondContact O-N 3.25Å |
| 246 | A | 71.2 | Confident | 67.8 | Low | 15 Ų | 15 | 58.2 Ų | 58.2 | 12% | 0.124 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -58.1 | -48.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | D242 R243 T248 Y253 | D242-A246 PolarHBondContact O-N 3.44Å; R243-A246 PolarHBondContact O-N 2.78Å; A246-T248 PolarHBondContact O-N 3.07Å; A246-Y253 HydrophobicContact CB-CD1 4.03Å; A246-Y253 HydrophobicContact CB-CD2 3.72Å; A246-Y253 HydrophobicContact CB-CE1 4.13Å; A246-Y253 HydrophobicContact CB-CE2 3.82Å; A246-Y253 HydrophobicContact CB-CG 3.84Å |
| 247 | A | 68.5 | Low | 66 | Low | 18 Ų | 18 | 63.8 Ų | 63.8 | 15% | 0.149 | 32% | 0.319 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.6 | -4.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115 | R243 R245 T349 I353 | R243-A247 WeakPolarHBondContact O-CB 3.37Å; R243-A247 PolarHBondContact O-N 2.91Å; R245-A247 PolarHBondContact O-N 3.15Å; A247-T349 HydrophobicContact CB-CG2 3.68Å; A247-I353 HydrophobicContact CB-CD1 4.32Å; A247-I353 HydrophobicContact CB-CG1 4.19Å |
| 248 | T | 70.1 | Confident | 64.4 | Low | 53 Ų | 53 | 64.1 Ų | 64.1 | 33% | 0.325 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.2 | -28.7 | 174.9 | 49 | 0 | 0 | 0 | 0 | 113.6 | F244 R245 A246 | F244-T248 HydrophobicContact CD2-CG2 4.11Å; F244-T248 HydrophobicContact CE1-CG2 4.4Å; F244-T248 HydrophobicContact CE2-CG2 3.65Å; F244-T248 HydrophobicContact CZ-CG2 3.83Å; F244-T248 WeakPolarHBondContact O-CB 3.37Å; F244-T248 WeakPolarHBondContact O-CG2 3.44Å; F244-T248 PolarHBondContact O-N 3.08Å; F244-T248 VanDerWaalsContact O-N 3.12Å; F244-T248 PolarHBondContact O-OG1 2.81Å; R245-T248 PolarHBondContact O-N 3.04Å; R245-T248 PolarHBondContact O-OG1 3.19Å; A246-T248 PolarHBondContact O-N 3.07Å |
| 249 | N | 62.7 | Low | 63.2 | Low | 84 Ų | 84 | 68.4 Ų | 68.4 | 45% | 0.449 | 34% | 0.337 | S | S | . | . | trans | -130.8 | 62.7 | -176.9 | -69.1 | -75 | 0 | 0 | 0 | 111.6 | R245 Q251 M252 Y253 | R245-N249 PolarHBondContact O-N 3.25Å; N249-Q251 PolarHBondContact O-N 3.21Å; N249-Q251 VanDerWaalsContact O-N 3.11Å; N249-M252 PolarHBondContact O-N 3.46Å; N249-Y253 PolarHBondContact O-N 3.07Å; N249-Y253 VanDerWaalsContact O-N 3.13Å | ||
| 250 | V | 54.3 | Low | 62.3 | Low | 67 Ų | 67 | 72.6 Ų | 72.6 | 41% | 0.406 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.2 | -38.3 | -178.9 | -178 | 0 | 0 | 0 | 0 | 112.5 | ||
| 251 | Q | 44.9 | Very low | 62 | Low | 147 Ų | 147 | 77.4 Ų | 77.4 | 69% | 0.687 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -48.5 | -177.9 | -165.6 | 65.6 | 31.1 | 0 | 0 | 113.5 | N249 | N249-Q251 PolarHBondContact O-N 3.21Å; N249-Q251 VanDerWaalsContact O-N 3.11Å |
| 252 | M | 45.1 | Very low | 61.7 | Low | 120 Ų | 120 | 75.5 Ų | 75.5 | 59% | 0.591 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.1 | -11.6 | -174.8 | -73.3 | -163.2 | -64.7 | 0 | 0 | 114.1 | N249 Y254 E255 | N249-M252 PolarHBondContact O-N 3.46Å; M252-Y254 PolarHBondContact O-N 3.18Å; M252-E255 PolarHBondContact O-N 2.55Å |
| 253 | Y | 47.9 | Very low | 61.7 | Low | 37 Ų | 37 | 76.2 Ų | 76.2 | 15% | 0.145 | 39% | 0.394 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -26.1 | -178.8 | -169.5 | -96.5 | 0 | 0 | 0 | 113.3 | D242 R243 A246 N249 | D242-Y253 VanDerWaalsContact CG-OH 3.22Å; D242-Y253 VanDerWaalsContact OD1-CE2 3.25Å; D242-Y253 WeakPolarHBondContact OD1-CE2 3.46Å; D242-Y253 PolarHBondContact OD1-OH 3.31Å; D242-Y253 PolarHBondContact OD2-OH 3.29Å; R243-Y253 PolarHBondContact NH2-OH 3.38Å; A246-Y253 HydrophobicContact CB-CD1 4.03Å; A246-Y253 HydrophobicContact CB-CD2 3.72Å; A246-Y253 HydrophobicContact CB-CE1 4.13Å; A246-Y253 HydrophobicContact CB-CE2 3.82Å; A246-Y253 HydrophobicContact CB-CG 3.84Å; N249-Y253 PolarHBondContact O-N 3.07Å; N249-Y253 VanDerWaalsContact O-N 3.13Å |
| 254 | Y | 45.3 | Very low | 62.1 | Low | 94 Ų | 94 | 79.9 Ų | 79.9 | 37% | 0.369 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.5 | -20.6 | 179.5 | -74.5 | -97.8 | 0 | 0 | 0 | 114 | M252 F479 | M252-Y254 PolarHBondContact O-N 3.18Å; Y254-F479 HydrophobicContact CD1-CD1 4.16Å; Y254-F479 AromaticContact CD1-CE1 3.92Å; Y254-F479 HydrophobicContact CD1-CE1 3.92Å; Y254-F479 AromaticContact CE1-CD1 3.89Å; Y254-F479 HydrophobicContact CE1-CD1 3.89Å; Y254-F479 AromaticContact CE1-CE1 3.44Å; Y254-F479 HydrophobicContact CE1-CE1 3.44Å; Y254-F479 VanDerWaalsContact CE1-CE1 3.44Å; Y254-F479 HydrophobicContact CE1-CE2 4.25Å; Y254-F479 HydrophobicContact CE1-CG 4.48Å; Y254-F479 AromaticContact CE1-CZ 3.64Å; Y254-F479 HydrophobicContact CE1-CZ 3.64Å |
| 255 | E | 40.3 | Very low | 62.5 | Low | 137 Ų | 137 | 78.9 Ų | 78.9 | 64% | 0.64 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.1 | -34.7 | 179.3 | -68.1 | 179.8 | 144.5 | 0 | 0 | 112 | M252 I257 | M252-E255 PolarHBondContact O-N 2.55Å; E255-I257 PolarHBondContact O-N 3.02Å |
| 256 | M | 43.9 | Very low | 63 | Low | 115 Ų | 115 | 77.6 Ų | 77.6 | 57% | 0.567 | 42% | 0.42 | S | S | * | . | trans | -84.9 | 92.8 | 167.4 | -81.4 | 178.9 | 60.9 | 0 | 0 | 110.9 | E258 | M256-E258 HydrophobicContact CE-CG 3.92Å; M256-E258 PolarHBondContact O-N 3.47Å | ||
| 257 | I | 50.5 | Low | 63.8 | Low | 127 Ų | 127 | 78.7 Ų | 78.7 | 65% | 0.651 | 42% | 0.424 | S | S | * | . | trans | -58.9 | 95.3 | 140.6 | -62.2 | 176.2 | 0 | 0 | 0 | 105.4 | E255 N259 | E255-I257 PolarHBondContact O-N 3.02Å; I257-N259 PolarHBondContact O-N 2.97Å | ||
| 258 | E | 54.5 | Low | 64.8 | Low | 29 Ų | 29 | 79.9 Ų | 79.9 | 14% | 0.136 | 43% | 0.433 | C | S | . | . | trans | -69.8 | 109.6 | -175.7 | -157 | -176.7 | -144.1 | 0 | 0 | 108.3 | I179 M256 C260 S262 K266 | I179-E258 HydrophobicContact CD1-CB 4.21Å; I179-E258 WeakPolarHBondContact CD1-OE2 3.31Å; I179-E258 HydrophobicContact CG1-CB 4.49Å; M256-E258 HydrophobicContact CE-CG 3.92Å; M256-E258 PolarHBondContact O-N 3.47Å; E258-C260 PolarHBondContact O-N 3.39Å; E258-S262 PolarHBondContact OE1-OG 3.34Å; E258-K266 IonicContact OE1-NZ 2.76Å; E258-K266 PolarHBondContact OE1-NZ 2.91Å; E258-K266 IonicContact OE2-NZ 3.48Å; E258-K266 PolarHBondContact OE2-NZ 3.07Å | ||
| 259 | N | 62.2 | Low | 65.9 | Low | 115 Ų | 115 | 82.4 Ų | 82.4 | 62% | 0.615 | 45% | 0.448 | S | S | * | . | trans | -39.8 | 138.9 | -174.1 | -73.6 | -19.5 | 0 | 0 | 0 | 111.7 | I257 T261 S262 T263 | I257-N259 PolarHBondContact O-N 2.97Å; N259-T261 PolarHBondContact O-N 3.33Å; N259-S262 WeakPolarHBondContact O-CB 3.41Å; N259-S262 PolarHBondContact O-N 2.95Å; N259-T263 PolarHBondContact O-N 3.49Å | ||
| 260 | C | 67.1 | Low | 67.3 | Low | 90 Ų | 90 | 78.8 Ų | 78.8 | 61% | 0.608 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -50 | -33.7 | -177.8 | -64.2 | 0 | 0 | 0 | 0 | 112.4 | E258 S262 T263 T264 | E258-C260 PolarHBondContact O-N 3.39Å; C260-S262 PolarHBondContact O-N 2.75Å; C260-T263 PolarHBondContact O-N 3.06Å; C260-T264 WeakPolarHBondContact O-CB 3.32Å; C260-T264 PolarHBondContact O-N 3.32Å; C260-T264 PolarHBondContact O-OG1 2.89Å |
| 261 | T | 76.7 | Confident | 69.1 | Low | 106 Ų | 106 | 79.9 Ų | 79.9 | 65% | 0.65 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -55.2 | -40.3 | 172.5 | 52 | 0 | 0 | 0 | 0 | 114.5 | N259 A265 | N259-T261 PolarHBondContact O-N 3.33Å; T261-A265 VanDerWaalsContact O-CB 3.24Å; T261-A265 WeakPolarHBondContact O-CB 3.35Å; T261-A265 PolarHBondContact O-N 3.39Å |
| 262 | S | 79.9 | Confident | 71.4 | Confident | 39 Ų | 39 | 78.2 Ų | 78.2 | 27% | 0.273 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -71.4 | -41.1 | 176.5 | -177 | 0 | 0 | 0 | 0 | 111.9 | E258 N259 C260 A265 K266 | E258-S262 PolarHBondContact OE1-OG 3.34Å; N259-S262 WeakPolarHBondContact O-CB 3.41Å; N259-S262 PolarHBondContact O-N 2.95Å; C260-S262 PolarHBondContact O-N 2.75Å; S262-A265 PolarHBondContact O-N 2.97Å; S262-K266 WeakPolarHBondContact O-CG 3.27Å; S262-K266 PolarHBondContact O-N 3.34Å |
| 263 | T | 80.4 | Confident | 73.5 | Confident | 22 Ų | 22 | 73.4 Ų | 73.4 | 14% | 0.135 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.9 | -47.9 | 174.9 | -64.3 | 0 | 0 | 0 | 0 | 110.6 | N259 C260 A265 K266 L267 | N259-T263 PolarHBondContact O-N 3.49Å; C260-T263 PolarHBondContact O-N 3.06Å; T263-A265 VanDerWaalsContact C-N 3.32Å; T263-A265 PolarHBondContact O-N 2.88Å; T263-K266 PolarHBondContact O-N 3.15Å; T263-L267 HydrophobicContact CG2-CD1 4.42Å; T263-L267 WeakPolarHBondContact O-CG 3.39Å; T263-L267 PolarHBondContact O-N 2.72Å |
| 264 | T | 83.4 | Confident | 75.5 | Confident | 88 Ų | 88 | 71.7 Ų | 71.7 | 54% | 0.54 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61.1 | -38 | 175.2 | -59.2 | 0 | 0 | 0 | 0 | 112.1 | C260 K266 L267 A268 | C260-T264 WeakPolarHBondContact O-CB 3.32Å; C260-T264 PolarHBondContact O-N 3.32Å; C260-T264 PolarHBondContact O-OG1 2.89Å; T264-K266 PolarHBondContact O-N 3.26Å; T264-L267 PolarHBondContact O-N 3.12Å; T264-A268 WeakPolarHBondContact O-CB 3.37Å; T264-A268 PolarHBondContact O-N 2.94Å |
| 265 | A | 87 | Confident | 77.7 | Confident | 53 Ų | 53 | 69.5 Ų | 69.5 | 44% | 0.438 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.1 | -40.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | T261 S262 T263 A268 V269 | T261-A265 VanDerWaalsContact O-CB 3.24Å; T261-A265 WeakPolarHBondContact O-CB 3.35Å; T261-A265 PolarHBondContact O-N 3.39Å; S262-A265 PolarHBondContact O-N 2.97Å; T263-A265 VanDerWaalsContact C-N 3.32Å; T263-A265 PolarHBondContact O-N 2.88Å; A265-A268 PolarHBondContact O-N 2.91Å; A265-V269 WeakPolarHBondContact O-CG2 3.39Å; A265-V269 PolarHBondContact O-N 3.15Å |
| 266 | K | 86.2 | Confident | 79.9 | Confident | 73 Ų | 73 | 68.1 Ų | 68.1 | 32% | 0.317 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -64.6 | -42.6 | 175 | -68.8 | 168.2 | -170.2 | -179.6 | 0 | 111.8 | E258 S262 T263 T264 V269 I270 | E258-K266 IonicContact OE1-NZ 2.76Å; E258-K266 PolarHBondContact OE1-NZ 2.91Å; E258-K266 IonicContact OE2-NZ 3.48Å; E258-K266 PolarHBondContact OE2-NZ 3.07Å; S262-K266 WeakPolarHBondContact O-CG 3.27Å; S262-K266 PolarHBondContact O-N 3.34Å; T263-K266 PolarHBondContact O-N 3.15Å; T264-K266 PolarHBondContact O-N 3.26Å; K266-V269 PolarHBondContact O-N 3.03Å; K266-I270 WeakPolarHBondContact O-CG1 3.25Å; K266-I270 PolarHBondContact O-N 2.97Å |
| 267 | L | 89.3 | Confident | 81.8 | Confident | 39 Ų | 39 | 65.5 Ų | 65.5 | 20% | 0.204 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.3 | -43.9 | 174.6 | -64.7 | 177.9 | 0 | 0 | 0 | 111.3 | L183 N186 T263 T264 V269 I270 W271 | L183-L267 HydrophobicContact CD2-CD2 4.04Å; N186-L267 HydrophobicContact CB-CD2 3.69Å; T263-L267 HydrophobicContact CG2-CD1 4.42Å; T263-L267 WeakPolarHBondContact O-CG 3.39Å; T263-L267 PolarHBondContact O-N 2.72Å; T264-L267 PolarHBondContact O-N 3.12Å; L267-V269 VanDerWaalsContact C-N 3.33Å; L267-V269 PolarHBondContact O-N 3.18Å; L267-I270 WeakPolarHBondContact O-CB 3.34Å; L267-I270 PolarHBondContact O-N 3.37Å; L267-I270 VanDerWaalsContact O-N 3.15Å; L267-W271 PolarHBondContact O-N 3.38Å |
| 268 | A | 89.9 | Confident | 83.4 | Confident | 42 Ų | 42 | 59.5 Ų | 59.5 | 35% | 0.347 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.1 | -40.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | T264 A265 W271 I272 | T264-A268 WeakPolarHBondContact O-CB 3.37Å; T264-A268 PolarHBondContact O-N 2.94Å; A265-A268 PolarHBondContact O-N 2.91Å; A268-W271 PolarHBondContact O-N 2.86Å; A268-I272 HydrophobicContact CB-CD1 4.46Å; A268-I272 VanDerWaalsContact O-CB 3.26Å; A268-I272 WeakPolarHBondContact O-CB 3.36Å; A268-I272 WeakPolarHBondContact O-CG1 3.29Å; A268-I272 PolarHBondContact O-N 2.77Å |
| 269 | V | 91.7 | Very high | 84.7 | Confident | 106 Ų | 106 | 61.1 Ų | 61.1 | 64% | 0.642 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64.2 | -40.9 | 174.1 | 169.9 | 0 | 0 | 0 | 0 | 111.8 | A265 K266 L267 G273 | A265-V269 WeakPolarHBondContact O-CG2 3.39Å; A265-V269 PolarHBondContact O-N 3.15Å; K266-V269 PolarHBondContact O-N 3.03Å; L267-V269 VanDerWaalsContact C-N 3.33Å; L267-V269 PolarHBondContact O-N 3.18Å; V269-G273 WeakPolarHBondContact O-CA 3.4Å; V269-G273 PolarHBondContact O-N 3.35Å |
| 270 | I | 91.9 | Very high | 85.3 | Confident | 9 Ų | 9 | 57.3 Ų | 57.3 | 5% | 0.046 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.4 | -49.2 | 175.3 | -71.9 | 164.4 | 0 | 0 | 0 | 110.9 | L183 V231 F234 A238 K266 L267 A274 | L183-I270 HydrophobicContact CD2-CD1 3.6Å; V231-I270 HydrophobicContact CG1-CG2 4.16Å; F234-I270 HydrophobicContact CB-CB 4.42Å; F234-I270 HydrophobicContact CB-CG1 3.98Å; F234-I270 HydrophobicContact CB-CG2 4.19Å; A238-I270 HydrophobicContact CB-CD1 4.2Å; K266-I270 WeakPolarHBondContact O-CG1 3.25Å; K266-I270 PolarHBondContact O-N 2.97Å; L267-I270 WeakPolarHBondContact O-CB 3.34Å; L267-I270 PolarHBondContact O-N 3.37Å; L267-I270 VanDerWaalsContact O-N 3.15Å; I270-A274 VanDerWaalsContact O-CB 3.3Å; I270-A274 WeakPolarHBondContact O-CB 3.46Å; I270-A274 PolarHBondContact O-N 3.04Å |
| 271 | W | 93.1 | Very high | 85.6 | Confident | 89 Ų | 89 | 53.4 Ų | 53.4 | 34% | 0.337 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -67.1 | -53.7 | -178.4 | -80.6 | 60.2 | 0 | 0 | 0 | 111.9 | N186 V189 W190 L267 A268 G273 A274 L275 | N186-W271 PolarHBondContact OD1-NE1 2.69Å; V189-W271 HydrophobicContact CG1-CH2 4.47Å; V189-W271 HydrophobicContact CG1-CZ2 4.29Å; W190-W271 HydrophobicContact CE3-CE3 4.48Å; W190-W271 AromaticContact CE3-CH2 3.98Å; W190-W271 HydrophobicContact CE3-CH2 3.98Å; W190-W271 HydrophobicContact CE3-CZ2 4.06Å; W190-W271 HydrophobicContact CE3-CZ3 4.19Å; W190-W271 HydrophobicContact CZ3-CD2 4.46Å; W190-W271 HydrophobicContact CZ3-CE3 4.05Å; W190-W271 HydrophobicContact CZ3-CH2 4.15Å; W190-W271 AromaticContact CZ3-CZ3 3.89Å; W190-W271 HydrophobicContact CZ3-CZ3 3.89Å; L267-W271 PolarHBondContact O-N 3.38Å; A268-W271 PolarHBondContact O-N 2.86Å; W271-G273 VanDerWaalsContact C-N 3.31Å; W271-G273 PolarHBondContact O-N 2.83Å; W271-A274 PolarHBondContact O-N 2.75Å; W271-L275 HydrophobicContact CE3-CD1 4.42Å; W271-L275 WeakPolarHBondContact O-CB 3.23Å; W271-L275 WeakPolarHBondContact O-CD1 3.11Å; W271-L275 WeakPolarHBondContact O-CG 3.43Å; W271-L275 PolarHBondContact O-N 2.8Å |
| 272 | I | 92.8 | Very high | 85.5 | Confident | 112 Ų | 112 | 50.8 Ų | 50.8 | 57% | 0.574 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -62.2 | -41.7 | -179 | -64.4 | 167.3 | 0 | 0 | 0 | 109.9 | A268 L276 | A268-I272 HydrophobicContact CB-CD1 4.46Å; A268-I272 VanDerWaalsContact O-CB 3.26Å; A268-I272 WeakPolarHBondContact O-CB 3.36Å; A268-I272 WeakPolarHBondContact O-CG1 3.29Å; A268-I272 PolarHBondContact O-N 2.77Å; I272-L276 WeakPolarHBondContact O-CB 3.26Å; I272-L276 PolarHBondContact O-N 2.91Å |
| 273 | G | 89.7 | Confident | 85.1 | Confident | 20 Ų | 20 | 54.8 Ų | 54.8 | 21% | 0.206 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.8 | -46.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | V269 W271 L277 | V269-G273 WeakPolarHBondContact O-CA 3.4Å; V269-G273 PolarHBondContact O-N 3.35Å; W271-G273 VanDerWaalsContact C-N 3.31Å; W271-G273 PolarHBondContact O-N 2.83Å; G273-L277 WeakPolarHBondContact O-CB 3.29Å; G273-L277 WeakPolarHBondContact O-CD1 3.49Å; G273-L277 VanDerWaalsContact O-CG 3.28Å; G273-L277 WeakPolarHBondContact O-CG 3.42Å; G273-L277 PolarHBondContact O-N 3.43Å; G273-L277 VanDerWaalsContact O-N 3.16Å |
| 274 | A | 90.3 | Very high | 84.5 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -68 | -46.3 | 179 | 0 | 0 | 0 | 0 | 0 | 112.7 | V231 F234 I270 W271 L277 A278 | V231-A274 HydrophobicContact CB-CB 4.35Å; V231-A274 HydrophobicContact CG2-CB 3.47Å; V231-A274 VanDerWaalsContact CG2-CB 3.47Å; F234-A274 HydrophobicContact CD2-CB 4.21Å; F234-A274 HydrophobicContact CE2-CB 4.3Å; I270-A274 VanDerWaalsContact O-CB 3.3Å; I270-A274 WeakPolarHBondContact O-CB 3.46Å; I270-A274 PolarHBondContact O-N 3.04Å; W271-A274 PolarHBondContact O-N 2.75Å; A274-L277 PolarHBondContact O-N 2.83Å; A274-A278 WeakPolarHBondContact O-CB 3.28Å; A274-A278 PolarHBondContact O-N 3.09Å; A274-A278 VanDerWaalsContact O-N 3.08Å |
| 275 | L | 89.9 | Confident | 83.8 | Confident | 49 Ų | 49 | 52.7 Ų | 52.7 | 26% | 0.257 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 178.4 | -67.4 | 166.9 | 0 | 0 | 0 | 111.2 | W190 Y223 A227 W271 L277 A278 L279 | W190-L275 HydrophobicContact CH2-CD2 3.99Å; Y223-L275 HydrophobicContact CE1-CD2 4.19Å; Y223-L275 WeakPolarHBondContact OH-CD2 3.28Å; Y223-L275 PolarHBondContact OH-O 3.5Å; A227-L275 HydrophobicContact CB-CD2 4.34Å; W271-L275 HydrophobicContact CE3-CD1 4.42Å; W271-L275 WeakPolarHBondContact O-CB 3.23Å; W271-L275 WeakPolarHBondContact O-CD1 3.11Å; W271-L275 WeakPolarHBondContact O-CG 3.43Å; W271-L275 PolarHBondContact O-N 2.8Å; L275-L277 PolarHBondContact O-N 3.33Å; L275-A278 PolarHBondContact O-N 3.37Å; L275-L279 PolarHBondContact O-N 3.21Å; L275-L279 VanDerWaalsContact O-N 3.16Å |
| 276 | L | 88.1 | Confident | 82.6 | Confident | 107 Ų | 107 | 52.5 Ų | 52.5 | 56% | 0.56 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -61.1 | -42.8 | 178.9 | -175.5 | 74.1 | 0 | 0 | 0 | 112.2 | I272 A278 L279 | I272-L276 WeakPolarHBondContact O-CB 3.26Å; I272-L276 PolarHBondContact O-N 2.91Å; L276-A278 VanDerWaalsContact C-N 3.3Å; L276-L279 HydrophobicContact CD1-CD1 3.95Å; L276-L279 WeakPolarHBondContact O-CB 3.37Å; L276-L279 PolarHBondContact O-N 2.97Å |
| 277 | L | 83.6 | Confident | 81.3 | Confident | 61 Ų | 61 | 50.6 Ų | 50.6 | 32% | 0.319 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -77.1 | -15.2 | 179.5 | -67.5 | 169.7 | 0 | 0 | 0 | 113.4 | F234 G273 A274 L275 W329 Y334 | F234-L277 HydrophobicContact CE2-CD1 4.07Å; F234-L277 HydrophobicContact CZ-CD1 3.67Å; G273-L277 WeakPolarHBondContact O-CB 3.29Å; G273-L277 WeakPolarHBondContact O-CD1 3.49Å; G273-L277 VanDerWaalsContact O-CG 3.28Å; G273-L277 WeakPolarHBondContact O-CG 3.42Å; G273-L277 PolarHBondContact O-N 3.43Å; G273-L277 VanDerWaalsContact O-N 3.16Å; A274-L277 PolarHBondContact O-N 2.83Å; L275-L277 PolarHBondContact O-N 3.33Å; L277-W329 HydrophobicContact CD2-CZ2 4.39Å; L277-Y334 WeakPolarHBondContact CB-OH 3.28Å; L277-Y334 PolarHBondContact O-OH 2.9Å |
| 278 | A | 84.5 | Confident | 79.8 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -86.4 | -19.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y223 V226 A227 A274 L275 L276 P280 E281 | Y223-A278 HydrophobicContact CD2-CB 3.69Å; Y223-A278 WeakPolarHBondContact CD2-O 3.25Å; Y223-A278 HydrophobicContact CE2-CB 3.59Å; V226-A278 HydrophobicContact CB-CB 4.35Å; V226-A278 HydrophobicContact CG1-CB 4.04Å; A227-A278 HydrophobicContact CB-CB 3.95Å; A274-A278 WeakPolarHBondContact O-CB 3.28Å; A274-A278 PolarHBondContact O-N 3.09Å; A274-A278 VanDerWaalsContact O-N 3.08Å; L275-A278 PolarHBondContact O-N 3.37Å; L276-A278 VanDerWaalsContact C-N 3.3Å; A278-P280 VanDerWaalsContact C-N 3.31Å; A278-P280 WeakPolarHBondContact O-CD 3.23Å; A278-P280 VanDerWaalsContact O-N 3.08Å; A278-E281 PolarHBondContact O-N 2.86Å; A278-E281 VanDerWaalsContact O-N 3.1Å |
| 279 | L | 80.6 | Confident | 78.2 | Confident | 63 Ų | 63 | 50.7 Ų | 50.7 | 33% | 0.33 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -48.7 | -35.8 | -177 | -73.1 | -178.7 | 0 | 0 | 0 | 116.1 | Y223 L275 L276 E281 L282 L283 | Y223-L279 HydrophobicContact CE2-CD2 4.03Å; L275-L279 PolarHBondContact O-N 3.21Å; L275-L279 VanDerWaalsContact O-N 3.16Å; L276-L279 HydrophobicContact CD1-CD1 3.95Å; L276-L279 WeakPolarHBondContact O-CB 3.37Å; L276-L279 PolarHBondContact O-N 2.97Å; L279-E281 VanDerWaalsContact C-N 3.28Å; L279-E281 PolarHBondContact O-N 3.48Å; L279-L282 HydrophobicContact CD2-CD2 4.33Å; L279-L282 WeakPolarHBondContact O-CB 3.23Å; L279-L282 PolarHBondContact O-N 3.07Å; L279-L282 VanDerWaalsContact O-N 3.12Å; L279-L283 WeakPolarHBondContact O-CG 3.47Å; L279-L283 PolarHBondContact O-N 3.23Å |
| 280 | P | 75.6 | Confident | 76.5 | Confident | 35 Ų | 35 | 49.9 Ų | 49.9 | 23% | 0.227 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -56.7 | -37.8 | 178.4 | -28 | 37.1 | 0 | 0 | 0 | 113.8 | A278 L282 L283 I284 Y322 | A278-P280 VanDerWaalsContact C-N 3.31Å; A278-P280 WeakPolarHBondContact O-CD 3.23Å; A278-P280 VanDerWaalsContact O-N 3.08Å; P280-L282 VanDerWaalsContact C-N 3.32Å; P280-L282 PolarHBondContact O-N 3.43Å; P280-L283 PolarHBondContact O-N 3.39Å; P280-I284 HydrophobicContact CB-CD1 4.13Å; P280-I284 VanDerWaalsContact O-CB 3.3Å; P280-I284 WeakPolarHBondContact O-CB 3.22Å; P280-I284 WeakPolarHBondContact O-CD1 3.32Å; P280-I284 VanDerWaalsContact O-CG1 3.27Å; P280-I284 WeakPolarHBondContact O-CG1 3.47Å; P280-I284 PolarHBondContact O-N 3.22Å; P280-Y322 HydrophobicContact CB-CD1 4.28Å; P280-Y322 HydrophobicContact CB-CD2 4.47Å; P280-Y322 HydrophobicContact CB-CE1 3.65Å; P280-Y322 HydrophobicContact CB-CE2 3.89Å; P280-Y322 VanDerWaalsContact CB-CZ 3.45Å; P280-Y322 HydrophobicContact CG-CE2 4.09Å |
| 281 | E | 73.8 | Confident | 74.6 | Confident | 9 Ų | 9 | 55.8 Ų | 55.8 | 4% | 0.042 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.4 | -38.5 | 177.2 | -73.2 | -63.9 | 123.8 | 0 | 0 | 111.9 | V226 A278 L279 L283 R285 R326 | V226-E281 HydrophobicContact CG2-CG 4.11Å; A278-E281 PolarHBondContact O-N 2.86Å; A278-E281 VanDerWaalsContact O-N 3.1Å; L279-E281 VanDerWaalsContact C-N 3.28Å; L279-E281 PolarHBondContact O-N 3.48Å; E281-L283 VanDerWaalsContact C-N 3.27Å; E281-L283 PolarHBondContact O-N 3.23Å; E281-R285 WeakPolarHBondContact O-CB 3.4Å; E281-R285 PolarHBondContact O-N 3.25Å; E281-R285 IonicContact OE2-CZ 3.43Å; E281-R285 IonicContact OE2-NE 2.71Å; E281-R285 PolarHBondContact OE2-NE 3.47Å; E281-R285 IonicContact OE2-NH2 3.81Å; E281-R285 PolarHBondContact OE2-NH2 3.01Å; E281-R326 WeakPolarHBondContact OE1-CD 3.34Å; E281-R326 IonicContact OE1-NE 3.71Å; E281-R326 IonicContact OE1-NH1 2.7Å |
| 282 | L | 74.6 | Confident | 72.6 | Confident | 51 Ų | 51 | 54.4 Ų | 54.4 | 27% | 0.267 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -67.8 | -26.6 | 178.9 | -168 | 72.1 | 0 | 0 | 0 | 112.8 | R219 V220 Y223 L279 P280 | R219-L282 HydrophobicContact CB-CD1 4.19Å; V220-L282 HydrophobicContact CG2-CD1 4.4Å; Y223-L282 HydrophobicContact CD1-CD1 4.31Å; Y223-L282 HydrophobicContact CD2-CB 3.8Å; Y223-L282 HydrophobicContact CD2-CD2 4.49Å; Y223-L282 HydrophobicContact CE2-CB 4.4Å; Y223-L282 HydrophobicContact CE2-CD2 4.48Å; Y223-L282 HydrophobicContact CG-CB 4.1Å; Y223-L282 HydrophobicContact CG-CD1 4.05Å; Y223-L282 HydrophobicContact CG-CG 4.49Å; L279-L282 HydrophobicContact CD2-CD2 4.33Å; L279-L282 WeakPolarHBondContact O-CB 3.23Å; L279-L282 PolarHBondContact O-N 3.07Å; L279-L282 VanDerWaalsContact O-N 3.12Å; P280-L282 VanDerWaalsContact C-N 3.32Å; P280-L282 PolarHBondContact O-N 3.43Å |
| 283 | L | 69.9 | Low | 70.7 | Confident | 122 Ų | 122 | 52.9 Ų | 52.9 | 64% | 0.639 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -94.4 | -29.2 | -176.1 | -65.7 | 174.5 | 0 | 0 | 0 | 113.7 | L279 P280 E281 | L279-L283 WeakPolarHBondContact O-CG 3.47Å; L279-L283 PolarHBondContact O-N 3.23Å; P280-L283 PolarHBondContact O-N 3.39Å; E281-L283 VanDerWaalsContact C-N 3.27Å; E281-L283 PolarHBondContact O-N 3.23Å |
| 284 | I | 68.4 | Low | 69.1 | Low | 23 Ų | 23 | 57.1 Ų | 57.1 | 12% | 0.118 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -101.1 | -21.8 | -170.1 | -64.3 | 168.9 | 0 | 0 | 0 | 112.3 | P280 I305 R306 I307 Y322 | P280-I284 HydrophobicContact CB-CD1 4.13Å; P280-I284 VanDerWaalsContact O-CB 3.3Å; P280-I284 WeakPolarHBondContact O-CB 3.22Å; P280-I284 WeakPolarHBondContact O-CD1 3.32Å; P280-I284 VanDerWaalsContact O-CG1 3.27Å; P280-I284 WeakPolarHBondContact O-CG1 3.47Å; P280-I284 PolarHBondContact O-N 3.22Å; I284-I305 HydrophobicContact CG2-CG2 3.54Å; I284-R306 PolarHBondContact O-N 2.98Å; I284-I307 HydrophobicContact CG2-CG1 4.29Å; I284-Y322 HydrophobicContact CD1-CD1 3.51Å; I284-Y322 HydrophobicContact CD1-CE1 4.05Å; I284-Y322 HydrophobicContact CD1-CG 4.18Å |
| 285 | R | 68.1 | Low | 67 | Low | 44 Ų | 44 | 62 Ų | 62 | 17% | 0.166 | 36% | 0.358 | C | S | . | . | B | Isolated β-bridge | trans | -85.3 | 138.2 | 179.9 | -168.6 | 172.4 | -70.6 | -103.7 | 7.7 | 111.8 | C218 E281 | C218-R285 WeakPolarHBondContact O-CD 3.34Å; E281-R285 WeakPolarHBondContact O-CB 3.4Å; E281-R285 PolarHBondContact O-N 3.25Å; E281-R285 IonicContact OE2-CZ 3.43Å; E281-R285 IonicContact OE2-NE 2.71Å; E281-R285 PolarHBondContact OE2-NE 3.47Å; E281-R285 IonicContact OE2-NH2 3.81Å; E281-R285 PolarHBondContact OE2-NH2 3.01Å |
| 286 | Q | 62.9 | Low | 65.3 | Low | 48 Ų | 48 | 68 Ų | 68 | 22% | 0.224 | 39% | 0.39 | C | S | . | . | trans | -138.2 | 155.2 | -179 | -62 | -168.2 | -22.6 | 0 | 0 | 110.4 | C218 I304 R306 | C218-Q286 VanDerWaalsContact SG-C 3.57Å; C218-Q286 PolarHBondContact SG-O 2.88Å; C218-Q286 VanDerWaalsContact SG-O 3.4Å; Q286-I304 PolarHBondContact N-O 2.82Å; Q286-I304 VanDerWaalsContact N-O 3.08Å; Q286-I304 PolarHBondContact O-N 2.9Å; Q286-R306 VanDerWaalsContact CD-O 3.24Å; Q286-R306 PolarHBondContact OE1-O 3Å | ||
| 287 | L | 57.9 | Low | 63.5 | Low | 34 Ų | 34 | 67.6 Ų | 67.6 | 18% | 0.178 | 39% | 0.386 | C | S | . | . | trans | -89.7 | 130.6 | 169.2 | -172.4 | 62 | 0 | 0 | 0 | 109.3 | W211 E215 C218 E301 C303 | W211-L287 HydrophobicContact CD2-CD1 4.43Å; W211-L287 HydrophobicContact CG-CD1 4.19Å; W211-L287 HydrophobicContact CG-CD2 4.43Å; E215-L287 HydrophobicContact CB-CB 4.09Å; E215-L287 HydrophobicContact CG-CB 4.34Å; C218-L287 HydrophobicContact CB-CB 4.23Å; C218-L287 HydrophobicContact CB-CD1 4.21Å; L287-E301 HydrophobicContact CD1-CB 4.22Å; L287-C303 HydrophobicContact CD1-CB 4.21Å | ||
| 288 | V | 59.1 | Low | 62.1 | Low | 22 Ų | 22 | 69.4 Ų | 69.4 | 13% | 0.133 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.3 | 116.4 | 176.7 | -177.2 | 0 | 0 | 0 | 0 | 108.4 | R302 I304 R306 | V288-R302 PolarHBondContact N-O 3.48Å; V288-R302 PolarHBondContact O-N 2.95Å; V288-R302 VanDerWaalsContact O-O 3.09Å; V288-I304 HydrophobicContact CB-CD1 3.9Å; V288-I304 HydrophobicContact CB-CG1 3.84Å; V288-I304 HydrophobicContact CG1-CD1 4.25Å; V288-I304 HydrophobicContact CG2-CD1 3.83Å; V288-I304 HydrophobicContact CG2-CG1 3.61Å; V288-R306 HydrophobicContact CG2-CG 4.33Å |
| 289 | A | 55.8 | Low | 60.7 | Low | 60 Ų | 60 | 72.7 Ų | 72.7 | 50% | 0.496 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.7 | 126.8 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | P299 | A289-P299 HydrophobicContact CB-CB 4.5Å |
| 290 | E | 55.1 | Low | 59.7 | Low | 89 Ų | 89 | 72.3 Ų | 72.3 | 42% | 0.416 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 115 | 175.4 | -167.8 | 165 | -156.9 | 0 | 0 | 108.4 | T292 V300 R302 | E290-T292 PolarHBondContact O-N 2.69Å; E290-V300 PolarHBondContact N-O 3.21Å; E290-V300 PolarHBondContact O-N 3.49Å; E290-R302 VanDerWaalsContact OE2-CD 3.22Å; E290-R302 WeakPolarHBondContact OE2-CD 3.33Å; E290-R302 IonicContact OE2-CZ 2.82Å; E290-R302 IonicContact OE2-NE 3.2Å; E290-R302 IonicContact OE2-NH1 3.28Å; E290-R302 PolarHBondContact OE2-NH1 3.07Å |
| 291 | D | 52.5 | Low | 58.9 | Low | 133 Ų | 133 | 74 Ų | 74 | 71% | 0.711 | 43% | 0.427 | S | S | * | . | trans | -68.3 | 121.1 | 176.4 | -62.5 | -50.7 | 0 | 0 | 0 | 109.1 | G293 | D291-G293 PolarHBondContact O-N 3.48Š| ||
| 292 | T | 52.2 | Low | 58.2 | Low | 60 Ų | 60 | 78.6 Ų | 78.6 | 37% | 0.368 | 44% | 0.444 | S | S | . | . | trans | -65.3 | -2.5 | -171.2 | -41.7 | 0 | 0 | 0 | 0 | 114.2 | E290 L294 E297 P298 | E290-T292 PolarHBondContact O-N 2.69Å; T292-L294 PolarHBondContact O-N 2.87Å; T292-E297 HydrophobicContact CG2-CG 4.39Å; T292-E297 WeakPolarHBondContact CG2-OE2 3.37Å; T292-P298 PolarHBondContact OG1-O 3.2Å | ||
| 293 | G | 52.6 | Low | 57.7 | Low | 80 Ų | 80 | 77.2 Ų | 77.2 | 83% | 0.825 | 44% | 0.439 | S | S | * | . | S | Bend | trans | 71.7 | -5.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | D291 | D291-G293 PolarHBondContact O-N 3.48Š|
| 294 | L | 56.5 | Low | 57.4 | Low | 110 Ų | 110 | 74.2 Ų | 74.2 | 58% | 0.576 | 42% | 0.422 | S | S | * | . | S | Bend | trans | -100.4 | 133.9 | 175 | -162 | 73 | 0 | 0 | 0 | 109.1 | T292 | T292-L294 PolarHBondContact O-N 2.87Š|
| 295 | P | 45.9 | Very low | 56.9 | Low | 103 Ų | 103 | 75.4 Ų | 75.4 | 67% | 0.669 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | 147.9 | 170.1 | 27.5 | -33.7 | 0 | 0 | 0 | 110.7 | E297 | P295-E297 VanDerWaalsContact C-N 3.29Å; P295-E297 PolarHBondContact O-N 2.88Å |
| 296 | D | 53.4 | Low | 56.4 | Low | 173 Ų | 173 | 79.7 Ų | 79.7 | 93% | 0.925 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.7 | 6.9 | 178.2 | -53.6 | -36.5 | 0 | 0 | 0 | 117.6 | ||
| 297 | E | 51.4 | Low | 56.2 | Low | 100 Ų | 100 | 78.9 Ų | 78.9 | 47% | 0.467 | 44% | 0.442 | S | S | . | . | S | Bend | trans | -99.1 | 130.7 | 168.6 | -163.1 | 168.3 | -174.6 | 0 | 0 | 111.1 | T292 P295 | T292-E297 HydrophobicContact CG2-CG 4.39Å; T292-E297 WeakPolarHBondContact CG2-OE2 3.37Å; P295-E297 VanDerWaalsContact C-N 3.29Å; P295-E297 PolarHBondContact O-N 2.88Å |
| 298 | P | 53.3 | Low | 56 | Low | 98 Ų | 98 | 79 Ų | 79 | 64% | 0.636 | 45% | 0.445 | S | S | * | . | P | Polyproline II helix | trans | -68 | 147.8 | -178.4 | 27.6 | -34.9 | 0 | 0 | 0 | 112.1 | T292 | T292-P298 PolarHBondContact OG1-O 3.2Š|
| 299 | P | 56.1 | Low | 55.7 | Low | 69 Ų | 69 | 84 Ų | 84 | 45% | 0.448 | 48% | 0.476 | S | S | . | . | P | Polyproline II helix | trans | -66.3 | 138.7 | -178.4 | 28.1 | -35.4 | 0 | 0 | 0 | 111.5 | A289 | A289-P299 HydrophobicContact CB-CB 4.5Š|
| 300 | V | 58.2 | Low | 55.7 | Low | 55 Ų | 55 | 85.8 Ų | 85.8 | 33% | 0.333 | 49% | 0.485 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.6 | 118.5 | -174.9 | -174.8 | 0 | 0 | 0 | 0 | 110.1 | E290 R302 | E290-V300 PolarHBondContact N-O 3.21Å; E290-V300 PolarHBondContact O-N 3.49Å; V300-R302 HydrophobicContact CG1-CG 4.07Å; V300-R302 PolarHBondContact O-N 3.46Å; V300-R302 VanDerWaalsContact O-N 3.13Å |
| 301 | E | 58.8 | Low | 55.9 | Low | 71 Ų | 71 | 85 Ų | 85 | 33% | 0.332 | 48% | 0.483 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.6 | 95.4 | 179.4 | -65.7 | -168.1 | 135.9 | 0 | 0 | 111.8 | W211 L287 | W211-E301 PolarHBondContact N-OE2 3.04Å; W211-E301 PolarHBondContact NE1-O 3.47Å; L287-E301 HydrophobicContact CD1-CB 4.22Å |
| 302 | R | 59.6 | Low | 56.7 | Low | 106 Ų | 106 | 82.9 Ų | 82.9 | 40% | 0.4 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 122.2 | -179.8 | -68.3 | 174 | 167.2 | 175.4 | -6.3 | 111.1 | V288 E290 V300 I304 | V288-R302 PolarHBondContact N-O 3.48Å; V288-R302 PolarHBondContact O-N 2.95Å; V288-R302 VanDerWaalsContact O-O 3.09Å; E290-R302 VanDerWaalsContact OE2-CD 3.22Å; E290-R302 WeakPolarHBondContact OE2-CD 3.33Å; E290-R302 IonicContact OE2-CZ 2.82Å; E290-R302 IonicContact OE2-NE 3.2Å; E290-R302 IonicContact OE2-NH1 3.28Å; E290-R302 PolarHBondContact OE2-NH1 3.07Å; V300-R302 HydrophobicContact CG1-CG 4.07Å; V300-R302 PolarHBondContact O-N 3.46Å; V300-R302 VanDerWaalsContact O-N 3.13Å; R302-I304 VanDerWaalsContact C-N 3.32Å; R302-I304 HydrophobicContact CB-CG2 4.03Å; R302-I304 PolarHBondContact O-N 3.15Å |
| 303 | C | 64.6 | Low | 57.1 | Low | 22 Ų | 22 | 86.4 Ų | 86.4 | 15% | 0.149 | 49% | 0.493 | C | S | . | . | trans | -81.8 | 75.6 | 177 | -178.3 | 0 | 0 | 0 | 0 | 111.3 | W211 C218 L287 | W211-C303 HydrophobicContact CH2-CB 3.57Å; W211-C303 HydrophobicContact CZ2-CB 3.2Å; W211-C303 HydrophobicContact CZ3-CB 4.45Å; C218-C303 VanDerWaalsContact C-SG 3.54Å; C218-C303 WeakPolarHBondContact CA-SG 3.44Å; C218-C303 HydrophobicContact CB-CB 3.75Å; C218-C303 WeakPolarHBondContact CB-SG 3.32Å; C218-C303 PolarHBondContact O-SG 2.93Å; C218-C303 VanDerWaalsContact SG-CA 3.55Å; C218-C303 WeakPolarHBondContact SG-CB 3.31Å; C218-C303 CovalentContact SG-SG 2.03Å; C218-C303 PolarHBondContact SG-SG 2.71Å; L287-C303 HydrophobicContact CD1-CB 4.21Å | ||
| 304 | I | 62.4 | Low | 57.4 | Low | 58 Ų | 58 | 90.4 Ų | 90.4 | 30% | 0.297 | 49% | 0.492 | S | S | . | . | trans | -95.5 | 156.3 | -176 | 59.4 | 172.7 | 0 | 0 | 0 | 112.9 | Q286 V288 R302 R306 | Q286-I304 PolarHBondContact N-O 2.82Å; Q286-I304 VanDerWaalsContact N-O 3.08Å; Q286-I304 PolarHBondContact O-N 2.9Å; V288-I304 HydrophobicContact CB-CD1 3.9Å; V288-I304 HydrophobicContact CB-CG1 3.84Å; V288-I304 HydrophobicContact CG1-CD1 4.25Å; V288-I304 HydrophobicContact CG2-CD1 3.83Å; V288-I304 HydrophobicContact CG2-CG1 3.61Å; R302-I304 VanDerWaalsContact C-N 3.32Å; R302-I304 HydrophobicContact CB-CG2 4.03Å; R302-I304 PolarHBondContact O-N 3.15Å; I304-R306 HydrophobicContact CD1-CG 4.04Å; I304-R306 HydrophobicContact CG1-CG 4.24Å; I304-R306 PolarHBondContact O-N 3.2Å | ||
| 305 | I | 58.9 | Low | 57.6 | Low | 48 Ų | 48 | 89.3 Ų | 89.3 | 25% | 0.246 | 49% | 0.487 | C | S | . | . | B | Isolated β-bridge | trans | -74.9 | 117.8 | 169 | -74.1 | 144 | 0 | 0 | 0 | 108.5 | I284 E323 | I284-I305 HydrophobicContact CG2-CG2 3.54Å; I305-E323 HydrophobicContact CG2-CG 4.32Å; I305-E323 WeakPolarHBondContact CG2-OE1 3.44Å |
| 306 | R | 57.2 | Low | 58.5 | Low | 134 Ų | 134 | 88.4 Ų | 88.4 | 51% | 0.506 | 47% | 0.471 | S | S | . | . | trans | -131.8 | 113.1 | 168.1 | -80.5 | -160.1 | -179.8 | 177.3 | 2.8 | 109.6 | I284 Q286 V288 I304 S308 | I284-R306 PolarHBondContact O-N 2.98Å; Q286-R306 VanDerWaalsContact CD-O 3.24Å; Q286-R306 PolarHBondContact OE1-O 3Å; V288-R306 HydrophobicContact CG2-CG 4.33Å; I304-R306 HydrophobicContact CD1-CG 4.04Å; I304-R306 HydrophobicContact CG1-CG 4.24Å; I304-R306 PolarHBondContact O-N 3.2Å; R306-S308 PolarHBondContact O-N 2.84Å | ||
| 307 | I | 58.1 | Low | 59.1 | Low | 32 Ų | 32 | 84.2 Ų | 84.2 | 16% | 0.164 | 45% | 0.451 | C | S | . | . | trans | -71.6 | 109 | 169.3 | -52.3 | 165.8 | 0 | 0 | 0 | 106.8 | I284 T309 Y316 L320 E323 | I284-I307 HydrophobicContact CG2-CG1 4.29Å; I307-T309 PolarHBondContact O-N 2.92Å; I307-Y316 HydrophobicContact CB-CD2 4.38Å; I307-Y316 HydrophobicContact CB-CE2 4.43Å; I307-Y316 HydrophobicContact CG2-CD2 3.57Å; I307-Y316 HydrophobicContact CG2-CE2 4.09Å; I307-Y316 HydrophobicContact CG2-CG 4.41Å; I307-L320 HydrophobicContact CD1-CD2 3.82Å; I307-L320 HydrophobicContact CD1-CG 3.93Å; I307-E323 HydrophobicContact CD1-CG 4.42Å | ||
| 308 | S | 53.5 | Low | 59.7 | Low | 35 Ų | 35 | 84.4 Ų | 84.4 | 25% | 0.245 | 45% | 0.454 | C | S | . | . | trans | -61 | 129 | 178.7 | -173 | 0 | 0 | 0 | 0 | 110.8 | R306 S310 L311 | R306-S308 PolarHBondContact O-N 2.84Å; S308-S310 PolarHBondContact O-N 3.23Å; S308-S310 VanDerWaalsContact O-N 3.09Å; S308-S310 PolarHBondContact OG-N 3Å; S308-S310 PolarHBondContact OG-OG 3.3Å; S308-L311 PolarHBondContact O-N 3.41Å; S308-L311 VanDerWaalsContact O-N 3.12Å | ||
| 309 | T | 52.9 | Low | 60.3 | Low | 128 Ų | 128 | 79.9 Ų | 79.9 | 79% | 0.785 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.2 | -1.4 | 175.3 | 51 | 0 | 0 | 0 | 0 | 113.6 | I307 Y316 | I307-T309 PolarHBondContact O-N 2.92Å; T309-Y316 HydrophobicContact CG2-CE2 4.29Å |
| 310 | S | 55.7 | Low | 60.8 | Low | 98 Ų | 98 | 80.8 Ų | 80.8 | 69% | 0.685 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.9 | -4.5 | 170.5 | 64.1 | 0 | 0 | 0 | 0 | 114.6 | S308 | S308-S310 PolarHBondContact O-N 3.23Å; S308-S310 VanDerWaalsContact O-N 3.09Å; S308-S310 PolarHBondContact OG-N 3Å; S308-S310 PolarHBondContact OG-OG 3.3Å |
| 311 | L | 59.7 | Low | 61.2 | Low | 72 Ų | 72 | 82.1 Ų | 82.1 | 38% | 0.377 | 44% | 0.435 | S | S | . | . | S | Bend | trans | -76.5 | 144.8 | 172.6 | -102.8 | 59.3 | 0 | 0 | 0 | 110.8 | S308 L315 | S308-L311 PolarHBondContact O-N 3.41Å; S308-L311 VanDerWaalsContact O-N 3.12Å; L311-L315 HydrophobicContact CB-CB 4.33Å; L311-L315 HydrophobicContact CD2-CB 4.05Å; L311-L315 HydrophobicContact CD2-CD1 4.4Å; L311-L315 HydrophobicContact CG-CB 4.37Å; L311-L315 HydrophobicContact CG-CD1 4.4Å |
| 312 | P | 69.3 | Low | 61.7 | Low | 88 Ų | 88 | 80.4 Ų | 80.4 | 57% | 0.571 | 43% | 0.426 | S | S | * | . | trans | -52.3 | 143 | 173.1 | -26.7 | 33.8 | 0 | 0 | 0 | 112.6 | M314 L315 Y316 | P312-M314 PolarHBondContact O-N 3.05Å; P312-L315 WeakPolarHBondContact O-CA 3.46Å; P312-L315 PolarHBondContact O-N 2.93Å; P312-Y316 PolarHBondContact O-N 3.44Å; P312-Y316 VanDerWaalsContact O-N 3.09Å | ||
| 313 | D | 60.6 | Low | 62 | Low | 135 Ų | 135 | 78.8 Ų | 78.8 | 72% | 0.722 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -49.6 | -37.6 | -172.6 | -56.6 | -41.7 | 0 | 0 | 0 | 114 | L315 Y316 V317 | D313-L315 VanDerWaalsContact C-N 3.33Å; D313-L315 PolarHBondContact O-N 2.97Å; D313-Y316 PolarHBondContact O-N 2.91Å; D313-V317 WeakPolarHBondContact O-CB 3.2Å; D313-V317 WeakPolarHBondContact O-CG2 3.33Å; D313-V317 PolarHBondContact O-N 2.9Å |
| 314 | M | 59.4 | Low | 62 | Low | 163 Ų | 163 | 80.3 Ų | 80.3 | 80% | 0.803 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -60.3 | -38.9 | 176.1 | -70.4 | -64.8 | -66.5 | 0 | 0 | 113 | P312 L318 | P312-M314 PolarHBondContact O-N 3.05Å; M314-L318 WeakPolarHBondContact O-CB 3.26Å; M314-L318 PolarHBondContact O-N 3.32Å |
| 315 | L | 61.3 | Low | 62.5 | Low | 87 Ų | 87 | 79.8 Ų | 79.8 | 46% | 0.455 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -79.7 | -30 | 175.7 | -65.8 | 179.6 | 0 | 0 | 0 | 112 | L311 P312 D313 L318 G319 | L311-L315 HydrophobicContact CB-CB 4.33Å; L311-L315 HydrophobicContact CD2-CB 4.05Å; L311-L315 HydrophobicContact CD2-CD1 4.4Å; L311-L315 HydrophobicContact CG-CB 4.37Å; L311-L315 HydrophobicContact CG-CD1 4.4Å; P312-L315 WeakPolarHBondContact O-CA 3.46Å; P312-L315 PolarHBondContact O-N 2.93Å; D313-L315 VanDerWaalsContact C-N 3.33Å; D313-L315 PolarHBondContact O-N 2.97Å; L315-L318 HydrophobicContact CD2-CD2 4.29Å; L315-G319 PolarHBondContact O-N 3.33Å |
| 316 | Y | 65.1 | Low | 63.2 | Low | 85 Ų | 85 | 79.9 Ų | 79.9 | 33% | 0.333 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.6 | -48 | 173.2 | -177.4 | -99.3 | 0 | 0 | 0 | 111.6 | I307 T309 P312 D313 G319 L320 | I307-Y316 HydrophobicContact CB-CD2 4.38Å; I307-Y316 HydrophobicContact CB-CE2 4.43Å; I307-Y316 HydrophobicContact CG2-CD2 3.57Å; I307-Y316 HydrophobicContact CG2-CE2 4.09Å; I307-Y316 HydrophobicContact CG2-CG 4.41Å; T309-Y316 HydrophobicContact CG2-CE2 4.29Å; P312-Y316 PolarHBondContact O-N 3.44Å; P312-Y316 VanDerWaalsContact O-N 3.09Å; D313-Y316 PolarHBondContact O-N 2.91Å; Y316-G319 PolarHBondContact O-N 3.47Å; Y316-L320 HydrophobicContact CD1-CD1 3.96Å; Y316-L320 HydrophobicContact CE1-CD1 3.45Å; Y316-L320 VanDerWaalsContact CE1-CD1 3.45Å; Y316-L320 HydrophobicContact CE1-CG 4.36Å; Y316-L320 PolarHBondContact O-N 3Å |
| 317 | V | 65.9 | Low | 63.8 | Low | 84 Ų | 84 | 75 Ų | 75 | 51% | 0.509 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -66 | -37.5 | 174.7 | 174.3 | 0 | 0 | 0 | 0 | 111.5 | D313 G319 L320 T321 | D313-V317 WeakPolarHBondContact O-CB 3.2Å; D313-V317 WeakPolarHBondContact O-CG2 3.33Å; D313-V317 PolarHBondContact O-N 2.9Å; V317-G319 VanDerWaalsContact C-N 3.34Å; V317-L320 PolarHBondContact O-N 3.46Å; V317-T321 PolarHBondContact O-N 2.93Å; V317-T321 PolarHBondContact O-OG1 3.27Å |
| 318 | L | 63.9 | Low | 64.7 | Low | 104 Ų | 104 | 81.1 Ų | 81.1 | 55% | 0.545 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.3 | -38.1 | 172.5 | -174.6 | 61.8 | 0 | 0 | 0 | 111.7 | M314 L315 T321 Y322 | M314-L318 WeakPolarHBondContact O-CB 3.26Å; M314-L318 PolarHBondContact O-N 3.32Å; L315-L318 HydrophobicContact CD2-CD2 4.29Å; L318-T321 WeakPolarHBondContact CA-OG1 3.22Å; L318-T321 PolarHBondContact O-OG1 2.87Å; L318-Y322 WeakPolarHBondContact O-CB 3.23Å; L318-Y322 PolarHBondContact O-N 3.32Å |
| 319 | G | 65.3 | Low | 65.9 | Low | 4 Ų | 4 | 85.5 Ų | 85.5 | 4% | 0.041 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.2 | -45 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L315 Y316 V317 Y322 E323 | L315-G319 PolarHBondContact O-N 3.33Å; Y316-G319 PolarHBondContact O-N 3.47Å; V317-G319 VanDerWaalsContact C-N 3.34Å; G319-Y322 CarbonylContact O-C 3.6Å; G319-Y322 PolarHBondContact O-N 3.35Å; G319-E323 PolarHBondContact O-N 2.72Å |
| 320 | L | 66.2 | Low | 66.8 | Low | 88 Ų | 88 | 80.4 Ų | 80.4 | 46% | 0.461 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -67 | -38.8 | 178 | -73 | 173.1 | 0 | 0 | 0 | 112.7 | I307 Y316 V317 G324 | I307-L320 HydrophobicContact CD1-CD2 3.82Å; I307-L320 HydrophobicContact CD1-CG 3.93Å; Y316-L320 HydrophobicContact CD1-CD1 3.96Å; Y316-L320 HydrophobicContact CE1-CD1 3.45Å; Y316-L320 VanDerWaalsContact CE1-CD1 3.45Å; Y316-L320 HydrophobicContact CE1-CG 4.36Å; Y316-L320 PolarHBondContact O-N 3Å; V317-L320 PolarHBondContact O-N 3.46Å; L320-G324 PolarHBondContact O-N 2.89Å |
| 321 | T | 66.9 | Low | 67.9 | Low | 82 Ų | 82 | 78.8 Ų | 78.8 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -71.5 | -33 | 173.2 | 49.4 | 0 | 0 | 0 | 0 | 111.8 | V317 L318 A325 | V317-T321 PolarHBondContact O-N 2.93Å; V317-T321 PolarHBondContact O-OG1 3.27Å; L318-T321 WeakPolarHBondContact CA-OG1 3.22Å; L318-T321 PolarHBondContact O-OG1 2.87Å; T321-A325 WeakPolarHBondContact O-CB 3.12Å; T321-A325 PolarHBondContact O-N 3Å |
| 322 | Y | 68.9 | Low | 68.9 | Low | 36 Ų | 36 | 76.4 Ų | 76.4 | 14% | 0.141 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -66.9 | -40.5 | 171.9 | -173.1 | -99.4 | 0 | 0 | 0 | 112.4 | P280 I284 L318 G319 G324 A325 R326 | P280-Y322 HydrophobicContact CB-CD1 4.28Å; P280-Y322 HydrophobicContact CB-CD2 4.47Å; P280-Y322 HydrophobicContact CB-CE1 3.65Å; P280-Y322 HydrophobicContact CB-CE2 3.89Å; P280-Y322 VanDerWaalsContact CB-CZ 3.45Å; P280-Y322 HydrophobicContact CG-CE2 4.09Å; I284-Y322 HydrophobicContact CD1-CD1 3.51Å; I284-Y322 HydrophobicContact CD1-CE1 4.05Å; I284-Y322 HydrophobicContact CD1-CG 4.18Å; L318-Y322 WeakPolarHBondContact O-CB 3.23Å; L318-Y322 PolarHBondContact O-N 3.32Å; G319-Y322 CarbonylContact O-C 3.6Å; G319-Y322 PolarHBondContact O-N 3.35Å; Y322-G324 PolarHBondContact O-N 2.66Å; Y322-A325 PolarHBondContact O-N 3.36Å; Y322-R326 HydrophobicContact CD1-CB 4.16Å; Y322-R326 HydrophobicContact CE1-CB 3.86Å; Y322-R326 HydrophobicContact CE1-CG 3.94Å; Y322-R326 HydrophobicContact CE2-CB 4.39Å; Y322-R326 WeakPolarHBondContact O-CA 3.45Å; Y322-R326 WeakPolarHBondContact O-CB 3.29Å; Y322-R326 PolarHBondContact O-N 2.86Å |
| 323 | E | 65.9 | Low | 69.3 | Low | 72 Ų | 72 | 74.1 Ų | 74.1 | 34% | 0.336 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -53.2 | -50.5 | 174.3 | -90.3 | -75.3 | 100.5 | 0 | 0 | 111.9 | I305 I307 G319 R326 | I305-E323 HydrophobicContact CG2-CG 4.32Å; I305-E323 WeakPolarHBondContact CG2-OE1 3.44Å; I307-E323 HydrophobicContact CD1-CG 4.42Å; G319-E323 PolarHBondContact O-N 2.72Å; E323-R326 IonicContact OE1-CZ 2.71Å; E323-R326 IonicContact OE1-NH1 3.74Å; E323-R326 PolarHBondContact OE1-NH1 3.4Å; E323-R326 IonicContact OE1-NH2 2.66Å; E323-R326 PolarHBondContact OE1-NH2 2.92Å; E323-R326 IonicContact OE2-NH2 3.95Å |
| 324 | G | 65.8 | Low | 70 | Confident | 53 Ų | 53 | 67.8 Ų | 67.8 | 55% | 0.546 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -72.2 | -30.4 | 178 | 0 | 0 | 0 | 0 | 0 | 114.5 | L320 Y322 | L320-G324 PolarHBondContact O-N 2.89Å; Y322-G324 PolarHBondContact O-N 2.66Å |
| 325 | A | 71.6 | Confident | 70.9 | Confident | 47 Ų | 47 | 61.4 Ų | 61.4 | 39% | 0.388 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -93.6 | -21.1 | -177 | 0 | 0 | 0 | 0 | 0 | 114.5 | T321 Y322 L327 W328 W329 | T321-A325 WeakPolarHBondContact O-CB 3.12Å; T321-A325 PolarHBondContact O-N 3Å; Y322-A325 PolarHBondContact O-N 3.36Å; A325-L327 VanDerWaalsContact C-N 3.3Å; A325-L327 PolarHBondContact O-N 3.45Å; A325-W328 CarbonylContact O-C 3.52Å; A325-W328 PolarHBondContact O-N 2.91Å; A325-W328 VanDerWaalsContact O-N 3.1Å; A325-W329 WeakPolarHBondContact O-CB 3.31Å; A325-W329 PolarHBondContact O-N 2.99Å |
| 326 | R | 73.2 | Confident | 71.9 | Confident | 50 Ų | 50 | 59 Ų | 59 | 19% | 0.189 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -52.9 | -48.6 | -174 | 170.9 | -179.3 | 60.2 | -124.9 | -13.6 | 110.8 | E281 Y322 E323 W328 W329 C330 | E281-R326 WeakPolarHBondContact OE1-CD 3.34Å; E281-R326 IonicContact OE1-NE 3.71Å; E281-R326 IonicContact OE1-NH1 2.7Å; Y322-R326 HydrophobicContact CD1-CB 4.16Å; Y322-R326 HydrophobicContact CE1-CB 3.86Å; Y322-R326 HydrophobicContact CE1-CG 3.94Å; Y322-R326 HydrophobicContact CE2-CB 4.39Å; Y322-R326 WeakPolarHBondContact O-CA 3.45Å; Y322-R326 WeakPolarHBondContact O-CB 3.29Å; Y322-R326 PolarHBondContact O-N 2.86Å; E323-R326 IonicContact OE1-CZ 2.71Å; E323-R326 IonicContact OE1-NH1 3.74Å; E323-R326 PolarHBondContact OE1-NH1 3.4Å; E323-R326 IonicContact OE1-NH2 2.66Å; E323-R326 PolarHBondContact OE1-NH2 2.92Å; E323-R326 IonicContact OE2-NH2 3.95Å; R326-W328 VanDerWaalsContact C-N 3.33Å; R326-W328 PolarHBondContact O-N 2.92Å; R326-W329 PolarHBondContact O-N 3.32Å; R326-C330 WeakPolarHBondContact O-CB 3.47Å; R326-C330 PolarHBondContact O-N 2.97Å; R326-C330 PolarHBondContact O-SG 3.13Å |
| 327 | L | 71.6 | Confident | 72.8 | Confident | 33 Ų | 33 | 60.5 Ų | 60.5 | 17% | 0.173 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.1 | -43.7 | -177.2 | -166.9 | 67 | 0 | 0 | 0 | 111.5 | A325 F331 I397 A400 Y401 | A325-L327 VanDerWaalsContact C-N 3.3Å; A325-L327 PolarHBondContact O-N 3.45Å; L327-F331 WeakPolarHBondContact O-CB 3.24Å; L327-F331 PolarHBondContact O-N 2.96Å; L327-I397 HydrophobicContact CD1-CG1 3.76Å; L327-I397 HydrophobicContact CD2-CB 4.46Å; L327-I397 HydrophobicContact CD2-CG1 4.05Å; L327-I397 HydrophobicContact CG-CG1 3.96Å; L327-A400 HydrophobicContact CD1-CB 4.5Å; L327-A400 HydrophobicContact CD2-CB 3.71Å; L327-Y401 HydrophobicContact CD2-CD2 4Å; L327-Y401 HydrophobicContact CD2-CE2 3.43Å; L327-Y401 VanDerWaalsContact CD2-CE2 3.43Å |
| 328 | W | 76.6 | Confident | 73.5 | Confident | 159 Ų | 159 | 56.9 Ų | 56.9 | 60% | 0.602 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -71.7 | -33.7 | 176.5 | -64.5 | 99.6 | 0 | 0 | 0 | 113.1 | A325 R326 G332 Y401 | A325-W328 CarbonylContact O-C 3.52Å; A325-W328 PolarHBondContact O-N 2.91Å; A325-W328 VanDerWaalsContact O-N 3.1Å; R326-W328 VanDerWaalsContact C-N 3.33Å; R326-W328 PolarHBondContact O-N 2.92Å; W328-G332 WeakPolarHBondContact O-CA 3.41Å; W328-G332 PolarHBondContact O-N 3.33Å; W328-Y401 PolarHBondContact NE1-OH 3.46Å |
| 329 | W | 77.5 | Confident | 74.2 | Confident | 127 Ų | 127 | 52.8 Ų | 52.8 | 48% | 0.481 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -68.6 | -46.5 | 174.5 | -178.1 | -95.9 | 0 | 0 | 0 | 111.1 | L277 A325 R326 G332 C333 | L277-W329 HydrophobicContact CD2-CZ2 4.39Å; A325-W329 WeakPolarHBondContact O-CB 3.31Å; A325-W329 PolarHBondContact O-N 2.99Å; R326-W329 PolarHBondContact O-N 3.32Å; W329-G332 PolarHBondContact O-N 3.03Å; W329-C333 WeakPolarHBondContact O-CB 3.17Å; W329-C333 PolarHBondContact O-N 2.71Å |
| 330 | C | 72.8 | Confident | 75.2 | Confident | 21 Ų | 21 | 58.4 Ų | 58.4 | 14% | 0.142 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.4 | -49 | 177.5 | -67.9 | 0 | 0 | 0 | 0 | 111.1 | R326 G332 Y334 F335 | R326-C330 WeakPolarHBondContact O-CB 3.47Å; R326-C330 PolarHBondContact O-N 2.97Å; R326-C330 PolarHBondContact O-SG 3.13Å; C330-G332 VanDerWaalsContact C-N 3.32Å; C330-G332 PolarHBondContact O-N 2.91Å; C330-Y334 HydrophobicContact CB-CD2 4.22Å; C330-Y334 WeakPolarHBondContact O-CB 3.35Å; C330-Y334 PolarHBondContact O-N 3.34Å; C330-F335 PolarHBondContact O-N 3.37Å |
| 331 | F | 78.9 | Confident | 76.1 | Confident | 65 Ų | 65 | 58.1 Ų | 58.1 | 29% | 0.285 | 31% | 0.306 | S | S | . | . | I | π-helix | trans | -61.7 | -38.4 | 175.5 | -177.2 | -102.2 | 0 | 0 | 0 | 112.3 | L327 F335 C336 I397 | L327-F331 WeakPolarHBondContact O-CB 3.24Å; L327-F331 PolarHBondContact O-N 2.96Å; F331-F335 HydrophobicContact CD2-CB 4.47Å; F331-F335 AromaticContact CD2-CD1 3.77Å; F331-F335 HydrophobicContact CD2-CD1 3.77Å; F331-F335 HydrophobicContact CD2-CG 4.43Å; F331-F335 AromaticContact CE2-CD1 3.48Å; F331-F335 HydrophobicContact CE2-CD1 3.48Å; F331-F335 VanDerWaalsContact CE2-CD1 3.48Å; F331-F335 AromaticContact CE2-CE1 3.87Å; F331-F335 HydrophobicContact CE2-CE1 3.87Å; F331-F335 HydrophobicContact CE2-CG 4.48Å; F331-F335 HydrophobicContact CZ-CD1 4.09Å; F331-F335 HydrophobicContact CZ-CE1 4.3Å; F331-F335 WeakPolarHBondContact O-CB 3.3Å; F331-C336 WeakPolarHBondContact CE1-SG 3.28Å; F331-C336 WeakPolarHBondContact O-CB 3.49Å; F331-C336 PolarHBondContact O-N 2.96Å; F331-I397 HydrophobicContact CD2-CD1 4.01Å; F331-I397 HydrophobicContact CE2-CD1 4.39Å |
| 332 | G | 80.6 | Confident | 76.8 | Confident | 21 Ų | 21 | 54.4 Ų | 54.4 | 22% | 0.216 | 28% | 0.284 | C | S | . | . | I | π-helix | trans | -71.7 | -54.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | W328 W329 C330 L337 | W328-G332 WeakPolarHBondContact O-CA 3.41Å; W328-G332 PolarHBondContact O-N 3.33Å; W329-G332 PolarHBondContact O-N 3.03Å; C330-G332 VanDerWaalsContact C-N 3.32Å; C330-G332 PolarHBondContact O-N 2.91Å; G332-L337 WeakPolarHBondContact O-CB 3.06Å; G332-L337 WeakPolarHBondContact O-CG 3.37Å; G332-L337 PolarHBondContact O-N 2.94Å |
| 333 | C | 77.9 | Confident | 77.5 | Confident | 40 Ų | 40 | 57.1 Ų | 57.1 | 27% | 0.27 | 30% | 0.299 | S | S | . | . | I | π-helix | trans | -89.8 | -31.1 | -166.6 | -63.6 | 0 | 0 | 0 | 0 | 114.6 | W329 P338 | W329-C333 WeakPolarHBondContact O-CB 3.17Å; W329-C333 PolarHBondContact O-N 2.71Å; C333-P338 VanDerWaalsContact O-CD 3.23Å; C333-P338 WeakPolarHBondContact O-CD 3.46Å; C333-P338 WeakPolarHBondContact O-CG 3.34Å |
| 334 | Y | 75.3 | Confident | 78.3 | Confident | 3 Ų | 3 | 55.1 Ų | 55.1 | 1% | 0.012 | 30% | 0.298 | C | S | . | . | I | π-helix | trans | -99.7 | -29.8 | 176.4 | -62.6 | -62.6 | 0 | 0 | 0 | 113.3 | V226 L229 T233 L277 C330 P338 Y385 | V226-Y334 HydrophobicContact CG1-CE2 4.15Å; L229-Y334 HydrophobicContact CD2-CD2 3.95Å; L229-Y334 HydrophobicContact CD2-CG 3.89Å; L229-Y334 HydrophobicContact CG-CG 4.14Å; T233-Y334 PolarHBondContact OG1-O 2.92Å; L277-Y334 WeakPolarHBondContact CB-OH 3.28Å; L277-Y334 PolarHBondContact O-OH 2.9Å; C330-Y334 HydrophobicContact CB-CD2 4.22Å; C330-Y334 WeakPolarHBondContact O-CB 3.35Å; C330-Y334 PolarHBondContact O-N 3.34Å; Y334-P338 WeakPolarHBondContact O-CG 3.46Å; Y334-Y385 PolarHBondContact O-OH 3.45Å |
| 335 | F | 78.4 | Confident | 79.1 | Confident | 29 Ų | 29 | 53.7 Ų | 53.7 | 13% | 0.127 | 28% | 0.28 | C | S | . | . | I | π-helix | trans | -98 | -67.8 | 178.6 | 179.9 | -102.1 | 0 | 0 | 0 | 113.4 | C330 F331 P338 T339 V389 V390 | C330-F335 PolarHBondContact O-N 3.37Å; F331-F335 HydrophobicContact CD2-CB 4.47Å; F331-F335 AromaticContact CD2-CD1 3.77Å; F331-F335 HydrophobicContact CD2-CD1 3.77Å; F331-F335 HydrophobicContact CD2-CG 4.43Å; F331-F335 AromaticContact CE2-CD1 3.48Å; F331-F335 HydrophobicContact CE2-CD1 3.48Å; F331-F335 VanDerWaalsContact CE2-CD1 3.48Å; F331-F335 AromaticContact CE2-CE1 3.87Å; F331-F335 HydrophobicContact CE2-CE1 3.87Å; F331-F335 HydrophobicContact CE2-CG 4.48Å; F331-F335 HydrophobicContact CZ-CD1 4.09Å; F331-F335 HydrophobicContact CZ-CE1 4.3Å; F331-F335 WeakPolarHBondContact O-CB 3.3Å; F335-P338 WeakPolarHBondContact O-CD 3.49Å; F335-T339 HydrophobicContact CD2-CG2 3.93Å; F335-T339 HydrophobicContact CE2-CG2 3.66Å; F335-T339 HydrophobicContact CZ-CG2 4.24Å; F335-T339 VanDerWaalsContact O-CB 3.31Å; F335-T339 WeakPolarHBondContact O-CB 3.38Å; F335-T339 VanDerWaalsContact O-CG2 3.25Å; F335-T339 WeakPolarHBondContact O-CG2 3.49Å; F335-T339 PolarHBondContact O-N 2.88Å; F335-T339 PolarHBondContact O-OG1 2.72Å; F335-V389 HydrophobicContact CD2-CG1 4Å; F335-V390 HydrophobicContact CE2-CG2 3.38Å; F335-V390 HydrophobicContact CZ-CG2 3.39Å |
| 336 | C | 82.4 | Confident | 79.4 | Confident | 37 Ų | 37 | 52.3 Ų | 52.3 | 25% | 0.25 | 27% | 0.267 | C | S | . | . | I | π-helix | trans | -66.4 | -54.9 | -171.2 | -78.5 | 0 | 0 | 0 | 0 | 114.1 | F331 T339 L340 | F331-C336 WeakPolarHBondContact CE1-SG 3.28Å; F331-C336 WeakPolarHBondContact O-CB 3.49Å; F331-C336 PolarHBondContact O-N 2.96Å; C336-T339 PolarHBondContact O-N 3.41Å; C336-T339 PolarHBondContact O-OG1 2.87Å; C336-L340 VanDerWaalsContact O-CB 3.29Å; C336-L340 WeakPolarHBondContact O-CB 3.23Å; C336-L340 WeakPolarHBondContact O-CG 3.3Å; C336-L340 PolarHBondContact O-N 3.47Å |
| 337 | L | 83 | Confident | 79.8 | Confident | 115 Ų | 115 | 54.4 Ų | 54.4 | 60% | 0.602 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -59.4 | -45.3 | -178.8 | -71.3 | 173.5 | 0 | 0 | 0 | 112 | G332 F341 | G332-L337 WeakPolarHBondContact O-CB 3.06Å; G332-L337 WeakPolarHBondContact O-CG 3.37Å; G332-L337 PolarHBondContact O-N 2.94Å; L337-F341 WeakPolarHBondContact O-CB 3.47Å; L337-F341 PolarHBondContact O-N 2.81Å |
| 338 | P | 80.3 | Confident | 80.3 | Confident | 9 Ų | 9 | 55.8 Ų | 55.8 | 6% | 0.058 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -71.9 | -37.7 | 178.8 | -23.9 | 38.9 | 0 | 0 | 0 | 114.1 | T233 C333 Y334 F335 F341 T342 | T233-P338 HydrophobicContact CG2-CB 3.75Å; T233-P338 HydrophobicContact CG2-CG 3.36Å; C333-P338 VanDerWaalsContact O-CD 3.23Å; C333-P338 WeakPolarHBondContact O-CD 3.46Å; C333-P338 WeakPolarHBondContact O-CG 3.34Å; Y334-P338 WeakPolarHBondContact O-CG 3.46Å; F335-P338 WeakPolarHBondContact O-CD 3.49Å; P338-F341 PolarHBondContact O-N 2.93Å; P338-T342 WeakPolarHBondContact O-CB 3.3Å; P338-T342 VanDerWaalsContact O-CG2 3.24Å; P338-T342 WeakPolarHBondContact O-CG2 3.16Å; P338-T342 PolarHBondContact O-N 2.94Å; P338-T342 PolarHBondContact O-OG1 3.46Å |
| 339 | T | 79.5 | Confident | 80.3 | Confident | 17 Ų | 17 | 48.3 Ų | 48.3 | 10% | 0.104 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -67.3 | -44.1 | 176.2 | 53.4 | 0 | 0 | 0 | 0 | 111.4 | F335 C336 F341 T342 I343 Y385 | F335-T339 HydrophobicContact CD2-CG2 3.93Å; F335-T339 HydrophobicContact CE2-CG2 3.66Å; F335-T339 HydrophobicContact CZ-CG2 4.24Å; F335-T339 VanDerWaalsContact O-CB 3.31Å; F335-T339 WeakPolarHBondContact O-CB 3.38Å; F335-T339 VanDerWaalsContact O-CG2 3.25Å; F335-T339 WeakPolarHBondContact O-CG2 3.49Å; F335-T339 PolarHBondContact O-N 2.88Å; F335-T339 PolarHBondContact O-OG1 2.72Å; C336-T339 PolarHBondContact O-N 3.41Å; C336-T339 PolarHBondContact O-OG1 2.87Å; T339-F341 VanDerWaalsContact C-N 3.33Å; T339-F341 PolarHBondContact O-N 3.1Å; T339-T342 WeakPolarHBondContact CA-OG1 3.29Å; T339-T342 PolarHBondContact O-N 3.48Å; T339-T342 PolarHBondContact O-OG1 3.46Å; T339-I343 WeakPolarHBondContact O-CB 3.39Å; T339-I343 WeakPolarHBondContact O-CD1 3.48Å; T339-I343 WeakPolarHBondContact O-CG1 3.48Å; T339-I343 PolarHBondContact O-N 2.92Å; T339-Y385 HydrophobicContact CG2-CD1 4.23Å; T339-Y385 HydrophobicContact CG2-CE1 4.09Å |
| 340 | L | 85.2 | Confident | 80 | Confident | 122 Ų | 122 | 44.1 Ų | 44.1 | 64% | 0.639 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -62.3 | -40.1 | 174.9 | -68.2 | 172.2 | 0 | 0 | 0 | 111.8 | C336 G344 | C336-L340 VanDerWaalsContact O-CB 3.29Å; C336-L340 WeakPolarHBondContact O-CB 3.23Å; C336-L340 WeakPolarHBondContact O-CG 3.3Å; C336-L340 PolarHBondContact O-N 3.47Å; L340-G344 PolarHBondContact O-N 2.87Å |
| 341 | F | 85.8 | Confident | 80.4 | Confident | 82 Ų | 82 | 51.7 Ų | 51.7 | 36% | 0.36 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -65.5 | -52.2 | 176 | -177.8 | -98.3 | 0 | 0 | 0 | 112.4 | C237 C240 I241 L337 P338 T339 I343 G344 C345 | C237-F341 HydrophobicContact CB-CD1 4.06Å; C237-F341 HydrophobicContact CB-CE1 4.02Å; C240-F341 HydrophobicContact CB-CE1 4.37Å; I241-F341 HydrophobicContact CD1-CE1 4.17Å; I241-F341 HydrophobicContact CD1-CZ 3.91Å; I241-F341 HydrophobicContact CG1-CE1 3.93Å; I241-F341 HydrophobicContact CG1-CZ 3.64Å; L337-F341 WeakPolarHBondContact O-CB 3.47Å; L337-F341 PolarHBondContact O-N 2.81Å; P338-F341 PolarHBondContact O-N 2.93Å; T339-F341 VanDerWaalsContact C-N 3.33Å; T339-F341 PolarHBondContact O-N 3.1Å; F341-I343 PolarHBondContact O-N 3.4Å; F341-G344 PolarHBondContact O-N 2.74Å; F341-C345 VanDerWaalsContact CZ-SG 3.59Å; F341-C345 WeakPolarHBondContact O-CB 3.36Å; F341-C345 PolarHBondContact O-N 3.25Å |
| 342 | T | 81.9 | Confident | 80.3 | Confident | 5 Ų | 5 | 54.2 Ų | 54.2 | 3% | 0.031 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -64.7 | -40.9 | -178.5 | 52.8 | 0 | 0 | 0 | 0 | 111.9 | L236 P338 T339 S346 | L236-T342 HydrophobicContact CB-CG2 4.12Å; P338-T342 WeakPolarHBondContact O-CB 3.3Å; P338-T342 VanDerWaalsContact O-CG2 3.24Å; P338-T342 WeakPolarHBondContact O-CG2 3.16Å; P338-T342 PolarHBondContact O-N 2.94Å; P338-T342 PolarHBondContact O-OG1 3.46Å; T339-T342 WeakPolarHBondContact CA-OG1 3.29Å; T339-T342 PolarHBondContact O-N 3.48Å; T339-T342 PolarHBondContact O-OG1 3.46Å; T342-S346 WeakPolarHBondContact O-CB 3.18Å; T342-S346 PolarHBondContact O-N 3.42Å; T342-S346 PolarHBondContact O-OG 3.16Å |
| 343 | I | 82.5 | Confident | 79.8 | Confident | 92 Ų | 92 | 53.9 Ų | 53.9 | 47% | 0.472 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.4 | -47.2 | 172.5 | -67.7 | 166.7 | 0 | 0 | 0 | 110.4 | T339 F341 S346 L347 | T339-I343 WeakPolarHBondContact O-CB 3.39Å; T339-I343 WeakPolarHBondContact O-CD1 3.48Å; T339-I343 WeakPolarHBondContact O-CG1 3.48Å; T339-I343 PolarHBondContact O-N 2.92Å; F341-I343 PolarHBondContact O-N 3.4Å; I343-S346 PolarHBondContact O-N 3.01Å; I343-L347 HydrophobicContact CG2-CD1 3.79Å; I343-L347 HydrophobicContact CG2-CG 4.3Å; I343-L347 WeakPolarHBondContact O-CB 3.21Å; I343-L347 VanDerWaalsContact O-CG 3.29Å; I343-L347 WeakPolarHBondContact O-CG 3.38Å; I343-L347 PolarHBondContact O-N 2.99Å |
| 344 | G | 83.9 | Confident | 79.6 | Confident | 31 Ų | 31 | 60.1 Ų | 60.1 | 32% | 0.32 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.7 | -53.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L340 F341 S346 L347 V348 | L340-G344 PolarHBondContact O-N 2.87Å; F341-G344 PolarHBondContact O-N 2.74Å; G344-S346 VanDerWaalsContact C-N 3.35Å; G344-S346 PolarHBondContact O-N 3.42Å; G344-L347 PolarHBondContact O-N 2.86Å; G344-V348 WeakPolarHBondContact O-CG2 3.33Å; G344-V348 PolarHBondContact O-N 3.34Å |
| 345 | C | 81.3 | Confident | 79.5 | Confident | 23 Ų | 23 | 66.3 Ų | 66.3 | 16% | 0.155 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.7 | -41.2 | 176.1 | -74.3 | 0 | 0 | 0 | 0 | 112.3 | C240 F341 V348 T349 | C240-C345 HydrophobicContact CB-CB 3.84Å; F341-C345 VanDerWaalsContact CZ-SG 3.59Å; F341-C345 WeakPolarHBondContact O-CB 3.36Å; F341-C345 PolarHBondContact O-N 3.25Å; C345-V348 PolarHBondContact O-N 3.17Å; C345-T349 VanDerWaalsContact O-CB 3.22Å; C345-T349 WeakPolarHBondContact O-CB 3.4Å; C345-T349 PolarHBondContact O-N 2.9Å; C345-T349 PolarHBondContact O-OG1 3Å |
| 346 | S | 77.9 | Confident | 79.1 | Confident | 17 Ų | 17 | 67.4 Ų | 67.4 | 12% | 0.119 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -65.2 | -42 | 177.5 | -62.5 | 0 | 0 | 0 | 0 | 112 | T342 I343 G344 T349 A350 | T342-S346 WeakPolarHBondContact O-CB 3.18Å; T342-S346 PolarHBondContact O-N 3.42Å; T342-S346 PolarHBondContact O-OG 3.16Å; I343-S346 PolarHBondContact O-N 3.01Å; G344-S346 VanDerWaalsContact C-N 3.35Å; G344-S346 PolarHBondContact O-N 3.42Å; S346-T349 PolarHBondContact O-N 3.43Å; S346-A350 VanDerWaalsContact O-CB 3.23Å; S346-A350 WeakPolarHBondContact O-CB 3.36Å; S346-A350 PolarHBondContact O-N 3.28Å |
| 347 | L | 81.6 | Confident | 78.5 | Confident | 94 Ų | 94 | 70.6 Ų | 70.6 | 49% | 0.492 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.8 | -42.2 | 176.2 | -74.2 | 172.9 | 0 | 0 | 0 | 112.3 | I343 G344 R351 | I343-L347 HydrophobicContact CG2-CD1 3.79Å; I343-L347 HydrophobicContact CG2-CG 4.3Å; I343-L347 WeakPolarHBondContact O-CB 3.21Å; I343-L347 VanDerWaalsContact O-CG 3.29Å; I343-L347 WeakPolarHBondContact O-CG 3.38Å; I343-L347 PolarHBondContact O-N 2.99Å; G344-L347 PolarHBondContact O-N 2.86Å; L347-R351 WeakPolarHBondContact O-CB 3.03Å; L347-R351 WeakPolarHBondContact O-CG 3.47Å; L347-R351 PolarHBondContact O-N 2.84Å |
| 348 | V | 83.4 | Confident | 78 | Confident | 62 Ų | 62 | 72.9 Ų | 72.9 | 38% | 0.376 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65.5 | -43.2 | 176.2 | 173.5 | 0 | 0 | 0 | 0 | 110.7 | F244 G344 C345 R351 K352 | F244-V348 HydrophobicContact CD2-CG1 4.17Å; F244-V348 HydrophobicContact CE2-CG1 3.65Å; G344-V348 WeakPolarHBondContact O-CG2 3.33Å; G344-V348 PolarHBondContact O-N 3.34Å; C345-V348 PolarHBondContact O-N 3.17Å; V348-R351 PolarHBondContact O-N 3.37Å; V348-K352 WeakPolarHBondContact O-CG 3.24Å; V348-K352 PolarHBondContact O-N 3.38Å |
| 349 | T | 75.3 | Confident | 77.6 | Confident | 2 Ų | 2 | 76.1 Ų | 76.1 | 1% | 0.012 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -65 | -45.7 | 178.6 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | A247 C345 S346 R351 K352 I353 N375 | A247-T349 HydrophobicContact CB-CG2 3.68Å; C345-T349 VanDerWaalsContact O-CB 3.22Å; C345-T349 WeakPolarHBondContact O-CB 3.4Å; C345-T349 PolarHBondContact O-N 2.9Å; C345-T349 PolarHBondContact O-OG1 3Å; S346-T349 PolarHBondContact O-N 3.43Å; T349-R351 VanDerWaalsContact C-N 3.34Å; T349-R351 PolarHBondContact O-N 3.34Å; T349-K352 PolarHBondContact O-N 3.4Å; T349-I353 HydrophobicContact CG2-CD1 3.8Å; T349-I353 WeakPolarHBondContact O-CG1 3.29Å; T349-I353 PolarHBondContact O-N 3.19Å; T349-N375 WeakPolarHBondContact CG2-OD1 3.37Å |
| 350 | A | 73.1 | Confident | 76.9 | Confident | 40 Ų | 40 | 76.7 Ų | 76.7 | 33% | 0.331 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.4 | -37.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | S346 R354 | S346-A350 VanDerWaalsContact O-CB 3.23Å; S346-A350 WeakPolarHBondContact O-CB 3.36Å; S346-A350 PolarHBondContact O-N 3.28Å; A350-R354 WeakPolarHBondContact O-CB 3.43Å; A350-R354 VanDerWaalsContact O-CG 3.29Å; A350-R354 WeakPolarHBondContact O-CG 3.41Å; A350-R354 PolarHBondContact O-N 2.93Å |
| 351 | R | 80.3 | Confident | 75.6 | Confident | 180 Ų | 180 | 77 Ų | 77 | 68% | 0.679 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -64.5 | -44.9 | 173.1 | -76.3 | 170.6 | -178.8 | -177.3 | 1.8 | 111.8 | L347 V348 T349 H355 | L347-R351 WeakPolarHBondContact O-CB 3.03Å; L347-R351 WeakPolarHBondContact O-CG 3.47Å; L347-R351 PolarHBondContact O-N 2.84Å; V348-R351 PolarHBondContact O-N 3.37Å; T349-R351 VanDerWaalsContact C-N 3.34Å; T349-R351 PolarHBondContact O-N 3.34Å; R351-H355 WeakPolarHBondContact O-CB 3.3Å; R351-H355 PolarHBondContact O-N 2.82Å |
| 352 | K | 75.9 | Confident | 74.2 | Confident | 117 Ų | 117 | 83.4 Ų | 83.4 | 51% | 0.509 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -60.5 | -47.3 | 176.4 | -79.1 | -74.6 | -174.2 | 174 | 0 | 111.8 | V348 T349 H355 A356 | V348-K352 WeakPolarHBondContact O-CG 3.24Å; V348-K352 PolarHBondContact O-N 3.38Å; T349-K352 PolarHBondContact O-N 3.4Å; K352-H355 PolarHBondContact O-N 2.97Å; K352-A356 PolarHBondContact O-N 2.7Å |
| 353 | I | 70.8 | Confident | 72.8 | Confident | 14 Ų | 14 | 88.3 Ų | 88.3 | 7% | 0.072 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -65.5 | -43.9 | 179.9 | -66.4 | 166.2 | 0 | 0 | 0 | 111.4 | A247 T349 H355 A356 E357 N375 | A247-I353 HydrophobicContact CB-CD1 4.32Å; A247-I353 HydrophobicContact CB-CG1 4.19Å; T349-I353 HydrophobicContact CG2-CD1 3.8Å; T349-I353 WeakPolarHBondContact O-CG1 3.29Å; T349-I353 PolarHBondContact O-N 3.19Å; I353-H355 VanDerWaalsContact C-N 3.31Å; I353-H355 PolarHBondContact O-N 3.48Å; I353-A356 PolarHBondContact O-N 3.36Å; I353-A356 VanDerWaalsContact O-N 3.17Å; I353-E357 WeakPolarHBondContact O-CB 3.3Å; I353-E357 PolarHBondContact O-N 2.98Å; I353-N375 HydrophobicContact CD1-CB 4.16Å; I353-N375 WeakPolarHBondContact CD1-ND2 3.47Å |
| 354 | R | 73.2 | Confident | 71.5 | Confident | 171 Ų | 171 | 88 Ų | 88 | 65% | 0.645 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -60.8 | -38.8 | 175.1 | -74.8 | 176.5 | -179.1 | -168.9 | 1.3 | 112.5 | A350 E357 Q358 | A350-R354 WeakPolarHBondContact O-CB 3.43Å; A350-R354 VanDerWaalsContact O-CG 3.29Å; A350-R354 WeakPolarHBondContact O-CG 3.41Å; A350-R354 PolarHBondContact O-N 2.93Å; R354-E357 PolarHBondContact O-N 2.96Å; R354-Q358 WeakPolarHBondContact O-CB 3.12Å; R354-Q358 VanDerWaalsContact O-CG 3.25Å; R354-Q358 WeakPolarHBondContact O-CG 3.4Å; R354-Q358 PolarHBondContact O-N 2.86Å |
| 355 | H | 74.4 | Confident | 70.3 | Confident | 134 Ų | 134 | 92.2 Ų | 92.2 | 62% | 0.62 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -69.5 | -35.9 | 175.7 | -169.4 | -56.7 | 0 | 0 | 0 | 112.1 | R351 K352 I353 A359 | R351-H355 WeakPolarHBondContact O-CB 3.3Å; R351-H355 PolarHBondContact O-N 2.82Å; K352-H355 PolarHBondContact O-N 2.97Å; I353-H355 VanDerWaalsContact C-N 3.31Å; I353-H355 PolarHBondContact O-N 3.48Å; H355-A359 WeakPolarHBondContact O-CB 3.25Å; H355-A359 PolarHBondContact O-N 3.33Å |
| 356 | A | 69.8 | Low | 69.1 | Low | 52 Ų | 52 | 98.5 Ų | 98.5 | 43% | 0.43 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68 | -41.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | K352 I353 A359 S360 | K352-A356 PolarHBondContact O-N 2.7Å; I353-A356 PolarHBondContact O-N 3.36Å; I353-A356 VanDerWaalsContact O-N 3.17Å; A356-A359 PolarHBondContact O-N 3.45Å; A356-S360 WeakPolarHBondContact O-CB 3.42Å; A356-S360 PolarHBondContact O-N 3.43Å |
| 357 | E | 70.3 | Confident | 68 | Low | 103 Ų | 103 | 100.5 Ų | 100.5 | 48% | 0.481 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.3 | -46.6 | 174.4 | -175.7 | 174.6 | -157.5 | 0 | 0 | 111.4 | I353 R354 A359 S360 I368 | I353-E357 WeakPolarHBondContact O-CB 3.3Å; I353-E357 PolarHBondContact O-N 2.98Å; R354-E357 PolarHBondContact O-N 2.96Å; E357-A359 VanDerWaalsContact C-N 3.31Å; E357-A359 PolarHBondContact O-N 3.34Å; E357-S360 PolarHBondContact O-N 3.25Å; E357-S360 VanDerWaalsContact O-N 3.08Å; E357-S360 PolarHBondContact O-OG 2.84Å; E357-I368 HydrophobicContact CB-CG2 4.19Å; E357-I368 HydrophobicContact CG-CG2 4.3Å |
| 358 | Q | 72.2 | Confident | 66.9 | Low | 164 Ų | 164 | 97 Ų | 97 | 77% | 0.766 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.7 | -32.8 | 175.6 | -75 | 172 | -15.8 | 0 | 0 | 113.5 | R354 S360 | R354-Q358 WeakPolarHBondContact O-CB 3.12Å; R354-Q358 VanDerWaalsContact O-CG 3.25Å; R354-Q358 WeakPolarHBondContact O-CG 3.4Å; R354-Q358 PolarHBondContact O-N 2.86Å; Q358-S360 VanDerWaalsContact C-N 3.34Å |
| 359 | A | 71.4 | Confident | 65.7 | Low | 76 Ų | 76 | 103 Ų | 103 | 63% | 0.628 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -81.1 | -12.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | H355 A356 E357 | H355-A359 WeakPolarHBondContact O-CB 3.25Å; H355-A359 PolarHBondContact O-N 3.33Å; A356-A359 PolarHBondContact O-N 3.45Å; E357-A359 VanDerWaalsContact C-N 3.31Å; E357-A359 PolarHBondContact O-N 3.34Å |
| 360 | S | 63.9 | Low | 64.8 | Low | 30 Ų | 30 | 106.6 Ų | 106.6 | 21% | 0.21 | 52% | 0.517 | C | S | . | . | trans | -88.5 | 121.9 | -172.1 | 73.6 | 0 | 0 | 0 | 0 | 113.4 | A356 E357 Q358 I368 | A356-S360 WeakPolarHBondContact O-CB 3.42Å; A356-S360 PolarHBondContact O-N 3.43Å; E357-S360 PolarHBondContact O-N 3.25Å; E357-S360 VanDerWaalsContact O-N 3.08Å; E357-S360 PolarHBondContact O-OG 2.84Å; Q358-S360 VanDerWaalsContact C-N 3.34Å; S360-I368 WeakPolarHBondContact OG-CD1 3.44Å | ||
| 361 | V | 59 | Low | 64.1 | Low | 128 Ų | 128 | 106.7 Ų | 106.7 | 78% | 0.776 | 51% | 0.511 | S | S | * | . | trans | -76.6 | 148.3 | 166.5 | -176.3 | 0 | 0 | 0 | 0 | 109.3 | S363 | V361-S363 PolarHBondContact O-N 2.9Š| ||
| 362 | R | 55.5 | Low | 63.1 | Low | 217 Ų | 217 | 100.9 Ų | 100.9 | 82% | 0.819 | 50% | 0.498 | S | S | * | . | G | 310 helix | trans | -23.5 | -27.1 | -170.9 | -163.2 | 170.8 | -178.3 | 160.6 | -2 | 120.4 | ||
| 363 | S | 53 | Low | 62.3 | Low | 107 Ų | 107 | 97.5 Ų | 97.5 | 75% | 0.748 | 48% | 0.484 | S | S | * | . | G | 310 helix | trans | -67 | -52.1 | -175.4 | -152.7 | 0 | 0 | 0 | 0 | 114 | V361 K365 | V361-S363 PolarHBondContact O-N 2.9Å; S363-K365 PolarHBondContact O-N 3.41Å |
| 364 | N | 56.3 | Low | 61.9 | Low | 86 Ų | 86 | 99.9 Ų | 99.9 | 46% | 0.46 | 50% | 0.495 | S | S | . | . | G | 310 helix | trans | -73.5 | 6 | -170 | -74 | 22.5 | 0 | 0 | 0 | 115 | K366 Q367 I368 | N364-K366 PolarHBondContact O-N 3.32Å; N364-K366 VanDerWaalsContact O-N 3.14Å; N364-Q367 PolarHBondContact O-N 3.49Å; N364-Q367 VanDerWaalsContact O-N 3.13Å; N364-I368 HydrophobicContact CB-CD1 3.84Å; N364-I368 HydrophobicContact CB-CG1 4.31Å; N364-I368 WeakPolarHBondContact O-CG1 3.39Å; N364-I368 PolarHBondContact O-N 3.06Å |
| 365 | K | 57.3 | Low | 61.6 | Low | 119 Ų | 119 | 92.8 Ų | 92.8 | 52% | 0.517 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.4 | -23.4 | -175.7 | -73.3 | -166.9 | 172.3 | -166.6 | 0 | 114.7 | S363 R369 | S363-K365 PolarHBondContact O-N 3.41Å; K365-R369 WeakPolarHBondContact O-CB 3.04Å; K365-R369 VanDerWaalsContact O-CD 3.31Å; K365-R369 WeakPolarHBondContact O-CD 3.42Å; K365-R369 WeakPolarHBondContact O-CG 3.31Å; K365-R369 PolarHBondContact O-N 3.1Å |
| 366 | K | 56.3 | Low | 61.5 | Low | 155 Ų | 155 | 89.7 Ų | 89.7 | 67% | 0.674 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -72.5 | -48.8 | 171.8 | -76.5 | -165.3 | 175.4 | -167.6 | 0 | 111.7 | N364 R369 L370 | N364-K366 PolarHBondContact O-N 3.32Å; N364-K366 VanDerWaalsContact O-N 3.14Å; K366-R369 WeakPolarHBondContact O-CB 3.48Å; K366-R369 PolarHBondContact O-N 3.09Å; K366-L370 PolarHBondContact O-N 2.92Å |
| 367 | Q | 55.7 | Low | 61.8 | Low | 59 Ų | 59 | 87.5 Ų | 87.5 | 28% | 0.276 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 180 | -176.4 | 172.9 | -13.4 | 0 | 0 | 112.1 | N364 R369 L370 E371 | N364-Q367 PolarHBondContact O-N 3.49Å; N364-Q367 VanDerWaalsContact O-N 3.13Å; Q367-R369 PolarHBondContact O-N 3.5Å; Q367-L370 PolarHBondContact O-N 2.9Å; Q367-L370 VanDerWaalsContact O-N 3.09Å; Q367-E371 PolarHBondContact NE2-OE1 3.21Å; Q367-E371 PolarHBondContact O-N 3.28Å |
| 368 | I | 58.6 | Low | 62.2 | Low | 20 Ų | 20 | 82.9 Ų | 82.9 | 10% | 0.103 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -61.6 | -32.8 | 178.2 | -65.4 | 165.5 | 0 | 0 | 0 | 111.5 | E357 S360 N364 S372 | E357-I368 HydrophobicContact CB-CG2 4.19Å; E357-I368 HydrophobicContact CG-CG2 4.3Å; S360-I368 WeakPolarHBondContact OG-CD1 3.44Å; N364-I368 HydrophobicContact CB-CD1 3.84Å; N364-I368 HydrophobicContact CB-CG1 4.31Å; N364-I368 WeakPolarHBondContact O-CG1 3.39Å; N364-I368 PolarHBondContact O-N 3.06Å; I368-S372 WeakPolarHBondContact O-CB 3.28Å; I368-S372 PolarHBondContact O-N 3.3Å |
| 369 | R | 57.8 | Low | 62.5 | Low | 190 Ų | 190 | 78 Ų | 78 | 72% | 0.717 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -65.9 | -42.4 | 173.7 | -81.5 | 172 | 174.6 | -170.6 | -3.5 | 112.6 | K365 K366 Q367 Q373 | K365-R369 WeakPolarHBondContact O-CB 3.04Å; K365-R369 VanDerWaalsContact O-CD 3.31Å; K365-R369 WeakPolarHBondContact O-CD 3.42Å; K365-R369 WeakPolarHBondContact O-CG 3.31Å; K365-R369 PolarHBondContact O-N 3.1Å; K366-R369 WeakPolarHBondContact O-CB 3.48Å; K366-R369 PolarHBondContact O-N 3.09Å; Q367-R369 PolarHBondContact O-N 3.5Å; R369-Q373 WeakPolarHBondContact O-CB 3.42Å; R369-Q373 PolarHBondContact O-N 2.74Å |
| 370 | L | 56.5 | Low | 62.9 | Low | 77 Ų | 77 | 75.1 Ų | 75.1 | 40% | 0.403 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -65.7 | -45.5 | 177.7 | -76.2 | 162 | 0 | 0 | 0 | 111.5 | K366 Q367 Q373 M374 P478 | K366-L370 PolarHBondContact O-N 2.92Å; Q367-L370 PolarHBondContact O-N 2.9Å; Q367-L370 VanDerWaalsContact O-N 3.09Å; L370-Q373 PolarHBondContact O-N 3.12Å; L370-M374 PolarHBondContact O-N 2.73Å; L370-M374 VanDerWaalsContact O-N 3.13Å; L370-P478 HydrophobicContact CD1-CG 3.83Å |
| 371 | E | 59.2 | Low | 63.9 | Low | 41 Ų | 41 | 74 Ų | 74 | 19% | 0.192 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 175.5 | -71 | 175.2 | -166.1 | 0 | 0 | 111.8 | Q367 Q373 M374 N375 | Q367-E371 PolarHBondContact NE2-OE1 3.21Å; Q367-E371 PolarHBondContact O-N 3.28Å; E371-Q373 VanDerWaalsContact C-N 3.31Å; E371-Q373 PolarHBondContact O-N 3.4Å; E371-M374 PolarHBondContact O-N 2.89Å; E371-N375 PolarHBondContact O-N 3.03Å; E371-N375 PolarHBondContact O-ND2 3.37Å |
| 372 | S | 57.8 | Low | 65 | Low | 59 Ų | 59 | 68.8 Ų | 68.8 | 41% | 0.413 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.7 | -39.8 | 175.1 | -174.2 | 0 | 0 | 0 | 0 | 112.1 | I368 N375 C376 | I368-S372 WeakPolarHBondContact O-CB 3.28Å; I368-S372 PolarHBondContact O-N 3.3Å; S372-N375 PolarHBondContact O-N 3.31Å; S372-C376 PolarHBondContact O-N 3.17Å |
| 373 | Q | 60.5 | Low | 66.3 | Low | 46 Ų | 46 | 63.8 Ų | 63.8 | 22% | 0.215 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.6 | -44.4 | 178.4 | -171.7 | -177.7 | -8.5 | 0 | 0 | 113.1 | R369 L370 E371 N375 C376 T377 L436 R438 | R369-Q373 WeakPolarHBondContact O-CB 3.42Å; R369-Q373 PolarHBondContact O-N 2.74Å; L370-Q373 PolarHBondContact O-N 3.12Å; E371-Q373 VanDerWaalsContact C-N 3.31Å; E371-Q373 PolarHBondContact O-N 3.4Å; Q373-N375 PolarHBondContact O-N 3.47Å; Q373-C376 WeakPolarHBondContact O-CB 3.23Å; Q373-C376 PolarHBondContact O-N 3.41Å; Q373-T377 PolarHBondContact O-N 3.44Å; Q373-T377 VanDerWaalsContact O-N 3.12Å; Q373-T377 PolarHBondContact O-OG1 2.82Å; Q373-L436 PolarHBondContact NE2-O 3.08Å; Q373-R438 VanDerWaalsContact NE2-CB 3.33Å |
| 374 | M | 62 | Low | 67.9 | Low | 63 Ų | 63 | 59.7 Ų | 59.7 | 31% | 0.31 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.2 | -31.7 | 176.3 | -65.2 | -171.8 | 81.3 | 0 | 0 | 111.9 | R243 L370 E371 T377 V378 | R243-M374 PolarHBondContact NH1-SD 3.33Å; L370-M374 PolarHBondContact O-N 2.73Å; L370-M374 VanDerWaalsContact O-N 3.13Å; E371-M374 PolarHBondContact O-N 2.89Å; M374-T377 WeakPolarHBondContact O-CB 3.36Å; M374-T377 PolarHBondContact O-N 3.17Å; M374-V378 PolarHBondContact O-N 2.92Å |
| 375 | N | 66.8 | Low | 69.2 | Low | 23 Ų | 23 | 56 Ų | 56 | 12% | 0.123 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -76.5 | -33.5 | 175.5 | -76.1 | -77.9 | 0 | 0 | 0 | 113 | T349 I353 E371 S372 Q373 T377 V378 V379 | T349-N375 WeakPolarHBondContact CG2-OD1 3.37Å; I353-N375 HydrophobicContact CD1-CB 4.16Å; I353-N375 WeakPolarHBondContact CD1-ND2 3.47Å; E371-N375 PolarHBondContact O-N 3.03Å; E371-N375 PolarHBondContact O-ND2 3.37Å; S372-N375 PolarHBondContact O-N 3.31Å; Q373-N375 PolarHBondContact O-N 3.47Å; N375-T377 PolarHBondContact O-N 2.74Å; N375-V378 PolarHBondContact O-N 3.45Å; N375-V379 WeakPolarHBondContact O-CG2 3.21Å; N375-V379 PolarHBondContact O-N 3.49Å |
| 376 | C | 72.6 | Confident | 70.4 | Confident | 69 Ų | 69 | 51.2 Ų | 51.2 | 47% | 0.466 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -58.2 | -38.5 | 168.9 | -177.2 | 0 | 0 | 0 | 0 | 111.5 | S372 Q373 A380 | S372-C376 PolarHBondContact O-N 3.17Å; Q373-C376 WeakPolarHBondContact O-CB 3.23Å; Q373-C376 PolarHBondContact O-N 3.41Å; C376-A380 WeakPolarHBondContact O-CB 3.4Å; C376-A380 PolarHBondContact O-N 3.24Å |
| 377 | T | 75.9 | Confident | 71.7 | Confident | 5 Ų | 5 | 46.9 Ų | 46.9 | 3% | 0.031 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.4 | -49.3 | 176 | -52.8 | 0 | 0 | 0 | 0 | 111.9 | Q373 M374 N375 V379 A380 L381 L433 C437 | Q373-T377 PolarHBondContact O-N 3.44Å; Q373-T377 VanDerWaalsContact O-N 3.12Å; Q373-T377 PolarHBondContact O-OG1 2.82Å; M374-T377 WeakPolarHBondContact O-CB 3.36Å; M374-T377 PolarHBondContact O-N 3.17Å; N375-T377 PolarHBondContact O-N 2.74Å; T377-V379 PolarHBondContact O-N 3.47Å; T377-A380 PolarHBondContact O-N 3.46Å; T377-L381 HydrophobicContact CG2-CD1 4.35Å; T377-L381 WeakPolarHBondContact O-CG 3.21Å; T377-L381 PolarHBondContact O-N 2.92Å; T377-L433 HydrophobicContact CG2-CD2 3.54Å; T377-C437 VanDerWaalsContact CG2-SG 3.54Å; T377-C437 PolarHBondContact OG1-SG 3.35Å |
| 378 | V | 77.6 | Confident | 73.1 | Confident | 7 Ų | 7 | 44.8 Ų | 44.8 | 4% | 0.042 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65 | -38.3 | 179.1 | 172.7 | 0 | 0 | 0 | 0 | 112.1 | L239 C240 R243 M374 N375 L381 A382 | L239-V378 HydrophobicContact CB-CG2 4.25Å; C240-V378 VanDerWaalsContact SG-CG1 3.57Å; R243-V378 HydrophobicContact CG-CB 4.47Å; R243-V378 HydrophobicContact CG-CG2 3.73Å; M374-V378 PolarHBondContact O-N 2.92Å; N375-V378 PolarHBondContact O-N 3.45Å; V378-L381 PolarHBondContact O-N 3.36Å; V378-A382 WeakPolarHBondContact O-CB 3.25Å; V378-A382 PolarHBondContact O-N 2.83Å |
| 379 | V | 79.3 | Confident | 74.2 | Confident | 61 Ų | 61 | 43.9 Ų | 43.9 | 37% | 0.37 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.5 | -43.7 | 172.8 | 168.3 | 0 | 0 | 0 | 0 | 111.3 | N375 T377 A382 I383 | N375-V379 WeakPolarHBondContact O-CG2 3.21Å; N375-V379 PolarHBondContact O-N 3.49Å; T377-V379 PolarHBondContact O-N 3.47Å; V379-A382 PolarHBondContact O-N 2.9Å; V379-I383 HydrophobicContact CG1-CD1 3.88Å; V379-I383 VanDerWaalsContact O-CG1 3.3Å; V379-I383 WeakPolarHBondContact O-CG1 3.49Å; V379-I383 PolarHBondContact O-N 3.42Å |
| 380 | A | 80.7 | Confident | 75.4 | Confident | 15 Ų | 15 | 37.4 Ų | 37.4 | 12% | 0.124 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -70.2 | -38.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | C376 T377 A382 I383 V384 L432 L436 | C376-A380 WeakPolarHBondContact O-CB 3.4Å; C376-A380 PolarHBondContact O-N 3.24Å; T377-A380 PolarHBondContact O-N 3.46Å; A380-A382 VanDerWaalsContact C-N 3.32Å; A380-A382 PolarHBondContact O-N 2.97Å; A380-I383 PolarHBondContact O-N 3.19Å; A380-V384 PolarHBondContact O-N 3.31Å; A380-L432 HydrophobicContact CB-CD1 4.41Å; A380-L432 HydrophobicContact CB-CD2 3.88Å; A380-L432 HydrophobicContact CB-CG 4.38Å; A380-L436 HydrophobicContact CB-CD1 3.15Å |
| 381 | L | 83.6 | Confident | 76.8 | Confident | 6 Ų | 6 | 36 Ų | 36 | 3% | 0.031 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.2 | -43.5 | 171.1 | -74.7 | 172.9 | 0 | 0 | 0 | 111.4 | L184 L236 L239 T377 V378 I383 V384 Y385 T429 L432 L433 | L184-L381 HydrophobicContact CD2-CD1 3.92Å; L236-L381 HydrophobicContact CD2-CB 3.78Å; L236-L381 HydrophobicContact CD2-CD1 4.34Å; L239-L381 HydrophobicContact CD1-CD1 4.15Å; T377-L381 HydrophobicContact CG2-CD1 4.35Å; T377-L381 WeakPolarHBondContact O-CG 3.21Å; T377-L381 PolarHBondContact O-N 2.92Å; V378-L381 PolarHBondContact O-N 3.36Å; L381-I383 VanDerWaalsContact C-N 3.32Å; L381-I383 PolarHBondContact O-N 2.99Å; L381-V384 PolarHBondContact O-N 3.32Å; L381-Y385 VanDerWaalsContact O-CB 3.3Å; L381-Y385 WeakPolarHBondContact O-CB 3.41Å; L381-Y385 PolarHBondContact O-N 3.5Å; L381-T429 HydrophobicContact CD2-CG2 4.06Å; L381-L432 HydrophobicContact CD2-CD2 4.2Å; L381-L433 HydrophobicContact CD1-CD2 4.08Å; L381-L433 HydrophobicContact CD2-CD2 4.01Å; L381-L433 HydrophobicContact CD2-CG 4.31Å; L381-L433 HydrophobicContact CG-CD2 4.25Å |
| 382 | A | 82.4 | Confident | 77.9 | Confident | 20 Ų | 20 | 34.9 Ų | 34.9 | 17% | 0.165 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.5 | -34.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V378 V379 A380 G386 | V378-A382 WeakPolarHBondContact O-CB 3.25Å; V378-A382 PolarHBondContact O-N 2.83Å; V379-A382 PolarHBondContact O-N 2.9Å; A380-A382 VanDerWaalsContact C-N 3.32Å; A380-A382 PolarHBondContact O-N 2.97Å; A382-G386 PolarHBondContact O-N 3.45Å |
| 383 | I | 83.4 | Confident | 78.9 | Confident | 111 Ų | 111 | 32.7 Ų | 32.7 | 57% | 0.569 | 20% | 0.201 | S | C | * | . | H | α-helix | trans | -66.7 | -46.3 | 173.2 | -71 | 164.2 | 0 | 0 | 0 | 111.1 | V379 A380 L381 G386 A387 | V379-I383 HydrophobicContact CG1-CD1 3.88Å; V379-I383 VanDerWaalsContact O-CG1 3.3Å; V379-I383 WeakPolarHBondContact O-CG1 3.49Å; V379-I383 PolarHBondContact O-N 3.42Å; A380-I383 PolarHBondContact O-N 3.19Å; L381-I383 VanDerWaalsContact C-N 3.32Å; L381-I383 PolarHBondContact O-N 2.99Å; I383-G386 PolarHBondContact O-N 2.92Å; I383-A387 VanDerWaalsContact O-CB 3.23Å; I383-A387 WeakPolarHBondContact O-CB 3.24Å; I383-A387 PolarHBondContact O-N 2.83Å |
| 384 | V | 85.1 | Confident | 80 | Confident | 21 Ų | 21 | 35 Ų | 35 | 13% | 0.127 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.1 | -41.1 | 177.8 | 168.3 | 0 | 0 | 0 | 0 | 111.5 | A380 L381 A387 C388 V428 L432 | A380-V384 PolarHBondContact O-N 3.31Å; L381-V384 PolarHBondContact O-N 3.32Å; V384-A387 PolarHBondContact O-N 3.12Å; V384-C388 PolarHBondContact O-N 2.91Å; V384-V428 HydrophobicContact CG1-CB 4.44Å; V384-V428 HydrophobicContact CG1-CG1 3.91Å; V384-V428 HydrophobicContact CG2-CG1 4.22Å; V384-L432 HydrophobicContact CB-CD2 4.24Å; V384-L432 HydrophobicContact CG2-CD1 4.17Å; V384-L432 HydrophobicContact CG2-CD2 3.68Å; V384-L432 HydrophobicContact CG2-CG 4.46Å |
| 385 | Y | 84.7 | Confident | 80.8 | Confident | 9 Ų | 9 | 32.6 Ų | 32.6 | 4% | 0.035 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -55.4 | -53.2 | 171.5 | -177.2 | -99.9 | 0 | 0 | 0 | 110.7 | L229 T233 L236 Y334 T339 L381 A387 C388 V389 | L229-Y385 HydrophobicContact CD1-CE2 4.21Å; L229-Y385 WeakPolarHBondContact CD1-OH 3.1Å; T233-Y385 PolarHBondContact OG1-OH 3.48Å; L236-Y385 HydrophobicContact CD1-CD1 4.1Å; L236-Y385 HydrophobicContact CD1-CD2 3.54Å; L236-Y385 HydrophobicContact CD1-CE2 4.19Å; L236-Y385 HydrophobicContact CD1-CG 3.49Å; L236-Y385 VanDerWaalsContact CD1-CG 3.49Å; Y334-Y385 PolarHBondContact O-OH 3.45Å; T339-Y385 HydrophobicContact CG2-CD1 4.23Å; T339-Y385 HydrophobicContact CG2-CE1 4.09Å; L381-Y385 VanDerWaalsContact O-CB 3.3Å; L381-Y385 WeakPolarHBondContact O-CB 3.41Å; L381-Y385 PolarHBondContact O-N 3.5Å; Y385-A387 PolarHBondContact O-N 3.16Å; Y385-C388 PolarHBondContact O-N 2.91Å; Y385-V389 HydrophobicContact CD2-CG2 3.89Å; Y385-V389 HydrophobicContact CE1-CG1 4.5Å; Y385-V389 HydrophobicContact CE2-CG2 3.73Å; Y385-V389 HydrophobicContact CG-CG2 4.33Å; Y385-V389 WeakPolarHBondContact O-CB 3.39Å; Y385-V389 VanDerWaalsContact O-CG2 3.25Å; Y385-V389 WeakPolarHBondContact O-CG2 3.24Å; Y385-V389 PolarHBondContact O-N 3.08Å |
| 386 | G | 82.8 | Confident | 81.3 | Confident | 18 Ų | 18 | 34.1 Ų | 34.1 | 19% | 0.186 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.3 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | A382 I383 C388 V390 | A382-G386 PolarHBondContact O-N 3.45Å; I383-G386 PolarHBondContact O-N 2.92Å; G386-C388 PolarHBondContact O-N 3.21Å; G386-V390 WeakPolarHBondContact O-CB 3.38Å; G386-V390 WeakPolarHBondContact O-CG2 3.38Å; G386-V390 PolarHBondContact O-N 3.22Å |
| 387 | A | 84 | Confident | 81.6 | Confident | 65 Ų | 65 | 33.1 Ų | 33.1 | 54% | 0.537 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -68.1 | -32.1 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | I383 V384 Y385 P391 | I383-A387 VanDerWaalsContact O-CB 3.23Å; I383-A387 WeakPolarHBondContact O-CB 3.24Å; I383-A387 PolarHBondContact O-N 2.83Å; V384-A387 PolarHBondContact O-N 3.12Å; Y385-A387 PolarHBondContact O-N 3.16Å; A387-P391 WeakPolarHBondContact O-CD 3.17Å; A387-P391 WeakPolarHBondContact O-CG 3.2Å |
| 388 | C | 83.6 | Confident | 81.8 | Confident | 15 Ų | 15 | 35.3 Ų | 35.3 | 10% | 0.101 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -87.5 | -42.3 | 175.6 | -63.3 | 0 | 0 | 0 | 0 | 112.5 | V384 Y385 G386 P391 E392 R425 | V384-C388 PolarHBondContact O-N 2.91Å; Y385-C388 PolarHBondContact O-N 2.91Å; G386-C388 PolarHBondContact O-N 3.21Å; C388-P391 WeakPolarHBondContact O-CD 3.25Å; C388-E392 WeakPolarHBondContact O-CB 3.2Å; C388-E392 PolarHBondContact O-N 3.16Å; C388-R425 HydrophobicContact CB-CB 3.7Å; C388-R425 HydrophobicContact CB-CG 3.98Å |
| 389 | V | 83.3 | Confident | 81.5 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -80.8 | -27.1 | -171.9 | 177.8 | 0 | 0 | 0 | 0 | 112.5 | L229 F335 Y385 N393 | L229-V389 HydrophobicContact CD1-CG1 3.76Å; L229-V389 HydrophobicContact CD1-CG2 4Å; F335-V389 HydrophobicContact CD2-CG1 4Å; Y385-V389 HydrophobicContact CD2-CG2 3.89Å; Y385-V389 HydrophobicContact CE1-CG1 4.5Å; Y385-V389 HydrophobicContact CE2-CG2 3.73Å; Y385-V389 HydrophobicContact CG-CG2 4.33Å; Y385-V389 WeakPolarHBondContact O-CB 3.39Å; Y385-V389 VanDerWaalsContact O-CG2 3.25Å; Y385-V389 WeakPolarHBondContact O-CG2 3.24Å; Y385-V389 PolarHBondContact O-N 3.08Å; V389-N393 WeakPolarHBondContact CG1-ND2 3.25Å; V389-N393 WeakPolarHBondContact O-CB 3.28Å; V389-N393 PolarHBondContact O-N 2.97Å; V389-N393 PolarHBondContact O-ND2 2.67Å |
| 390 | V | 82.8 | Confident | 81.2 | Confident | 54 Ų | 54 | 36.3 Ų | 36.3 | 33% | 0.327 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.8 | -54.6 | 173.7 | 167.4 | 0 | 0 | 0 | 0 | 111.6 | F335 G386 E392 N393 I394 | F335-V390 HydrophobicContact CE2-CG2 3.38Å; F335-V390 HydrophobicContact CZ-CG2 3.39Å; G386-V390 WeakPolarHBondContact O-CB 3.38Å; G386-V390 WeakPolarHBondContact O-CG2 3.38Å; G386-V390 PolarHBondContact O-N 3.22Å; V390-E392 VanDerWaalsContact C-N 3.33Å; V390-E392 PolarHBondContact O-N 3.45Å; V390-N393 PolarHBondContact O-N 3.25Å; V390-I394 HydrophobicContact CG1-CD1 3.63Å; V390-I394 HydrophobicContact CG1-CG1 4.42Å; V390-I394 VanDerWaalsContact O-CG1 3.3Å; V390-I394 WeakPolarHBondContact O-CG1 3.38Å; V390-I394 PolarHBondContact O-N 3.4Å |
| 391 | P | 84.1 | Confident | 80.9 | Confident | 48 Ų | 48 | 41.9 Ų | 41.9 | 31% | 0.312 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -67.3 | -33.9 | -179.4 | -19.8 | 34.3 | 0 | 0 | 0 | 112.5 | A387 C388 I394 C395 L421 | A387-P391 WeakPolarHBondContact O-CD 3.17Å; A387-P391 WeakPolarHBondContact O-CG 3.2Å; C388-P391 WeakPolarHBondContact O-CD 3.25Å; P391-I394 PolarHBondContact O-N 3.4Å; P391-C395 WeakPolarHBondContact O-CB 3.36Å; P391-C395 PolarHBondContact O-N 3.28Å; P391-C395 PolarHBondContact O-SG 3.38Å; P391-L421 HydrophobicContact CB-CD1 3.79Å |
| 392 | E | 82.3 | Confident | 80.5 | Confident | 18 Ų | 18 | 46.5 Ų | 46.5 | 8% | 0.084 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -56.7 | -52 | 172 | -176.2 | -160.3 | 138.7 | 0 | 0 | 111.2 | C388 V390 I394 C395 N396 L421 | C388-E392 WeakPolarHBondContact O-CB 3.2Å; C388-E392 PolarHBondContact O-N 3.16Å; V390-E392 VanDerWaalsContact C-N 3.33Å; V390-E392 PolarHBondContact O-N 3.45Å; E392-I394 PolarHBondContact O-N 2.9Å; E392-C395 PolarHBondContact O-N 3.44Å; E392-N396 PolarHBondContact O-N 3.16Å; E392-N396 PolarHBondContact O-ND2 3.36Å; E392-L421 HydrophobicContact CB-CB 4.44Å |
| 393 | N | 80.1 | Confident | 79.7 | Confident | 13 Ų | 13 | 48.1 Ų | 48.1 | 7% | 0.07 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.6 | -38.5 | 177.3 | -84.1 | -102 | 0 | 0 | 0 | 112 | V389 V390 N396 I397 | V389-N393 WeakPolarHBondContact CG1-ND2 3.25Å; V389-N393 WeakPolarHBondContact O-CB 3.28Å; V389-N393 PolarHBondContact O-N 2.97Å; V389-N393 PolarHBondContact O-ND2 2.67Å; V390-N393 PolarHBondContact O-N 3.25Å; N393-N396 PolarHBondContact O-N 2.82Å; N393-I397 WeakPolarHBondContact O-CB 3.5Å; N393-I397 WeakPolarHBondContact O-CD1 3.15Å; N393-I397 WeakPolarHBondContact O-CG1 3.39Å; N393-I397 PolarHBondContact O-N 3.01Å |
| 394 | I | 82.4 | Confident | 78.8 | Confident | 95 Ų | 95 | 48.2 Ų | 48.2 | 49% | 0.487 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | 175.4 | -69.9 | 167.3 | 0 | 0 | 0 | 110.8 | V390 P391 E392 N396 I397 V398 | V390-I394 HydrophobicContact CG1-CD1 3.63Å; V390-I394 HydrophobicContact CG1-CG1 4.42Å; V390-I394 VanDerWaalsContact O-CG1 3.3Å; V390-I394 WeakPolarHBondContact O-CG1 3.38Å; V390-I394 PolarHBondContact O-N 3.4Å; P391-I394 PolarHBondContact O-N 3.4Å; E392-I394 PolarHBondContact O-N 2.9Å; I394-N396 VanDerWaalsContact C-N 3.33Å; I394-N396 PolarHBondContact O-N 3.28Å; I394-I397 PolarHBondContact O-N 3.09Å; I394-V398 HydrophobicContact CG2-CG2 4.32Å; I394-V398 WeakPolarHBondContact O-CB 3.31Å; I394-V398 VanDerWaalsContact O-CG2 3.29Å; I394-V398 WeakPolarHBondContact O-CG2 3.22Å; I394-V398 PolarHBondContact O-N 2.79Å |
| 395 | C | 80 | Confident | 78 | Confident | 11 Ų | 11 | 50.2 Ų | 50.2 | 7% | 0.074 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.5 | -42.5 | 177.5 | -65.7 | 0 | 0 | 0 | 0 | 111.4 | P391 E392 V398 S399 L414 | P391-C395 WeakPolarHBondContact O-CB 3.36Å; P391-C395 PolarHBondContact O-N 3.28Å; P391-C395 PolarHBondContact O-SG 3.38Å; E392-C395 PolarHBondContact O-N 3.44Å; C395-V398 PolarHBondContact O-N 3.42Å; C395-S399 WeakPolarHBondContact O-CB 3.43Å; C395-S399 PolarHBondContact O-N 2.93Å; C395-S399 PolarHBondContact O-OG 2.99Å; C395-L414 HydrophobicContact CB-CD2 4.23Å |
| 396 | N | 76.7 | Confident | 77.5 | Confident | 55 Ų | 55 | 51.3 Ų | 51.3 | 29% | 0.294 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.7 | -37.8 | 178 | -64.6 | -15.1 | 0 | 0 | 0 | 112.1 | E392 N393 I394 A400 S418 | E392-N396 PolarHBondContact O-N 3.16Å; E392-N396 PolarHBondContact O-ND2 3.36Å; N393-N396 PolarHBondContact O-N 2.82Å; I394-N396 VanDerWaalsContact C-N 3.33Å; I394-N396 PolarHBondContact O-N 3.28Å; N396-A400 WeakPolarHBondContact O-CB 3.16Å; N396-A400 PolarHBondContact O-N 2.66Å; N396-S418 WeakPolarHBondContact OD1-CB 3.42Å; N396-S418 PolarHBondContact OD1-OG 3.4Å |
| 397 | I | 79.6 | Confident | 77.2 | Confident | 48 Ų | 48 | 53.9 Ų | 53.9 | 25% | 0.246 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -68.1 | -43.7 | 175.1 | -70.1 | 164.2 | 0 | 0 | 0 | 111.4 | L327 F331 N393 I394 A400 Y401 | L327-I397 HydrophobicContact CD1-CG1 3.76Å; L327-I397 HydrophobicContact CD2-CB 4.46Å; L327-I397 HydrophobicContact CD2-CG1 4.05Å; L327-I397 HydrophobicContact CG-CG1 3.96Å; F331-I397 HydrophobicContact CD2-CD1 4.01Å; F331-I397 HydrophobicContact CE2-CD1 4.39Å; N393-I397 WeakPolarHBondContact O-CB 3.5Å; N393-I397 WeakPolarHBondContact O-CD1 3.15Å; N393-I397 WeakPolarHBondContact O-CG1 3.39Å; N393-I397 PolarHBondContact O-N 3.01Å; I394-I397 PolarHBondContact O-N 3.09Å; I397-A400 PolarHBondContact O-N 2.99Å; I397-Y401 HydrophobicContact CG2-CD2 3.98Å; I397-Y401 HydrophobicContact CG2-CE2 4.41Å; I397-Y401 PolarHBondContact O-N 3.38Å |
| 398 | V | 79.8 | Confident | 76.6 | Confident | 52 Ų | 52 | 57.7 Ų | 57.7 | 32% | 0.315 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -62.5 | -45 | 175.7 | 169.9 | 0 | 0 | 0 | 0 | 110.1 | I394 C395 A400 Y401 M402 L414 | I394-V398 HydrophobicContact CG2-CG2 4.32Å; I394-V398 WeakPolarHBondContact O-CB 3.31Å; I394-V398 VanDerWaalsContact O-CG2 3.29Å; I394-V398 WeakPolarHBondContact O-CG2 3.22Å; I394-V398 PolarHBondContact O-N 2.79Å; C395-V398 PolarHBondContact O-N 3.42Å; V398-A400 VanDerWaalsContact C-N 3.28Å; V398-A400 PolarHBondContact O-N 2.89Å; V398-Y401 PolarHBondContact O-N 3.46Å; V398-M402 HydrophobicContact CG1-CB 4.25Å; V398-M402 HydrophobicContact CG1-CG 4.31Å; V398-M402 WeakPolarHBondContact O-CA 3.43Å; V398-M402 VanDerWaalsContact O-CB 3.29Å; V398-M402 WeakPolarHBondContact O-CB 3.48Å; V398-M402 PolarHBondContact O-N 3.42Å; V398-L414 HydrophobicContact CG1-CD1 3.91Å |
| 399 | S | 72.2 | Confident | 76.1 | Confident | 29 Ų | 29 | 63.1 Ų | 63.1 | 20% | 0.203 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.2 | -31.3 | 177.3 | -55.7 | 0 | 0 | 0 | 0 | 112.7 | C395 M411 | C395-S399 WeakPolarHBondContact O-CB 3.43Å; C395-S399 PolarHBondContact O-N 2.93Å; C395-S399 PolarHBondContact O-OG 2.99Å; S399-M411 WeakPolarHBondContact O-CE 3.2Å |
| 400 | A | 72.1 | Confident | 75.7 | Confident | 59 Ų | 59 | 65.6 Ų | 65.6 | 49% | 0.488 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -74.6 | -40.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | L327 N396 I397 V398 | L327-A400 HydrophobicContact CD1-CB 4.5Å; L327-A400 HydrophobicContact CD2-CB 3.71Å; N396-A400 WeakPolarHBondContact O-CB 3.16Å; N396-A400 PolarHBondContact O-N 2.66Å; I397-A400 PolarHBondContact O-N 2.99Å; V398-A400 VanDerWaalsContact C-N 3.28Å; V398-A400 PolarHBondContact O-N 2.89Å |
| 401 | Y | 74.9 | Confident | 75.3 | Confident | 133 Ų | 133 | 65 Ų | 65 | 52% | 0.522 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -98.5 | -26.2 | -172.9 | -75.4 | -61 | 0 | 0 | 0 | 115.4 | L327 W328 I397 V398 | L327-Y401 HydrophobicContact CD2-CD2 4Å; L327-Y401 HydrophobicContact CD2-CE2 3.43Å; L327-Y401 VanDerWaalsContact CD2-CE2 3.43Å; W328-Y401 PolarHBondContact NE1-OH 3.46Å; I397-Y401 HydrophobicContact CG2-CD2 3.98Å; I397-Y401 HydrophobicContact CG2-CE2 4.41Å; I397-Y401 PolarHBondContact O-N 3.38Å; V398-Y401 PolarHBondContact O-N 3.46Å |
| 402 | M | 73.8 | Confident | 74.7 | Confident | 102 Ų | 102 | 66.3 Ų | 66.3 | 50% | 0.502 | 40% | 0.395 | S | S | . | . | S | Bend | trans | -103.5 | 4.1 | -175.1 | -60.8 | -63.7 | -62.9 | 0 | 0 | 113.6 | V398 A404 G405 V406 | V398-M402 HydrophobicContact CG1-CB 4.25Å; V398-M402 HydrophobicContact CG1-CG 4.31Å; V398-M402 WeakPolarHBondContact O-CA 3.43Å; V398-M402 VanDerWaalsContact O-CB 3.29Å; V398-M402 WeakPolarHBondContact O-CB 3.48Å; V398-M402 PolarHBondContact O-N 3.42Å; M402-A404 PolarHBondContact O-N 3.26Å; M402-A404 VanDerWaalsContact O-N 3.09Å; M402-G405 CarbonylContact O-C 3.55Å; M402-G405 PolarHBondContact O-N 2.94Å; M402-V406 HydrophobicContact CB-CG2 3.74Å; M402-V406 WeakPolarHBondContact O-CG2 3.33Å; M402-V406 PolarHBondContact O-N 2.89Å; M402-V406 VanDerWaalsContact O-N 3.09Å |
| 403 | A | 66.7 | Low | 74.5 | Confident | 55 Ų | 55 | 70 Ų | 70 | 46% | 0.455 | 42% | 0.419 | S | S | . | . | G | 310 helix | trans | -50.3 | -37.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | G405 M411 | A403-G405 VanDerWaalsContact C-N 3.27Å; A403-G405 PolarHBondContact O-N 3.22Å; A403-M411 HydrophobicContact CB-CE 3.67Å |
| 404 | A | 65.1 | Low | 74.4 | Confident | 113 Ų | 113 | 70.9 Ų | 70.9 | 93% | 0.934 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -77.2 | -5.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | M402 | M402-A404 PolarHBondContact O-N 3.26Å; M402-A404 VanDerWaalsContact O-N 3.09Å |
| 405 | G | 67.6 | Low | 74.2 | Confident | 63 Ų | 63 | 70.4 Ų | 70.4 | 65% | 0.649 | 42% | 0.419 | S | S | * | . | G | 310 helix | trans | -129.7 | 5.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | M402 A403 | M402-G405 CarbonylContact O-C 3.55Å; M402-G405 PolarHBondContact O-N 2.94Å; A403-G405 VanDerWaalsContact C-N 3.27Å; A403-G405 PolarHBondContact O-N 3.22Å |
| 406 | V | 73.2 | Confident | 74.2 | Confident | 32 Ų | 32 | 71.7 Ų | 71.7 | 19% | 0.194 | 43% | 0.425 | C | S | . | . | S | Bend | trans | -121.4 | 128.1 | -178.2 | 172.6 | 0 | 0 | 0 | 0 | 108.7 | M402 T410 M411 | M402-V406 HydrophobicContact CB-CG2 3.74Å; M402-V406 WeakPolarHBondContact O-CG2 3.33Å; M402-V406 PolarHBondContact O-N 2.89Å; M402-V406 VanDerWaalsContact O-N 3.09Å; V406-T410 HydrophobicContact CG1-CG2 3.5Å; V406-T410 VanDerWaalsContact CG1-CG2 3.5Å; V406-M411 HydrophobicContact CB-CG 4.39Å; V406-M411 HydrophobicContact CB-SD 3.78Å; V406-M411 HydrophobicContact CG1-CG 3.93Å; V406-M411 HydrophobicContact CG1-SD 3.59Å; V406-M411 VanDerWaalsContact CG1-SD 3.59Å |
| 407 | P | 77.3 | Confident | 74.5 | Confident | 71 Ų | 71 | 72.7 Ų | 72.7 | 46% | 0.461 | 43% | 0.43 | S | S | . | . | trans | -68.5 | 146.7 | -178.9 | 29.3 | -36.1 | 0 | 0 | 0 | 111.7 | H409 T410 M411 | P407-H409 VanDerWaalsContact C-N 3.29Å; P407-H409 WeakPolarHBondContact CG-CE1 3.47Å; P407-H409 PolarHBondContact O-N 3.23Å; P407-H409 VanDerWaalsContact O-N 3.09Å; P407-T410 WeakPolarHBondContact O-CB 3.12Å; P407-T410 PolarHBondContact O-N 3.29Å; P407-M411 PolarHBondContact O-N 2.97Å | ||
| 408 | E | 72.2 | Confident | 74.7 | Confident | 146 Ų | 146 | 70.7 Ų | 70.7 | 68% | 0.682 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -52.5 | -39.8 | -168.1 | -60.7 | -169.7 | 154.5 | 0 | 0 | 114.3 | T410 M411 S412 | E408-T410 PolarHBondContact O-N 3.27Å; E408-M411 WeakPolarHBondContact O-CA 3.23Å; E408-M411 WeakPolarHBondContact O-CB 3.18Å; E408-M411 PolarHBondContact O-N 3.31Å; E408-S412 PolarHBondContact O-N 2.97Å; E408-S412 PolarHBondContact O-OG 2.97Å |
| 409 | H | 71.2 | Confident | 74.9 | Confident | 128 Ų | 128 | 69.2 Ų | 69.2 | 59% | 0.593 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -57.2 | -35.9 | 177.1 | 67 | -99.2 | 0 | 0 | 0 | 112.9 | P407 V413 | P407-H409 VanDerWaalsContact C-N 3.29Å; P407-H409 WeakPolarHBondContact CG-CE1 3.47Å; P407-H409 PolarHBondContact O-N 3.23Å; P407-H409 VanDerWaalsContact O-N 3.09Å; H409-V413 VanDerWaalsContact O-CG2 3.31Å; H409-V413 WeakPolarHBondContact O-CG2 3.47Å; H409-V413 PolarHBondContact O-N 3.29Å; H409-V413 VanDerWaalsContact O-N 3.14Å |
| 410 | T | 76.1 | Confident | 75.6 | Confident | 52 Ų | 52 | 69.9 Ų | 69.9 | 32% | 0.319 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -74.3 | -33.4 | 177.4 | -65.7 | 0 | 0 | 0 | 0 | 110.7 | V406 P407 E408 V413 L414 | V406-T410 HydrophobicContact CG1-CG2 3.5Å; V406-T410 VanDerWaalsContact CG1-CG2 3.5Å; P407-T410 WeakPolarHBondContact O-CB 3.12Å; P407-T410 PolarHBondContact O-N 3.29Å; E408-T410 PolarHBondContact O-N 3.27Å; T410-V413 PolarHBondContact O-N 3.43Å; T410-L414 HydrophobicContact CG2-CD1 4.12Å; T410-L414 HydrophobicContact CG2-CG 4.42Å; T410-L414 WeakPolarHBondContact O-CB 3.48Å; T410-L414 VanDerWaalsContact O-CG 3.27Å; T410-L414 WeakPolarHBondContact O-CG 3.13Å; T410-L414 PolarHBondContact O-N 2.85Å |
| 411 | M | 73.2 | Confident | 76.4 | Confident | 41 Ų | 41 | 68.7 Ų | 68.7 | 20% | 0.202 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -64.7 | -44.9 | 174.6 | -59.1 | -66.4 | -71 | 0 | 0 | 111.3 | S399 A403 V406 P407 E408 L414 H415 | S399-M411 WeakPolarHBondContact O-CE 3.2Å; A403-M411 HydrophobicContact CB-CE 3.67Å; V406-M411 HydrophobicContact CB-CG 4.39Å; V406-M411 HydrophobicContact CB-SD 3.78Å; V406-M411 HydrophobicContact CG1-CG 3.93Å; V406-M411 HydrophobicContact CG1-SD 3.59Å; V406-M411 VanDerWaalsContact CG1-SD 3.59Å; P407-M411 PolarHBondContact O-N 2.97Å; E408-M411 WeakPolarHBondContact O-CA 3.23Å; E408-M411 WeakPolarHBondContact O-CB 3.18Å; E408-M411 PolarHBondContact O-N 3.31Å; M411-L414 PolarHBondContact O-N 3.48Å; M411-H415 PolarHBondContact O-N 2.97Å |
| 412 | S | 73.5 | Confident | 77.1 | Confident | 76 Ų | 76 | 62.6 Ų | 62.6 | 53% | 0.531 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -60.8 | -44.5 | 174.9 | -56.1 | 0 | 0 | 0 | 0 | 112 | E408 L414 H415 L416 | E408-S412 PolarHBondContact O-N 2.97Å; E408-S412 PolarHBondContact O-OG 2.97Å; S412-L414 PolarHBondContact O-N 2.88Å; S412-H415 PolarHBondContact O-N 2.67Å; S412-L416 WeakPolarHBondContact O-CB 3.46Å; S412-L416 PolarHBondContact O-N 3.22Å |
| 413 | V | 77.6 | Confident | 77.9 | Confident | 96 Ų | 96 | 58 Ų | 58 | 58% | 0.582 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -64.5 | -38 | 176.5 | 170.1 | 0 | 0 | 0 | 0 | 112.1 | H409 T410 L417 | H409-V413 VanDerWaalsContact O-CG2 3.31Å; H409-V413 WeakPolarHBondContact O-CG2 3.47Å; H409-V413 PolarHBondContact O-N 3.29Å; H409-V413 VanDerWaalsContact O-N 3.14Å; T410-V413 PolarHBondContact O-N 3.43Å; V413-L417 WeakPolarHBondContact O-CB 3.45Å; V413-L417 PolarHBondContact O-N 3.43Å |
| 414 | L | 77.8 | Confident | 79.1 | Confident | 31 Ų | 31 | 57.1 Ų | 57.1 | 16% | 0.162 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -66.1 | -39.2 | 176.1 | -77.3 | 169.2 | 0 | 0 | 0 | 112.6 | C395 V398 T410 M411 S412 S418 | C395-L414 HydrophobicContact CB-CD2 4.23Å; V398-L414 HydrophobicContact CG1-CD1 3.91Å; T410-L414 HydrophobicContact CG2-CD1 4.12Å; T410-L414 HydrophobicContact CG2-CG 4.42Å; T410-L414 WeakPolarHBondContact O-CB 3.48Å; T410-L414 VanDerWaalsContact O-CG 3.27Å; T410-L414 WeakPolarHBondContact O-CG 3.13Å; T410-L414 PolarHBondContact O-N 2.85Å; M411-L414 PolarHBondContact O-N 3.48Å; S412-L414 PolarHBondContact O-N 2.88Å; L414-S418 PolarHBondContact O-N 2.91Å; L414-S418 VanDerWaalsContact O-N 3.08Å |
| 415 | H | 77.1 | Confident | 80.3 | Confident | 85 Ų | 85 | 52 Ų | 52 | 39% | 0.394 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -69.2 | -46.3 | 176.9 | -170.9 | 34.7 | 0 | 0 | 0 | 111.7 | M411 S412 L417 S418 Q419 | M411-H415 PolarHBondContact O-N 2.97Å; S412-H415 PolarHBondContact O-N 2.67Å; H415-L417 VanDerWaalsContact C-N 3.26Å; H415-L417 PolarHBondContact O-N 3.45Å; H415-S418 PolarHBondContact O-N 3.01Å; H415-S418 VanDerWaalsContact O-N 3.15Å; H415-S418 PolarHBondContact O-OG 2.95Å; H415-S418 VanDerWaalsContact O-OG 3.11Å; H415-Q419 WeakPolarHBondContact O-CG 3.44Å; H415-Q419 PolarHBondContact O-N 3.46Å |
| 416 | L | 80.4 | Confident | 81.5 | Confident | 39 Ų | 39 | 49 Ų | 49 | 20% | 0.204 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61 | -36.6 | 176 | -175.3 | 143.1 | 0 | 0 | 0 | 111.6 | I148 E206 S412 L420 | I148-L416 HydrophobicContact CD1-CD1 3.5Å; I148-L416 HydrophobicContact CG1-CD1 3.94Å; I148-L416 HydrophobicContact CG1-CD2 4.26Å; E206-L416 HydrophobicContact CG-CD1 4.09Å; S412-L416 WeakPolarHBondContact O-CB 3.46Å; S412-L416 PolarHBondContact O-N 3.22Å; L416-L420 WeakPolarHBondContact O-CB 3.48Å; L416-L420 PolarHBondContact O-N 3.37Å |
| 417 | L | 83.4 | Confident | 82.4 | Confident | 75 Ų | 75 | 47.7 Ų | 47.7 | 39% | 0.393 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -66.2 | -41.7 | 174.7 | -178.6 | 60.7 | 0 | 0 | 0 | 112.3 | V413 H415 L420 L421 | V413-L417 WeakPolarHBondContact O-CB 3.45Å; V413-L417 PolarHBondContact O-N 3.43Å; H415-L417 VanDerWaalsContact C-N 3.26Å; H415-L417 PolarHBondContact O-N 3.45Å; L417-L420 PolarHBondContact O-N 3.23Å; L417-L421 HydrophobicContact CD1-CD1 4.38Å; L417-L421 HydrophobicContact CD1-CG 4.46Å; L417-L421 HydrophobicContact CG-CD1 4.15Å; L417-L421 WeakPolarHBondContact O-CB 3.45Å; L417-L421 WeakPolarHBondContact O-CD1 3.22Å; L417-L421 VanDerWaalsContact O-CG 3.24Å; L417-L421 WeakPolarHBondContact O-CG 3.31Å; L417-L421 PolarHBondContact O-N 3.42Å |
| 418 | S | 83.6 | Confident | 83 | Confident | 6 Ų | 6 | 47.4 Ų | 47.4 | 4% | 0.042 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -69.1 | -40.3 | 178.5 | 68.4 | 0 | 0 | 0 | 0 | 112.3 | N396 L414 H415 L421 L422 | N396-S418 WeakPolarHBondContact OD1-CB 3.42Å; N396-S418 PolarHBondContact OD1-OG 3.4Å; L414-S418 PolarHBondContact O-N 2.91Å; L414-S418 VanDerWaalsContact O-N 3.08Å; H415-S418 PolarHBondContact O-N 3.01Å; H415-S418 VanDerWaalsContact O-N 3.15Å; H415-S418 PolarHBondContact O-OG 2.95Å; H415-S418 VanDerWaalsContact O-OG 3.11Å; S418-L421 PolarHBondContact O-N 3.12Å; S418-L422 PolarHBondContact O-N 3.26Å |
| 419 | Q | 85 | Confident | 83.8 | Confident | 22 Ų | 22 | 41 Ų | 41 | 10% | 0.103 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -59.7 | -47 | 170.6 | -70.6 | 176.5 | -47.7 | 0 | 0 | 111.9 | H415 L421 L422 F423 | H415-Q419 WeakPolarHBondContact O-CG 3.44Å; H415-Q419 PolarHBondContact O-N 3.46Å; Q419-L421 VanDerWaalsContact C-N 3.3Å; Q419-L421 PolarHBondContact O-N 2.67Å; Q419-L422 WeakPolarHBondContact O-CB 3.35Å; Q419-L422 PolarHBondContact O-N 3.08Å; Q419-L422 VanDerWaalsContact O-N 3.17Å; Q419-F423 HydrophobicContact CB-CE2 4.33Å; Q419-F423 WeakPolarHBondContact O-CD2 3.3Å; Q419-F423 PolarHBondContact O-N 3.29Å; Q419-F423 VanDerWaalsContact O-N 3.16Å |
| 420 | L | 86.6 | Confident | 84.7 | Confident | 43 Ų | 43 | 34.9 Ų | 34.9 | 23% | 0.225 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -61.5 | -37.7 | 179.6 | -170.3 | 67.3 | 0 | 0 | 0 | 112.2 | V151 I155 L416 L417 F423 C424 | V151-L420 HydrophobicContact CG1-CD1 4.06Å; V151-L420 HydrophobicContact CG1-CD2 4.3Å; I155-L420 HydrophobicContact CD1-CD1 3.48Å; I155-L420 VanDerWaalsContact CD1-CD1 3.48Å; I155-L420 HydrophobicContact CD1-CG 4.32Å; L416-L420 WeakPolarHBondContact O-CB 3.48Å; L416-L420 PolarHBondContact O-N 3.37Å; L417-L420 PolarHBondContact O-N 3.23Å; L420-F423 PolarHBondContact O-N 3.1Å; L420-C424 WeakPolarHBondContact O-CB 3.49Å; L420-C424 PolarHBondContact O-N 3.26Å; L420-C424 PolarHBondContact O-SG 3.01Å |
| 421 | L | 87.9 | Confident | 85.1 | Confident | 33 Ų | 33 | 34.1 Ų | 34.1 | 17% | 0.173 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.9 | -39.2 | 175.7 | -76 | 162.5 | 0 | 0 | 0 | 112.6 | P391 E392 L417 S418 Q419 C424 R425 | P391-L421 HydrophobicContact CB-CD1 3.79Å; E392-L421 HydrophobicContact CB-CB 4.44Å; L417-L421 HydrophobicContact CD1-CD1 4.38Å; L417-L421 HydrophobicContact CD1-CG 4.46Å; L417-L421 HydrophobicContact CG-CD1 4.15Å; L417-L421 WeakPolarHBondContact O-CB 3.45Å; L417-L421 WeakPolarHBondContact O-CD1 3.22Å; L417-L421 VanDerWaalsContact O-CG 3.24Å; L417-L421 WeakPolarHBondContact O-CG 3.31Å; L417-L421 PolarHBondContact O-N 3.42Å; S418-L421 PolarHBondContact O-N 3.12Å; Q419-L421 VanDerWaalsContact C-N 3.3Å; Q419-L421 PolarHBondContact O-N 2.67Å; L421-C424 WeakPolarHBondContact O-CB 3.03Å; L421-C424 PolarHBondContact O-N 3.21Å; L421-R425 PolarHBondContact O-N 2.93Å |
| 422 | L | 89.3 | Confident | 85.7 | Confident | 6 Ų | 6 | 33.7 Ų | 33.7 | 3% | 0.031 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.5 | -45.1 | 175.6 | 177.3 | 60.3 | 0 | 0 | 0 | 111.7 | E225 S418 Q419 R425 A426 | E225-L422 HydrophobicContact CB-CD2 3.71Å; E225-L422 HydrophobicContact CG-CD2 3.7Å; S418-L422 PolarHBondContact O-N 3.26Å; Q419-L422 WeakPolarHBondContact O-CB 3.35Å; Q419-L422 PolarHBondContact O-N 3.08Å; Q419-L422 VanDerWaalsContact O-N 3.17Å; L422-R425 WeakPolarHBondContact O-CB 3.02Å; L422-R425 PolarHBondContact O-N 2.99Å; L422-A426 PolarHBondContact O-N 3.08Å |
| 423 | F | 91.6 | Very high | 86.1 | Confident | 4 Ų | 4 | 30.2 Ų | 30.2 | 2% | 0.018 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -70.4 | -35.4 | 176.2 | -59.9 | -61.2 | 0 | 0 | 0 | 112.3 | I155 C198 L199 V202 Q419 L420 R425 A426 A427 | I155-F423 HydrophobicContact CG2-CB 3.91Å; C198-F423 HydrophobicContact CB-CE1 3.98Å; C198-F423 HydrophobicContact CB-CZ 4.21Å; L199-F423 HydrophobicContact CB-CD1 3.86Å; L199-F423 HydrophobicContact CB-CE1 3.88Å; L199-F423 HydrophobicContact CB-CG 4.25Å; L199-F423 HydrophobicContact CB-CZ 4.27Å; L199-F423 HydrophobicContact CD1-CB 4.18Å; L199-F423 HydrophobicContact CD1-CD1 4.27Å; L199-F423 HydrophobicContact CD1-CD2 3.63Å; L199-F423 HydrophobicContact CD1-CE2 4.04Å; L199-F423 HydrophobicContact CD1-CG 3.77Å; L199-F423 HydrophobicContact CG-CG 4.46Å; V202-F423 HydrophobicContact CB-CE2 4.23Å; V202-F423 HydrophobicContact CB-CZ 4.39Å; V202-F423 HydrophobicContact CG1-CE2 4.28Å; V202-F423 HydrophobicContact CG2-CE2 4.18Å; V202-F423 HydrophobicContact CG2-CZ 4Å; Q419-F423 HydrophobicContact CB-CE2 4.33Å; Q419-F423 WeakPolarHBondContact O-CD2 3.3Å; Q419-F423 PolarHBondContact O-N 3.29Å; Q419-F423 VanDerWaalsContact O-N 3.16Å; L420-F423 PolarHBondContact O-N 3.1Å; F423-R425 VanDerWaalsContact C-N 3.34Å; F423-R425 PolarHBondContact O-N 3.4Å; F423-A426 PolarHBondContact O-N 3.33Å; F423-A427 PolarHBondContact O-N 3.13Å; F423-A427 VanDerWaalsContact O-N 3.07Å |
| 424 | C | 90.9 | Very high | 86.3 | Confident | 38 Ų | 38 | 26.9 Ų | 26.9 | 26% | 0.257 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -58.5 | -44.4 | 170.5 | -73.8 | 0 | 0 | 0 | 0 | 111.6 | I155 L420 L421 A426 A427 V428 | I155-C424 VanDerWaalsContact CD1-SG 3.51Å; L420-C424 WeakPolarHBondContact O-CB 3.49Å; L420-C424 PolarHBondContact O-N 3.26Å; L420-C424 PolarHBondContact O-SG 3.01Å; L421-C424 WeakPolarHBondContact O-CB 3.03Å; L421-C424 PolarHBondContact O-N 3.21Å; C424-A426 VanDerWaalsContact C-N 3.31Å; C424-A426 PolarHBondContact O-N 3.11Å; C424-A427 PolarHBondContact O-N 3.44Å; C424-V428 WeakPolarHBondContact O-CB 3.48Å; C424-V428 VanDerWaalsContact O-CG2 3.27Å; C424-V428 WeakPolarHBondContact O-CG2 3.36Å; C424-V428 PolarHBondContact O-N 3.31Å |
| 425 | R | 91.2 | Very high | 86.4 | Confident | 4 Ų | 4 | 32.2 Ų | 32.2 | 2% | 0.015 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -55.7 | -46.9 | 175.3 | -171.9 | -154.5 | 55.6 | 57.5 | 2.1 | 111.1 | D191 S228 C388 L421 L422 F423 A427 V428 T429 | D191-R425 IonicContact OD1-CZ 2.61Å; D191-R425 IonicContact OD1-NH1 3.51Å; D191-R425 PolarHBondContact OD1-NH1 3.39Å; D191-R425 IonicContact OD1-NH2 3.79Å; D191-R425 PolarHBondContact OD1-NH2 3.36Å; D191-R425 IonicContact OD2-CZ 2.94Å; D191-R425 IonicContact OD2-NH1 3.31Å; D191-R425 PolarHBondContact OD2-NH1 3.04Å; D191-R425 IonicContact OD2-NH2 2.72Å; S228-R425 PolarHBondContact OG-NH2 3.15Å; C388-R425 HydrophobicContact CB-CB 3.7Å; C388-R425 HydrophobicContact CB-CG 3.98Å; L421-R425 PolarHBondContact O-N 2.93Å; L422-R425 WeakPolarHBondContact O-CB 3.02Å; L422-R425 PolarHBondContact O-N 2.99Å; F423-R425 VanDerWaalsContact C-N 3.34Å; F423-R425 PolarHBondContact O-N 3.4Å; R425-A427 VanDerWaalsContact C-N 3.32Å; R425-A427 PolarHBondContact O-N 2.88Å; R425-V428 PolarHBondContact O-N 2.94Å; R425-T429 WeakPolarHBondContact O-CB 3.21Å; R425-T429 PolarHBondContact O-N 3.33Å; R425-T429 PolarHBondContact O-OG1 3.49Å |
| 426 | A | 91.9 | Very high | 86.2 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -67.6 | -28 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | N163 D191 I195 L422 F423 C424 P430 | N163-A426 PolarHBondContact ND2-O 3.03Å; D191-A426 HydrophobicContact CB-CB 3.82Å; I195-A426 HydrophobicContact CD1-CB 3.69Å; I195-A426 HydrophobicContact CG1-CB 3.96Å; L422-A426 PolarHBondContact O-N 3.08Å; F423-A426 PolarHBondContact O-N 3.33Å; C424-A426 VanDerWaalsContact C-N 3.31Å; C424-A426 PolarHBondContact O-N 3.11Å; A426-P430 WeakPolarHBondContact O-CD 3.22Å |
| 427 | A | 92.3 | Very high | 85.7 | Confident | 5 Ų | 5 | 29.6 Ų | 29.6 | 4% | 0.041 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -86.9 | -34.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | I155 V158 I195 F423 C424 R425 P430 | I155-A427 HydrophobicContact CG2-CB 3.92Å; V158-A427 HydrophobicContact CG1-CB 4.47Å; I195-A427 HydrophobicContact CD1-CB 4.01Å; F423-A427 PolarHBondContact O-N 3.13Å; F423-A427 VanDerWaalsContact O-N 3.07Å; C424-A427 PolarHBondContact O-N 3.44Å; R425-A427 VanDerWaalsContact C-N 3.32Å; R425-A427 PolarHBondContact O-N 2.88Å; A427-P430 WeakPolarHBondContact O-CD 3.43Å; A427-P430 WeakPolarHBondContact O-CG 3.37Å |
| 428 | V | 90.9 | Very high | 84.8 | Confident | 66 Ų | 66 | 34.8 Ų | 34.8 | 40% | 0.4 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -74.7 | -33.1 | 178.6 | 173.2 | 0 | 0 | 0 | 0 | 111.8 | V384 C424 R425 A431 L432 | V384-V428 HydrophobicContact CG1-CB 4.44Å; V384-V428 HydrophobicContact CG1-CG1 3.91Å; V384-V428 HydrophobicContact CG2-CG1 4.22Å; C424-V428 WeakPolarHBondContact O-CB 3.48Å; C424-V428 VanDerWaalsContact O-CG2 3.27Å; C424-V428 WeakPolarHBondContact O-CG2 3.36Å; C424-V428 PolarHBondContact O-N 3.31Å; R425-V428 PolarHBondContact O-N 2.94Å; V428-A431 PolarHBondContact O-N 3Å; V428-L432 WeakPolarHBondContact O-CB 3.41Å; V428-L432 PolarHBondContact O-N 2.88Å |
| 429 | T | 89.3 | Confident | 84 | Confident | 10 Ų | 10 | 37.6 Ų | 37.6 | 6% | 0.061 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -49.6 | -58.6 | 178 | -63.9 | 0 | 0 | 0 | 0 | 113.3 | L381 R425 A431 L432 L433 | L381-T429 HydrophobicContact CD2-CG2 4.06Å; R425-T429 WeakPolarHBondContact O-CB 3.21Å; R425-T429 PolarHBondContact O-N 3.33Å; R425-T429 PolarHBondContact O-OG1 3.49Å; T429-A431 PolarHBondContact O-N 3.46Å; T429-L432 PolarHBondContact O-N 3.13Å; T429-L433 HydrophobicContact CG2-CD1 4.44Å; T429-L433 WeakPolarHBondContact O-CG 3.29Å; T429-L433 PolarHBondContact O-N 2.88Å; T429-L433 VanDerWaalsContact O-N 3.13Å |
| 430 | P | 88.3 | Confident | 83.1 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -65.8 | -37.5 | 179.6 | 26.9 | -37.3 | 0 | 0 | 0 | 113.3 | G162 N163 I166 A426 A427 L432 L433 L434 | G162-P430 VanDerWaalsContact C-CB 3.41Å; N163-P430 WeakPolarHBondContact OD1-CG 3.08Å; I166-P430 HydrophobicContact CG1-CB 3.8Å; A426-P430 WeakPolarHBondContact O-CD 3.22Å; A427-P430 WeakPolarHBondContact O-CD 3.43Å; A427-P430 WeakPolarHBondContact O-CG 3.37Å; P430-L432 VanDerWaalsContact C-N 3.34Å; P430-L432 PolarHBondContact O-N 3.22Å; P430-L433 WeakPolarHBondContact O-CB 3.15Å; P430-L433 PolarHBondContact O-N 3.38Å; P430-L434 WeakPolarHBondContact O-CG 3.3Å; P430-L434 PolarHBondContact O-N 3.21Å |
| 431 | A | 86.3 | Confident | 82.3 | Confident | 36 Ų | 36 | 35.4 Ų | 35.4 | 30% | 0.298 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -62.1 | -42.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | V428 T429 L433 L434 L435 | V428-A431 PolarHBondContact O-N 3Å; T429-A431 PolarHBondContact O-N 3.46Å; A431-L433 VanDerWaalsContact C-N 3.34Å; A431-L433 PolarHBondContact O-N 3.01Å; A431-L434 PolarHBondContact O-N 3.01Å; A431-L435 VanDerWaalsContact O-CG 3.29Å; A431-L435 WeakPolarHBondContact O-CG 3.41Å; A431-L435 PolarHBondContact O-N 2.76Å; A431-L435 VanDerWaalsContact O-N 3.1Å |
| 432 | L | 85 | Confident | 81.5 | Confident | 33 Ų | 33 | 40.5 Ų | 40.5 | 17% | 0.173 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.6 | -41.4 | 174.1 | -169.9 | 80.8 | 0 | 0 | 0 | 111.9 | A380 L381 V384 V428 T429 P430 L435 L436 | A380-L432 HydrophobicContact CB-CD1 4.41Å; A380-L432 HydrophobicContact CB-CD2 3.88Å; A380-L432 HydrophobicContact CB-CG 4.38Å; L381-L432 HydrophobicContact CD2-CD2 4.2Å; V384-L432 HydrophobicContact CB-CD2 4.24Å; V384-L432 HydrophobicContact CG2-CD1 4.17Å; V384-L432 HydrophobicContact CG2-CD2 3.68Å; V384-L432 HydrophobicContact CG2-CG 4.46Å; V428-L432 WeakPolarHBondContact O-CB 3.41Å; V428-L432 PolarHBondContact O-N 2.88Å; T429-L432 PolarHBondContact O-N 3.13Å; P430-L432 VanDerWaalsContact C-N 3.34Å; P430-L432 PolarHBondContact O-N 3.22Å; L432-L435 PolarHBondContact O-N 2.95Å; L432-L436 HydrophobicContact CD1-CD1 3.97Å; L432-L436 HydrophobicContact CD2-CD1 4.39Å; L432-L436 HydrophobicContact CG-CD1 3.83Å; L432-L436 HydrophobicContact CG-CG 4.48Å; L432-L436 WeakPolarHBondContact O-CB 3.41Å; L432-L436 WeakPolarHBondContact O-CG 3.5Å; L432-L436 PolarHBondContact O-N 3.41Å |
| 433 | L | 82.6 | Confident | 80.6 | Confident | 2 Ų | 2 | 41.6 Ų | 41.6 | 1% | 0.01 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.6 | -47 | 176.9 | -70.1 | 175.4 | 0 | 0 | 0 | 111.8 | I166 L184 T377 L381 T429 P430 A431 L435 L436 C437 L440 | I166-L433 HydrophobicContact CD1-CB 3.74Å; I166-L433 HydrophobicContact CD1-CD1 4.17Å; L184-L433 HydrophobicContact CB-CD1 4.42Å; L184-L433 HydrophobicContact CD1-CD2 3.97Å; L184-L433 HydrophobicContact CD2-CD1 3.95Å; L184-L433 HydrophobicContact CD2-CD2 3.69Å; L184-L433 HydrophobicContact CD2-CG 4.49Å; L184-L433 HydrophobicContact CG-CD2 4.43Å; T377-L433 HydrophobicContact CG2-CD2 3.54Å; L381-L433 HydrophobicContact CD1-CD2 4.08Å; L381-L433 HydrophobicContact CD2-CD2 4.01Å; L381-L433 HydrophobicContact CD2-CG 4.31Å; L381-L433 HydrophobicContact CG-CD2 4.25Å; T429-L433 HydrophobicContact CG2-CD1 4.44Å; T429-L433 WeakPolarHBondContact O-CG 3.29Å; T429-L433 PolarHBondContact O-N 2.88Å; T429-L433 VanDerWaalsContact O-N 3.13Å; P430-L433 WeakPolarHBondContact O-CB 3.15Å; P430-L433 PolarHBondContact O-N 3.38Å; A431-L433 VanDerWaalsContact C-N 3.34Å; A431-L433 PolarHBondContact O-N 3.01Å; L433-L435 VanDerWaalsContact C-N 3.31Å; L433-L435 PolarHBondContact O-N 3Å; L433-L436 PolarHBondContact O-N 2.79Å; L433-C437 WeakPolarHBondContact O-CB 3.27Å; L433-C437 PolarHBondContact O-N 2.03Å; L433-L440 HydrophobicContact CB-CD2 4.48Å |
| 434 | L | 81.8 | Confident | 79.7 | Confident | 27 Ų | 27 | 44.9 Ų | 44.9 | 14% | 0.141 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.9 | -38.1 | 178 | -66.9 | 176.3 | 0 | 0 | 0 | 112.2 | A165 I166 I169 P430 A431 G441 F444 | A165-L434 HydrophobicContact CB-CD1 4.36Å; I166-L434 HydrophobicContact CD1-CD2 3.76Å; I166-L434 HydrophobicContact CD1-CG 3.97Å; I169-L434 HydrophobicContact CD1-CD2 3.85Å; P430-L434 WeakPolarHBondContact O-CG 3.3Å; P430-L434 PolarHBondContact O-N 3.21Å; A431-L434 PolarHBondContact O-N 3.01Å; L434-G441 WeakPolarHBondContact O-CA 3.47Å; L434-F444 HydrophobicContact CD1-CD2 4.4Å; L434-F444 HydrophobicContact CD1-CG 4.37Å; L434-F444 HydrophobicContact CD2-CB 3.99Å; L434-F444 HydrophobicContact CD2-CG 4.23Å |
| 435 | L | 79.3 | Confident | 79 | Confident | 142 Ų | 142 | 48 Ų | 48 | 74% | 0.743 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -73.4 | -38.6 | 179.9 | -70.5 | 170.3 | 0 | 0 | 0 | 113.6 | A431 L432 L433 | A431-L435 VanDerWaalsContact O-CG 3.29Å; A431-L435 WeakPolarHBondContact O-CG 3.41Å; A431-L435 PolarHBondContact O-N 2.76Å; A431-L435 VanDerWaalsContact O-N 3.1Å; L432-L435 PolarHBondContact O-N 2.95Å; L433-L435 VanDerWaalsContact C-N 3.31Å; L433-L435 PolarHBondContact O-N 3Å |
| 436 | L | 72.1 | Confident | 78.1 | Confident | 52 Ų | 52 | 52.1 Ų | 52.1 | 27% | 0.272 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -91.6 | -39.5 | -175.4 | -63.5 | 179.6 | 0 | 0 | 0 | 113.1 | Q373 A380 L432 L433 R438 | Q373-L436 PolarHBondContact NE2-O 3.08Å; A380-L436 HydrophobicContact CB-CD1 3.15Å; L432-L436 HydrophobicContact CD1-CD1 3.97Å; L432-L436 HydrophobicContact CD2-CD1 4.39Å; L432-L436 HydrophobicContact CG-CD1 3.83Å; L432-L436 HydrophobicContact CG-CG 4.48Å; L432-L436 WeakPolarHBondContact O-CB 3.41Å; L432-L436 WeakPolarHBondContact O-CG 3.5Å; L432-L436 PolarHBondContact O-N 3.41Å; L433-L436 PolarHBondContact O-N 2.79Å; L436-R438 VanDerWaalsContact C-N 3.32Å; L436-R438 PolarHBondContact O-N 3.31Å |
| 437 | C | 70.2 | Confident | 77 | Confident | 17 Ų | 17 | 54.5 Ų | 54.5 | 12% | 0.115 | 29% | 0.285 | C | S | . | . | trans | -81.2 | 77.1 | 174.5 | -66.6 | 0 | 0 | 0 | 0 | 110.2 | T377 L433 P439 L440 G441 | T377-C437 VanDerWaalsContact CG2-SG 3.54Å; T377-C437 PolarHBondContact OG1-SG 3.35Å; L433-C437 WeakPolarHBondContact O-CB 3.27Å; L433-C437 PolarHBondContact O-N 2.03Å; C437-P439 VanDerWaalsContact C-N 3.28Å; C437-L440 HydrophobicContact CB-CB 3.64Å; C437-L440 HydrophobicContact CB-CD2 4.28Å; C437-L440 CarbonylContact O-C 3.59Å; C437-L440 VanDerWaalsContact O-CA 3.29Å; C437-L440 WeakPolarHBondContact O-CA 3.49Å; C437-L440 WeakPolarHBondContact O-CB 3.33Å; C437-L440 PolarHBondContact O-N 2.78Å; C437-G441 PolarHBondContact O-N 3.4Å | ||
| 438 | R | 65.9 | Low | 75.9 | Confident | 185 Ų | 185 | 56.5 Ų | 56.5 | 70% | 0.698 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -38.6 | -41.7 | 170.7 | -64.5 | 179.6 | 173.3 | -163 | -4.5 | 116.2 | Q373 L436 L440 G441 R442 | Q373-R438 VanDerWaalsContact NE2-CB 3.33Å; L436-R438 VanDerWaalsContact C-N 3.32Å; L436-R438 PolarHBondContact O-N 3.31Å; R438-L440 VanDerWaalsContact C-N 3.32Å; R438-L440 PolarHBondContact O-N 3.29Å; R438-G441 PolarHBondContact O-N 2.79Å; R438-R442 WeakPolarHBondContact O-CB 3.27Å; R438-R442 WeakPolarHBondContact O-CG 3.43Å; R438-R442 PolarHBondContact O-N 2.88Å |
| 439 | P | 65.1 | Low | 74.7 | Confident | 65 Ų | 65 | 56.7 Ų | 56.7 | 42% | 0.422 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -65.8 | -32.7 | 174.5 | 24.7 | -34.9 | 0 | 0 | 0 | 113.5 | M176 C437 A443 | M176-P439 HydrophobicContact CE-CB 4.19Å; M176-P439 HydrophobicContact CE-CG 4.42Å; C437-P439 VanDerWaalsContact C-N 3.28Å; P439-A443 WeakPolarHBondContact O-CB 3.29Å; P439-A443 PolarHBondContact O-N 3.14Å |
| 440 | L | 66.1 | Low | 73.1 | Confident | 6 Ų | 6 | 60 Ų | 60 | 3% | 0.031 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -73.9 | -45.3 | 173.9 | -133.3 | 70 | 0 | 0 | 0 | 110.7 | I166 I169 M176 L433 C437 R438 A443 F444 | I166-L440 HydrophobicContact CD1-CD2 3.43Å; I166-L440 VanDerWaalsContact CD1-CD2 3.43Å; I166-L440 HydrophobicContact CD1-CG 4.4Å; I169-L440 HydrophobicContact CB-CD1 4.48Å; I169-L440 HydrophobicContact CD1-CG 4.38Å; I169-L440 HydrophobicContact CG2-CD1 3.53Å; I169-L440 HydrophobicContact CG2-CG 3.91Å; M176-L440 HydrophobicContact CE-CD1 4.41Å; L433-L440 HydrophobicContact CB-CD2 4.48Å; C437-L440 HydrophobicContact CB-CB 3.64Å; C437-L440 HydrophobicContact CB-CD2 4.28Å; C437-L440 CarbonylContact O-C 3.59Å; C437-L440 VanDerWaalsContact O-CA 3.29Å; C437-L440 WeakPolarHBondContact O-CA 3.49Å; C437-L440 WeakPolarHBondContact O-CB 3.33Å; C437-L440 PolarHBondContact O-N 2.78Å; R438-L440 VanDerWaalsContact C-N 3.32Å; R438-L440 PolarHBondContact O-N 3.29Å; L440-A443 PolarHBondContact O-N 3.43Å; L440-F444 WeakPolarHBondContact O-CB 3.44Å; L440-F444 PolarHBondContact O-N 2.88Å |
| 441 | G | 70.6 | Confident | 71.4 | Confident | 12 Ų | 12 | 64.4 Ų | 64.4 | 12% | 0.124 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.8 | -33.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114 | L434 C437 R438 L445 | L434-G441 WeakPolarHBondContact O-CA 3.47Å; C437-G441 PolarHBondContact O-N 3.4Å; R438-G441 PolarHBondContact O-N 2.79Å; G441-L445 VanDerWaalsContact O-CG 3.32Å; G441-L445 WeakPolarHBondContact O-CG 3.35Å; G441-L445 PolarHBondContact O-N 3.3Å; G441-L445 VanDerWaalsContact O-N 3.07Å |
| 442 | R | 71.4 | Confident | 69.6 | Low | 140 Ų | 140 | 67.6 Ų | 67.6 | 53% | 0.528 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.5 | -55.7 | 168 | -82.5 | -172.3 | 175.9 | 175.2 | -3 | 110.3 | R438 F444 L445 D446 E473 | R438-R442 WeakPolarHBondContact O-CB 3.27Å; R438-R442 WeakPolarHBondContact O-CG 3.43Å; R438-R442 PolarHBondContact O-N 2.88Å; R442-F444 PolarHBondContact O-N 2.82Å; R442-F444 VanDerWaalsContact O-N 3.09Å; R442-L445 CarbonylContact O-C 3.57Å; R442-L445 WeakPolarHBondContact O-CA 3.22Å; R442-L445 WeakPolarHBondContact O-CB 3.33Å; R442-L445 PolarHBondContact O-N 3.32Å; R442-D446 PolarHBondContact O-N 2.97Å; R442-E473 IonicContact CZ-OE2 3.3Å; R442-E473 VanDerWaalsContact CZ-OE2 3.3Å; R442-E473 IonicContact NH1-OE2 2.7Å; R442-E473 PolarHBondContact NH1-OE2 3.01Å; R442-E473 IonicContact NH2-OE2 3.08Å; R442-E473 PolarHBondContact NH2-OE2 3.42Å |
| 443 | A | 70.9 | Confident | 67.6 | Low | 29 Ų | 29 | 70.2 Ų | 70.2 | 24% | 0.24 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -56.4 | -31.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | I169 P439 L440 C447 | I169-A443 HydrophobicContact CG1-CB 4.4Å; I169-A443 HydrophobicContact CG2-CB 3.79Å; P439-A443 WeakPolarHBondContact O-CB 3.29Å; P439-A443 PolarHBondContact O-N 3.14Å; L440-A443 PolarHBondContact O-N 3.43Å; A443-C447 VanDerWaalsContact O-CB 3.28Å; A443-C447 WeakPolarHBondContact O-CB 3.4Å; A443-C447 PolarHBondContact O-N 2.92Å; A443-C447 VanDerWaalsContact O-N 3.09Å |
| 444 | F | 72.4 | Confident | 65.5 | Low | 73 Ų | 73 | 76.8 Ų | 76.8 | 32% | 0.32 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64.4 | -52.5 | 169.2 | 179.5 | -110.2 | 0 | 0 | 0 | 112.3 | A165 I169 L434 L440 R442 D446 C447 C448 | A165-F444 HydrophobicContact CB-CD2 3.68Å; A165-F444 HydrophobicContact CB-CE2 3.63Å; I169-F444 HydrophobicContact CD1-CB 3.81Å; I169-F444 HydrophobicContact CD1-CD2 4.46Å; L434-F444 HydrophobicContact CD1-CD2 4.4Å; L434-F444 HydrophobicContact CD1-CG 4.37Å; L434-F444 HydrophobicContact CD2-CB 3.99Å; L434-F444 HydrophobicContact CD2-CG 4.23Å; L440-F444 WeakPolarHBondContact O-CB 3.44Å; L440-F444 PolarHBondContact O-N 2.88Å; R442-F444 PolarHBondContact O-N 2.82Å; R442-F444 VanDerWaalsContact O-N 3.09Å; F444-D446 VanDerWaalsContact C-N 3.33Å; F444-D446 PolarHBondContact O-N 3.29Å; F444-C447 PolarHBondContact O-N 3.3Å; F444-C448 VanDerWaalsContact CZ-SG 3.55Å; F444-C448 WeakPolarHBondContact O-CB 3.4Å; F444-C448 PolarHBondContact O-N 3.45Å; F444-C448 PolarHBondContact O-SG 3.21Å; F444-C448 VanDerWaalsContact O-SG 3.42Å |
| 445 | L | 74.9 | Confident | 63.3 | Low | 103 Ų | 103 | 83.6 Ų | 83.6 | 54% | 0.539 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -59.7 | -42.3 | 176.8 | -72.9 | 168.4 | 0 | 0 | 0 | 111.8 | G441 R442 C447 C448 C449 | G441-L445 VanDerWaalsContact O-CG 3.32Å; G441-L445 WeakPolarHBondContact O-CG 3.35Å; G441-L445 PolarHBondContact O-N 3.3Å; G441-L445 VanDerWaalsContact O-N 3.07Å; R442-L445 CarbonylContact O-C 3.57Å; R442-L445 WeakPolarHBondContact O-CA 3.22Å; R442-L445 WeakPolarHBondContact O-CB 3.33Å; R442-L445 PolarHBondContact O-N 3.32Å; L445-C447 PolarHBondContact O-N 2.87Å; L445-C448 PolarHBondContact O-N 3.46Å; L445-C449 VanDerWaalsContact O-CB 3.22Å; L445-C449 WeakPolarHBondContact O-CB 3.15Å; L445-C449 PolarHBondContact O-N 3.01Å; L445-C449 PolarHBondContact O-SG 3.48Å |
| 446 | D | 72.6 | Confident | 61.1 | Low | 91 Ų | 91 | 82.3 Ų | 82.3 | 49% | 0.487 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.8 | -44.7 | 178.4 | -55.3 | -35.4 | 0 | 0 | 0 | 110.4 | R442 F444 C449 C450 | R442-D446 PolarHBondContact O-N 2.97Å; F444-D446 VanDerWaalsContact C-N 3.33Å; F444-D446 PolarHBondContact O-N 3.29Å; D446-C449 PolarHBondContact O-N 2.99Å; D446-C450 WeakPolarHBondContact O-CB 3.16Å; D446-C450 PolarHBondContact O-N 2.85Å; D446-C450 PolarHBondContact O-SG 3.36Å |
| 447 | C | 68.5 | Low | 59.3 | Low | 50 Ų | 50 | 85.4 Ų | 85.4 | 34% | 0.338 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64 | -47.1 | 175.4 | -170.8 | 0 | 0 | 0 | 0 | 112.3 | A443 F444 L445 C449 C450 C451 | A443-C447 VanDerWaalsContact O-CB 3.28Å; A443-C447 WeakPolarHBondContact O-CB 3.4Å; A443-C447 PolarHBondContact O-N 2.92Å; A443-C447 VanDerWaalsContact O-N 3.09Å; F444-C447 PolarHBondContact O-N 3.3Å; L445-C447 PolarHBondContact O-N 2.87Å; C447-C449 PolarHBondContact O-N 3.31Å; C447-C450 PolarHBondContact O-N 3Å; C447-C451 PolarHBondContact O-N 2.96Å; C447-C451 PolarHBondContact O-SG 2.7Å; C447-C451 VanDerWaalsContact O-SG 3.41Å |
| 448 | C | 70.3 | Confident | 57.6 | Low | 48 Ų | 48 | 90.7 Ų | 90.7 | 32% | 0.324 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.3 | -40.9 | 176.5 | -72.9 | 0 | 0 | 0 | 0 | 112.6 | F444 L445 C451 C452 | F444-C448 VanDerWaalsContact CZ-SG 3.55Å; F444-C448 WeakPolarHBondContact O-CB 3.4Å; F444-C448 PolarHBondContact O-N 3.45Å; F444-C448 PolarHBondContact O-SG 3.21Å; F444-C448 VanDerWaalsContact O-SG 3.42Å; L445-C448 PolarHBondContact O-N 3.46Å; C448-C451 PolarHBondContact O-N 3.41Å; C448-C452 WeakPolarHBondContact O-CB 3.44Å; C448-C452 PolarHBondContact O-N 2.73Å; C448-C452 PolarHBondContact O-SG 3.23Å |
| 449 | C | 64.3 | Low | 55.9 | Low | 69 Ų | 69 | 87.4 Ų | 87.4 | 47% | 0.466 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.1 | -43.7 | 176 | -75.2 | 0 | 0 | 0 | 0 | 111.4 | L445 D446 C447 C451 C452 C453 | L445-C449 VanDerWaalsContact O-CB 3.22Å; L445-C449 WeakPolarHBondContact O-CB 3.15Å; L445-C449 PolarHBondContact O-N 3.01Å; L445-C449 PolarHBondContact O-SG 3.48Å; D446-C449 PolarHBondContact O-N 2.99Å; C447-C449 PolarHBondContact O-N 3.31Å; C449-C451 VanDerWaalsContact C-N 3.32Å; C449-C451 PolarHBondContact O-N 2.77Å; C449-C452 PolarHBondContact O-N 3.26Å; C449-C453 VanDerWaalsContact O-CB 3.23Å; C449-C453 WeakPolarHBondContact O-CB 3.12Å; C449-C453 PolarHBondContact O-N 3.41Å; C449-C453 PolarHBondContact O-SG 2.9Å |
| 450 | C | 57.4 | Low | 54.3 | Low | 81 Ų | 81 | 88.5 Ų | 88.5 | 55% | 0.547 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.1 | -40.2 | 173.5 | -73.8 | 0 | 0 | 0 | 0 | 112.5 | D446 C447 N454 | D446-C450 WeakPolarHBondContact O-CB 3.16Å; D446-C450 PolarHBondContact O-N 2.85Å; D446-C450 PolarHBondContact O-SG 3.36Å; C447-C450 PolarHBondContact O-N 3Å; C450-N454 WeakPolarHBondContact O-CB 3.37Å; C450-N454 VanDerWaalsContact O-CG 3.3Å; C450-N454 PolarHBondContact O-N 2.68Å; C450-N454 PolarHBondContact O-ND2 2.79Å |
| 451 | C | 52.3 | Low | 53 | Low | 92 Ų | 92 | 95.1 Ų | 95.1 | 62% | 0.622 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -67.7 | -37.7 | 175.1 | -70.9 | 0 | 0 | 0 | 0 | 113.2 | C447 C448 C449 | C447-C451 PolarHBondContact O-N 2.96Å; C447-C451 PolarHBondContact O-SG 2.7Å; C447-C451 VanDerWaalsContact O-SG 3.41Å; C448-C451 PolarHBondContact O-N 3.41Å; C449-C451 VanDerWaalsContact C-N 3.32Å; C449-C451 PolarHBondContact O-N 2.77Å |
| 452 | C | 47.8 | Very low | 51.1 | Low | 102 Ų | 102 | 99 Ų | 99 | 69% | 0.689 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -79.9 | -34.9 | -179.4 | -70.2 | 0 | 0 | 0 | 0 | 113.7 | C448 C449 | C448-C452 WeakPolarHBondContact O-CB 3.44Å; C448-C452 PolarHBondContact O-N 2.73Å; C448-C452 PolarHBondContact O-SG 3.23Å; C449-C452 PolarHBondContact O-N 3.26Å |
| 453 | C | 42.7 | Very low | 49.1 | Very low | 88 Ų | 88 | 96.7 Ų | 96.7 | 60% | 0.595 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -80.2 | -20.5 | -176.1 | -68.7 | 0 | 0 | 0 | 0 | 113.6 | C449 H455 V456 | C449-C453 VanDerWaalsContact O-CB 3.23Å; C449-C453 WeakPolarHBondContact O-CB 3.12Å; C449-C453 PolarHBondContact O-N 3.41Å; C449-C453 PolarHBondContact O-SG 2.9Å; C453-H455 PolarHBondContact O-N 3.1Å; C453-V456 PolarHBondContact O-N 3.32Å |
| 454 | N | 39.8 | Very low | 47.4 | Very low | 141 Ų | 141 | 102 Ų | 102 | 75% | 0.754 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | 5.9 | 178.8 | -89.3 | -20.4 | 0 | 0 | 0 | 115.3 | C450 | C450-N454 WeakPolarHBondContact O-CB 3.37Å; C450-N454 VanDerWaalsContact O-CG 3.3Å; C450-N454 PolarHBondContact O-N 2.68Å; C450-N454 PolarHBondContact O-ND2 2.79Å |
| 455 | H | 35.1 | Very low | 45.6 | Very low | 170 Ų | 170 | 104.8 Ų | 104.8 | 79% | 0.787 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | 4.2 | 178.6 | -113.4 | -66.3 | 0 | 0 | 0 | 115.3 | C453 | C453-H455 PolarHBondContact O-N 3.1Š|
| 456 | V | 31.7 | Very low | 43.6 | Very low | 115 Ų | 115 | 105.6 Ų | 105.6 | 70% | 0.697 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -114.7 | 117.5 | 175.3 | -177.3 | 0 | 0 | 0 | 0 | 110.4 | C453 S458 | C453-V456 PolarHBondContact O-N 3.32Å; V456-S458 PolarHBondContact O-N 3.39Å |
| 457 | P | 34.7 | Very low | 41.9 | Very low | 117 Ų | 117 | 108.3 Ų | 108.3 | 76% | 0.76 | 67% | 0.672 | S | S | * | * | trans | -64.8 | 129.5 | 172.9 | -21.2 | 33.5 | 0 | 0 | 0 | 111.8 | ||||
| 458 | S | 35.1 | Very low | 40.2 | Very low | 128 Ų | 128 | 112.7 Ų | 112.7 | 90% | 0.895 | 69% | 0.687 | S | S | * | * | trans | -62.5 | 135.4 | -174.2 | -50.9 | 0 | 0 | 0 | 0 | 114.1 | V456 | V456-S458 PolarHBondContact O-N 3.39Š| ||
| 459 | S | 29.5 | Very low | 38.5 | Very low | 115 Ų | 115 | 116.7 Ų | 116.7 | 80% | 0.804 | 70% | 0.701 | S | S | * | * | trans | -150.9 | 145.8 | 157.4 | 60.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 460 | A | 31.8 | Very low | 37 | Very low | 89 Ų | 89 | 117.2 Ų | 117.2 | 74% | 0.736 | 70% | 0.704 | S | S | * | * | trans | 62.3 | 79.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 461 | T | 39.1 | Very low | 35.9 | Very low | 144 Ų | 144 | 117.2 Ų | 117.2 | 88% | 0.883 | 70% | 0.702 | S | S | * | * | 33.3 | 108.6 | 125.5 | 56.1 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 462 | A | 30.3 | Very low | 35.3 | Very low | 95 Ų | 95 | 115.7 Ų | 115.7 | 79% | 0.785 | 69% | 0.69 | S | S | * | * | trans | -161.1 | 138.9 | 148.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 463 | S | 30.4 | Very low | 34.9 | Very low | 91 Ų | 91 | 115.4 Ų | 115.4 | 64% | 0.636 | 68% | 0.678 | S | S | * | * | trans | 48.6 | 103.5 | 162.3 | 56.8 | 0 | 0 | 0 | 0 | 120 | D465 | S463-D465 VanDerWaalsContact C-N 3.26Å; S463-D465 PolarHBondContact O-N 2.84Å | ||
| 464 | D | 34.3 | Very low | 34.6 | Very low | 139 Ų | 139 | 117.2 Ų | 117.2 | 74% | 0.743 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -11.1 | 168.6 | -72.3 | -50 | 0 | 0 | 0 | 114.6 | N466 E467 | D464-N466 PolarHBondContact O-N 3.27Å; D464-E467 PolarHBondContact O-N 3.19Å |
| 465 | D | 33.9 | Very low | 34.3 | Very low | 133 Ų | 133 | 116.3 Ų | 116.3 | 71% | 0.711 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -59.8 | -26.2 | -168 | -63.5 | -71.2 | 0 | 0 | 0 | 114.6 | S463 | S463-D465 VanDerWaalsContact C-N 3.26Å; S463-D465 PolarHBondContact O-N 2.84Å |
| 466 | N | 34.8 | Very low | 34.3 | Very low | 120 Ų | 120 | 113.1 Ų | 113.1 | 64% | 0.642 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -83.9 | -23.5 | -171.4 | -156.8 | 34.1 | 0 | 0 | 0 | 113.9 | D464 H468 E469 C470 | D464-N466 PolarHBondContact O-N 3.27Å; N466-H468 VanDerWaalsContact C-N 3.33Å; N466-E469 PolarHBondContact O-N 3.21Å; N466-C470 PolarHBondContact O-N 2.82Å |
| 467 | E | 35.2 | Very low | 34.5 | Very low | 148 Ų | 148 | 109.7 Ų | 109.7 | 69% | 0.692 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -71.7 | -30.3 | 176.1 | -65.5 | -154.6 | 142.4 | 0 | 0 | 111.8 | D464 T471 | D464-E467 PolarHBondContact O-N 3.19Å; E467-T471 WeakPolarHBondContact O-CB 3.15Å; E467-T471 WeakPolarHBondContact O-CG2 3.11Å; E467-T471 PolarHBondContact O-N 3.14Å; E467-T471 PolarHBondContact O-OG1 2.76Å |
| 468 | H | 32.7 | Very low | 34.8 | Very low | 141 Ų | 141 | 105.5 Ų | 105.5 | 65% | 0.653 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -68.9 | -33.1 | 174.2 | -87.1 | 60.4 | 0 | 0 | 0 | 112.7 | N466 T471 T472 | N466-H468 VanDerWaalsContact C-N 3.33Å; H468-T471 WeakPolarHBondContact CA-OG1 3.2Å; H468-T471 PolarHBondContact O-OG1 3.41Å; H468-T472 WeakPolarHBondContact O-CB 3.41Å; H468-T472 VanDerWaalsContact O-CG2 3.27Å; H468-T472 WeakPolarHBondContact O-CG2 3.45Å; H468-T472 PolarHBondContact O-N 3.12Å; H468-T472 VanDerWaalsContact O-N 3.08Å; H468-T472 PolarHBondContact O-OG1 2.99Å |
| 469 | E | 34.6 | Very low | 34.9 | Very low | 133 Ų | 133 | 103.5 Ų | 103.5 | 62% | 0.621 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -74.6 | -36.9 | 176.1 | -163.1 | 166 | 178.5 | 0 | 0 | 111.8 | N466 T472 E473 | N466-E469 PolarHBondContact O-N 3.21Å; E469-T472 PolarHBondContact O-OG1 2.79Å; E469-E473 PolarHBondContact O-N 3.09Å |
| 470 | C | 34.2 | Very low | 35.2 | Very low | 80 Ų | 80 | 100 Ų | 100 | 54% | 0.541 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -68.4 | -47.7 | 175.3 | -170.6 | 0 | 0 | 0 | 0 | 112.8 | N466 T472 E473 L474 | N466-C470 PolarHBondContact O-N 2.82Å; C470-T472 VanDerWaalsContact C-N 3.33Å; C470-T472 PolarHBondContact O-N 3.23Å; C470-E473 PolarHBondContact O-N 2.83Å; C470-L474 PolarHBondContact O-N 3.21Å |
| 471 | T | 33.6 | Very low | 35.4 | Very low | 80 Ų | 80 | 99.3 Ų | 99.3 | 49% | 0.491 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.4 | -38.1 | 176.8 | 49.4 | 0 | 0 | 0 | 0 | 111.9 | E467 H468 L474 E475 | E467-T471 WeakPolarHBondContact O-CB 3.15Å; E467-T471 WeakPolarHBondContact O-CG2 3.11Å; E467-T471 PolarHBondContact O-N 3.14Å; E467-T471 PolarHBondContact O-OG1 2.76Å; H468-T471 WeakPolarHBondContact CA-OG1 3.2Å; H468-T471 PolarHBondContact O-OG1 3.41Å; T471-L474 PolarHBondContact O-N 3.06Å; T471-E475 WeakPolarHBondContact O-CB 3.44Å; T471-E475 PolarHBondContact O-N 3.09Å |
| 472 | T | 39.2 | Very low | 35.5 | Very low | 60 Ų | 60 | 97.3 Ų | 97.3 | 37% | 0.368 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -71.1 | -33.1 | 175.7 | 54.2 | 0 | 0 | 0 | 0 | 113.8 | H468 E469 C470 L474 E475 L476 | H468-T472 WeakPolarHBondContact O-CB 3.41Å; H468-T472 VanDerWaalsContact O-CG2 3.27Å; H468-T472 WeakPolarHBondContact O-CG2 3.45Å; H468-T472 PolarHBondContact O-N 3.12Å; H468-T472 VanDerWaalsContact O-N 3.08Å; H468-T472 PolarHBondContact O-OG1 2.99Å; E469-T472 PolarHBondContact O-OG1 2.79Å; C470-T472 VanDerWaalsContact C-N 3.33Å; C470-T472 PolarHBondContact O-N 3.23Å; T472-L474 VanDerWaalsContact C-N 3.28Å; T472-L474 PolarHBondContact O-N 3.09Å; T472-E475 PolarHBondContact O-N 3.05Å; T472-L476 WeakPolarHBondContact O-CB 3.32Å; T472-L476 WeakPolarHBondContact O-CD1 3.4Å; T472-L476 WeakPolarHBondContact O-CG 3.41Å; T472-L476 PolarHBondContact O-N 2.88Å |
| 473 | E | 39.1 | Very low | 35.9 | Very low | 97 Ų | 97 | 98.8 Ų | 98.8 | 45% | 0.453 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.3 | -29.6 | 171.1 | -81.7 | -107.8 | 107 | 0 | 0 | 112.5 | R442 E469 C470 | R442-E473 IonicContact CZ-OE2 3.3Å; R442-E473 VanDerWaalsContact CZ-OE2 3.3Å; R442-E473 IonicContact NH1-OE2 2.7Å; R442-E473 PolarHBondContact NH1-OE2 3.01Å; R442-E473 IonicContact NH2-OE2 3.08Å; R442-E473 PolarHBondContact NH2-OE2 3.42Å; E469-E473 PolarHBondContact O-N 3.09Å; C470-E473 PolarHBondContact O-N 2.83Å |
| 474 | L | 36.4 | Very low | 36.2 | Very low | 125 Ų | 125 | 103.7 Ų | 103.7 | 65% | 0.654 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -75.8 | -47 | 170.8 | -104.3 | 70.4 | 0 | 0 | 0 | 112.5 | C470 T471 T472 L476 S477 | C470-L474 PolarHBondContact O-N 3.21Å; T471-L474 PolarHBondContact O-N 3.06Å; T472-L474 VanDerWaalsContact C-N 3.28Å; T472-L474 PolarHBondContact O-N 3.09Å; L474-L476 PolarHBondContact O-N 3.36Å; L474-S477 WeakPolarHBondContact O-CB 3.29Å; L474-S477 PolarHBondContact O-N 2.7Å; L474-S477 VanDerWaalsContact O-N 3.12Å; L474-S477 PolarHBondContact O-OG 3.41Å |
| 475 | E | 34.5 | Very low | 36.4 | Very low | 122 Ų | 122 | 104.7 Ų | 104.7 | 57% | 0.57 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.9 | -17.8 | 176.6 | -74 | -143.7 | 139.1 | 0 | 0 | 113.5 | T471 T472 S480 | T471-E475 WeakPolarHBondContact O-CB 3.44Å; T471-E475 PolarHBondContact O-N 3.09Å; T472-E475 PolarHBondContact O-N 3.05Å; E475-S480 VanDerWaalsContact C-OG 3.3Å; E475-S480 PolarHBondContact O-OG 3.05Å |
| 476 | L | 34.9 | Very low | 36.6 | Very low | 104 Ų | 104 | 104.5 Ų | 104.5 | 55% | 0.545 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.4 | 12 | 173.4 | -67.6 | 170.5 | 0 | 0 | 0 | 113.8 | T472 L474 T481 | T472-L476 WeakPolarHBondContact O-CB 3.32Å; T472-L476 WeakPolarHBondContact O-CD1 3.4Å; T472-L476 WeakPolarHBondContact O-CG 3.41Å; T472-L476 PolarHBondContact O-N 2.88Å; L474-L476 PolarHBondContact O-N 3.36Å; L476-T481 HydrophobicContact CD2-CG2 4.41Å |
| 477 | S | 37.2 | Very low | 36.5 | Very low | 42 Ų | 42 | 102.5 Ų | 102.5 | 29% | 0.294 | 52% | 0.519 | S | S | . | . | S | Bend | trans | -59.8 | 145.9 | 159.7 | 82.8 | 0 | 0 | 0 | 0 | 109.9 | L474 F479 S480 T481 | L474-S477 WeakPolarHBondContact O-CB 3.29Å; L474-S477 PolarHBondContact O-N 2.7Å; L474-S477 VanDerWaalsContact O-N 3.12Å; L474-S477 PolarHBondContact O-OG 3.41Å; S477-F479 PolarHBondContact O-N 2.84Å; S477-S480 PolarHBondContact O-N 3.37Å; S477-S480 PolarHBondContact O-OG 3.36Å; S477-S480 PolarHBondContact OG-OG 3.28Å; S477-T481 PolarHBondContact O-OG1 2.96Å |
| 478 | P | 39.5 | Very low | 36.5 | Very low | 30 Ų | 30 | 102.2 Ų | 102.2 | 20% | 0.195 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -62.2 | -17 | 178.8 | -26.2 | 36.1 | 0 | 0 | 0 | 114.5 | L370 I482 | L370-P478 HydrophobicContact CD1-CG 3.83Å; P478-I482 WeakPolarHBondContact O-CG1 3.34Å |
| 479 | F | 38.4 | Very low | 36.8 | Very low | 86 Ų | 86 | 104.6 Ų | 104.6 | 38% | 0.377 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -75.5 | -25.8 | -177.1 | -65.5 | -92.5 | 0 | 0 | 0 | 113.8 | Y254 S477 R483 | Y254-F479 HydrophobicContact CD1-CD1 4.16Å; Y254-F479 AromaticContact CD1-CE1 3.92Å; Y254-F479 HydrophobicContact CD1-CE1 3.92Å; Y254-F479 AromaticContact CE1-CD1 3.89Å; Y254-F479 HydrophobicContact CE1-CD1 3.89Å; Y254-F479 AromaticContact CE1-CE1 3.44Å; Y254-F479 HydrophobicContact CE1-CE1 3.44Å; Y254-F479 VanDerWaalsContact CE1-CE1 3.44Å; Y254-F479 HydrophobicContact CE1-CE2 4.25Å; Y254-F479 HydrophobicContact CE1-CG 4.48Å; Y254-F479 AromaticContact CE1-CZ 3.64Å; Y254-F479 HydrophobicContact CE1-CZ 3.64Å; S477-F479 PolarHBondContact O-N 2.84Å; F479-R483 VanDerWaalsContact O-CB 3.28Å; F479-R483 WeakPolarHBondContact O-CB 3.48Å |
| 480 | S | 34.7 | Very low | 36.7 | Very low | 42 Ų | 42 | 104.8 Ų | 104.8 | 29% | 0.294 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -90.6 | -46.6 | 179.4 | 39.2 | 0 | 0 | 0 | 0 | 112 | E475 S477 R483 R484 | E475-S480 VanDerWaalsContact C-OG 3.3Å; E475-S480 PolarHBondContact O-OG 3.05Å; S477-S480 PolarHBondContact O-N 3.37Å; S477-S480 PolarHBondContact O-OG 3.36Å; S477-S480 PolarHBondContact OG-OG 3.28Å; S480-R483 PolarHBondContact O-N 3.47Å; S480-R484 PolarHBondContact O-N 2.95Å |
| 481 | T | 36.1 | Very low | 36.9 | Very low | 74 Ų | 74 | 106.5 Ų | 106.5 | 45% | 0.454 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -66.2 | -45.2 | -175.4 | 27.8 | 0 | 0 | 0 | 0 | 112.7 | L476 S477 R483 R484 | L476-T481 HydrophobicContact CD2-CG2 4.41Å; S477-T481 PolarHBondContact O-OG1 2.96Å; T481-R483 VanDerWaalsContact C-N 3.33Å; T481-R483 PolarHBondContact O-N 3.37Å; T481-R484 WeakPolarHBondContact O-CB 3.38Å; T481-R484 PolarHBondContact O-N 2.98Å |
| 482 | I | 41.2 | Very low | 36.9 | Very low | 102 Ų | 102 | 107.4 Ų | 107.4 | 52% | 0.523 | 56% | 0.563 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.2 | -34.4 | 176.4 | -60.9 | 174.4 | 0 | 0 | 0 | 111 | P478 R484 E485 | P478-I482 WeakPolarHBondContact O-CG1 3.34Å; I482-R484 PolarHBondContact O-N 3.44Å; I482-E485 PolarHBondContact O-N 2.8Å |
| 483 | R | 39.3 | Very low | 36.7 | Very low | 125 Ų | 125 | 108.2 Ų | 108.2 | 47% | 0.472 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -64.6 | -24.3 | 175.7 | -175.8 | 176.2 | -68.2 | -123.5 | -1.4 | 112.5 | F479 S480 T481 E485 L486 S487 | F479-R483 VanDerWaalsContact O-CB 3.28Å; F479-R483 WeakPolarHBondContact O-CB 3.48Å; S480-R483 PolarHBondContact O-N 3.47Å; T481-R483 VanDerWaalsContact C-N 3.33Å; T481-R483 PolarHBondContact O-N 3.37Å; R483-E485 VanDerWaalsContact C-N 3.29Å; R483-E485 PolarHBondContact O-N 2.86Å; R483-L486 PolarHBondContact O-N 2.97Å; R483-S487 VanDerWaalsContact O-CB 3.24Å; R483-S487 WeakPolarHBondContact O-CB 3.49Å; R483-S487 PolarHBondContact O-N 2.68Å |
| 484 | R | 36.8 | Very low | 36.2 | Very low | 194 Ų | 194 | 108.6 Ų | 108.6 | 73% | 0.732 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -68.7 | -24.9 | -179.4 | -154.7 | 170.6 | -171.2 | 131 | 0.1 | 113.4 | S480 T481 I482 | S480-R484 PolarHBondContact O-N 2.95Å; T481-R484 WeakPolarHBondContact O-CB 3.38Å; T481-R484 PolarHBondContact O-N 2.98Å; I482-R484 PolarHBondContact O-N 3.44Å |
| 485 | E | 37.7 | Very low | 36 | Very low | 161 Ų | 161 | 110.5 Ų | 110.5 | 75% | 0.752 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -77 | -42.8 | 168.9 | -65.6 | -167.7 | 134.3 | 0 | 0 | 111.7 | I482 R483 S487 | I482-E485 PolarHBondContact O-N 2.8Å; R483-E485 VanDerWaalsContact C-N 3.29Å; R483-E485 PolarHBondContact O-N 2.86Å; E485-S487 PolarHBondContact O-N 3.09Å |
| 486 | L | 37.7 | Very low | 35.8 | Very low | 128 Ų | 128 | 111.6 Ų | 111.6 | 67% | 0.67 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -72.2 | -26.6 | -178.4 | -168.6 | 62.3 | 0 | 0 | 0 | 113.3 | R483 N488 Y489 | R483-L486 PolarHBondContact O-N 2.97Å; L486-N488 PolarHBondContact O-N 2.87Å; L486-N488 VanDerWaalsContact O-N 3.07Å; L486-Y489 PolarHBondContact O-N 3.37Å |
| 487 | S | 33.2 | Very low | 35.9 | Very low | 78 Ų | 78 | 112 Ų | 112 | 55% | 0.545 | 63% | 0.631 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.9 | -4 | -178.1 | -168.4 | 0 | 0 | 0 | 0 | 114.6 | R483 E485 Y489 | R483-S487 VanDerWaalsContact O-CB 3.24Å; R483-S487 WeakPolarHBondContact O-CB 3.49Å; R483-S487 PolarHBondContact O-N 2.68Å; E485-S487 PolarHBondContact O-N 3.09Å; S487-Y489 PolarHBondContact O-N 3.09Å |
| 488 | N | 35.8 | Very low | 35.8 | Very low | 142 Ų | 142 | 115.6 Ų | 115.6 | 76% | 0.759 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -9.8 | 165.6 | -72.7 | -34.2 | 0 | 0 | 0 | 112.7 | L486 | L486-N488 PolarHBondContact O-N 2.87Å; L486-N488 VanDerWaalsContact O-N 3.07Å |
| 489 | Y | 39.2 | Very low | 35.6 | Very low | 192 Ų | 192 | 120.4 Ų | 120.4 | 75% | 0.753 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -102 | 121.3 | 164.3 | -78 | -89.3 | 0 | 0 | 0 | 110.5 | L486 S487 P491 | L486-Y489 PolarHBondContact O-N 3.37Å; S487-Y489 PolarHBondContact O-N 3.09Å; Y489-P491 WeakPolarHBondContact O-CD 3.01Å |
| 490 | T | 32.8 | Very low | 35.4 | Very low | 137 Ų | 137 | 122.4 Ų | 122.4 | 84% | 0.84 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 119.7 | -178.4 | 48.1 | 0 | 0 | 0 | 0 | 112 | ||
| 491 | P | 38.1 | Very low | 35.5 | Very low | 115 Ų | 115 | 127.4 Ų | 127.4 | 75% | 0.747 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 126.7 | 170.4 | 31.5 | -31.5 | 0 | 0 | 0 | 110.3 | Y489 | Y489-P491 WeakPolarHBondContact O-CD 3.01Š|
| 492 | A | 32.4 | Very low | 35.4 | Very low | 100 Ų | 100 | 131 Ų | 131 | 83% | 0.826 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 131.9 | 163.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||
| 493 | G | 35.9 | Very low | 35 | Very low | 77 Ų | 77 | 133.1 Ų | 133.1 | 79% | 0.794 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 137.2 | -171 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 494 | S | 29.4 | Very low | 34.7 | Very low | 105 Ų | 105 | 133.7 Ų | 133.7 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | trans | -124.6 | 125.4 | 155.1 | 51.9 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 495 | N | 31.2 | Very low | 34.5 | Very low | 165 Ų | 165 | 128.7 Ų | 128.7 | 88% | 0.882 | 77% | 0.773 | S | S | * | * | trans | -79 | 152.4 | 177.8 | -63.6 | -14.9 | 0 | 0 | 0 | 110.1 | ||||
| 496 | C | 30.7 | Very low | 34.2 | Very low | 144 Ų | 144 | 125.7 Ų | 125.7 | 97% | 0.973 | 78% | 0.775 | S | S | * | * | trans | -131.7 | 0 | 171.8 | -77.1 | 0 | 0 | 0 | 0 | 109.1 | Y174 | Y174-C496 HydrophobicContact CE2-CB 4.07Š|
Retrieved 496 of 496 residues in 178.6 ms
(Link to these results)