| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.8 | Very low | 34.7 | Very low | 233 Ų | 233 | 151.4 Ų | 151.4 | 100% | 1.148 | 78% | 0.78 | S | S | * | * | 0 | 108 | 0 | -68.3 | 155.4 | 175.4 | 0 | 0 | 105 | |||||
| 2 | V | 31.9 | Very low | 34.2 | Very low | 128 Ų | 128 | 147.9 Ų | 147.9 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | 66.1 | 114.4 | 50.9 | -173.7 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 3 | N | 34 | Very low | 33.7 | Very low | 128 Ų | 128 | 147.5 Ų | 147.5 | 68% | 0.684 | 76% | 0.764 | S | S | * | * | cis | -150.8 | -157.8 | -12.3 | -122.4 | 17.3 | 0 | 0 | 0 | 109 | ||||
| 4 | E | 35.6 | Very low | 34 | Very low | 165 Ų | 165 | 145.4 Ų | 145.4 | 77% | 0.771 | 76% | 0.761 | S | S | * | * | cis | -157.7 | 175.7 | 17.8 | -151.6 | 102.3 | -114.8 | 0 | 0 | 110.9 | ||||
| 5 | G | 35 | Very low | 34.4 | Very low | 61 Ų | 61 | 143.7 Ų | 143.7 | 63% | 0.629 | 76% | 0.763 | S | S | * | * | trans | -143.2 | 166 | 156.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 6 | P | 47.8 | Very low | 34.5 | Very low | 118 Ų | 118 | 140.1 Ų | 140.1 | 77% | 0.766 | 76% | 0.759 | S | S | * | * | -157.4 | 176.1 | 103.3 | 40.3 | -21.2 | 0 | 0 | 0 | 116.8 | |||||
| 7 | N | 31.1 | Very low | 35.1 | Very low | 135 Ų | 135 | 138 Ų | 138 | 72% | 0.722 | 75% | 0.754 | S | S | * | * | trans | 34 | 143.1 | 143.1 | -55 | 7 | 0 | 0 | 0 | 121.4 | ||||
| 8 | Q | 33.8 | Very low | 34.9 | Very low | 178 Ų | 178 | 140.6 Ų | 140.6 | 83% | 0.832 | 76% | 0.76 | S | S | * | * | cis | 80.2 | 141.9 | 32.4 | -156.9 | 176.8 | 27.3 | 0 | 0 | 114.2 | ||||
| 9 | E | 33.4 | Very low | 34.7 | Very low | 175 Ų | 175 | 138.3 Ų | 138.3 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | trans | 101.3 | 144.8 | -164.7 | -64.5 | 170.3 | 175.3 | 0 | 0 | 112.8 | ||||
| 10 | E | 32.3 | Very low | 34.6 | Very low | 155 Ų | 155 | 135.8 Ų | 135.8 | 72% | 0.724 | 76% | 0.755 | S | S | * | * | cis | -153.1 | 140.1 | -20.5 | -115.6 | -167.4 | 144.8 | 0 | 0 | 108.8 | ||||
| 11 | R | 28.8 | Very low | 34.4 | Very low | 189 Ų | 189 | 136.4 Ų | 136.4 | 71% | 0.713 | 76% | 0.756 | S | S | * | * | 63.2 | 131.2 | 103.8 | -93.8 | -175.7 | 172.2 | -91.9 | 2.2 | 119.1 | |||||
| 12 | D | 28.8 | Very low | 33.9 | Very low | 110 Ų | 110 | 133.6 Ų | 133.6 | 59% | 0.588 | 74% | 0.74 | S | S | * | * | trans | 63.7 | 156.9 | 142 | -49.7 | -21.6 | 0 | 0 | 0 | 119.9 | ||||
| 13 | D | 28.4 | Very low | 33.7 | Very low | 142 Ų | 142 | 131.5 Ų | 131.5 | 76% | 0.759 | 74% | 0.736 | S | S | * | * | cis | -146.3 | 172.2 | -3.4 | -141.6 | -31.7 | 0 | 0 | 0 | 113 | ||||
| 14 | T | 37.2 | Very low | 33.5 | Very low | 118 Ų | 118 | 132.8 Ų | 132.8 | 72% | 0.724 | 74% | 0.743 | S | S | * | * | trans | -82 | 158.1 | 168.6 | -16.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 15 | P | 40.4 | Very low | 34 | Very low | 121 Ų | 121 | 130 Ų | 130 | 79% | 0.786 | 74% | 0.739 | S | S | * | * | -152.8 | 179.7 | 89.6 | 39.1 | -19.5 | 0 | 0 | 0 | 116.3 | |||||
| 16 | A | 35.5 | Very low | 33.6 | Very low | 86 Ų | 86 | 132.7 Ų | 132.7 | 71% | 0.711 | 75% | 0.748 | S | S | * | * | trans | -83.3 | -166.4 | 163.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 17 | P | 44.5 | Very low | 32.7 | Very low | 104 Ų | 104 | 133.3 Ų | 133.3 | 68% | 0.675 | 75% | 0.75 | S | S | * | * | cis | -149 | -174.7 | 33.2 | 42.4 | -19.3 | 0 | 0 | 0 | 118.1 | ||||
| 18 | E | 32.3 | Very low | 32.4 | Very low | 184 Ų | 184 | 131.6 Ų | 131.6 | 86% | 0.86 | 75% | 0.749 | S | S | * | * | trans | 58.9 | 159.4 | 139.5 | -86.6 | 173.1 | 178.5 | 0 | 0 | 122.7 | ||||
| 19 | S | 31.3 | Very low | 32.1 | Very low | 98 Ų | 98 | 129.7 Ų | 129.7 | 69% | 0.685 | 75% | 0.749 | S | S | * | * | cis | -150.4 | 154.9 | -7.2 | 59.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 20 | A | 31.8 | Very low | 31.9 | Very low | 87 Ų | 87 | 129.6 Ų | 129.6 | 72% | 0.719 | 75% | 0.748 | S | S | * | * | 57 | 154.7 | 103.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 21 | L | 31 | Very low | 32 | Very low | 150 Ų | 150 | 127.7 Ų | 127.7 | 79% | 0.785 | 75% | 0.749 | S | S | * | * | cis | -122.9 | -159.3 | 14.2 | -63.3 | 149.4 | 0 | 0 | 0 | 109.7 | ||||
| 22 | Q | 27.9 | Very low | 32 | Very low | 173 Ų | 173 | 123.9 Ų | 123.9 | 81% | 0.808 | 75% | 0.751 | S | S | * | * | cis | -159.7 | 170.8 | 0.9 | -137.8 | 157.7 | 26.2 | 0 | 0 | 105.8 | ||||
| 23 | A | 27.8 | Very low | 32 | Very low | 85 Ų | 85 | 124.5 Ų | 124.5 | 70% | 0.702 | 76% | 0.759 | S | S | * | * | cis | -152.7 | -159.4 | 9.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 24 | D | 27.8 | Very low | 32 | Very low | 154 Ų | 154 | 123.3 Ų | 123.3 | 82% | 0.824 | 76% | 0.762 | S | S | * | * | trans | -138.6 | -172.3 | -169 | -90.4 | -55.2 | 0 | 0 | 0 | 111.2 | ||||
| 25 | P | 47.7 | Very low | 31.6 | Very low | 107 Ų | 107 | 125 Ų | 125 | 70% | 0.695 | 76% | 0.764 | S | S | * | * | -139.2 | -174.5 | -50.4 | 40.5 | -24.8 | 0 | 0 | 0 | 113.1 | |||||
| 26 | S | 25.7 | Very low | 31.1 | Very low | 117 Ų | 117 | 126.2 Ų | 126.2 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -165.6 | 127.5 | 143.4 | 2 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 27 | V | 28.4 | Very low | 31 | Very low | 131 Ų | 131 | 127.6 Ų | 127.6 | 79% | 0.794 | 77% | 0.766 | S | S | * | * | trans | 57.9 | 81.8 | 137.2 | -166.3 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 28 | S | 25.9 | Very low | 30.2 | Very low | 100 Ų | 100 | 127.6 Ų | 127.6 | 70% | 0.699 | 77% | 0.769 | S | S | * | * | 24 | 155.7 | 118 | 60.1 | 0 | 0 | 0 | 0 | 125.9 | |||||
| 29 | V | 26.7 | Very low | 30.1 | Very low | 137 Ų | 137 | 125.7 Ų | 125.7 | 83% | 0.83 | 77% | 0.769 | S | S | * | * | trans | 106.2 | 123 | 151.5 | -174.4 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 30 | H | 29.4 | Very low | 29.8 | Very low | 173 Ų | 173 | 125.3 Ų | 125.3 | 80% | 0.801 | 77% | 0.767 | S | S | * | * | trans | -79.5 | 155.3 | 167.2 | -104.4 | -62.1 | 0 | 0 | 0 | 111.2 | ||||
| 31 | P | 34.4 | Very low | 29.6 | Very low | 115 Ų | 115 | 128 Ų | 128 | 75% | 0.747 | 77% | 0.774 | S | S | * | * | -155.1 | 178.2 | 72.5 | 41.8 | -21.6 | 0 | 0 | 0 | 117.3 | |||||
| 32 | S | 29.8 | Very low | 29.6 | Very low | 110 Ų | 110 | 129.3 Ų | 129.3 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -85.6 | 146.7 | 166.8 | 31.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 33 | V | 28.2 | Very low | 30 | Very low | 122 Ų | 122 | 126.2 Ų | 126.2 | 74% | 0.739 | 77% | 0.771 | S | S | * | * | trans | -138.8 | 126.7 | 164.4 | -176.8 | 0 | 0 | 0 | 0 | 109.8 | I35 | V33-I35 HydrophobicContact CG1-CD1 4.38Å; V33-I35 HydrophobicContact CG1-CG1 3.98Å | ||
| 34 | S | 28.1 | Very low | 29.9 | Very low | 118 Ų | 118 | 127.1 Ų | 127.1 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | trans | -97.5 | 132.4 | 168.6 | 53.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 35 | I | 28.6 | Very low | 29.8 | Very low | 152 Ų | 152 | 124.8 Ų | 124.8 | 78% | 0.779 | 77% | 0.768 | S | S | * | * | trans | -129.6 | 126 | 169.3 | -57.9 | -177.3 | 0 | 0 | 0 | 110.2 | V33 | V33-I35 HydrophobicContact CG1-CD1 4.38Å; V33-I35 HydrophobicContact CG1-CG1 3.98Å | ||
| 36 | N | 31 | Very low | 28.8 | Very low | 148 Ų | 148 | 124.9 Ų | 124.9 | 79% | 0.791 | 77% | 0.771 | S | S | * | * | trans | -132.9 | 141.3 | 156 | -163 | 15.3 | 0 | 0 | 0 | 105.4 | ||||
| 37 | P | 33.4 | Very low | 28.9 | Very low | 115 Ų | 115 | 124.3 Ų | 124.3 | 75% | 0.747 | 77% | 0.773 | S | S | * | * | -142.1 | 141 | 128.3 | 35.2 | -21.9 | 0 | 0 | 0 | 114.5 | |||||
| 38 | S | 27.6 | Very low | 28.9 | Very low | 103 Ų | 103 | 126.1 Ų | 126.1 | 72% | 0.72 | 77% | 0.772 | S | S | * | * | trans | -80.6 | 147.2 | 164.3 | 53.2 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 39 | V | 29.2 | Very low | 29.3 | Very low | 144 Ų | 144 | 127.4 Ų | 127.4 | 87% | 0.873 | 78% | 0.778 | S | S | * | * | trans | 175.2 | 142.9 | 157.3 | 134.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 40 | S | 26.4 | Very low | 29.4 | Very low | 90 Ų | 90 | 126 Ų | 126 | 63% | 0.629 | 77% | 0.774 | S | S | * | * | cis | -170.4 | 152.4 | -19.6 | 63.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 41 | V | 27 | Very low | 29.3 | Very low | 145 Ų | 145 | 122.2 Ų | 122.2 | 88% | 0.879 | 77% | 0.773 | S | S | * | * | trans | 76 | 137.1 | 139.4 | 165.1 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 42 | H | 30.2 | Very low | 29 | Very low | 177 Ų | 177 | 124.9 Ų | 124.9 | 82% | 0.819 | 78% | 0.781 | S | S | * | * | trans | -82.1 | 179.3 | 172.9 | -94.7 | -57.1 | 0 | 0 | 0 | 111.8 | ||||
| 43 | P | 36.5 | Very low | 28.9 | Very low | 108 Ų | 108 | 124.8 Ų | 124.8 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | cis | -158.6 | 173.5 | 39 | 44.7 | -21.1 | 0 | 0 | 0 | 121.8 | ||||
| 44 | S | 26.2 | Very low | 28.8 | Very low | 104 Ų | 104 | 127.8 Ų | 127.8 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | 52.5 | 128.8 | 137.8 | 68.4 | 0 | 0 | 0 | 0 | 125.5 | ||||
| 45 | S | 25.4 | Very low | 29.4 | Very low | 105 Ų | 105 | 127.2 Ų | 127.2 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | 120.4 | 113.9 | 118.7 | -143.2 | 0 | 0 | 0 | 0 | 121 | |||||
| 46 | S | 26.8 | Very low | 29.3 | Very low | 109 Ų | 109 | 125.8 Ų | 125.8 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | 46.7 | 123.8 | 133.8 | 66.1 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 47 | A | 27.6 | Very low | 29.1 | Very low | 104 Ų | 104 | 122.2 Ų | 122.2 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | trans | -159.7 | 148.6 | 134.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 48 | H | 28.3 | Very low | 29.5 | Very low | 169 Ų | 169 | 125.4 Ų | 125.4 | 78% | 0.782 | 80% | 0.797 | S | S | * | * | trans | -106.7 | 164.7 | 170.9 | -101.7 | -78.2 | 0 | 0 | 0 | 110.3 | ||||
| 49 | P | 34.6 | Very low | 29.5 | Very low | 128 Ų | 128 | 124.9 Ų | 124.9 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | -138.6 | 173.6 | 101.6 | 35.2 | -21 | 0 | 0 | 0 | 114.1 | |||||
| 50 | S | 28.2 | Very low | 29.4 | Very low | 106 Ų | 106 | 126.5 Ų | 126.5 | 74% | 0.741 | 80% | 0.796 | S | S | * | * | trans | -131 | 148 | -173.9 | -52.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 51 | A | 28.8 | Very low | 29.6 | Very low | 95 Ų | 95 | 128.1 Ų | 128.1 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | -154.6 | 129.6 | 166.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 52 | L | 27.6 | Very low | 29.7 | Very low | 171 Ų | 171 | 126.4 Ų | 126.4 | 90% | 0.895 | 80% | 0.799 | S | S | * | * | trans | 28.6 | 118 | 155.9 | -78.4 | 64.7 | 0 | 0 | 0 | 121.1 | ||||
| 53 | A | 26.4 | Very low | 29.6 | Very low | 107 Ų | 107 | 123.6 Ų | 123.6 | 88% | 0.884 | 80% | 0.799 | S | S | * | * | -165.2 | 144.4 | 113.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 54 | Q | 26 | Very low | 29.4 | Very low | 186 Ų | 186 | 124 Ų | 124 | 87% | 0.869 | 81% | 0.805 | S | S | * | * | trans | -156.4 | 163.1 | 170.8 | -103.9 | -165.4 | -4.7 | 0 | 0 | 107.7 | ||||
| 55 | P | 42.2 | Very low | 29.5 | Very low | 105 Ų | 105 | 121.5 Ų | 121.5 | 68% | 0.682 | 80% | 0.796 | S | S | * | * | cis | -132.3 | -158.2 | -24.8 | 37.9 | -19.4 | 0 | 0 | 0 | 111.2 | ||||
| 56 | S | 25.9 | Very low | 30 | Very low | 123 Ų | 123 | 122.2 Ų | 122.2 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | 89.1 | 134.7 | 161.8 | -49.5 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 57 | G | 27.3 | Very low | 30.3 | Very low | 73 Ų | 73 | 125.7 Ų | 125.7 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | trans | 149.5 | 92.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A59 | G57-A59 PolarHBondContact O-N 3.33Š| ||
| 58 | L | 40.9 | Very low | 30.7 | Very low | 182 Ų | 182 | 127.8 Ų | 127.8 | 95% | 0.953 | 80% | 0.799 | S | S | * | * | trans | -69.9 | 111.1 | 166.1 | -86.2 | 81.3 | 0 | 0 | 0 | 108.6 | ||||
| 59 | A | 28.1 | Very low | 31.2 | Very low | 91 Ų | 91 | 125.7 Ų | 125.7 | 75% | 0.752 | 79% | 0.793 | S | S | * | * | trans | -111.7 | 123.5 | 163.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | G57 | G57-A59 PolarHBondContact O-N 3.33Š| ||
| 60 | H | 27.2 | Very low | 31.6 | Very low | 178 Ų | 178 | 123.4 Ų | 123.4 | 82% | 0.824 | 78% | 0.78 | S | S | * | * | trans | -60.6 | 133.5 | 171.6 | -73.9 | -102.1 | 0 | 0 | 0 | 109.1 | S62 | H60-S62 PolarHBondContact O-N 2.92Š| ||
| 61 | P | 30.6 | Very low | 32.2 | Very low | 124 Ų | 124 | 122.4 Ų | 122.4 | 81% | 0.805 | 77% | 0.769 | S | S | * | * | trans | -60.6 | 114.3 | 155 | 27.4 | -30.4 | 0 | 0 | 0 | 106.5 | ||||
| 62 | S | 28.6 | Very low | 33.2 | Very low | 109 Ų | 109 | 122.7 Ų | 122.7 | 76% | 0.762 | 76% | 0.757 | S | S | * | * | trans | -57.7 | 143.1 | 174.6 | 42.4 | 0 | 0 | 0 | 0 | 109.2 | H60 S64 | H60-S62 PolarHBondContact O-N 2.92Å; S62-S64 PolarHBondContact O-N 2.87Å | ||
| 63 | S | 29.2 | Very low | 34 | Very low | 118 Ų | 118 | 121.9 Ų | 121.9 | 83% | 0.825 | 75% | 0.746 | S | S | * | * | trans | -61.7 | 101.6 | -178.6 | 55.2 | 0 | 0 | 0 | 0 | 110.3 | G65 | S63-G65 VanDerWaalsContact C-N 3.33Å; S63-G65 PolarHBondContact O-N 3.48Å | ||
| 64 | S | 32.3 | Very low | 35.4 | Very low | 116 Ų | 116 | 120.8 Ų | 120.8 | 81% | 0.811 | 73% | 0.728 | S | S | * | * | trans | -58.6 | 103.6 | 154 | 47.3 | 0 | 0 | 0 | 0 | 106.4 | S62 | S62-S64 PolarHBondContact O-N 2.87Š| ||
| 65 | G | 27.4 | Very low | 37.2 | Very low | 52 Ų | 52 | 114.9 Ų | 114.9 | 54% | 0.536 | 71% | 0.707 | S | S | . | * | P | Polyproline II helix | trans | -53.6 | 153.9 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | S63 E67 | S63-G65 VanDerWaalsContact C-N 3.33Å; S63-G65 PolarHBondContact O-N 3.48Å; G65-E67 PolarHBondContact O-N 3.28Å |
| 66 | P | 35.7 | Very low | 38.8 | Very low | 121 Ų | 121 | 120.9 Ų | 120.9 | 79% | 0.786 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 134.2 | -178 | 23.8 | -34.2 | 0 | 0 | 0 | 109.9 | D68 | P66-D68 PolarHBondContact O-N 3.22Š|
| 67 | E | 34.3 | Very low | 41.3 | Very low | 182 Ų | 182 | 119.1 Ų | 119.1 | 85% | 0.85 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 129.3 | 175.9 | -68.1 | -170.4 | 127.2 | 0 | 0 | 109.5 | G65 L69 | G65-E67 PolarHBondContact O-N 3.28Å; E67-L69 PolarHBondContact O-N 2.97Å |
| 68 | D | 35.6 | Very low | 44.1 | Very low | 147 Ų | 147 | 116.6 Ų | 116.6 | 79% | 0.786 | 66% | 0.658 | S | S | * | * | trans | -50.8 | 105.9 | -168.6 | -172.9 | 15.8 | 0 | 0 | 0 | 110.5 | P66 S70 | P66-D68 PolarHBondContact O-N 3.22Å; D68-S70 WeakPolarHBondContact O-CA 3.29Å; D68-S70 PolarHBondContact O-N 3.21Å | ||
| 69 | L | 38 | Very low | 46.4 | Very low | 126 Ų | 126 | 112.7 Ų | 112.7 | 66% | 0.66 | 63% | 0.631 | S | S | * | * | trans | -63.5 | 94 | -164.9 | -99.6 | 167.7 | 0 | 0 | 0 | 109.2 | E67 V71 | E67-L69 PolarHBondContact O-N 2.97Å; L69-V71 VanDerWaalsContact O-CA 3.29Å; L69-V71 WeakPolarHBondContact O-CA 3.15Å; L69-V71 WeakPolarHBondContact O-CG2 3.21Å; L69-V71 PolarHBondContact O-N 2.87Å | ||
| 70 | S | 42.7 | Very low | 49.4 | Very low | 80 Ų | 80 | 110.3 Ų | 110.3 | 56% | 0.559 | 61% | 0.611 | S | S | * | * | trans | -49.6 | 95 | -155.4 | 50.3 | 0 | 0 | 0 | 0 | 113 | D68 I72 | D68-S70 WeakPolarHBondContact O-CA 3.29Å; D68-S70 PolarHBondContact O-N 3.21Å; S70-I72 WeakPolarHBondContact O-CG1 3.43Å; S70-I72 PolarHBondContact O-N 3.46Å | ||
| 71 | V | 41.3 | Very low | 52.3 | Low | 85 Ų | 85 | 101.8 Ų | 101.8 | 52% | 0.515 | 57% | 0.572 | S | S | . | * | trans | -64.6 | 112.8 | -157 | -167.8 | 0 | 0 | 0 | 0 | 109.8 | L69 K73 | L69-V71 VanDerWaalsContact O-CA 3.29Å; L69-V71 WeakPolarHBondContact O-CA 3.15Å; L69-V71 WeakPolarHBondContact O-CG2 3.21Å; L69-V71 PolarHBondContact O-N 2.87Å; V71-K73 HydrophobicContact CB-CG 4.37Å; V71-K73 HydrophobicContact CG1-CD 4.44Å; V71-K73 HydrophobicContact CG1-CG 3.85Å; V71-K73 PolarHBondContact O-N 2.94Å | ||
| 72 | I | 49.1 | Very low | 55.2 | Low | 101 Ų | 101 | 96 Ų | 96 | 52% | 0.518 | 53% | 0.534 | S | S | . | . | trans | -73.1 | 69.7 | -175.2 | -49.2 | -179.3 | 0 | 0 | 0 | 109.4 | S70 V74 | S70-I72 WeakPolarHBondContact O-CG1 3.43Å; S70-I72 PolarHBondContact O-N 3.46Å; I72-V74 VanDerWaalsContact C-N 3.26Å; I72-V74 HydrophobicContact CG2-CG2 4.34Å; I72-V74 PolarHBondContact O-N 3.34Å | ||
| 73 | K | 45.6 | Very low | 58.3 | Low | 153 Ų | 153 | 95.8 Ų | 95.8 | 67% | 0.665 | 52% | 0.524 | S | S | * | . | trans | -78.1 | 80.4 | 178.3 | -71.7 | -168.3 | 176.7 | 176 | 0 | 109.7 | V71 S75 | V71-K73 HydrophobicContact CB-CG 4.37Å; V71-K73 HydrophobicContact CG1-CD 4.44Å; V71-K73 HydrophobicContact CG1-CG 3.85Å; V71-K73 PolarHBondContact O-N 2.94Å; K73-S75 PolarHBondContact O-N 3.3Å | ||
| 74 | V | 56.4 | Low | 61.4 | Low | 85 Ų | 85 | 90.7 Ų | 90.7 | 52% | 0.515 | 49% | 0.488 | S | S | . | . | trans | -45 | 104.5 | 171.6 | 176.6 | 0 | 0 | 0 | 0 | 110.5 | I72 | I72-V74 VanDerWaalsContact C-N 3.26Å; I72-V74 HydrophobicContact CG2-CG2 4.34Å; I72-V74 PolarHBondContact O-N 3.34Å | ||
| 75 | S | 62.9 | Low | 64.4 | Low | 62 Ų | 62 | 85.1 Ų | 85.1 | 43% | 0.434 | 45% | 0.449 | S | S | . | . | trans | -80.9 | 126.7 | -174.8 | -173.3 | 0 | 0 | 0 | 0 | 111.3 | K73 R77 R78 | K73-S75 PolarHBondContact O-N 3.3Å; S75-R77 PolarHBondContact O-N 2.95Å; S75-R77 PolarHBondContact OG-N 2.76Å; S75-R78 VanDerWaalsContact O-CG 3.27Å; S75-R78 WeakPolarHBondContact O-CG 3.36Å; S75-R78 PolarHBondContact O-N 2.77Å; S75-R78 VanDerWaalsContact O-N 3.07Å | ||
| 76 | R | 75.5 | Confident | 67.6 | Low | 231 Ų | 231 | 83.2 Ų | 83.2 | 87% | 0.872 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.4 | -24.1 | 172.6 | -69.5 | -174 | 177.7 | -175.8 | -0.9 | 113.3 | R78 W79 | R76-R78 PolarHBondContact O-N 2.94Å; R76-W79 PolarHBondContact O-N 3.32Å |
| 77 | R | 79.4 | Confident | 70.5 | Confident | 86 Ų | 86 | 79.2 Ų | 79.2 | 33% | 0.325 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.8 | -26.9 | 177.4 | -171 | 172.8 | -179.7 | 125.4 | -3.8 | 113.8 | S75 W79 A80 V81 I264 V265 | S75-R77 PolarHBondContact O-N 2.95Å; S75-R77 PolarHBondContact OG-N 2.76Å; R77-W79 VanDerWaalsContact C-N 3.32Å; R77-W79 PolarHBondContact O-N 2.93Å; R77-A80 WeakPolarHBondContact O-CB 2.94Å; R77-A80 PolarHBondContact O-N 2.89Å; R77-A80 VanDerWaalsContact O-N 3.13Å; R77-V81 PolarHBondContact O-N 3.25Å; R77-I264 PolarHBondContact NH2-O 2.94Å; R77-V265 VanDerWaalsContact CZ-O 3.27Å; R77-V265 PolarHBondContact NE-O 3.4Å; R77-V265 VanDerWaalsContact NH2-C 3.29Å; R77-V265 PolarHBondContact NH2-O 3.47Å |
| 78 | R | 85.5 | Confident | 73.4 | Confident | 19 Ų | 19 | 70.6 Ų | 70.6 | 7% | 0.072 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -59.4 | -39.9 | 179.4 | 71.9 | -170.7 | -177.1 | 154.3 | 2.6 | 113.3 | S75 R76 A80 V81 V82 W199 F200 E204 | S75-R78 VanDerWaalsContact O-CG 3.27Å; S75-R78 WeakPolarHBondContact O-CG 3.36Å; S75-R78 PolarHBondContact O-N 2.77Å; S75-R78 VanDerWaalsContact O-N 3.07Å; R76-R78 PolarHBondContact O-N 2.94Å; R78-A80 VanDerWaalsContact C-N 3.33Å; R78-V81 PolarHBondContact O-N 2.96Å; R78-V82 PolarHBondContact O-N 2.83Å; R78-V82 VanDerWaalsContact O-N 3.08Å; R78-W199 HydrophobicContact CB-CB 4.1Å; R78-W199 HydrophobicContact CB-CE3 3.86Å; R78-W199 WeakPolarHBondContact CD-O 3.24Å; R78-F200 HydrophobicContact CB-CE1 4.27Å; R78-F200 HydrophobicContact CB-CE2 4.02Å; R78-F200 HydrophobicContact CB-CZ 3.8Å; R78-F200 HydrophobicContact CG-CD1 4.31Å; R78-F200 HydrophobicContact CG-CE1 3.65Å; R78-F200 HydrophobicContact CG-CE2 4.3Å; R78-F200 HydrophobicContact CG-CZ 3.63Å; R78-E204 IonicContact CZ-OE1 3.97Å; R78-E204 IonicContact CZ-OE2 2.87Å; R78-E204 IonicContact NH1-OE1 2.68Å; R78-E204 IonicContact NH1-OE2 2.77Å; R78-E204 PolarHBondContact NH1-OE2 3.24Å; R78-E204 IonicContact NH2-OE1 3.47Å; R78-E204 PolarHBondContact NH2-OE1 2.92Å; R78-E204 IonicContact NH2-OE2 3.27Å; R78-E204 PolarHBondContact NH2-OE2 2.88Å |
| 79 | W | 88.8 | Confident | 76.3 | Confident | 100 Ų | 100 | 63.7 Ų | 63.7 | 38% | 0.379 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -70.5 | -32.5 | 177.8 | -73.2 | 121.9 | 0 | 0 | 0 | 111.4 | R76 R77 V82 L83 F200 T207 | R76-W79 PolarHBondContact O-N 3.32Å; R77-W79 VanDerWaalsContact C-N 3.32Å; R77-W79 PolarHBondContact O-N 2.93Å; W79-V82 PolarHBondContact O-N 3.4Å; W79-L83 VanDerWaalsContact O-CB 3.26Å; W79-L83 WeakPolarHBondContact O-CB 3.35Å; W79-L83 PolarHBondContact O-N 3.44Å; W79-F200 AromaticContact CD2-CE1 3.81Å; W79-F200 HydrophobicContact CD2-CE1 3.81Å; W79-F200 HydrophobicContact CD2-CZ 4.17Å; W79-F200 AromaticContact CE2-CE1 3.77Å; W79-F200 AromaticContact CE3-CE1 3.91Å; W79-F200 HydrophobicContact CE3-CE1 3.91Å; W79-F200 HydrophobicContact CE3-CZ 4.04Å; W79-F200 HydrophobicContact CG-CE1 4.5Å; W79-F200 AromaticContact CH2-CE1 3.93Å; W79-F200 HydrophobicContact CH2-CE1 3.93Å; W79-F200 HydrophobicContact CZ2-CD1 4.49Å; W79-F200 AromaticContact CZ2-CE1 3.84Å; W79-F200 HydrophobicContact CZ2-CE1 3.84Å; W79-F200 AromaticContact CZ3-CE1 3.97Å; W79-F200 HydrophobicContact CZ3-CE1 3.97Å; W79-F200 HydrophobicContact CZ3-CZ 4.33Å; W79-T207 HydrophobicContact CH2-CG2 4.22Å |
| 80 | A | 90.3 | Very high | 79.1 | Confident | 41 Ų | 41 | 60 Ų | 60 | 34% | 0.339 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -67.6 | -35.7 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | R77 R78 V84 V265 | R77-A80 WeakPolarHBondContact O-CB 2.94Å; R77-A80 PolarHBondContact O-N 2.89Å; R77-A80 VanDerWaalsContact O-N 3.13Å; R78-A80 VanDerWaalsContact C-N 3.33Å; A80-V84 WeakPolarHBondContact O-CB 3.28Å; A80-V84 VanDerWaalsContact O-CG2 3.27Å; A80-V84 WeakPolarHBondContact O-CG2 3.38Å; A80-V84 PolarHBondContact O-N 3.44Å; A80-V265 HydrophobicContact CB-CG1 3.96Å |
| 81 | V | 90 | Very high | 81.7 | Confident | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.6 | -47.6 | 173.5 | 173.3 | 0 | 0 | 0 | 0 | 110.8 | R77 R78 F85 I195 W199 V265 F266 | R77-V81 PolarHBondContact O-N 3.25Å; R78-V81 PolarHBondContact O-N 2.96Å; V81-F85 WeakPolarHBondContact O-CB 3.48Å; V81-F85 PolarHBondContact O-N 3.41Å; V81-I195 HydrophobicContact CG1-CG2 4.2Å; V81-W199 HydrophobicContact CG2-CD2 4.47Å; V81-W199 HydrophobicContact CG2-CE3 4.45Å; V81-W199 HydrophobicContact CG2-CH2 4.17Å; V81-W199 HydrophobicContact CG2-CZ2 4.19Å; V81-W199 HydrophobicContact CG2-CZ3 4.29Å; V81-V265 HydrophobicContact CG2-CG1 4.05Å; V81-F266 HydrophobicContact CG1-CD1 4.18Å; V81-F266 HydrophobicContact CG1-CD2 4.35Å; V81-F266 HydrophobicContact CG1-CE1 3.83Å; V81-F266 HydrophobicContact CG1-CE2 4Å; V81-F266 HydrophobicContact CG1-CG 4.44Å; V81-F266 HydrophobicContact CG1-CZ 3.75Å |
| 82 | V | 91.4 | Very high | 84.4 | Confident | 1 Ų | 1 | 52.5 Ų | 52.5 | 1% | 0.006 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 176.1 | 169.7 | 0 | 0 | 0 | 0 | 112 | R78 W79 F85 S86 I195 F200 A208 V211 A212 | R78-V82 PolarHBondContact O-N 2.83Å; R78-V82 VanDerWaalsContact O-N 3.08Å; W79-V82 PolarHBondContact O-N 3.4Å; V82-F85 WeakPolarHBondContact O-CB 3.5Å; V82-F85 PolarHBondContact O-N 2.84Å; V82-S86 PolarHBondContact O-N 2.96Å; V82-S86 PolarHBondContact O-OG 3.47Å; V82-S86 VanDerWaalsContact O-OG 3.06Å; V82-I195 HydrophobicContact CG2-CG2 3.63Å; V82-F200 HydrophobicContact CB-CZ 4.43Å; V82-F200 HydrophobicContact CG2-CE2 3.43Å; V82-F200 VanDerWaalsContact CG2-CE2 3.43Å; V82-F200 HydrophobicContact CG2-CZ 3.57Å; V82-A208 HydrophobicContact CG2-CB 4.36Å; V82-V211 HydrophobicContact CG1-CB 4.02Å; V82-V211 HydrophobicContact CG1-CG1 3.74Å; V82-A212 HydrophobicContact CG1-CB 4.46Å |
| 83 | L | 92.6 | Very high | 86.7 | Confident | 106 Ų | 106 | 47.8 Ų | 47.8 | 56% | 0.555 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -66.6 | -44 | -180 | -172.3 | 150.3 | 0 | 0 | 0 | 111.8 | W79 F85 S86 C87 | W79-L83 VanDerWaalsContact O-CB 3.26Å; W79-L83 WeakPolarHBondContact O-CB 3.35Å; W79-L83 PolarHBondContact O-N 3.44Å; L83-F85 VanDerWaalsContact C-N 3.3Å; L83-F85 PolarHBondContact O-N 3.05Å; L83-S86 PolarHBondContact O-N 3.05Å; L83-C87 PolarHBondContact O-N 3.04Å; L83-C87 PolarHBondContact O-SG 3.06Å |
| 84 | V | 94.3 | Very high | 89.1 | Confident | 10 Ų | 10 | 41.4 Ų | 41.4 | 6% | 0.061 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.6 | -39 | 174.2 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | A80 C87 Y88 L261 V262 V265 F266 | A80-V84 WeakPolarHBondContact O-CB 3.28Å; A80-V84 VanDerWaalsContact O-CG2 3.27Å; A80-V84 WeakPolarHBondContact O-CG2 3.38Å; A80-V84 PolarHBondContact O-N 3.44Å; V84-C87 PolarHBondContact O-N 3.15Å; V84-Y88 HydrophobicContact CG1-CD1 4.33Å; V84-Y88 WeakPolarHBondContact O-CD1 3.38Å; V84-Y88 PolarHBondContact O-N 3.2Å; V84-Y88 VanDerWaalsContact O-N 3.16Å; V84-L261 HydrophobicContact CG1-CB 4.16Å; V84-L261 HydrophobicContact CG2-CB 4.28Å; V84-V262 HydrophobicContact CG1-CG2 3.64Å; V84-V265 HydrophobicContact CG2-CB 4.28Å; V84-V265 HydrophobicContact CG2-CG1 4.23Å; V84-V265 HydrophobicContact CG2-CG2 4.22Å; V84-F266 HydrophobicContact CB-CE2 4.38Å; V84-F266 HydrophobicContact CG1-CD2 4.41Å; V84-F266 HydrophobicContact CG1-CE2 4.11Å |
| 85 | F | 94.7 | Very high | 91.1 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.2 | -55.2 | 170.7 | 177 | -90.7 | 0 | 0 | 0 | 111.9 | V81 V82 L83 C87 Y88 S89 I188 M191 P192 I195 A212 F266 | V81-F85 WeakPolarHBondContact O-CB 3.48Å; V81-F85 PolarHBondContact O-N 3.41Å; V82-F85 WeakPolarHBondContact O-CB 3.5Å; V82-F85 PolarHBondContact O-N 2.84Å; L83-F85 VanDerWaalsContact C-N 3.3Å; L83-F85 PolarHBondContact O-N 3.05Å; F85-C87 PolarHBondContact O-N 2.85Å; F85-Y88 HydrophobicContact CB-CE1 4.41Å; F85-Y88 HydrophobicContact CD2-CE1 4.23Å; F85-Y88 HydrophobicContact CD2-CE2 4.07Å; F85-Y88 AromaticContact CD2-CZ 3.63Å; F85-Y88 WeakPolarHBondContact CD2-OH 3.27Å; F85-Y88 HydrophobicContact CE2-CE2 4.17Å; F85-Y88 PolarHBondContact O-N 2.97Å; F85-S89 WeakPolarHBondContact O-CB 3.38Å; F85-S89 PolarHBondContact O-N 3.48Å; F85-I188 HydrophobicContact CE2-CG2 4.05Å; F85-I188 HydrophobicContact CZ-CG2 3.9Å; F85-I188 WeakPolarHBondContact CZ-O 3.48Å; F85-M191 HydrophobicContact CD2-CB 4.18Å; F85-M191 HydrophobicContact CE2-CB 3.51Å; F85-M191 HydrophobicContact CE2-CE 4.08Å; F85-M191 HydrophobicContact CE2-SD 4.42Å; F85-M191 HydrophobicContact CZ-CB 4.14Å; F85-P192 HydrophobicContact CE1-CG 3.83Å; F85-P192 HydrophobicContact CZ-CG 3.81Å; F85-I195 HydrophobicContact CB-CD1 3.82Å; F85-I195 HydrophobicContact CD1-CD1 4.29Å; F85-I195 HydrophobicContact CD2-CD1 3.34Å; F85-I195 HydrophobicContact CE2-CD1 4.04Å; F85-I195 HydrophobicContact CG-CD1 3.51Å; F85-A212 HydrophobicContact CD1-CB 3.53Å; F85-A212 HydrophobicContact CE1-CB 3.68Å; F85-A212 WeakPolarHBondContact CE1-O 3.39Å; F85-F266 HydrophobicContact CB-CZ 4.09Å |
| 86 | S | 95.1 | Very high | 92.7 | Very high | 12 Ų | 12 | 34.8 Ų | 34.8 | 8% | 0.084 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -55.1 | -42.1 | -179.7 | -61 | 0 | 0 | 0 | 0 | 111 | V82 L83 S89 M90 V211 A212 | V82-S86 PolarHBondContact O-N 2.96Å; V82-S86 PolarHBondContact O-OG 3.47Å; V82-S86 VanDerWaalsContact O-OG 3.06Å; L83-S86 PolarHBondContact O-N 3.05Å; S86-S89 PolarHBondContact O-N 3.36Å; S86-M90 WeakPolarHBondContact O-CB 3.27Å; S86-M90 PolarHBondContact O-N 3.09Å; S86-V211 PolarHBondContact OG-O 3.22Å; S86-A212 WeakPolarHBondContact OG-CA 3.3Å |
| 87 | C | 96.1 | Very high | 93.7 | Very high | 36 Ų | 36 | 23.9 Ų | 23.9 | 24% | 0.243 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -69.5 | -34.3 | -179.1 | -65 | 0 | 0 | 0 | 0 | 114.6 | L83 V84 F85 M90 C91 L258 | L83-C87 PolarHBondContact O-N 3.04Å; L83-C87 PolarHBondContact O-SG 3.06Å; V84-C87 PolarHBondContact O-N 3.15Å; F85-C87 PolarHBondContact O-N 2.85Å; C87-M90 WeakPolarHBondContact O-CB 3.29Å; C87-C91 PolarHBondContact O-N 3.1Å; C87-C91 VanDerWaalsContact O-N 3.15Å; C87-L258 HydrophobicContact CB-CD2 3.52Å; C87-L258 WeakPolarHBondContact O-CD1 3.47Å |
| 88 | Y | 95.2 | Very high | 94.4 | Very high | 2 Ų | 2 | 19.8 Ų | 19.8 | 1% | 0.008 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -84 | -27.3 | 173.6 | 76.6 | -111.6 | 0 | 0 | 0 | 113.5 | V84 F85 M90 C91 N92 A148 I188 M191 V262 F266 | V84-Y88 HydrophobicContact CG1-CD1 4.33Å; V84-Y88 WeakPolarHBondContact O-CD1 3.38Å; V84-Y88 PolarHBondContact O-N 3.2Å; V84-Y88 VanDerWaalsContact O-N 3.16Å; F85-Y88 HydrophobicContact CB-CE1 4.41Å; F85-Y88 HydrophobicContact CD2-CE1 4.23Å; F85-Y88 HydrophobicContact CD2-CE2 4.07Å; F85-Y88 AromaticContact CD2-CZ 3.63Å; F85-Y88 WeakPolarHBondContact CD2-OH 3.27Å; F85-Y88 HydrophobicContact CE2-CE2 4.17Å; F85-Y88 PolarHBondContact O-N 2.97Å; Y88-M90 VanDerWaalsContact C-N 3.35Å; Y88-C91 PolarHBondContact O-N 3.08Å; Y88-N92 PolarHBondContact O-N 2.88Å; Y88-A148 WeakPolarHBondContact OH-CB 3.34Å; Y88-I188 HydrophobicContact CD2-CD1 4.03Å; Y88-I188 HydrophobicContact CD2-CG1 4.23Å; Y88-I188 HydrophobicContact CE2-CD1 4.27Å; Y88-I188 HydrophobicContact CE2-CG1 3.94Å; Y88-I188 HydrophobicContact CE2-CG2 4.27Å; Y88-M191 HydrophobicContact CE2-CE 4.26Å; Y88-M191 WeakPolarHBondContact OH-CE 3.31Å; Y88-V262 HydrophobicContact CD1-CG2 3.38Å; Y88-V262 HydrophobicContact CE1-CG2 3.4Å; Y88-V262 HydrophobicContact CG-CG2 4.44Å; Y88-F266 HydrophobicContact CE1-CE2 4Å; Y88-F266 HydrophobicContact CE1-CZ 4.1Å |
| 89 | S | 96.3 | Very high | 94.9 | Very high | 2 Ų | 2 | 18.9 Ų | 18.9 | 1% | 0.014 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.4 | -44.9 | 166.9 | -173.4 | 0 | 0 | 0 | 0 | 111 | F85 S86 C91 N92 A93 N216 | F85-S89 WeakPolarHBondContact O-CB 3.38Å; F85-S89 PolarHBondContact O-N 3.48Å; S86-S89 PolarHBondContact O-N 3.36Å; S89-C91 PolarHBondContact O-N 3.14Å; S89-N92 PolarHBondContact O-N 2.83Å; S89-A93 WeakPolarHBondContact O-CB 3.48Å; S89-A93 PolarHBondContact O-N 3.03Å; S89-N216 WeakPolarHBondContact OG-CB 3.45Å; S89-N216 PolarHBondContact OG-ND2 3.45Å |
| 90 | M | 97.1 | Very high | 95.1 | Very high | 47 Ų | 47 | 14.4 Ų | 14.4 | 23% | 0.232 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -55.1 | -46.6 | 170.7 | -174.5 | -175.8 | 73.4 | 0 | 0 | 112 | S86 C87 Y88 N92 A93 F94 G215 L218 G219 I222 | S86-M90 WeakPolarHBondContact O-CB 3.27Å; S86-M90 PolarHBondContact O-N 3.09Å; C87-M90 WeakPolarHBondContact O-CB 3.29Å; Y88-M90 VanDerWaalsContact C-N 3.35Å; M90-N92 PolarHBondContact O-N 3.44Å; M90-A93 PolarHBondContact O-N 3.25Å; M90-F94 WeakPolarHBondContact O-CB 3.39Å; M90-F94 PolarHBondContact O-N 3.35Å; M90-G215 WeakPolarHBondContact CA-O 3.22Å; M90-G215 WeakPolarHBondContact CB-O 3.41Å; M90-G215 PolarHBondContact N-O 2.72Å; M90-L218 HydrophobicContact SD-CD2 3.91Å; M90-L218 HydrophobicContact SD-CG 4.03Å; M90-G219 VanDerWaalsContact CG-CA 3.5Å; M90-G219 VanDerWaalsContact O-CA 3.28Å; M90-G219 WeakPolarHBondContact O-CA 3.48Å; M90-I222 HydrophobicContact CG-CD1 4.29Å; M90-I222 HydrophobicContact SD-CD1 3.79Å |
| 91 | C | 97.8 | Very high | 95.2 | Very high | 9 Ų | 9 | 12.6 Ų | 12.6 | 6% | 0.061 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -64.4 | -34.5 | 178.2 | -178.1 | 0 | 0 | 0 | 0 | 113.5 | C87 Y88 S89 Q95 N155 L258 | C87-C91 PolarHBondContact O-N 3.1Å; C87-C91 VanDerWaalsContact O-N 3.15Å; Y88-C91 PolarHBondContact O-N 3.08Å; S89-C91 PolarHBondContact O-N 3.14Å; C91-Q95 WeakPolarHBondContact O-CG 3.29Å; C91-Q95 PolarHBondContact O-N 3.14Å; C91-N155 PolarHBondContact SG-ND2 3.13Å; C91-N155 VanDerWaalsContact SG-ND2 3.45Å; C91-L258 HydrophobicContact CB-CD1 3.75Å |
| 92 | N | 98.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -75.9 | -41.2 | 176.5 | -178.4 | -106.6 | 0 | 0 | 0 | 112.7 | Y88 S89 M90 F94 Q95 W96 Y124 N155 C181 Q185 I188 | Y88-N92 PolarHBondContact O-N 2.88Å; S89-N92 PolarHBondContact O-N 2.83Å; M90-N92 PolarHBondContact O-N 3.44Å; N92-F94 VanDerWaalsContact C-N 3.34Å; N92-Q95 PolarHBondContact O-N 3.22Å; N92-Q95 VanDerWaalsContact O-N 3.15Å; N92-W96 PolarHBondContact O-N 3.09Å; N92-W96 VanDerWaalsContact O-N 3.12Å; N92-Y124 PolarHBondContact O-OH 3.31Å; N92-N155 WeakPolarHBondContact CA-OD1 3.5Å; N92-N155 WeakPolarHBondContact CB-OD1 3.1Å; N92-N155 PolarHBondContact ND2-OD1 3.11Å; N92-C181 PolarHBondContact ND2-O 3.42Å; N92-Q185 WeakPolarHBondContact OD1-CA 3.35Å; N92-Q185 VanDerWaalsContact OD1-CB 3.27Å; N92-Q185 WeakPolarHBondContact OD1-CB 3.28Å; N92-Q185 WeakPolarHBondContact OD1-CG 3.36Å; N92-I188 HydrophobicContact CB-CD1 3.4Å |
| 93 | A | 97 | Very high | 95.7 | Very high | 1 Ų | 1 | 12.6 Ų | 12.6 | 1% | 0.008 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -67.4 | -33 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | S89 M90 W96 I97 N216 I220 | S89-A93 WeakPolarHBondContact O-CB 3.48Å; S89-A93 PolarHBondContact O-N 3.03Å; M90-A93 PolarHBondContact O-N 3.25Å; A93-W96 WeakPolarHBondContact O-CB 3.12Å; A93-W96 PolarHBondContact O-N 3.08Å; A93-I97 PolarHBondContact O-N 2.9Å; A93-N216 VanDerWaalsContact CB-O 3.31Å; A93-N216 WeakPolarHBondContact CB-O 3.48Å; A93-I220 HydrophobicContact CB-CG1 4.03Å |
| 94 | F | 97.6 | Very high | 95.8 | Very high | 20 Ų | 20 | 9.1 Ų | 9.1 | 9% | 0.088 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -56.3 | -51.6 | 166.7 | -178.3 | -78.2 | 0 | 0 | 0 | 111 | M90 N92 W96 I97 Q98 G219 I222 G223 V226 P227 I251 | M90-F94 WeakPolarHBondContact O-CB 3.39Å; M90-F94 PolarHBondContact O-N 3.35Å; N92-F94 VanDerWaalsContact C-N 3.34Å; F94-W96 PolarHBondContact O-N 3.37Å; F94-I97 PolarHBondContact O-N 3.47Å; F94-Q98 HydrophobicContact CD1-CB 4.24Å; F94-Q98 HydrophobicContact CE1-CB 3.83Å; F94-Q98 WeakPolarHBondContact O-CB 3.41Å; F94-Q98 PolarHBondContact O-N 2.85Å; F94-G219 WeakPolarHBondContact CA-O 3.39Å; F94-I222 HydrophobicContact CD2-CB 4.25Å; F94-I222 HydrophobicContact CD2-CG2 3.81Å; F94-I222 HydrophobicContact CE2-CG2 3.89Å; F94-G223 VanDerWaalsContact CD2-CA 3.47Å; F94-V226 HydrophobicContact CE2-CB 4Å; F94-V226 HydrophobicContact CE2-CG1 4.38Å; F94-V226 HydrophobicContact CZ-CB 4.36Å; F94-V226 HydrophobicContact CZ-CG1 4.39Å; F94-P227 HydrophobicContact CE1-CG 4.48Å; F94-P227 HydrophobicContact CE2-CG 4.41Å; F94-P227 HydrophobicContact CZ-CG 3.82Å; F94-I251 HydrophobicContact CD1-CD1 4.2Å; F94-I251 HydrophobicContact CD1-CG1 4.27Å; F94-I251 HydrophobicContact CE1-CD1 3.61Å; F94-I251 HydrophobicContact CE1-CG1 3.91Å |
| 95 | Q | 97.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 8.6 Ų | 8.6 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -67.2 | -20.3 | -176.1 | -76.5 | -169 | 80.8 | 0 | 0 | 114.2 | C91 N92 N155 Q178 C181 I251 | C91-Q95 WeakPolarHBondContact O-CG 3.29Å; C91-Q95 PolarHBondContact O-N 3.14Å; N92-Q95 PolarHBondContact O-N 3.22Å; N92-Q95 VanDerWaalsContact O-N 3.15Å; Q95-N155 PolarHBondContact NE2-O 2.85Å; Q95-N155 PolarHBondContact NE2-OD1 2.73Å; Q95-Q178 PolarHBondContact O-NE2 3.01Å; Q95-Q178 PolarHBondContact O-OE1 3.17Å; Q95-C181 PolarHBondContact OE1-SG 3.35Å; Q95-I251 HydrophobicContact CG-CG2 3.69Å |
| 96 | W | 96.9 | Very high | 95.8 | Very high | 8 Ų | 8 | 8.6 Ų | 8.6 | 3% | 0.03 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -66.8 | -55.7 | 169.4 | 174.8 | 40.3 | 0 | 0 | 0 | 111.2 | N92 A93 F94 S121 Y124 M125 I220 Y319 | N92-W96 PolarHBondContact O-N 3.09Å; N92-W96 VanDerWaalsContact O-N 3.12Å; A93-W96 WeakPolarHBondContact O-CB 3.12Å; A93-W96 PolarHBondContact O-N 3.08Å; F94-W96 PolarHBondContact O-N 3.37Å; W96-S121 PolarHBondContact NE1-O 3.35Å; W96-S121 PolarHBondContact NE1-OG 3.37Å; W96-Y124 HydrophobicContact CB-CD1 3.72Å; W96-Y124 HydrophobicContact CB-CE1 3.52Å; W96-Y124 HydrophobicContact CB-CE2 4.42Å; W96-Y124 HydrophobicContact CB-CG 4.26Å; W96-Y124 AromaticContact CD1-CD1 3.86Å; W96-Y124 AromaticContact CD1-CD2 3.97Å; W96-Y124 AromaticContact CD1-CG 3.6Å; W96-Y124 AromaticContact CG-CD1 3.86Å; W96-Y124 HydrophobicContact CG-CD1 3.86Å; W96-Y124 HydrophobicContact CG-CE1 4.19Å; W96-Y124 HydrophobicContact CG-CG 4.08Å; W96-Y124 PolarHBondContact N-OH 3.3Å; W96-M125 HydrophobicContact CZ2-CE 4.2Å; W96-I220 HydrophobicContact CE3-CD1 4.43Å; W96-I220 HydrophobicContact CE3-CG1 4.27Å; W96-I220 HydrophobicContact CZ3-CD1 3.84Å; W96-I220 HydrophobicContact CZ3-CG1 4.1Å; W96-Y319 AromaticContact CH2-CD1 3.67Å; W96-Y319 HydrophobicContact CH2-CD1 3.67Å; W96-Y319 HydrophobicContact CH2-CE1 4.17Å; W96-Y319 HydrophobicContact CH2-CG 4.19Å; W96-Y319 HydrophobicContact CZ2-CD1 4.28Å; W96-Y319 HydrophobicContact CZ2-CG 4.35Å |
| 97 | I | 95.3 | Very high | 95.8 | Very high | 1 Ų | 1 | 11.1 Ų | 11.1 | 1% | 0.005 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -81.3 | -23 | -171.5 | -68.7 | -59.6 | 0 | 0 | 0 | 114.1 | A93 F94 Y99 G100 S101 I220 F224 | A93-I97 PolarHBondContact O-N 2.9Å; F94-I97 PolarHBondContact O-N 3.47Å; I97-Y99 PolarHBondContact O-N 3.27Å; I97-G100 WeakPolarHBondContact O-CA 3.27Å; I97-G100 PolarHBondContact O-N 2.82Å; I97-S101 PolarHBondContact O-N 3.43Å; I97-S101 PolarHBondContact O-OG 2.99Å; I97-I220 HydrophobicContact CG1-CG2 4.07Å; I97-F224 HydrophobicContact CD1-CZ 4.47Å; I97-F224 HydrophobicContact CG2-CD1 3.75Å; I97-F224 HydrophobicContact CG2-CD2 4.28Å; I97-F224 HydrophobicContact CG2-CE1 3.71Å; I97-F224 HydrophobicContact CG2-CE2 4.27Å; I97-F224 HydrophobicContact CG2-CG 4.03Å; I97-F224 HydrophobicContact CG2-CZ 3.98Å |
| 98 | Q | 95.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 12.3 Ų | 12.3 | 0% | 0 | 6% | 0.062 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -52 | -26.9 | -171.1 | 73.3 | -176.5 | 26.3 | 0 | 0 | 116.1 | F94 S101 I102 P227 I251 | F94-Q98 HydrophobicContact CD1-CB 4.24Å; F94-Q98 HydrophobicContact CE1-CB 3.83Å; F94-Q98 WeakPolarHBondContact O-CB 3.41Å; F94-Q98 PolarHBondContact O-N 2.85Å; Q98-S101 PolarHBondContact O-OG 3.49Å; Q98-I102 WeakPolarHBondContact O-CG1 3.48Å; Q98-P227 HydrophobicContact CB-CG 4.09Å; Q98-I251 VanDerWaalsContact OE1-CD1 3.29Å |
| 99 | Y | 95.3 | Very high | 95.7 | Very high | 1 Ų | 1 | 12.2 Ų | 12.2 | 0% | 0.004 | 6% | 0.062 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | -33.7 | 176.9 | -65 | -77.3 | 0 | 0 | 0 | 112.5 | I97 I102 N103 F106 L120 K162 T174 F248 | I97-Y99 PolarHBondContact O-N 3.27Å; Y99-I102 CarbonylContact O-C 3.57Å; Y99-N103 VanDerWaalsContact O-CA 3.23Å; Y99-N103 WeakPolarHBondContact O-CA 3.31Å; Y99-N103 PolarHBondContact O-N 3.24Å; Y99-N103 VanDerWaalsContact O-N 3.14Å; Y99-F106 HydrophobicContact CD1-CD1 4.11Å; Y99-F106 AromaticContact CD1-CD2 3.56Å; Y99-F106 HydrophobicContact CD1-CD2 3.56Å; Y99-F106 AromaticContact CD1-CE1 3.98Å; Y99-F106 HydrophobicContact CD1-CE1 3.98Å; Y99-F106 AromaticContact CD1-CE2 3.4Å; Y99-F106 HydrophobicContact CD1-CE2 3.4Å; Y99-F106 AromaticContact CD1-CG 3.92Å; Y99-F106 HydrophobicContact CD1-CG 3.92Å; Y99-F106 AromaticContact CD1-CZ 3.63Å; Y99-F106 HydrophobicContact CD1-CZ 3.63Å; Y99-F106 HydrophobicContact CE1-CD1 4.27Å; Y99-F106 HydrophobicContact CE1-CD2 4.37Å; Y99-F106 AromaticContact CE1-CE1 3.82Å; Y99-F106 HydrophobicContact CE1-CE1 3.82Å; Y99-F106 AromaticContact CE1-CE2 3.92Å; Y99-F106 HydrophobicContact CE1-CE2 3.92Å; Y99-F106 AromaticContact CE1-CZ 3.63Å; Y99-F106 HydrophobicContact CE1-CZ 3.63Å; Y99-F106 HydrophobicContact CG-CD2 4.37Å; Y99-F106 HydrophobicContact CG-CE2 4.22Å; Y99-L120 HydrophobicContact CD1-CD1 3.64Å; Y99-L120 HydrophobicContact CD2-CB 4.22Å; Y99-L120 HydrophobicContact CD2-CD1 3.93Å; Y99-L120 HydrophobicContact CE1-CD1 4.12Å; Y99-L120 HydrophobicContact CE2-CD1 4.36Å; Y99-L120 HydrophobicContact CG-CB 4.36Å; Y99-L120 HydrophobicContact CG-CD1 3.56Å; Y99-K162 WeakPolarHBondContact OH-CD 3.19Å; Y99-T174 HydrophobicContact CD1-CG2 4.41Å; Y99-T174 HydrophobicContact CE1-CG2 3.65Å; Y99-T174 HydrophobicContact CE2-CG2 4.32Å; Y99-F248 HydrophobicContact CE1-CZ 4.11Å; Y99-F248 WeakPolarHBondContact OH-CZ 3.38Å |
| 100 | G | 92.5 | Very high | 95.7 | Very high | 5 Ų | 5 | 12.7 Ų | 12.7 | 5% | 0.052 | 6% | 0.063 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -35.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | I97 I102 N103 N326 | I97-G100 WeakPolarHBondContact O-CA 3.27Å; I97-G100 PolarHBondContact O-N 2.82Å; G100-I102 PolarHBondContact O-N 3.02Å; G100-N103 PolarHBondContact O-N 2.74Å; G100-N326 WeakPolarHBondContact O-CB 3.44Å |
| 101 | S | 94.1 | Very high | 95.5 | Very high | 3 Ų | 3 | 13.3 Ų | 13.3 | 2% | 0.021 | 8% | 0.081 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -28.5 | 177.2 | 53.1 | 0 | 0 | 0 | 0 | 113.8 | I97 Q98 G223 N326 | I97-S101 PolarHBondContact O-N 3.43Å; I97-S101 PolarHBondContact O-OG 2.99Å; Q98-S101 PolarHBondContact O-OG 3.49Å; S101-G223 WeakPolarHBondContact CB-O 3.33Å; S101-G223 PolarHBondContact OG-O 2.88Å; S101-N326 PolarHBondContact O-ND2 3.05Å |
| 102 | I | 94.7 | Very high | 95.4 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 9% | 0.089 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -129.4 | 43.8 | 177.9 | 52.3 | 170.4 | 0 | 0 | 0 | 111.3 | Q98 Y99 G100 N104 I105 F106 P227 P228 V231 M247 | Q98-I102 WeakPolarHBondContact O-CG1 3.48Å; Y99-I102 CarbonylContact O-C 3.57Å; G100-I102 PolarHBondContact O-N 3.02Å; I102-N104 PolarHBondContact O-N 3.47Å; I102-I105 HydrophobicContact CB-CB 4.22Å; I102-I105 HydrophobicContact CB-CD1 4.04Å; I102-I105 HydrophobicContact CG2-CD1 4Å; I102-I105 PolarHBondContact O-N 2.97Å; I102-I105 VanDerWaalsContact O-N 3.12Å; I102-F106 HydrophobicContact CD1-CD2 4.06Å; I102-F106 HydrophobicContact CD1-CE2 3.53Å; I102-F106 HydrophobicContact CD1-CZ 4.22Å; I102-F106 HydrophobicContact CG1-CD2 3.78Å; I102-F106 HydrophobicContact CG1-CE2 3.62Å; I102-F106 PolarHBondContact O-N 3.3Å; I102-F106 VanDerWaalsContact O-N 3.14Å; I102-P227 HydrophobicContact CD1-CB 3.68Å; I102-P227 HydrophobicContact CG1-CB 3.92Å; I102-P227 HydrophobicContact CG2-CB 4.27Å; I102-P228 HydrophobicContact CG2-CB 4Å; I102-P228 HydrophobicContact CG2-CG 3.64Å; I102-V231 HydrophobicContact CD1-CB 3.84Å; I102-V231 HydrophobicContact CD1-CG1 4.16Å; I102-V231 HydrophobicContact CD1-CG2 4.09Å; I102-M247 HydrophobicContact CD1-CE 4.49Å |
| 103 | N | 95.3 | Very high | 95.3 | Very high | 1 Ų | 1 | 18 Ų | 18 | 1% | 0.005 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -53 | -50.3 | -175.3 | -170.8 | -73.7 | 0 | 0 | 0 | 112.2 | Y99 G100 I105 F106 M107 I117 D118 N326 R327 | Y99-N103 VanDerWaalsContact O-CA 3.23Å; Y99-N103 WeakPolarHBondContact O-CA 3.31Å; Y99-N103 PolarHBondContact O-N 3.24Å; Y99-N103 VanDerWaalsContact O-N 3.14Å; G100-N103 PolarHBondContact O-N 2.74Å; N103-I105 VanDerWaalsContact C-N 3.3Å; N103-I105 PolarHBondContact O-N 2.96Å; N103-F106 PolarHBondContact O-N 2.75Å; N103-M107 WeakPolarHBondContact O-CG 3.44Å; N103-M107 PolarHBondContact O-N 3.48Å; N103-M107 PolarHBondContact OD1-SD 2.9Å; N103-I117 HydrophobicContact CB-CG2 4.45Å; N103-D118 PolarHBondContact ND2-OD1 3.42Å; N103-N326 HydrophobicContact CB-CB 4.22Å; N103-R327 HydrophobicContact CB-CG 4.22Å |
| 104 | N | 94.6 | Very high | 95 | Very high | 33 Ų | 33 | 18.2 Ų | 18.2 | 18% | 0.176 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -58.5 | -36.7 | 178.6 | 68.3 | -47 | 0 | 0 | 0 | 113.8 | I102 H108 N326 E337 | I102-N104 PolarHBondContact O-N 3.47Å; N104-H108 PolarHBondContact O-N 3.35Å; N104-H108 VanDerWaalsContact O-N 3.11Å; N104-N326 PolarHBondContact N-OD1 3.17Å; N104-N326 PolarHBondContact OD1-ND2 3.13Å; N104-N326 PolarHBondContact OD1-OD1 2.9Å; N104-E337 PolarHBondContact ND2-OE1 3.01Å |
| 105 | I | 94.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -71.1 | -41.3 | 178.6 | -65.7 | 171.1 | 0 | 0 | 0 | 110.7 | I102 N103 H108 F109 V231 N233 L240 E337 | I102-I105 HydrophobicContact CB-CB 4.22Å; I102-I105 HydrophobicContact CB-CD1 4.04Å; I102-I105 HydrophobicContact CG2-CD1 4Å; I102-I105 PolarHBondContact O-N 2.97Å; I102-I105 VanDerWaalsContact O-N 3.12Å; N103-I105 VanDerWaalsContact C-N 3.3Å; N103-I105 PolarHBondContact O-N 2.96Å; I105-H108 PolarHBondContact O-N 2.65Å; I105-F109 WeakPolarHBondContact O-CB 3.35Å; I105-F109 PolarHBondContact O-N 3.3Å; I105-V231 WeakPolarHBondContact CD1-O 3.22Å; I105-V231 HydrophobicContact CG2-CG1 3.98Å; I105-N233 HydrophobicContact CD1-CB 3.86Å; I105-N233 HydrophobicContact CG1-CB 3.92Å; I105-L240 HydrophobicContact CG2-CD1 3.56Å; I105-L240 HydrophobicContact CG2-CD2 3.97Å; I105-L240 HydrophobicContact CG2-CG 4.34Å; I105-E337 HydrophobicContact CD1-CG 4.21Å |
| 106 | F | 95.4 | Very high | 94.7 | Very high | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -72 | -32.1 | 176.2 | -80.7 | -63.4 | 0 | 0 | 0 | 113.5 | Y99 I102 N103 H108 F109 Y110 I117 I244 M247 F248 | Y99-F106 HydrophobicContact CD1-CD1 4.11Å; Y99-F106 AromaticContact CD1-CD2 3.56Å; Y99-F106 HydrophobicContact CD1-CD2 3.56Å; Y99-F106 AromaticContact CD1-CE1 3.98Å; Y99-F106 HydrophobicContact CD1-CE1 3.98Å; Y99-F106 AromaticContact CD1-CE2 3.4Å; Y99-F106 HydrophobicContact CD1-CE2 3.4Å; Y99-F106 AromaticContact CD1-CG 3.92Å; Y99-F106 HydrophobicContact CD1-CG 3.92Å; Y99-F106 AromaticContact CD1-CZ 3.63Å; Y99-F106 HydrophobicContact CD1-CZ 3.63Å; Y99-F106 HydrophobicContact CE1-CD1 4.27Å; Y99-F106 HydrophobicContact CE1-CD2 4.37Å; Y99-F106 AromaticContact CE1-CE1 3.82Å; Y99-F106 HydrophobicContact CE1-CE1 3.82Å; Y99-F106 AromaticContact CE1-CE2 3.92Å; Y99-F106 HydrophobicContact CE1-CE2 3.92Å; Y99-F106 AromaticContact CE1-CZ 3.63Å; Y99-F106 HydrophobicContact CE1-CZ 3.63Å; Y99-F106 HydrophobicContact CG-CD2 4.37Å; Y99-F106 HydrophobicContact CG-CE2 4.22Å; I102-F106 HydrophobicContact CD1-CD2 4.06Å; I102-F106 HydrophobicContact CD1-CE2 3.53Å; I102-F106 HydrophobicContact CD1-CZ 4.22Å; I102-F106 HydrophobicContact CG1-CD2 3.78Å; I102-F106 HydrophobicContact CG1-CE2 3.62Å; I102-F106 PolarHBondContact O-N 3.3Å; I102-F106 VanDerWaalsContact O-N 3.14Å; N103-F106 PolarHBondContact O-N 2.75Å; F106-H108 VanDerWaalsContact C-N 3.35Å; F106-F109 PolarHBondContact O-N 3.47Å; F106-Y110 HydrophobicContact CB-CD2 4.47Å; F106-Y110 HydrophobicContact CD1-CD2 4.03Å; F106-Y110 AromaticContact CD1-CE2 3.59Å; F106-Y110 HydrophobicContact CD1-CE2 3.59Å; F106-Y110 HydrophobicContact CE1-CE2 4.11Å; F106-Y110 PolarHBondContact O-N 3.27Å; F106-I117 HydrophobicContact CB-CD1 3.87Å; F106-I117 HydrophobicContact CB-CG1 4.32Å; F106-I117 HydrophobicContact CB-CG2 4.4Å; F106-I244 HydrophobicContact CD1-CD1 4.31Å; F106-I244 HydrophobicContact CE1-CD1 3.82Å; F106-I244 HydrophobicContact CE1-CG1 4.16Å; F106-I244 HydrophobicContact CE1-CG2 4.15Å; F106-I244 HydrophobicContact CZ-CG1 4.47Å; F106-I244 HydrophobicContact CZ-CG2 4.45Å; F106-M247 HydrophobicContact CE2-CE 4.48Å; F106-M247 HydrophobicContact CZ-CE 4.07Å; F106-F248 HydrophobicContact CE1-CZ 4.39Å; F106-F248 HydrophobicContact CZ-CE1 4.47Å; F106-F248 HydrophobicContact CZ-CZ 4.31Å |
| 107 | M | 95.1 | Very high | 94.6 | Very high | 64 Ų | 64 | 21.8 Ų | 21.8 | 32% | 0.315 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -56.8 | -49 | 166.9 | -70.7 | 172.4 | 62.2 | 0 | 0 | 110.7 | N103 G111 V112 A114 I117 | N103-M107 WeakPolarHBondContact O-CG 3.44Å; N103-M107 PolarHBondContact O-N 3.48Å; N103-M107 PolarHBondContact OD1-SD 2.9Å; M107-G111 VanDerWaalsContact O-CA 3.28Å; M107-G111 WeakPolarHBondContact O-CA 3.43Å; M107-G111 PolarHBondContact O-N 2.88Å; M107-V112 PolarHBondContact O-N 3.35Å; M107-A114 HydrophobicContact CE-CB 4.07Å; M107-A114 HydrophobicContact SD-CB 3.61Å; M107-I117 HydrophobicContact CG-CG1 3.88Å |
| 108 | H | 94.3 | Very high | 94.5 | Very high | 61 Ų | 61 | 21.9 Ų | 21.9 | 28% | 0.282 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -63.8 | -44.2 | 178.6 | 177.7 | -124.5 | 0 | 0 | 0 | 112.5 | N104 I105 F106 E235 R237 | N104-H108 PolarHBondContact O-N 3.35Å; N104-H108 VanDerWaalsContact O-N 3.11Å; I105-H108 PolarHBondContact O-N 2.65Å; F106-H108 VanDerWaalsContact C-N 3.35Å; H108-E235 PolarHBondContact CE1-O 3.09Å; H108-R237 PolarHBondContact NE2-NE 3Å; H108-R237 VanDerWaalsContact O-CZ 3.25Å; H108-R237 PolarHBondContact O-NH2 3.46Å; H108-R237 VanDerWaalsContact O-NH2 3.1Å |
| 109 | F | 95.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.3 | -49.8 | -177.9 | -175.7 | -112.1 | 0 | 0 | 0 | 113.1 | I105 F106 P168 L240 A241 I244 | I105-F109 WeakPolarHBondContact O-CB 3.35Å; I105-F109 PolarHBondContact O-N 3.3Å; F106-F109 PolarHBondContact O-N 3.47Å; F109-P168 VanDerWaalsContact O-CB 3.28Å; F109-P168 WeakPolarHBondContact O-CB 3.44Å; F109-P168 WeakPolarHBondContact O-CG 3.41Å; F109-L240 HydrophobicContact CB-CD2 3.86Å; F109-L240 HydrophobicContact CB-CG 4.41Å; F109-L240 HydrophobicContact CD2-CB 4.26Å; F109-L240 HydrophobicContact CD2-CD2 3.98Å; F109-L240 HydrophobicContact CD2-CG 3.88Å; F109-L240 HydrophobicContact CG-CD2 4.34Å; F109-L240 HydrophobicContact CG-CG 4.43Å; F109-A241 HydrophobicContact CE2-CB 3.79Å; F109-A241 HydrophobicContact CZ-CB 3.98Å; F109-I244 HydrophobicContact CB-CD1 4.24Å; F109-I244 HydrophobicContact CD1-CD1 3.75Å; F109-I244 HydrophobicContact CD2-CD1 3.94Å; F109-I244 HydrophobicContact CE1-CD1 4.05Å; F109-I244 HydrophobicContact CE2-CD1 4.24Å; F109-I244 HydrophobicContact CG-CD1 3.69Å; F109-I244 HydrophobicContact CZ-CD1 4.28Å |
| 110 | Y | 95.3 | Very high | 94.5 | Very high | 13 Ų | 13 | 26.7 Ų | 26.7 | 5% | 0.051 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -88.4 | -16.2 | -177 | -69 | -60.9 | 0 | 0 | 0 | 113.8 | F106 S165 P168 F171 T174 | F106-Y110 HydrophobicContact CB-CD2 4.47Å; F106-Y110 HydrophobicContact CD1-CD2 4.03Å; F106-Y110 AromaticContact CD1-CE2 3.59Å; F106-Y110 HydrophobicContact CD1-CE2 3.59Å; F106-Y110 HydrophobicContact CE1-CE2 4.11Å; F106-Y110 PolarHBondContact O-N 3.27Å; Y110-S165 WeakPolarHBondContact CE1-O 3.39Å; Y110-S165 PolarHBondContact OH-O 3.41Å; Y110-S165 PolarHBondContact OH-OG 2.9Å; Y110-S165 VanDerWaalsContact OH-OG 3.04Å; Y110-P168 WeakPolarHBondContact CD1-O 3.49Å; Y110-F171 HydrophobicContact CD1-CB 3.79Å; Y110-F171 HydrophobicContact CD1-CD2 4.38Å; Y110-F171 AromaticContact CD2-CD2 3.74Å; Y110-F171 HydrophobicContact CD2-CD2 3.74Å; Y110-F171 HydrophobicContact CE1-CB 4.35Å; Y110-F171 HydrophobicContact CE2-CD2 4.22Å; Y110-F171 HydrophobicContact CG-CB 3.98Å; Y110-F171 AromaticContact CG-CD2 3.85Å; Y110-F171 HydrophobicContact CG-CD2 3.85Å; Y110-F171 HydrophobicContact CG-CG 4.36Å; Y110-T174 PolarHBondContact OH-OG1 3.18Å |
| 111 | G | 94.1 | Very high | 94.6 | Very high | 59 Ų | 59 | 26.6 Ų | 26.6 | 61% | 0.608 | 15% | 0.152 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 70.1 | 31.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | M107 | M107-G111 VanDerWaalsContact O-CA 3.28Å; M107-G111 WeakPolarHBondContact O-CA 3.43Å; M107-G111 PolarHBondContact O-N 2.88Å |
| 112 | V | 95.8 | Very high | 94.7 | Very high | 38 Ų | 38 | 26.5 Ų | 26.5 | 23% | 0.23 | 15% | 0.151 | C | C | . | . | trans | -112.9 | 161.8 | -177 | -58.1 | 0 | 0 | 0 | 0 | 111.8 | M107 A116 I117 F171 | M107-V112 PolarHBondContact O-N 3.35Å; V112-A116 HydrophobicContact CB-CB 4.02Å; V112-A116 HydrophobicContact CG2-CB 4.04Å; V112-I117 HydrophobicContact CG2-CD1 3.46Å; V112-I117 VanDerWaalsContact CG2-CD1 3.46Å; V112-I117 HydrophobicContact CG2-CG1 4.05Å; V112-F171 HydrophobicContact CG1-CD1 4.26Å; V112-F171 HydrophobicContact CG1-CG 4.18Å; V112-F171 HydrophobicContact CG2-CD2 4.28Å; V112-F171 HydrophobicContact CG2-CE2 4.17Å | ||
| 113 | S | 94.8 | Very high | 94.7 | Very high | 69 Ų | 69 | 26.8 Ų | 26.8 | 48% | 0.483 | 15% | 0.153 | S | C | . | . | trans | -69.3 | 156.9 | 178.4 | 61.7 | 0 | 0 | 0 | 0 | 112.7 | F115 A116 I117 | S113-F115 PolarHBondContact O-N 2.87Å; S113-A116 WeakPolarHBondContact O-CB 3.18Å; S113-A116 PolarHBondContact O-N 3.02Å; S113-I117 PolarHBondContact O-N 2.93Å | ||
| 114 | A | 91.6 | Very high | 94.8 | Very high | 7 Ų | 7 | 26.8 Ų | 26.8 | 6% | 0.058 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -52.1 | -44.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | M107 A116 I117 D118 | M107-A114 HydrophobicContact CE-CB 4.07Å; M107-A114 HydrophobicContact SD-CB 3.61Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 3.34Å; A114-I117 CarbonylContact O-C 3.57Å; A114-I117 WeakPolarHBondContact O-CA 3.47Å; A114-I117 WeakPolarHBondContact O-CB 3.45Å; A114-I117 PolarHBondContact O-N 3.24Å; A114-D118 PolarHBondContact O-N 2.69Å |
| 115 | F | 92.9 | Very high | 94.8 | Very high | 80 Ų | 80 | 25.2 Ų | 25.2 | 35% | 0.351 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -56.3 | -35 | 176.6 | -176.8 | -100.5 | 0 | 0 | 0 | 113.8 | S113 D118 W119 M122 I449 | S113-F115 PolarHBondContact O-N 2.87Å; F115-D118 PolarHBondContact O-N 2.81Å; F115-W119 PolarHBondContact O-N 2.91Å; F115-M122 HydrophobicContact CD2-CE 4.43Å; F115-M122 HydrophobicContact CE2-CE 4.14Å; F115-I449 HydrophobicContact CE2-CG1 4.21Å; F115-I449 HydrophobicContact CE2-CG2 4.33Å |
| 116 | A | 94.8 | Very high | 94.9 | Very high | 21 Ų | 21 | 29 Ų | 29 | 17% | 0.174 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -70.1 | -35 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | V112 S113 A114 F171 | V112-A116 HydrophobicContact CB-CB 4.02Å; V112-A116 HydrophobicContact CG2-CB 4.04Å; S113-A116 WeakPolarHBondContact O-CB 3.18Å; S113-A116 PolarHBondContact O-N 3.02Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 3.34Å; A116-F171 HydrophobicContact CB-CE1 4.27Å; A116-F171 HydrophobicContact CB-CZ 4.04Å; A116-F171 WeakPolarHBondContact O-CZ 3.22Å |
| 117 | I | 95.6 | Very high | 94.9 | Very high | 2 Ų | 2 | 30.1 Ų | 30.1 | 1% | 0.01 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -71.3 | -41.1 | 172.5 | -53.6 | -53.2 | 0 | 0 | 0 | 110.8 | N103 F106 M107 V112 S113 A114 W119 L120 F171 | N103-I117 HydrophobicContact CB-CG2 4.45Å; F106-I117 HydrophobicContact CB-CD1 3.87Å; F106-I117 HydrophobicContact CB-CG1 4.32Å; F106-I117 HydrophobicContact CB-CG2 4.4Å; M107-I117 HydrophobicContact CG-CG1 3.88Å; V112-I117 HydrophobicContact CG2-CD1 3.46Å; V112-I117 VanDerWaalsContact CG2-CD1 3.46Å; V112-I117 HydrophobicContact CG2-CG1 4.05Å; S113-I117 PolarHBondContact O-N 2.93Å; A114-I117 CarbonylContact O-C 3.57Å; A114-I117 WeakPolarHBondContact O-CA 3.47Å; A114-I117 WeakPolarHBondContact O-CB 3.45Å; A114-I117 PolarHBondContact O-N 3.24Å; I117-W119 PolarHBondContact O-N 3.16Å; I117-L120 WeakPolarHBondContact O-CB 3.35Å; I117-L120 PolarHBondContact O-N 2.98Å; I117-F171 HydrophobicContact CD1-CE2 3.86Å |
| 118 | D | 93.3 | Very high | 94.8 | Very high | 3 Ų | 3 | 27.2 Ų | 27.2 | 2% | 0.016 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.7 | -29.8 | 177.1 | -58.9 | -31.2 | 0 | 0 | 0 | 111.8 | N103 A114 F115 L120 S121 M122 T323 R327 T448 | N103-D118 PolarHBondContact ND2-OD1 3.42Å; A114-D118 PolarHBondContact O-N 2.69Å; F115-D118 PolarHBondContact O-N 2.81Å; D118-L120 PolarHBondContact O-N 2.87Å; D118-S121 WeakPolarHBondContact O-CA 3.38Å; D118-S121 WeakPolarHBondContact O-CB 3.45Å; D118-S121 PolarHBondContact O-N 3.49Å; D118-M122 HydrophobicContact CB-CE 3.82Å; D118-M122 PolarHBondContact O-N 3.42Å; D118-T323 HydrophobicContact CB-CG2 4.27Å; D118-R327 IonicContact OD2-CZ 2.8Å; D118-R327 IonicContact OD2-NH1 2.89Å; D118-R327 PolarHBondContact OD2-NH1 2.82Å; D118-T448 HydrophobicContact CB-CG2 4.3Å |
| 119 | W | 95.1 | Very high | 94.8 | Very high | 100 Ų | 100 | 26.6 Ų | 26.6 | 38% | 0.379 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -62.1 | -25.5 | 172.7 | -164.9 | -104.1 | 0 | 0 | 0 | 113.4 | F115 I117 S121 M122 C123 L126 | F115-W119 PolarHBondContact O-N 2.91Å; I117-W119 PolarHBondContact O-N 3.16Å; W119-S121 PolarHBondContact O-N 3.22Å; W119-M122 HydrophobicContact CE3-CB 4.12Å; W119-M122 HydrophobicContact CE3-CE 3.96Å; W119-M122 HydrophobicContact CE3-SD 4.24Å; W119-M122 HydrophobicContact CZ3-CB 4.47Å; W119-M122 HydrophobicContact CZ3-SD 4.48Å; W119-M122 PolarHBondContact O-N 2.8Å; W119-C123 WeakPolarHBondContact O-CB 3.34Å; W119-C123 PolarHBondContact O-N 3.45Å; W119-L126 HydrophobicContact CH2-CD2 3.98Å; W119-L126 HydrophobicContact CZ2-CD2 3.78Å |
| 120 | L | 95.8 | Very high | 94.7 | Very high | 1 Ų | 1 | 30.5 Ų | 30.5 | 1% | 0.005 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -69 | -22.2 | 171.9 | -56.3 | 178.2 | 0 | 0 | 0 | 112.7 | Y99 I117 D118 F171 T174 V175 Q178 | Y99-L120 HydrophobicContact CD1-CD1 3.64Å; Y99-L120 HydrophobicContact CD2-CB 4.22Å; Y99-L120 HydrophobicContact CD2-CD1 3.93Å; Y99-L120 HydrophobicContact CE1-CD1 4.12Å; Y99-L120 HydrophobicContact CE2-CD1 4.36Å; Y99-L120 HydrophobicContact CG-CB 4.36Å; Y99-L120 HydrophobicContact CG-CD1 3.56Å; I117-L120 WeakPolarHBondContact O-CB 3.35Å; I117-L120 PolarHBondContact O-N 2.98Å; D118-L120 PolarHBondContact O-N 2.87Å; L120-F171 HydrophobicContact CD1-CE2 4.08Å; L120-F171 HydrophobicContact CD2-CE2 4.44Å; L120-F171 HydrophobicContact CD2-CZ 4.37Å; L120-F171 HydrophobicContact CG-CE2 4.45Å; L120-T174 HydrophobicContact CD1-CG2 3.56Å; L120-T174 HydrophobicContact CD2-CG2 3.9Å; L120-T174 HydrophobicContact CG-CG2 4.41Å; L120-V175 HydrophobicContact CD2-CB 4.46Å; L120-V175 HydrophobicContact CD2-CG2 3.89Å; L120-Q178 HydrophobicContact CB-CG 3.97Å; L120-Q178 HydrophobicContact CD2-CB 4.08Å; L120-Q178 HydrophobicContact CD2-CG 4.17Å; L120-Q178 VanDerWaalsContact O-CG 3.23Å; L120-Q178 WeakPolarHBondContact O-CG 3.31Å; L120-Q178 PolarHBondContact O-NE2 2.94Å |
| 121 | S | 94.6 | Very high | 94.5 | Very high | 4 Ų | 4 | 32.5 Ų | 32.5 | 3% | 0.028 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -85.1 | -47.8 | 168 | 176.9 | 0 | 0 | 0 | 0 | 110.7 | W96 D118 W119 C123 Y124 M125 T323 | W96-S121 PolarHBondContact NE1-O 3.35Å; W96-S121 PolarHBondContact NE1-OG 3.37Å; D118-S121 WeakPolarHBondContact O-CA 3.38Å; D118-S121 WeakPolarHBondContact O-CB 3.45Å; D118-S121 PolarHBondContact O-N 3.49Å; W119-S121 PolarHBondContact O-N 3.22Å; S121-C123 PolarHBondContact O-N 2.94Å; S121-Y124 WeakPolarHBondContact O-CB 3.29Å; S121-Y124 PolarHBondContact O-N 3.01Å; S121-M125 WeakPolarHBondContact OG-CE 3.41Å; S121-T323 VanDerWaalsContact CB-CG2 3.47Å; S121-T323 PolarHBondContact OG-OG1 3.26Å |
| 122 | M | 95.1 | Very high | 94.3 | Very high | 1 Ų | 1 | 30.3 Ų | 30.3 | 1% | 0.005 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.3 | -25.1 | -177 | -67.3 | -176.4 | -90.6 | 0 | 0 | 113.6 | F115 D118 W119 Y124 M125 L126 I445 T448 I449 | F115-M122 HydrophobicContact CD2-CE 4.43Å; F115-M122 HydrophobicContact CE2-CE 4.14Å; D118-M122 HydrophobicContact CB-CE 3.82Å; D118-M122 PolarHBondContact O-N 3.42Å; W119-M122 HydrophobicContact CE3-CB 4.12Å; W119-M122 HydrophobicContact CE3-CE 3.96Å; W119-M122 HydrophobicContact CE3-SD 4.24Å; W119-M122 HydrophobicContact CZ3-CB 4.47Å; W119-M122 HydrophobicContact CZ3-SD 4.48Å; W119-M122 PolarHBondContact O-N 2.8Å; M122-Y124 VanDerWaalsContact C-N 3.29Å; M122-Y124 PolarHBondContact O-N 3.19Å; M122-M125 WeakPolarHBondContact O-CB 3.38Å; M122-M125 PolarHBondContact O-N 2.65Å; M122-L126 WeakPolarHBondContact O-CB 3.4Å; M122-L126 PolarHBondContact O-N 2.91Å; M122-I445 HydrophobicContact SD-CG2 4.46Å; M122-T448 HydrophobicContact CE-CG2 4Å; M122-T448 HydrophobicContact CG-CG2 3.83Å; M122-T448 HydrophobicContact SD-CG2 3.84Å; M122-I449 HydrophobicContact CE-CG1 4.17Å; M122-I449 HydrophobicContact SD-CD1 4.13Å; M122-I449 HydrophobicContact SD-CG1 3.47Å; M122-I449 WeakPolarHBondContact SD-CG1 3.4Å |
| 123 | C | 96.6 | Very high | 93.8 | Very high | 6 Ų | 6 | 31.7 Ų | 31.7 | 4% | 0.041 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.8 | -29 | 177.5 | 79.7 | 0 | 0 | 0 | 0 | 113.3 | W119 S121 L126 T127 V179 S182 | W119-C123 WeakPolarHBondContact O-CB 3.34Å; W119-C123 PolarHBondContact O-N 3.45Å; S121-C123 PolarHBondContact O-N 2.94Å; C123-L126 PolarHBondContact O-N 2.71Å; C123-T127 PolarHBondContact O-N 2.95Å; C123-T127 PolarHBondContact O-OG1 2.99Å; C123-V179 HydrophobicContact CB-CG2 4.24Å; C123-S182 PolarHBondContact O-OG 3.07Å |
| 124 | Y | 96.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61.5 | -48.8 | 170.1 | -83.8 | -121.8 | 0 | 0 | 0 | 111.1 | N92 W96 S121 M122 L126 T127 Y128 Q178 C181 Q185 | N92-Y124 PolarHBondContact O-OH 3.31Å; W96-Y124 HydrophobicContact CB-CD1 3.72Å; W96-Y124 HydrophobicContact CB-CE1 3.52Å; W96-Y124 HydrophobicContact CB-CE2 4.42Å; W96-Y124 HydrophobicContact CB-CG 4.26Å; W96-Y124 AromaticContact CD1-CD1 3.86Å; W96-Y124 AromaticContact CD1-CD2 3.97Å; W96-Y124 AromaticContact CD1-CG 3.6Å; W96-Y124 AromaticContact CG-CD1 3.86Å; W96-Y124 HydrophobicContact CG-CD1 3.86Å; W96-Y124 HydrophobicContact CG-CE1 4.19Å; W96-Y124 HydrophobicContact CG-CG 4.08Å; W96-Y124 PolarHBondContact N-OH 3.3Å; S121-Y124 WeakPolarHBondContact O-CB 3.29Å; S121-Y124 PolarHBondContact O-N 3.01Å; M122-Y124 VanDerWaalsContact C-N 3.29Å; M122-Y124 PolarHBondContact O-N 3.19Å; Y124-L126 VanDerWaalsContact C-N 3.34Å; Y124-L126 PolarHBondContact O-N 2.99Å; Y124-T127 PolarHBondContact O-OG1 2.91Å; Y124-Y128 PolarHBondContact O-N 3.44Å; Y124-Q178 HydrophobicContact CD2-CG 4.42Å; Y124-Q178 HydrophobicContact CE2-CG 3.93Å; Y124-C181 HydrophobicContact CE2-CB 4.25Å; Y124-C181 WeakPolarHBondContact OH-CB 3.4Å; Y124-Q185 HydrophobicContact CD1-CB 3.99Å; Y124-Q185 VanDerWaalsContact CD1-CD 3.49Å; Y124-Q185 HydrophobicContact CD1-CG 4.11Å; Y124-Q185 HydrophobicContact CE1-CB 4.2Å; Y124-Q185 PolarHBondContact O-OE1 2.89Å |
| 125 | M | 95.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -60.6 | -45.8 | 176.6 | -43.5 | -177.1 | -166.6 | 0 | 0 | 111.1 | W96 S121 M122 Y128 I129 Q441 I445 | W96-M125 HydrophobicContact CZ2-CE 4.2Å; S121-M125 WeakPolarHBondContact OG-CE 3.41Å; M122-M125 WeakPolarHBondContact O-CB 3.38Å; M122-M125 PolarHBondContact O-N 2.65Å; M125-Y128 PolarHBondContact O-N 2.65Å; M125-I129 WeakPolarHBondContact O-CD1 3.48Å; M125-I129 WeakPolarHBondContact O-CG1 3.32Å; M125-Q441 VanDerWaalsContact CA-OE1 3.31Å; M125-Q441 HydrophobicContact CB-CB 4Å; M125-Q441 VanDerWaalsContact CG-OE1 3.28Å; M125-I445 HydrophobicContact CB-CD1 3.86Å; M125-I445 HydrophobicContact CB-CG1 3.55Å; M125-I445 HydrophobicContact CG-CG1 4.34Å; M125-I445 HydrophobicContact SD-CG1 3.99Å |
| 126 | L | 96 | Very high | 92.9 | Very high | 80 Ų | 80 | 28.8 Ų | 28.8 | 42% | 0.419 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -67.7 | -40.6 | -176.9 | -176.9 | 62.1 | 0 | 0 | 0 | 113.2 | W119 M122 C123 Y124 P130 I445 | W119-L126 HydrophobicContact CH2-CD2 3.98Å; W119-L126 HydrophobicContact CZ2-CD2 3.78Å; M122-L126 WeakPolarHBondContact O-CB 3.4Å; M122-L126 PolarHBondContact O-N 2.91Å; C123-L126 PolarHBondContact O-N 2.71Å; Y124-L126 VanDerWaalsContact C-N 3.34Å; Y124-L126 PolarHBondContact O-N 2.99Å; L126-P130 WeakPolarHBondContact O-CD 3.38Å; L126-I445 HydrophobicContact CB-CD1 4.22Å; L126-I445 HydrophobicContact CD1-CD1 4.45Å |
| 127 | T | 95.8 | Very high | 92.2 | Very high | 23 Ų | 23 | 34.4 Ų | 34.4 | 14% | 0.141 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -74.3 | -27.2 | 178.8 | 49.3 | 0 | 0 | 0 | 0 | 113.3 | C123 Y124 P130 L131 S182 V183 | C123-T127 PolarHBondContact O-N 2.95Å; C123-T127 PolarHBondContact O-OG1 2.99Å; Y124-T127 PolarHBondContact O-OG1 2.91Å; T127-P130 WeakPolarHBondContact O-CD 3.36Å; T127-L131 VanDerWaalsContact O-CB 3.3Å; T127-L131 WeakPolarHBondContact O-CB 3.41Å; T127-L131 WeakPolarHBondContact O-CG 3.38Å; T127-L131 PolarHBondContact O-N 2.99Å; T127-S182 WeakPolarHBondContact CG2-OG 3.47Å; T127-S182 WeakPolarHBondContact OG1-CB 3.31Å; T127-S182 PolarHBondContact OG1-O 3.49Å; T127-S182 PolarHBondContact OG1-OG 3.08Å; T127-V183 HydrophobicContact CG2-CG2 4.11Å |
| 128 | Y | 93.3 | Very high | 91.7 | Very high | 3 Ų | 3 | 36.5 Ų | 36.5 | 1% | 0.012 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.5 | -43.7 | 179.2 | -172.9 | -89.9 | 0 | 0 | 0 | 112.7 | Y124 M125 L131 L132 V186 L189 N437 I438 Q441 | Y124-Y128 PolarHBondContact O-N 3.44Å; M125-Y128 PolarHBondContact O-N 2.65Å; Y128-L131 PolarHBondContact O-N 2.78Å; Y128-L132 HydrophobicContact CE1-CB 4.43Å; Y128-L132 HydrophobicContact CE1-CD1 4.41Å; Y128-L132 HydrophobicContact CE1-CD2 3.94Å; Y128-L132 HydrophobicContact CE1-CG 4.49Å; Y128-L132 HydrophobicContact CE2-CD1 4.27Å; Y128-L132 WeakPolarHBondContact O-CB 3.45Å; Y128-L132 PolarHBondContact O-N 3.14Å; Y128-V186 HydrophobicContact CD2-CB 4.37Å; Y128-V186 HydrophobicContact CD2-CG1 4.11Å; Y128-V186 HydrophobicContact CD2-CG2 4.25Å; Y128-V186 HydrophobicContact CE2-CG1 4.43Å; Y128-L189 HydrophobicContact CD2-CD1 4.16Å; Y128-L189 HydrophobicContact CE2-CB 3.98Å; Y128-L189 HydrophobicContact CE2-CD1 3.89Å; Y128-N437 HydrophobicContact CE1-CB 3.58Å; Y128-N437 VanDerWaalsContact OH-CB 3.32Å; Y128-N437 WeakPolarHBondContact OH-CB 3.17Å; Y128-I438 HydrophobicContact CD1-CG1 4.33Å; Y128-I438 HydrophobicContact CE1-CG1 4.12Å; Y128-Q441 HydrophobicContact CD1-CG 3.66Å; Y128-Q441 HydrophobicContact CE1-CG 4.44Å; Y128-Q441 HydrophobicContact CG-CG 4.02Å |
| 129 | I | 93.2 | Very high | 91.1 | Very high | 48 Ų | 48 | 37.7 Ų | 37.7 | 25% | 0.246 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -56.3 | -54.6 | -174.5 | -63.9 | 157.7 | 0 | 0 | 0 | 113.1 | M125 I438 Q441 V442 I445 | M125-I129 WeakPolarHBondContact O-CD1 3.48Å; M125-I129 WeakPolarHBondContact O-CG1 3.32Å; I129-I438 HydrophobicContact CG2-CG2 4.42Å; I129-Q441 HydrophobicContact CD1-CB 4.02Å; I129-Q441 HydrophobicContact CG1-CB 3.9Å; I129-V442 HydrophobicContact CD1-CG2 3.6Å; I129-V442 HydrophobicContact CG1-CG2 4.13Å; I129-I445 HydrophobicContact CD1-CD1 3.94Å |
| 130 | P | 92.9 | Very high | 90.1 | Very high | 82 Ų | 82 | 38.5 Ų | 38.5 | 53% | 0.532 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -79.9 | -27.7 | -179.6 | 31.6 | -35.5 | 0 | 0 | 0 | 113.7 | L126 T127 P134 | L126-P130 WeakPolarHBondContact O-CD 3.38Å; T127-P130 WeakPolarHBondContact O-CD 3.36Å; P130-P134 VanDerWaalsContact O-CD 3.24Å; P130-P134 WeakPolarHBondContact O-CD 3.42Å |
| 131 | L | 92.9 | Very high | 89.2 | Confident | 55 Ų | 55 | 44.8 Ų | 44.8 | 29% | 0.288 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -89.4 | -13.3 | -173.7 | -61.8 | 173.7 | 0 | 0 | 0 | 113.9 | T127 Y128 L133 P134 V135 V183 V186 | T127-L131 VanDerWaalsContact O-CB 3.3Å; T127-L131 WeakPolarHBondContact O-CB 3.41Å; T127-L131 WeakPolarHBondContact O-CG 3.38Å; T127-L131 PolarHBondContact O-N 2.99Å; Y128-L131 PolarHBondContact O-N 2.78Å; L131-L133 PolarHBondContact O-N 3.34Å; L131-P134 WeakPolarHBondContact O-CD 3.46Å; L131-V135 HydrophobicContact CB-CG2 4.49Å; L131-V135 VanDerWaalsContact O-CB 3.3Å; L131-V135 WeakPolarHBondContact O-CB 3.49Å; L131-V135 VanDerWaalsContact O-CG2 3.23Å; L131-V135 WeakPolarHBondContact O-CG2 3.18Å; L131-V135 PolarHBondContact O-N 2.77Å; L131-V183 HydrophobicContact CD1-CB 4.41Å; L131-V183 HydrophobicContact CD1-CG1 4.07Å; L131-V183 HydrophobicContact CD1-CG2 3.97Å; L131-V186 HydrophobicContact CB-CB 4.41Å; L131-V186 HydrophobicContact CB-CG1 3.94Å; L131-V186 HydrophobicContact CB-CG2 4.19Å; L131-V186 HydrophobicContact CD1-CG2 4.46Å |
| 132 | L | 89.3 | Confident | 88.4 | Confident | 13 Ų | 13 | 49.1 Ų | 49.1 | 7% | 0.068 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -57.1 | -46.5 | 178.9 | -178.3 | 63.3 | 0 | 0 | 0 | 112.3 | Y128 V135 A136 G434 I438 | Y128-L132 HydrophobicContact CE1-CB 4.43Å; Y128-L132 HydrophobicContact CE1-CD1 4.41Å; Y128-L132 HydrophobicContact CE1-CD2 3.94Å; Y128-L132 HydrophobicContact CE1-CG 4.49Å; Y128-L132 HydrophobicContact CE2-CD1 4.27Å; Y128-L132 WeakPolarHBondContact O-CB 3.45Å; Y128-L132 PolarHBondContact O-N 3.14Å; L132-V135 PolarHBondContact O-N 3.35Å; L132-A136 VanDerWaalsContact O-CB 3.31Å; L132-A136 WeakPolarHBondContact O-CB 3.21Å; L132-A136 PolarHBondContact O-N 3.23Å; L132-G434 WeakPolarHBondContact CD2-O 3.36Å; L132-I438 HydrophobicContact CB-CD1 4.4Å; L132-I438 HydrophobicContact CD2-CD1 3.72Å; L132-I438 HydrophobicContact CD2-CG1 3.84Å |
| 133 | L | 86.1 | Confident | 87.7 | Confident | 67 Ų | 67 | 50 Ų | 50 | 35% | 0.351 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -66.8 | -48.3 | -177.7 | -49.6 | 175.5 | 0 | 0 | 0 | 112 | L131 V135 A136 W137 Y291 I295 | L131-L133 PolarHBondContact O-N 3.34Å; L133-V135 VanDerWaalsContact C-N 3.34Å; L133-V135 PolarHBondContact O-N 2.9Å; L133-A136 PolarHBondContact O-N 3.44Å; L133-W137 PolarHBondContact O-N 2.94Å; L133-W137 VanDerWaalsContact O-N 3.15Å; L133-Y291 HydrophobicContact CD2-CD1 4.28Å; L133-Y291 HydrophobicContact CD2-CE1 3.69Å; L133-I295 HydrophobicContact CD2-CD1 3.75Å |
| 134 | P | 88.5 | Confident | 87.1 | Confident | 70 Ų | 70 | 50.1 Ų | 50.1 | 46% | 0.455 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -55 | -42.8 | 170.1 | -28.1 | 34.6 | 0 | 0 | 0 | 114.3 | P130 L131 L138 | P130-P134 VanDerWaalsContact O-CD 3.24Å; P130-P134 WeakPolarHBondContact O-CD 3.42Å; L131-P134 WeakPolarHBondContact O-CD 3.46Å; P134-L138 VanDerWaalsContact O-CB 3.32Å; P134-L138 WeakPolarHBondContact O-CB 3.34Å; P134-L138 PolarHBondContact O-N 2.73Å |
| 135 | V | 87.8 | Confident | 86.6 | Confident | 12 Ų | 12 | 54 Ų | 54 | 7% | 0.073 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -73.7 | -34.8 | -176.8 | 171.6 | 0 | 0 | 0 | 0 | 112 | L131 L132 L133 L138 L139 V186 F187 | L131-V135 HydrophobicContact CB-CG2 4.49Å; L131-V135 VanDerWaalsContact O-CB 3.3Å; L131-V135 WeakPolarHBondContact O-CB 3.49Å; L131-V135 VanDerWaalsContact O-CG2 3.23Å; L131-V135 WeakPolarHBondContact O-CG2 3.18Å; L131-V135 PolarHBondContact O-N 2.77Å; L132-V135 PolarHBondContact O-N 3.35Å; L133-V135 VanDerWaalsContact C-N 3.34Å; L133-V135 PolarHBondContact O-N 2.9Å; V135-L138 PolarHBondContact O-N 2.91Å; V135-L139 WeakPolarHBondContact O-CB 3.26Å; V135-L139 PolarHBondContact O-N 2.89Å; V135-V186 HydrophobicContact CB-CG1 4.17Å; V135-V186 HydrophobicContact CG1-CG1 4.48Å; V135-V186 HydrophobicContact CG2-CB 4.39Å; V135-V186 HydrophobicContact CG2-CG1 4.03Å; V135-F187 HydrophobicContact CG1-CB 4.44Å; V135-F187 HydrophobicContact CG1-CD1 4.19Å; V135-F187 HydrophobicContact CG1-CD2 4.45Å; V135-F187 HydrophobicContact CG1-CG 4.11Å; V135-F187 HydrophobicContact CG2-CD2 4.17Å; V135-F187 HydrophobicContact CG2-CE1 4.38Å; V135-F187 HydrophobicContact CG2-CE2 3.85Å; V135-F187 HydrophobicContact CG2-CZ 3.96Å |
| 136 | A | 82.8 | Confident | 86.3 | Confident | 14 Ų | 14 | 56.4 Ų | 56.4 | 12% | 0.116 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.7 | -48.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L132 L133 L138 L139 E140 Y291 | L132-A136 VanDerWaalsContact O-CB 3.31Å; L132-A136 WeakPolarHBondContact O-CB 3.21Å; L132-A136 PolarHBondContact O-N 3.23Å; L133-A136 PolarHBondContact O-N 3.44Å; A136-L138 VanDerWaalsContact C-N 3.29Å; A136-L138 PolarHBondContact O-N 3.29Å; A136-L139 WeakPolarHBondContact O-CB 3.4Å; A136-L139 PolarHBondContact O-N 3.39Å; A136-L139 VanDerWaalsContact O-N 3.17Å; A136-E140 PolarHBondContact O-N 3.12Å; A136-Y291 HydrophobicContact CB-CE2 4.18Å; A136-Y291 WeakPolarHBondContact CB-OH 3.27Å |
| 137 | W | 81 | Confident | 86 | Confident | 139 Ų | 139 | 52.7 Ų | 52.7 | 53% | 0.527 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -60 | -39.5 | 173.3 | 175.8 | 86.3 | 0 | 0 | 0 | 112.3 | L133 L139 E140 K141 F142 | L133-W137 PolarHBondContact O-N 2.94Å; L133-W137 VanDerWaalsContact O-N 3.15Å; W137-L139 VanDerWaalsContact C-N 3.33Å; W137-L139 PolarHBondContact O-N 3.42Å; W137-E140 PolarHBondContact O-N 3.26Å; W137-K141 HydrophobicContact CH2-CD 3.61Å; W137-K141 HydrophobicContact CZ2-CD 3.5Å; W137-K141 VanDerWaalsContact CZ2-CD 3.5Å; W137-K141 HydrophobicContact CZ3-CD 4.22Å; W137-K141 WeakPolarHBondContact O-CB 3.3Å; W137-K141 PolarHBondContact O-N 2.93Å; W137-F142 HydrophobicContact CZ3-CE2 4.41Å |
| 138 | L | 83.8 | Confident | 85.9 | Confident | 46 Ų | 46 | 51.6 Ų | 51.6 | 24% | 0.241 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.3 | -36.7 | 177 | -159.3 | 77.7 | 0 | 0 | 0 | 111.7 | P134 V135 A136 K141 F142 I147 F187 | P134-L138 VanDerWaalsContact O-CB 3.32Å; P134-L138 WeakPolarHBondContact O-CB 3.34Å; P134-L138 PolarHBondContact O-N 2.73Å; V135-L138 PolarHBondContact O-N 2.91Å; A136-L138 VanDerWaalsContact C-N 3.29Å; A136-L138 PolarHBondContact O-N 3.29Å; L138-K141 PolarHBondContact O-N 3.11Å; L138-F142 HydrophobicContact CD1-CD2 3.38Å; L138-F142 HydrophobicContact CD1-CE2 3.5Å; L138-F142 HydrophobicContact CD1-CG 4.38Å; L138-F142 HydrophobicContact CG-CD2 3.89Å; L138-F142 HydrophobicContact CG-CE2 4.49Å; L138-F142 WeakPolarHBondContact O-CB 3.42Å; L138-F142 PolarHBondContact O-N 2.91Å; L138-I147 HydrophobicContact CB-CD1 3.92Å; L138-I147 HydrophobicContact CD2-CD1 3.64Å; L138-I147 HydrophobicContact CG-CD1 3.81Å; L138-F187 HydrophobicContact CD2-CE1 3.86Å; L138-F187 HydrophobicContact CD2-CZ 4.4Å |
| 139 | L | 80.7 | Confident | 85.9 | Confident | 27 Ų | 27 | 53.4 Ų | 53.4 | 14% | 0.141 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -67.2 | -38.1 | 175.5 | 176.5 | 60.4 | 0 | 0 | 0 | 112.7 | V135 A136 W137 G143 L144 I147 R194 | V135-L139 WeakPolarHBondContact O-CB 3.26Å; V135-L139 PolarHBondContact O-N 2.89Å; A136-L139 WeakPolarHBondContact O-CB 3.4Å; A136-L139 PolarHBondContact O-N 3.39Å; A136-L139 VanDerWaalsContact O-N 3.17Å; W137-L139 VanDerWaalsContact C-N 3.33Å; W137-L139 PolarHBondContact O-N 3.42Å; L139-G143 WeakPolarHBondContact O-CA 3.49Å; L139-G143 PolarHBondContact O-N 2.9Å; L139-L144 HydrophobicContact CD1-CD1 4.42Å; L139-I147 HydrophobicContact CB-CD1 4.4Å; L139-I147 HydrophobicContact CB-CG1 3.84Å; L139-I147 HydrophobicContact CD1-CB 4.03Å; L139-I147 HydrophobicContact CD1-CG1 3.75Å; L139-I147 HydrophobicContact CD1-CG2 4.22Å; L139-I147 HydrophobicContact CG-CG1 4.39Å; L139-R194 HydrophobicContact CD2-CB 4.3Å; L139-R194 HydrophobicContact CD2-CG 4.21Å |
| 140 | E | 75.6 | Confident | 86 | Confident | 118 Ų | 118 | 53.4 Ų | 53.4 | 55% | 0.551 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -69.6 | -42.1 | 175.1 | -70.6 | 172.5 | 173.8 | 0 | 0 | 111.6 | A136 W137 | A136-E140 PolarHBondContact O-N 3.12Å; W137-E140 PolarHBondContact O-N 3.26Å |
| 141 | K | 76 | Confident | 86.1 | Confident | 132 Ų | 132 | 49.5 Ų | 49.5 | 57% | 0.574 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -81.4 | -41.1 | -175.8 | -176.4 | 171.6 | 177.2 | 175.3 | 0 | 115 | W137 L138 | W137-K141 HydrophobicContact CH2-CD 3.61Å; W137-K141 HydrophobicContact CZ2-CD 3.5Å; W137-K141 VanDerWaalsContact CZ2-CD 3.5Å; W137-K141 HydrophobicContact CZ3-CD 4.22Å; W137-K141 WeakPolarHBondContact O-CB 3.3Å; W137-K141 PolarHBondContact O-N 2.93Å; L138-K141 PolarHBondContact O-N 3.11Å |
| 142 | F | 78.6 | Confident | 86.3 | Confident | 96 Ų | 96 | 47 Ų | 47 | 42% | 0.421 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -108.5 | -1.5 | -172.9 | -66.6 | -90.8 | 0 | 0 | 0 | 114.3 | W137 L138 T146 | W137-F142 HydrophobicContact CZ3-CE2 4.41Å; L138-F142 HydrophobicContact CD1-CD2 3.38Å; L138-F142 HydrophobicContact CD1-CE2 3.5Å; L138-F142 HydrophobicContact CD1-CG 4.38Å; L138-F142 HydrophobicContact CG-CD2 3.89Å; L138-F142 HydrophobicContact CG-CE2 4.49Å; L138-F142 WeakPolarHBondContact O-CB 3.42Å; L138-F142 PolarHBondContact O-N 2.91Å; F142-T146 HydrophobicContact CB-CG2 4.01Å; F142-T146 VanDerWaalsContact O-CB 3.32Å; F142-T146 WeakPolarHBondContact O-CB 3.5Å; F142-T146 PolarHBondContact O-OG1 3.42Å |
| 143 | G | 80 | Confident | 86.7 | Confident | 19 Ų | 19 | 48.4 Ų | 48.4 | 20% | 0.196 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | 77.6 | 170.6 | 171.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | L139 R145 T146 I147 E268 | L139-G143 WeakPolarHBondContact O-CA 3.49Å; L139-G143 PolarHBondContact O-N 2.9Å; G143-R145 PolarHBondContact O-N 3.26Å; G143-T146 PolarHBondContact O-N 2.97Å; G143-I147 PolarHBondContact O-N 2.74Å; G143-E268 VanDerWaalsContact C-OE1 3.25Å; G143-E268 WeakPolarHBondContact CA-OE1 3.37Å |
| 144 | L | 82.8 | Confident | 87.3 | Confident | 8 Ų | 8 | 47.2 Ų | 47.2 | 4% | 0.042 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.8 | -34.6 | -170.1 | -179.8 | 65.4 | 0 | 0 | 0 | 113.2 | L139 A148 M191 I195 F266 E268 | L139-L144 HydrophobicContact CD1-CD1 4.42Å; L144-A148 WeakPolarHBondContact O-CB 3.45Å; L144-A148 PolarHBondContact O-N 3.09Å; L144-A148 VanDerWaalsContact O-N 3.08Å; L144-M191 HydrophobicContact CD1-CG 3.97Å; L144-M191 HydrophobicContact CD1-SD 3.81Å; L144-I195 HydrophobicContact CD1-CD1 4.47Å; L144-I195 HydrophobicContact CD1-CG1 3.68Å; L144-I195 HydrophobicContact CD2-CG1 4.03Å; L144-I195 HydrophobicContact CG-CG1 4.42Å; L144-F266 HydrophobicContact CG-CD1 4.43Å; L144-F266 HydrophobicContact CG-CE1 4.31Å; L144-E268 PolarHBondContact N-OE1 2.87Å; L144-E268 VanDerWaalsContact N-OE1 3.11Å |
| 145 | R | 87.5 | Confident | 87.7 | Confident | 81 Ų | 81 | 44 Ų | 44 | 31% | 0.306 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -70.6 | -41.3 | -177 | -164.1 | -172.9 | -172 | -136.5 | -9.3 | 110.9 | G143 A148 L149 F263 F266 E268 | G143-R145 PolarHBondContact O-N 3.26Å; R145-A148 PolarHBondContact O-N 3.28Å; R145-L149 HydrophobicContact CG-CD1 4.14Å; R145-L149 WeakPolarHBondContact O-CB 3.46Å; R145-L149 WeakPolarHBondContact O-CG 3.42Å; R145-L149 PolarHBondContact O-N 3.49Å; R145-F263 PolarHBondContact NH2-O 3.42Å; R145-F263 VanDerWaalsContact NH2-O 3.09Å; R145-F266 HydrophobicContact CG-CB 4.2Å; R145-F266 PolarHBondContact NE-O 3.03Å; R145-E268 WeakPolarHBondContact CB-OE1 3.5Å; R145-E268 WeakPolarHBondContact CB-OE2 3.32Å; R145-E268 PolarHBondContact N-OE1 3.13Å |
| 146 | T | 87.8 | Confident | 88.2 | Confident | 52 Ų | 52 | 43.9 Ų | 43.9 | 32% | 0.319 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.3 | -49.6 | 179.2 | -49.8 | 0 | 0 | 0 | 0 | 110.4 | F142 G143 A148 L149 T150 | F142-T146 HydrophobicContact CB-CG2 4.01Å; F142-T146 VanDerWaalsContact O-CB 3.32Å; F142-T146 WeakPolarHBondContact O-CB 3.5Å; F142-T146 PolarHBondContact O-OG1 3.42Å; G143-T146 PolarHBondContact O-N 2.97Å; T146-A148 PolarHBondContact O-N 3.41Å; T146-L149 PolarHBondContact O-N 2.77Å; T146-T150 PolarHBondContact O-N 3.14Å; T146-T150 PolarHBondContact O-OG1 2.96Å; T146-T150 VanDerWaalsContact O-OG1 3.13Å |
| 147 | I | 90.6 | Very high | 89 | Confident | 1 Ų | 1 | 47.5 Ų | 47.5 | 1% | 0.005 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.5 | -42 | 179 | -64 | -56.6 | 0 | 0 | 0 | 112.4 | L138 L139 G143 L149 T150 G151 F187 M191 | L138-I147 HydrophobicContact CB-CD1 3.92Å; L138-I147 HydrophobicContact CD2-CD1 3.64Å; L138-I147 HydrophobicContact CG-CD1 3.81Å; L139-I147 HydrophobicContact CB-CD1 4.4Å; L139-I147 HydrophobicContact CB-CG1 3.84Å; L139-I147 HydrophobicContact CD1-CB 4.03Å; L139-I147 HydrophobicContact CD1-CG1 3.75Å; L139-I147 HydrophobicContact CD1-CG2 4.22Å; L139-I147 HydrophobicContact CG-CG1 4.39Å; G143-I147 PolarHBondContact O-N 2.74Å; I147-L149 PolarHBondContact O-N 3Å; I147-T150 PolarHBondContact O-N 3.04Å; I147-G151 PolarHBondContact O-N 3.47Å; I147-F187 HydrophobicContact CD1-CD1 3.9Å; I147-F187 HydrophobicContact CD1-CE1 4.04Å; I147-F187 HydrophobicContact CG2-CB 4.07Å; I147-F187 HydrophobicContact CG2-CD1 4Å; I147-M191 HydrophobicContact CB-SD 4.45Å; I147-M191 HydrophobicContact CG2-CE 3.84Å; I147-M191 HydrophobicContact CG2-CG 4.04Å; I147-M191 HydrophobicContact CG2-SD 3.83Å |
| 148 | A | 92.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.2 | -40.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y88 L144 R145 T146 S152 M191 V262 F266 | Y88-A148 WeakPolarHBondContact OH-CB 3.34Å; L144-A148 WeakPolarHBondContact O-CB 3.45Å; L144-A148 PolarHBondContact O-N 3.09Å; L144-A148 VanDerWaalsContact O-N 3.08Å; R145-A148 PolarHBondContact O-N 3.28Å; T146-A148 PolarHBondContact O-N 3.41Å; A148-S152 WeakPolarHBondContact O-CB 3.49Å; A148-S152 PolarHBondContact O-N 3.32Å; A148-S152 PolarHBondContact O-OG 2.93Å; A148-M191 HydrophobicContact CB-CE 4.42Å; A148-M191 HydrophobicContact CB-SD 4Å; A148-V262 HydrophobicContact CB-CG1 4.03Å; A148-F266 HydrophobicContact CB-CD1 3.33Å; A148-F266 HydrophobicContact CB-CD2 4.47Å; A148-F266 HydrophobicContact CB-CE1 3.39Å; A148-F266 HydrophobicContact CB-CG 3.91Å; A148-F266 HydrophobicContact CB-CZ 4.01Å |
| 149 | L | 94.7 | Very high | 90.4 | Very high | 41 Ų | 41 | 38.8 Ų | 38.8 | 22% | 0.215 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.9 | -47.3 | 175.5 | -79.4 | 168.2 | 0 | 0 | 0 | 111.8 | R145 T146 I147 S152 A153 V262 F263 | R145-L149 HydrophobicContact CG-CD1 4.14Å; R145-L149 WeakPolarHBondContact O-CB 3.46Å; R145-L149 WeakPolarHBondContact O-CG 3.42Å; R145-L149 PolarHBondContact O-N 3.49Å; T146-L149 PolarHBondContact O-N 2.77Å; I147-L149 PolarHBondContact O-N 3Å; L149-S152 PolarHBondContact O-N 3.07Å; L149-S152 PolarHBondContact O-OG 2.9Å; L149-A153 WeakPolarHBondContact O-CB 3.37Å; L149-A153 PolarHBondContact O-N 3.29Å; L149-V262 HydrophobicContact CD2-CG1 3.99Å; L149-V262 HydrophobicContact CG-CG1 4.21Å; L149-F263 HydrophobicContact CD2-CB 4.1Å; L149-F263 HydrophobicContact CD2-CD2 4.01Å |
| 150 | T | 95 | Very high | 91.2 | Very high | 48 Ų | 48 | 42.8 Ų | 42.8 | 29% | 0.294 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -63.1 | -46 | 178.7 | -56.7 | 0 | 0 | 0 | 0 | 111.6 | T146 I147 A153 L154 F187 | T146-T150 PolarHBondContact O-N 3.14Å; T146-T150 PolarHBondContact O-OG1 2.96Å; T146-T150 VanDerWaalsContact O-OG1 3.13Å; I147-T150 PolarHBondContact O-N 3.04Å; T150-A153 PolarHBondContact O-N 3.1Å; T150-L154 HydrophobicContact CG2-CD1 3.87Å; T150-L154 HydrophobicContact CG2-CG 4.37Å; T150-L154 WeakPolarHBondContact O-CB 3.38Å; T150-L154 VanDerWaalsContact O-CG 3.28Å; T150-L154 WeakPolarHBondContact O-CG 3.42Å; T150-L154 PolarHBondContact O-N 3.34Å; T150-F187 HydrophobicContact CG2-CD1 3.96Å; T150-F187 HydrophobicContact CG2-CE1 3.37Å; T150-F187 HydrophobicContact CG2-CE2 4.37Å; T150-F187 HydrophobicContact CG2-CZ 3.63Å |
| 151 | G | 95.6 | Very high | 92.3 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62 | -46.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | I147 N155 | I147-G151 PolarHBondContact O-N 3.47Å; G151-N155 VanDerWaalsContact O-CB 3.31Å; G151-N155 WeakPolarHBondContact O-CB 3.33Å; G151-N155 PolarHBondContact O-N 3.13Å |
| 152 | S | 96.8 | Very high | 93.2 | Very high | 3 Ų | 3 | 32.8 Ų | 32.8 | 2% | 0.021 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -69.8 | -35.2 | 177.4 | 56.8 | 0 | 0 | 0 | 0 | 113.2 | A148 L149 N155 C156 L259 | A148-S152 WeakPolarHBondContact O-CB 3.49Å; A148-S152 PolarHBondContact O-N 3.32Å; A148-S152 PolarHBondContact O-OG 2.93Å; L149-S152 PolarHBondContact O-N 3.07Å; L149-S152 PolarHBondContact O-OG 2.9Å; S152-N155 PolarHBondContact O-N 3.23Å; S152-C156 VanDerWaalsContact O-CB 3.3Å; S152-C156 WeakPolarHBondContact O-CB 3.2Å; S152-C156 PolarHBondContact O-N 2.89Å; S152-L259 WeakPolarHBondContact OG-CD1 3.32Å |
| 153 | A | 97.8 | Very high | 94 | Very high | 42 Ų | 42 | 29.4 Ų | 29.4 | 35% | 0.347 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -67.7 | -44.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L149 T150 C156 L157 L259 | L149-A153 WeakPolarHBondContact O-CB 3.37Å; L149-A153 PolarHBondContact O-N 3.29Å; T150-A153 PolarHBondContact O-N 3.1Å; A153-C156 PolarHBondContact O-N 3.48Å; A153-L157 WeakPolarHBondContact O-CB 3.39Å; A153-L157 PolarHBondContact O-N 3.46Å; A153-L259 HydrophobicContact CB-CD1 4Å; A153-L259 HydrophobicContact CB-CD2 4.45Å |
| 154 | L | 97.8 | Very high | 94.5 | Very high | 42 Ų | 42 | 30.4 Ų | 30.4 | 22% | 0.22 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.6 | -44.7 | 173.9 | -69.9 | 170.9 | 0 | 0 | 0 | 111.2 | T150 C156 L157 G158 I180 V183 A184 F187 | T150-L154 HydrophobicContact CG2-CD1 3.87Å; T150-L154 HydrophobicContact CG2-CG 4.37Å; T150-L154 WeakPolarHBondContact O-CB 3.38Å; T150-L154 VanDerWaalsContact O-CG 3.28Å; T150-L154 WeakPolarHBondContact O-CG 3.42Å; T150-L154 PolarHBondContact O-N 3.34Å; L154-C156 PolarHBondContact O-N 3.45Å; L154-L157 PolarHBondContact O-N 3.02Å; L154-G158 PolarHBondContact O-N 3.5Å; L154-I180 HydrophobicContact CB-CG2 4.44Å; L154-I180 HydrophobicContact CD2-CG2 4.27Å; L154-I180 VanDerWaalsContact O-CG2 3.32Å; L154-I180 WeakPolarHBondContact O-CG2 3.47Å; L154-V183 HydrophobicContact CD1-CG1 4.02Å; L154-A184 HydrophobicContact CB-CB 3.64Å; L154-F187 HydrophobicContact CD1-CD2 4.35Å; L154-F187 HydrophobicContact CD1-CE2 3.93Å; L154-F187 HydrophobicContact CD1-CZ 4.39Å |
| 155 | N | 97.7 | Very high | 95 | Very high | 3 Ų | 3 | 30 Ų | 30 | 2% | 0.016 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.7 | -33.3 | 178 | -172.4 | 65.1 | 0 | 0 | 0 | 113 | C91 N92 Q95 G151 S152 A159 A184 | C91-N155 PolarHBondContact SG-ND2 3.13Å; C91-N155 VanDerWaalsContact SG-ND2 3.45Å; N92-N155 WeakPolarHBondContact CA-OD1 3.5Å; N92-N155 WeakPolarHBondContact CB-OD1 3.1Å; N92-N155 PolarHBondContact ND2-OD1 3.11Å; Q95-N155 PolarHBondContact NE2-O 2.85Å; Q95-N155 PolarHBondContact NE2-OD1 2.73Å; G151-N155 VanDerWaalsContact O-CB 3.31Å; G151-N155 WeakPolarHBondContact O-CB 3.33Å; G151-N155 PolarHBondContact O-N 3.13Å; S152-N155 PolarHBondContact O-N 3.23Å; N155-A159 PolarHBondContact O-N 3.47Å; N155-A184 HydrophobicContact CB-CB 3.92Å |
| 156 | C | 98.1 | Very high | 95.2 | Very high | 9 Ų | 9 | 28.3 Ų | 28.3 | 6% | 0.061 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -72.6 | -46.4 | 172.8 | -174.1 | 0 | 0 | 0 | 0 | 112.2 | S152 A153 L154 G158 A159 W160 A255 T256 L259 | S152-C156 VanDerWaalsContact O-CB 3.3Å; S152-C156 WeakPolarHBondContact O-CB 3.2Å; S152-C156 PolarHBondContact O-N 2.89Å; A153-C156 PolarHBondContact O-N 3.48Å; L154-C156 PolarHBondContact O-N 3.45Å; C156-G158 PolarHBondContact O-N 3.24Å; C156-A159 WeakPolarHBondContact O-CB 3.33Å; C156-A159 PolarHBondContact O-N 3.13Å; C156-W160 VanDerWaalsContact O-CD1 3.24Å; C156-W160 PolarHBondContact O-N 3.1Å; C156-A255 HydrophobicContact CB-CB 4.11Å; C156-T256 PolarHBondContact SG-OG1 3.48Å; C156-L259 HydrophobicContact CB-CD2 4.14Å |
| 157 | L | 98.3 | Very high | 95.4 | Very high | 91 Ų | 91 | 31.5 Ų | 31.5 | 48% | 0.476 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -58.4 | -47.4 | 177.3 | 177.7 | 62.6 | 0 | 0 | 0 | 111.6 | A153 L154 A159 W160 V161 I180 | A153-L157 WeakPolarHBondContact O-CB 3.39Å; A153-L157 PolarHBondContact O-N 3.46Å; L154-L157 PolarHBondContact O-N 3.02Å; L157-A159 VanDerWaalsContact C-N 3.31Å; L157-A159 PolarHBondContact O-N 3.32Å; L157-W160 PolarHBondContact O-N 2.83Å; L157-V161 HydrophobicContact CD1-CG2 4.33Å; L157-V161 WeakPolarHBondContact O-CG2 3.37Å; L157-V161 PolarHBondContact O-N 3.05Å; L157-I180 HydrophobicContact CB-CG2 4.16Å; L157-I180 HydrophobicContact CD2-CG2 4.15Å; L157-I180 HydrophobicContact CG-CD1 4.45Å; L157-I180 HydrophobicContact CG-CG2 4.13Å |
| 158 | G | 97.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.8 | -33.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | L154 C156 K162 G177 C181 | L154-G158 PolarHBondContact O-N 3.5Å; C156-G158 PolarHBondContact O-N 3.24Å; G158-K162 WeakPolarHBondContact O-CD 3.4Å; G158-K162 VanDerWaalsContact O-CG 3.29Å; G158-K162 WeakPolarHBondContact O-CG 3.47Å; G158-K162 PolarHBondContact O-N 3.45Å; G158-G177 WeakPolarHBondContact CA-O 3.44Å; G158-C181 VanDerWaalsContact C-SG 3.53Å; G158-C181 VanDerWaalsContact CA-SG 3.54Å |
| 159 | A | 97.4 | Very high | 95.2 | Very high | 2 Ų | 2 | 40 Ų | 40 | 2% | 0.017 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.1 | -47.1 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | N155 C156 L157 K162 L163 I251 A255 | N155-A159 PolarHBondContact O-N 3.47Å; C156-A159 WeakPolarHBondContact O-CB 3.33Å; C156-A159 PolarHBondContact O-N 3.13Å; L157-A159 VanDerWaalsContact C-N 3.31Å; L157-A159 PolarHBondContact O-N 3.32Å; A159-K162 WeakPolarHBondContact O-CB 3.35Å; A159-K162 PolarHBondContact O-N 3.47Å; A159-L163 VanDerWaalsContact O-CD1 3.29Å; A159-L163 WeakPolarHBondContact O-CD1 3.49Å; A159-I251 HydrophobicContact CB-CG2 4Å; A159-A255 HydrophobicContact CB-CB 4.25Å |
| 160 | W | 97.9 | Very high | 95.2 | Very high | 111 Ų | 111 | 40.3 Ų | 40.3 | 42% | 0.42 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -66.8 | -36.6 | 178.5 | -76.9 | 109.7 | 0 | 0 | 0 | 113.5 | C156 L157 K162 L163 T256 | C156-W160 VanDerWaalsContact O-CD1 3.24Å; C156-W160 PolarHBondContact O-N 3.1Å; L157-W160 PolarHBondContact O-N 2.83Å; W160-K162 VanDerWaalsContact C-N 3.26Å; W160-K162 PolarHBondContact O-N 2.86Å; W160-L163 HydrophobicContact CE3-CD1 4.09Å; W160-L163 HydrophobicContact CE3-CD2 3.91Å; W160-L163 HydrophobicContact CZ3-CD2 3.72Å; W160-L163 PolarHBondContact O-N 2.91Å; W160-L163 VanDerWaalsContact O-N 3.16Å; W160-T256 PolarHBondContact NE1-OG1 3.4Å |
| 161 | V | 97.6 | Very high | 95.2 | Very high | 38 Ų | 38 | 39.7 Ų | 39.7 | 23% | 0.23 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.5 | -35.5 | 174.8 | 169.9 | 0 | 0 | 0 | 0 | 111.5 | L157 L163 G164 V173 V176 I180 | L157-V161 HydrophobicContact CD1-CG2 4.33Å; L157-V161 WeakPolarHBondContact O-CG2 3.37Å; L157-V161 PolarHBondContact O-N 3.05Å; V161-L163 VanDerWaalsContact C-N 3.27Å; V161-L163 PolarHBondContact O-N 3.35Å; V161-G164 WeakPolarHBondContact O-CA 3.27Å; V161-G164 PolarHBondContact O-N 3.37Å; V161-V173 HydrophobicContact CG1-CG1 4Å; V161-V173 WeakPolarHBondContact O-CG1 3.44Å; V161-V176 HydrophobicContact CG1-CG1 4.25Å; V161-I180 HydrophobicContact CG2-CD1 4.07Å |
| 162 | K | 96 | Very high | 95.2 | Very high | 1 Ų | 1 | 43.6 Ų | 43.6 | 0% | 0.004 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.4 | -25.2 | 177.2 | -67.9 | 161.5 | -176.6 | 178.9 | 0 | 113.6 | Y99 G158 A159 W160 G164 S165 F248 | Y99-K162 WeakPolarHBondContact OH-CD 3.19Å; G158-K162 WeakPolarHBondContact O-CD 3.4Å; G158-K162 VanDerWaalsContact O-CG 3.29Å; G158-K162 WeakPolarHBondContact O-CG 3.47Å; G158-K162 PolarHBondContact O-N 3.45Å; A159-K162 WeakPolarHBondContact O-CB 3.35Å; A159-K162 PolarHBondContact O-N 3.47Å; W160-K162 VanDerWaalsContact C-N 3.26Å; W160-K162 PolarHBondContact O-N 2.86Å; K162-G164 PolarHBondContact O-N 3.33Å; K162-S165 PolarHBondContact O-N 3.49Å; K162-S165 PolarHBondContact O-OG 3.04Å; K162-F248 HydrophobicContact CB-CD2 4.06Å; K162-F248 HydrophobicContact CB-CE2 4.03Å; K162-F248 HydrophobicContact CB-CG 4.4Å; K162-F248 HydrophobicContact CB-CZ 4.35Å; K162-F248 WeakPolarHBondContact O-CD2 2.89Å; K162-F248 VanDerWaalsContact O-CE2 3.29Å; K162-F248 WeakPolarHBondContact O-CE2 3.3Å |
| 163 | L | 94.1 | Very high | 95.2 | Very high | 25 Ų | 25 | 45.5 Ų | 45.5 | 13% | 0.131 | 25% | 0.248 | C | C | . | . | G | 310 helix | trans | -65 | -21.1 | 171.3 | -77.8 | 80.2 | 0 | 0 | 0 | 112.1 | A159 W160 V161 S165 L166 F248 Y249 | A159-L163 VanDerWaalsContact O-CD1 3.29Å; A159-L163 WeakPolarHBondContact O-CD1 3.49Å; W160-L163 HydrophobicContact CE3-CD1 4.09Å; W160-L163 HydrophobicContact CE3-CD2 3.91Å; W160-L163 HydrophobicContact CZ3-CD2 3.72Å; W160-L163 PolarHBondContact O-N 2.91Å; W160-L163 VanDerWaalsContact O-N 3.16Å; V161-L163 VanDerWaalsContact C-N 3.27Å; V161-L163 PolarHBondContact O-N 3.35Å; L163-S165 PolarHBondContact O-N 3.28Å; L163-L166 WeakPolarHBondContact O-CD1 3.13Å; L163-L166 WeakPolarHBondContact O-CG 3.45Å; L163-F248 HydrophobicContact CD1-CB 3.83Å; L163-F248 HydrophobicContact CG-CB 3.98Å; L163-Y249 HydrophobicContact CD2-CD1 3.43Å; L163-Y249 VanDerWaalsContact CD2-CD1 3.43Å; L163-Y249 HydrophobicContact CD2-CD2 4.18Å; L163-Y249 HydrophobicContact CD2-CE1 3.34Å; L163-Y249 HydrophobicContact CD2-CE2 4.1Å; L163-Y249 HydrophobicContact CD2-CG 3.85Å |
| 164 | G | 91.6 | Very high | 95.2 | Very high | 41 Ų | 41 | 43.5 Ų | 43.5 | 42% | 0.423 | 23% | 0.232 | S | C | . | . | G | 310 helix | trans | -72.2 | -10.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | V161 K162 L170 | V161-G164 WeakPolarHBondContact O-CA 3.27Å; V161-G164 PolarHBondContact O-N 3.37Å; K162-G164 PolarHBondContact O-N 3.33Å; G164-L170 VanDerWaalsContact O-CD1 3.24Å; G164-L170 WeakPolarHBondContact O-CD1 3.19Å |
| 165 | S | 93.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | G | 310 helix | trans | -102.1 | 18.3 | -173.8 | 73.4 | 0 | 0 | 0 | 0 | 115.2 | Y110 K162 L163 K167 L170 T174 | Y110-S165 WeakPolarHBondContact CE1-O 3.39Å; Y110-S165 PolarHBondContact OH-O 3.41Å; Y110-S165 PolarHBondContact OH-OG 2.9Å; Y110-S165 VanDerWaalsContact OH-OG 3.04Å; K162-S165 PolarHBondContact O-N 3.49Å; K162-S165 PolarHBondContact O-OG 3.04Å; L163-S165 PolarHBondContact O-N 3.28Å; S165-K167 PolarHBondContact O-N 3.42Å; S165-L170 WeakPolarHBondContact CB-O 3.36Å; S165-T174 WeakPolarHBondContact CB-OG1 3.33Å; S165-T174 PolarHBondContact OG-OG1 3.39Å |
| 166 | L | 92.4 | Very high | 95.2 | Very high | 44 Ų | 44 | 47.2 Ų | 47.2 | 23% | 0.23 | 26% | 0.256 | C | S | . | . | trans | -74.3 | 30.3 | -178.4 | -61.9 | 173 | 0 | 0 | 0 | 114.6 | L163 I244 F248 | L163-L166 WeakPolarHBondContact O-CD1 3.13Å; L163-L166 WeakPolarHBondContact O-CG 3.45Å; L166-I244 HydrophobicContact CD2-CB 4.26Å; L166-I244 HydrophobicContact CD2-CG2 3.77Å; L166-F248 HydrophobicContact CD2-CD2 3.86Å; L166-F248 HydrophobicContact CD2-CE2 4.22Å | ||
| 167 | K | 90.7 | Very high | 95.1 | Very high | 119 Ų | 119 | 46.8 Ų | 46.8 | 52% | 0.517 | 25% | 0.253 | S | S | . | . | S | Bend | trans | -139.3 | 146.2 | 171.8 | -57.8 | -174.1 | -176.9 | -179.4 | 0 | 110.2 | S165 H169 L170 | S165-K167 PolarHBondContact O-N 3.42Å; K167-H169 VanDerWaalsContact C-N 3.26Å; K167-H169 PolarHBondContact O-N 3.23Å; K167-H169 VanDerWaalsContact O-N 3.09Å; K167-L170 HydrophobicContact CB-CD1 3.83Å; K167-L170 HydrophobicContact CB-CG 4.05Å; K167-L170 HydrophobicContact CD-CD1 4.05Å; K167-L170 HydrophobicContact CG-CD1 3.99Å; K167-L170 PolarHBondContact O-N 2.92Å |
| 168 | P | 88.2 | Confident | 95.1 | Very high | 47 Ų | 47 | 42.4 Ų | 42.4 | 31% | 0.305 | 23% | 0.23 | S | C | . | . | G | 310 helix | trans | -53 | -33.1 | -177.9 | -32.4 | 37.5 | 0 | 0 | 0 | 116.1 | F109 Y110 L170 | F109-P168 VanDerWaalsContact O-CB 3.28Å; F109-P168 WeakPolarHBondContact O-CB 3.44Å; F109-P168 WeakPolarHBondContact O-CG 3.41Å; Y110-P168 WeakPolarHBondContact CD1-O 3.49Å; P168-L170 VanDerWaalsContact C-N 3.34Å |
| 169 | H | 90.9 | Very high | 95.1 | Very high | 134 Ų | 134 | 45.1 Ų | 45.1 | 62% | 0.62 | 25% | 0.246 | S | C | * | . | G | 310 helix | trans | -83.7 | -4.3 | 178.8 | 58.6 | -97.7 | 0 | 0 | 0 | 114.3 | K167 | K167-H169 VanDerWaalsContact C-N 3.26Å; K167-H169 PolarHBondContact O-N 3.23Å; K167-H169 VanDerWaalsContact O-N 3.09Å |
| 170 | L | 93.9 | Very high | 95.2 | Very high | 47 Ų | 47 | 46.7 Ų | 46.7 | 25% | 0.246 | 25% | 0.254 | C | S | . | . | G | 310 helix | trans | -98.1 | 22.6 | -175.5 | -60.8 | 176.8 | 0 | 0 | 0 | 113.3 | G164 S165 K167 P168 P172 V173 T174 | G164-L170 VanDerWaalsContact O-CD1 3.24Å; G164-L170 WeakPolarHBondContact O-CD1 3.19Å; S165-L170 WeakPolarHBondContact CB-O 3.36Å; K167-L170 HydrophobicContact CB-CD1 3.83Å; K167-L170 HydrophobicContact CB-CG 4.05Å; K167-L170 HydrophobicContact CD-CD1 4.05Å; K167-L170 HydrophobicContact CG-CD1 3.99Å; K167-L170 PolarHBondContact O-N 2.92Å; P168-L170 VanDerWaalsContact C-N 3.34Å; L170-P172 VanDerWaalsContact C-N 3.28Å; L170-V173 HydrophobicContact CB-CB 4.46Å; L170-V173 HydrophobicContact CB-CG2 4.15Å; L170-V173 HydrophobicContact CD2-CG2 4.22Å; L170-V173 WeakPolarHBondContact O-CB 3.38Å; L170-V173 PolarHBondContact O-N 2.95Å; L170-T174 PolarHBondContact O-N 2.84Å |
| 171 | F | 95.6 | Very high | 95.2 | Very high | 34 Ų | 34 | 41.4 Ų | 41.4 | 15% | 0.149 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -49.3 | -39.8 | 169.3 | -179.8 | -104.2 | 0 | 0 | 0 | 113.9 | Y110 V112 A116 I117 L120 V173 T174 V175 | Y110-F171 HydrophobicContact CD1-CB 3.79Å; Y110-F171 HydrophobicContact CD1-CD2 4.38Å; Y110-F171 AromaticContact CD2-CD2 3.74Å; Y110-F171 HydrophobicContact CD2-CD2 3.74Å; Y110-F171 HydrophobicContact CE1-CB 4.35Å; Y110-F171 HydrophobicContact CE2-CD2 4.22Å; Y110-F171 HydrophobicContact CG-CB 3.98Å; Y110-F171 AromaticContact CG-CD2 3.85Å; Y110-F171 HydrophobicContact CG-CD2 3.85Å; Y110-F171 HydrophobicContact CG-CG 4.36Å; V112-F171 HydrophobicContact CG1-CD1 4.26Å; V112-F171 HydrophobicContact CG1-CG 4.18Å; V112-F171 HydrophobicContact CG2-CD2 4.28Å; V112-F171 HydrophobicContact CG2-CE2 4.17Å; A116-F171 HydrophobicContact CB-CE1 4.27Å; A116-F171 HydrophobicContact CB-CZ 4.04Å; A116-F171 WeakPolarHBondContact O-CZ 3.22Å; I117-F171 HydrophobicContact CD1-CE2 3.86Å; L120-F171 HydrophobicContact CD1-CE2 4.08Å; L120-F171 HydrophobicContact CD2-CE2 4.44Å; L120-F171 HydrophobicContact CD2-CZ 4.37Å; L120-F171 HydrophobicContact CG-CE2 4.45Å; F171-V173 PolarHBondContact O-N 3.06Å; F171-T174 WeakPolarHBondContact O-CA 3.27Å; F171-T174 VanDerWaalsContact O-CB 3.31Å; F171-T174 WeakPolarHBondContact O-CB 3.36Å; F171-T174 PolarHBondContact O-N 3.19Å; F171-V175 HydrophobicContact CD1-CG2 4.05Å; F171-V175 HydrophobicContact CE1-CG2 3.55Å; F171-V175 HydrophobicContact CE2-CG2 4.41Å; F171-V175 HydrophobicContact CZ-CG2 3.75Å; F171-V175 PolarHBondContact O-N 2.74Å |
| 172 | P | 96.3 | Very high | 95.2 | Very high | 82 Ų | 82 | 39.6 Ų | 39.6 | 53% | 0.532 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -58.5 | -30.6 | 174.3 | -26.5 | 36.5 | 0 | 0 | 0 | 114.1 | L170 V175 V176 | L170-P172 VanDerWaalsContact C-N 3.28Å; P172-V175 PolarHBondContact O-N 3.48Å; P172-V176 WeakPolarHBondContact O-CG2 3.26Å; P172-V176 PolarHBondContact O-N 3.43Å |
| 173 | V | 96.9 | Very high | 95.2 | Very high | 44 Ų | 44 | 41.4 Ų | 41.4 | 27% | 0.267 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -71.1 | -36.4 | 176.2 | -174.6 | 0 | 0 | 0 | 0 | 110.8 | V161 L170 F171 V176 G177 | V161-V173 HydrophobicContact CG1-CG1 4Å; V161-V173 WeakPolarHBondContact O-CG1 3.44Å; L170-V173 HydrophobicContact CB-CB 4.46Å; L170-V173 HydrophobicContact CB-CG2 4.15Å; L170-V173 HydrophobicContact CD2-CG2 4.22Å; L170-V173 WeakPolarHBondContact O-CB 3.38Å; L170-V173 PolarHBondContact O-N 2.95Å; F171-V173 PolarHBondContact O-N 3.06Å; V173-V176 PolarHBondContact O-N 2.74Å; V173-G177 PolarHBondContact O-N 3.45Å |
| 174 | T | 96 | Very high | 95.4 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.3 | -45.5 | 168.3 | -79.1 | 0 | 0 | 0 | 0 | 111.1 | Y99 Y110 L120 S165 L170 F171 V176 G177 Q178 | Y99-T174 HydrophobicContact CD1-CG2 4.41Å; Y99-T174 HydrophobicContact CE1-CG2 3.65Å; Y99-T174 HydrophobicContact CE2-CG2 4.32Å; Y110-T174 PolarHBondContact OH-OG1 3.18Å; L120-T174 HydrophobicContact CD1-CG2 3.56Å; L120-T174 HydrophobicContact CD2-CG2 3.9Å; L120-T174 HydrophobicContact CG-CG2 4.41Å; S165-T174 WeakPolarHBondContact CB-OG1 3.33Å; S165-T174 PolarHBondContact OG-OG1 3.39Å; L170-T174 PolarHBondContact O-N 2.84Å; F171-T174 WeakPolarHBondContact O-CA 3.27Å; F171-T174 VanDerWaalsContact O-CB 3.31Å; F171-T174 WeakPolarHBondContact O-CB 3.36Å; F171-T174 PolarHBondContact O-N 3.19Å; T174-V176 PolarHBondContact O-N 3.34Å; T174-G177 PolarHBondContact O-N 3.21Å; T174-Q178 WeakPolarHBondContact O-CB 3.24Å; T174-Q178 PolarHBondContact O-N 3.07Å |
| 175 | V | 97.4 | Very high | 95.6 | Very high | 40 Ų | 40 | 38.7 Ų | 38.7 | 24% | 0.242 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60 | -47.2 | 177.6 | 177.7 | 0 | 0 | 0 | 0 | 111.1 | L120 F171 P172 Q178 V179 | L120-V175 HydrophobicContact CD2-CB 4.46Å; L120-V175 HydrophobicContact CD2-CG2 3.89Å; F171-V175 HydrophobicContact CD1-CG2 4.05Å; F171-V175 HydrophobicContact CE1-CG2 3.55Å; F171-V175 HydrophobicContact CE2-CG2 4.41Å; F171-V175 HydrophobicContact CZ-CG2 3.75Å; F171-V175 PolarHBondContact O-N 2.74Å; P172-V175 PolarHBondContact O-N 3.48Å; V175-Q178 PolarHBondContact O-N 3.41Å; V175-V179 HydrophobicContact CG1-CG2 4.41Å; V175-V179 WeakPolarHBondContact O-CB 3.42Å; V175-V179 WeakPolarHBondContact O-CG2 3.3Å; V175-V179 PolarHBondContact O-N 3.12Å |
| 176 | V | 98.1 | Very high | 95.6 | Very high | 82 Ų | 82 | 38.7 Ų | 38.7 | 50% | 0.497 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -61.7 | -48.1 | 177.7 | 173.2 | 0 | 0 | 0 | 0 | 111.5 | V161 P172 V173 T174 Q178 V179 I180 | V161-V176 HydrophobicContact CG1-CG1 4.25Å; P172-V176 WeakPolarHBondContact O-CG2 3.26Å; P172-V176 PolarHBondContact O-N 3.43Å; V173-V176 PolarHBondContact O-N 2.74Å; T174-V176 PolarHBondContact O-N 3.34Å; V176-Q178 VanDerWaalsContact C-N 3.3Å; V176-Q178 PolarHBondContact O-N 2.95Å; V176-V179 PolarHBondContact O-N 3.47Å; V176-I180 HydrophobicContact CG1-CD1 3.95Å; V176-I180 VanDerWaalsContact O-CG1 3.31Å; V176-I180 WeakPolarHBondContact O-CG1 3.44Å; V176-I180 PolarHBondContact O-N 3.32Å |
| 177 | G | 97.7 | Very high | 95.6 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62 | -37.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | G158 V173 T174 I180 C181 | G158-G177 WeakPolarHBondContact CA-O 3.44Å; V173-G177 PolarHBondContact O-N 3.45Å; T174-G177 PolarHBondContact O-N 3.21Å; G177-I180 PolarHBondContact O-N 3.45Å; G177-C181 PolarHBondContact O-N 3.24Å; G177-C181 VanDerWaalsContact O-N 3.16Å; G177-C181 PolarHBondContact O-SG 2.9Å; G177-C181 VanDerWaalsContact O-SG 3.35Å |
| 178 | Q | 97.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -68.4 | -42.2 | 176.3 | -168 | 71.5 | -16.9 | 0 | 0 | 112 | Q95 L120 Y124 T174 V175 V176 I180 C181 S182 | Q95-Q178 PolarHBondContact O-NE2 3.01Å; Q95-Q178 PolarHBondContact O-OE1 3.17Å; L120-Q178 HydrophobicContact CB-CG 3.97Å; L120-Q178 HydrophobicContact CD2-CB 4.08Å; L120-Q178 HydrophobicContact CD2-CG 4.17Å; L120-Q178 VanDerWaalsContact O-CG 3.23Å; L120-Q178 WeakPolarHBondContact O-CG 3.31Å; L120-Q178 PolarHBondContact O-NE2 2.94Å; Y124-Q178 HydrophobicContact CD2-CG 4.42Å; Y124-Q178 HydrophobicContact CE2-CG 3.93Å; T174-Q178 WeakPolarHBondContact O-CB 3.24Å; T174-Q178 PolarHBondContact O-N 3.07Å; V175-Q178 PolarHBondContact O-N 3.41Å; V176-Q178 VanDerWaalsContact C-N 3.3Å; V176-Q178 PolarHBondContact O-N 2.95Å; Q178-I180 VanDerWaalsContact C-N 3.32Å; Q178-I180 PolarHBondContact O-N 2.98Å; Q178-C181 CarbonylContact O-C 3.59Å; Q178-C181 PolarHBondContact O-N 3.43Å; Q178-S182 WeakPolarHBondContact O-CB 3.29Å; Q178-S182 PolarHBondContact O-N 3.4Å |
| 179 | V | 98.1 | Very high | 95.7 | Very high | 56 Ų | 56 | 31.4 Ų | 31.4 | 34% | 0.339 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -62.8 | -36.8 | 174.5 | 169.5 | 0 | 0 | 0 | 0 | 111.6 | C123 V175 V176 C181 S182 V183 | C123-V179 HydrophobicContact CB-CG2 4.24Å; V175-V179 HydrophobicContact CG1-CG2 4.41Å; V175-V179 WeakPolarHBondContact O-CB 3.42Å; V175-V179 WeakPolarHBondContact O-CG2 3.3Å; V175-V179 PolarHBondContact O-N 3.12Å; V176-V179 PolarHBondContact O-N 3.47Å; V179-C181 PolarHBondContact O-N 3.22Å; V179-S182 WeakPolarHBondContact CA-OG 3.49Å; V179-S182 PolarHBondContact O-N 3.42Å; V179-S182 PolarHBondContact O-OG 3.39Å; V179-V183 WeakPolarHBondContact O-CG2 3.46Å; V179-V183 PolarHBondContact O-N 2.86Å |
| 180 | I | 98.3 | Very high | 95.2 | Very high | 36 Ų | 36 | 26.4 Ų | 26.4 | 19% | 0.185 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.3 | -41.8 | 174.6 | -65.9 | 163.8 | 0 | 0 | 0 | 110.9 | L154 L157 V161 V176 G177 Q178 S182 A184 | L154-I180 HydrophobicContact CB-CG2 4.44Å; L154-I180 HydrophobicContact CD2-CG2 4.27Å; L154-I180 VanDerWaalsContact O-CG2 3.32Å; L154-I180 WeakPolarHBondContact O-CG2 3.47Å; L157-I180 HydrophobicContact CB-CG2 4.16Å; L157-I180 HydrophobicContact CD2-CG2 4.15Å; L157-I180 HydrophobicContact CG-CD1 4.45Å; L157-I180 HydrophobicContact CG-CG2 4.13Å; V161-I180 HydrophobicContact CG2-CD1 4.07Å; V176-I180 HydrophobicContact CG1-CD1 3.95Å; V176-I180 VanDerWaalsContact O-CG1 3.31Å; V176-I180 WeakPolarHBondContact O-CG1 3.44Å; V176-I180 PolarHBondContact O-N 3.32Å; G177-I180 PolarHBondContact O-N 3.45Å; Q178-I180 VanDerWaalsContact C-N 3.32Å; Q178-I180 PolarHBondContact O-N 2.98Å; I180-S182 VanDerWaalsContact C-N 3.3Å; I180-S182 PolarHBondContact O-N 3.28Å; I180-A184 PolarHBondContact O-N 2.9Å; I180-A184 VanDerWaalsContact O-N 3.08Å |
| 181 | C | 98 | Very high | 94.7 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -68.6 | -27.5 | 173 | -61.9 | 0 | 0 | 0 | 0 | 113.3 | N92 Q95 Y124 G158 G177 Q178 V179 A184 Q185 | N92-C181 PolarHBondContact ND2-O 3.42Å; Q95-C181 PolarHBondContact OE1-SG 3.35Å; Y124-C181 HydrophobicContact CE2-CB 4.25Å; Y124-C181 WeakPolarHBondContact OH-CB 3.4Å; G158-C181 VanDerWaalsContact C-SG 3.53Å; G158-C181 VanDerWaalsContact CA-SG 3.54Å; G177-C181 PolarHBondContact O-N 3.24Å; G177-C181 VanDerWaalsContact O-N 3.16Å; G177-C181 PolarHBondContact O-SG 2.9Å; G177-C181 VanDerWaalsContact O-SG 3.35Å; Q178-C181 CarbonylContact O-C 3.59Å; Q178-C181 PolarHBondContact O-N 3.43Å; V179-C181 PolarHBondContact O-N 3.22Å; C181-A184 WeakPolarHBondContact O-CB 3.47Å; C181-A184 PolarHBondContact O-N 3.24Å; C181-Q185 PolarHBondContact O-N 2.94Å; C181-Q185 VanDerWaalsContact O-N 3.11Å |
| 182 | S | 97.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -73.7 | -42.6 | 179.1 | 95.3 | 0 | 0 | 0 | 0 | 111.2 | C123 T127 Q178 V179 I180 A184 Q185 | C123-S182 PolarHBondContact O-OG 3.07Å; T127-S182 WeakPolarHBondContact CG2-OG 3.47Å; T127-S182 WeakPolarHBondContact OG1-CB 3.31Å; T127-S182 PolarHBondContact OG1-O 3.49Å; T127-S182 PolarHBondContact OG1-OG 3.08Å; Q178-S182 WeakPolarHBondContact O-CB 3.29Å; Q178-S182 PolarHBondContact O-N 3.4Å; V179-S182 WeakPolarHBondContact CA-OG 3.49Å; V179-S182 PolarHBondContact O-N 3.42Å; V179-S182 PolarHBondContact O-OG 3.39Å; I180-S182 VanDerWaalsContact C-N 3.3Å; I180-S182 PolarHBondContact O-N 3.28Å; S182-A184 VanDerWaalsContact C-N 3.29Å; S182-A184 PolarHBondContact O-N 3.38Å; S182-Q185 WeakPolarHBondContact O-CB 3.45Å; S182-Q185 PolarHBondContact O-N 2.91Å |
| 183 | V | 97.7 | Very high | 93.4 | Very high | 39 Ų | 39 | 20.8 Ų | 20.8 | 24% | 0.236 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.8 | -39.3 | 168 | 175.4 | 0 | 0 | 0 | 0 | 110.7 | T127 L131 L154 V179 Q185 V186 F187 | T127-V183 HydrophobicContact CG2-CG2 4.11Å; L131-V183 HydrophobicContact CD1-CB 4.41Å; L131-V183 HydrophobicContact CD1-CG1 4.07Å; L131-V183 HydrophobicContact CD1-CG2 3.97Å; L154-V183 HydrophobicContact CD1-CG1 4.02Å; V179-V183 WeakPolarHBondContact O-CG2 3.46Å; V179-V183 PolarHBondContact O-N 2.86Å; V183-Q185 PolarHBondContact O-N 3.37Å; V183-V186 PolarHBondContact O-N 3.21Å; V183-F187 HydrophobicContact CG1-CE2 4.26Å; V183-F187 WeakPolarHBondContact O-CD2 3.5Å |
| 184 | A | 97.2 | Very high | 92.5 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -58.8 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L154 N155 I180 C181 S182 V186 F187 I188 | L154-A184 HydrophobicContact CB-CB 3.64Å; N155-A184 HydrophobicContact CB-CB 3.92Å; I180-A184 PolarHBondContact O-N 2.9Å; I180-A184 VanDerWaalsContact O-N 3.08Å; C181-A184 WeakPolarHBondContact O-CB 3.47Å; C181-A184 PolarHBondContact O-N 3.24Å; S182-A184 VanDerWaalsContact C-N 3.29Å; S182-A184 PolarHBondContact O-N 3.38Å; A184-V186 PolarHBondContact O-N 3.15Å; A184-V186 VanDerWaalsContact O-N 3.09Å; A184-F187 WeakPolarHBondContact O-CB 3.48Å; A184-F187 PolarHBondContact O-N 3.29Å; A184-F187 VanDerWaalsContact O-N 3.1Å; A184-I188 WeakPolarHBondContact O-CG1 3.47Å; A184-I188 PolarHBondContact O-N 3.38Å |
| 185 | Q | 95.8 | Very high | 91.9 | Very high | 8 Ų | 8 | 22.8 Ų | 22.8 | 4% | 0.037 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -51.2 | -36.8 | -178.9 | -171.2 | -166.8 | 36.3 | 0 | 0 | 112.9 | N92 Y124 C181 S182 V183 F187 I188 L189 | N92-Q185 WeakPolarHBondContact OD1-CA 3.35Å; N92-Q185 VanDerWaalsContact OD1-CB 3.27Å; N92-Q185 WeakPolarHBondContact OD1-CB 3.28Å; N92-Q185 WeakPolarHBondContact OD1-CG 3.36Å; Y124-Q185 HydrophobicContact CD1-CB 3.99Å; Y124-Q185 VanDerWaalsContact CD1-CD 3.49Å; Y124-Q185 HydrophobicContact CD1-CG 4.11Å; Y124-Q185 HydrophobicContact CE1-CB 4.2Å; Y124-Q185 PolarHBondContact O-OE1 2.89Å; C181-Q185 PolarHBondContact O-N 2.94Å; C181-Q185 VanDerWaalsContact O-N 3.11Å; S182-Q185 WeakPolarHBondContact O-CB 3.45Å; S182-Q185 PolarHBondContact O-N 2.91Å; V183-Q185 PolarHBondContact O-N 3.37Å; Q185-F187 VanDerWaalsContact C-N 3.32Å; Q185-F187 PolarHBondContact O-N 3.05Å; Q185-I188 WeakPolarHBondContact O-CA 3.49Å; Q185-I188 WeakPolarHBondContact O-CB 3.5Å; Q185-I188 PolarHBondContact O-N 2.99Å; Q185-L189 HydrophobicContact CG-CD1 3.73Å; Q185-L189 HydrophobicContact CG-CG 3.94Å; Q185-L189 PolarHBondContact O-N 3.24Å |
| 186 | V | 93.8 | Very high | 91.1 | Very high | 1 Ų | 1 | 20.9 Ų | 20.9 | 1% | 0.006 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -63.9 | -37.2 | -176.1 | -163.4 | 0 | 0 | 0 | 0 | 111.9 | Y128 L131 V135 V183 A184 I188 | Y128-V186 HydrophobicContact CD2-CB 4.37Å; Y128-V186 HydrophobicContact CD2-CG1 4.11Å; Y128-V186 HydrophobicContact CD2-CG2 4.25Å; Y128-V186 HydrophobicContact CE2-CG1 4.43Å; L131-V186 HydrophobicContact CB-CB 4.41Å; L131-V186 HydrophobicContact CB-CG1 3.94Å; L131-V186 HydrophobicContact CB-CG2 4.19Å; L131-V186 HydrophobicContact CD1-CG2 4.46Å; V135-V186 HydrophobicContact CB-CG1 4.17Å; V135-V186 HydrophobicContact CG1-CG1 4.48Å; V135-V186 HydrophobicContact CG2-CB 4.39Å; V135-V186 HydrophobicContact CG2-CG1 4.03Å; V183-V186 PolarHBondContact O-N 3.21Å; A184-V186 PolarHBondContact O-N 3.15Å; A184-V186 VanDerWaalsContact O-N 3.09Å; V186-I188 VanDerWaalsContact C-N 3.32Å |
| 187 | F | 92.4 | Very high | 89.9 | Confident | 19 Ų | 19 | 18.4 Ų | 18.4 | 8% | 0.083 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -65.9 | -38.9 | 172.1 | -64.8 | -108.9 | 0 | 0 | 0 | 110.5 | V135 L138 I147 T150 L154 V183 A184 Q185 M191 | V135-F187 HydrophobicContact CG1-CB 4.44Å; V135-F187 HydrophobicContact CG1-CD1 4.19Å; V135-F187 HydrophobicContact CG1-CD2 4.45Å; V135-F187 HydrophobicContact CG1-CG 4.11Å; V135-F187 HydrophobicContact CG2-CD2 4.17Å; V135-F187 HydrophobicContact CG2-CE1 4.38Å; V135-F187 HydrophobicContact CG2-CE2 3.85Å; V135-F187 HydrophobicContact CG2-CZ 3.96Å; L138-F187 HydrophobicContact CD2-CE1 3.86Å; L138-F187 HydrophobicContact CD2-CZ 4.4Å; I147-F187 HydrophobicContact CD1-CD1 3.9Å; I147-F187 HydrophobicContact CD1-CE1 4.04Å; I147-F187 HydrophobicContact CG2-CB 4.07Å; I147-F187 HydrophobicContact CG2-CD1 4Å; T150-F187 HydrophobicContact CG2-CD1 3.96Å; T150-F187 HydrophobicContact CG2-CE1 3.37Å; T150-F187 HydrophobicContact CG2-CE2 4.37Å; T150-F187 HydrophobicContact CG2-CZ 3.63Å; L154-F187 HydrophobicContact CD1-CD2 4.35Å; L154-F187 HydrophobicContact CD1-CE2 3.93Å; L154-F187 HydrophobicContact CD1-CZ 4.39Å; V183-F187 HydrophobicContact CG1-CE2 4.26Å; V183-F187 WeakPolarHBondContact O-CD2 3.5Å; A184-F187 WeakPolarHBondContact O-CB 3.48Å; A184-F187 PolarHBondContact O-N 3.29Å; A184-F187 VanDerWaalsContact O-N 3.1Å; Q185-F187 VanDerWaalsContact C-N 3.32Å; Q185-F187 PolarHBondContact O-N 3.05Å; F187-M191 WeakPolarHBondContact O-CE 3.44Å |
| 188 | I | 92.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -72.1 | -54.5 | -172.5 | -56.3 | 179.3 | 0 | 0 | 0 | 112.1 | F85 Y88 N92 A184 Q185 V186 G190 M191 | F85-I188 HydrophobicContact CE2-CG2 4.05Å; F85-I188 HydrophobicContact CZ-CG2 3.9Å; F85-I188 WeakPolarHBondContact CZ-O 3.48Å; Y88-I188 HydrophobicContact CD2-CD1 4.03Å; Y88-I188 HydrophobicContact CD2-CG1 4.23Å; Y88-I188 HydrophobicContact CE2-CD1 4.27Å; Y88-I188 HydrophobicContact CE2-CG1 3.94Å; Y88-I188 HydrophobicContact CE2-CG2 4.27Å; N92-I188 HydrophobicContact CB-CD1 3.4Å; A184-I188 WeakPolarHBondContact O-CG1 3.47Å; A184-I188 PolarHBondContact O-N 3.38Å; Q185-I188 WeakPolarHBondContact O-CA 3.49Å; Q185-I188 WeakPolarHBondContact O-CB 3.5Å; Q185-I188 PolarHBondContact O-N 2.99Å; V186-I188 VanDerWaalsContact C-N 3.32Å; I188-G190 VanDerWaalsContact C-N 3.27Å; I188-G190 PolarHBondContact O-N 2.89Å; I188-M191 PolarHBondContact O-N 2.92Å; I188-M191 VanDerWaalsContact O-N 3.13Å |
| 189 | L | 87.5 | Confident | 87.9 | Confident | 37 Ų | 37 | 19.5 Ų | 19.5 | 19% | 0.194 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -65.6 | -25.7 | -168.8 | -73.6 | 177.9 | 0 | 0 | 0 | 114.1 | Y128 Q185 P192 | Y128-L189 HydrophobicContact CD2-CD1 4.16Å; Y128-L189 HydrophobicContact CE2-CB 3.98Å; Y128-L189 HydrophobicContact CE2-CD1 3.89Å; Q185-L189 HydrophobicContact CG-CD1 3.73Å; Q185-L189 HydrophobicContact CG-CG 3.94Å; Q185-L189 PolarHBondContact O-N 3.24Å; L189-P192 VanDerWaalsContact O-CD 3.24Å; L189-P192 WeakPolarHBondContact O-CD 3.43Å |
| 190 | G | 80.2 | Confident | 87.2 | Confident | 30 Ų | 30 | 16.8 Ų | 16.8 | 31% | 0.309 | 10% | 0.095 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -11.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | I188 | I188-G190 VanDerWaalsContact C-N 3.27Å; I188-G190 PolarHBondContact O-N 2.89Å |
| 191 | M | 83.8 | Confident | 85.9 | Confident | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -80.3 | -27.4 | -175 | -88.6 | -170 | -78.7 | 0 | 0 | 117.8 | F85 Y88 L144 I147 A148 F187 I188 S193 R194 I195 | F85-M191 HydrophobicContact CD2-CB 4.18Å; F85-M191 HydrophobicContact CE2-CB 3.51Å; F85-M191 HydrophobicContact CE2-CE 4.08Å; F85-M191 HydrophobicContact CE2-SD 4.42Å; F85-M191 HydrophobicContact CZ-CB 4.14Å; Y88-M191 HydrophobicContact CE2-CE 4.26Å; Y88-M191 WeakPolarHBondContact OH-CE 3.31Å; L144-M191 HydrophobicContact CD1-CG 3.97Å; L144-M191 HydrophobicContact CD1-SD 3.81Å; I147-M191 HydrophobicContact CB-SD 4.45Å; I147-M191 HydrophobicContact CG2-CE 3.84Å; I147-M191 HydrophobicContact CG2-CG 4.04Å; I147-M191 HydrophobicContact CG2-SD 3.83Å; A148-M191 HydrophobicContact CB-CE 4.42Å; A148-M191 HydrophobicContact CB-SD 4Å; F187-M191 WeakPolarHBondContact O-CE 3.44Å; I188-M191 PolarHBondContact O-N 2.92Å; I188-M191 VanDerWaalsContact O-N 3.13Å; M191-S193 PolarHBondContact O-N 3.41Å; M191-R194 PolarHBondContact O-N 3.21Å; M191-R194 VanDerWaalsContact O-N 3.14Å; M191-I195 HydrophobicContact CB-CD1 4.02Å; M191-I195 HydrophobicContact CB-CG1 4.39Å; M191-I195 WeakPolarHBondContact O-CG1 3.48Å; M191-I195 PolarHBondContact O-N 3.44Å |
| 192 | P | 87.2 | Confident | 84.6 | Confident | 11 Ų | 11 | 19.7 Ų | 19.7 | 7% | 0.071 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -53.2 | -52.9 | -172.9 | -30 | 36.1 | 0 | 0 | 0 | 114.7 | F85 L189 R194 I195 A196 A212 V213 | F85-P192 HydrophobicContact CE1-CG 3.83Å; F85-P192 HydrophobicContact CZ-CG 3.81Å; L189-P192 VanDerWaalsContact O-CD 3.24Å; L189-P192 WeakPolarHBondContact O-CD 3.43Å; P192-R194 VanDerWaalsContact C-N 3.35Å; P192-R194 PolarHBondContact O-N 2.93Å; P192-I195 PolarHBondContact O-N 3.34Å; P192-A196 WeakPolarHBondContact O-CB 3.41Å; P192-A196 PolarHBondContact O-N 2.97Å; P192-A196 VanDerWaalsContact O-N 3.07Å; P192-A212 HydrophobicContact CB-CB 3.76Å; P192-A212 HydrophobicContact CG-CB 4.24Å; P192-V213 HydrophobicContact CB-CG2 3.9Å; P192-V213 HydrophobicContact CG-CG2 4.08Å |
| 193 | S | 78.6 | Confident | 83.3 | Confident | 33 Ų | 33 | 27.3 Ų | 27.3 | 23% | 0.231 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.9 | -40.8 | 178.4 | 53.3 | 0 | 0 | 0 | 0 | 111.5 | M191 A196 S197 | M191-S193 PolarHBondContact O-N 3.41Å; S193-A196 PolarHBondContact O-N 3.35Å; S193-S197 WeakPolarHBondContact O-CB 3.4Å; S193-S197 PolarHBondContact O-N 3.38Å |
| 194 | R | 77.3 | Confident | 82.4 | Confident | 86 Ų | 86 | 28.5 Ų | 28.5 | 33% | 0.325 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -74.6 | -30 | -178.7 | -158.8 | 51.2 | 156.8 | 173 | -8.7 | 113.7 | L139 M191 P192 S197 V198 Y282 | L139-R194 HydrophobicContact CD2-CB 4.3Å; L139-R194 HydrophobicContact CD2-CG 4.21Å; M191-R194 PolarHBondContact O-N 3.21Å; M191-R194 VanDerWaalsContact O-N 3.14Å; P192-R194 VanDerWaalsContact C-N 3.35Å; P192-R194 PolarHBondContact O-N 2.93Å; R194-S197 PolarHBondContact NH1-OG 3.01Å; R194-S197 VanDerWaalsContact NH1-OG 3.16Å; R194-V198 VanDerWaalsContact O-CB 3.31Å; R194-V198 WeakPolarHBondContact O-CB 3.05Å; R194-V198 WeakPolarHBondContact O-CG2 3.28Å; R194-V198 PolarHBondContact O-N 2.93Å; R194-Y282 PolarHBondContact NH1-OH 2.98Å |
| 195 | I | 83.2 | Confident | 81.4 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -65.7 | -49.1 | 168.9 | -68.2 | 168 | 0 | 0 | 0 | 109.2 | V81 V82 F85 L144 M191 P192 S197 V198 W199 F266 | V81-I195 HydrophobicContact CG1-CG2 4.2Å; V82-I195 HydrophobicContact CG2-CG2 3.63Å; F85-I195 HydrophobicContact CB-CD1 3.82Å; F85-I195 HydrophobicContact CD1-CD1 4.29Å; F85-I195 HydrophobicContact CD2-CD1 3.34Å; F85-I195 HydrophobicContact CE2-CD1 4.04Å; F85-I195 HydrophobicContact CG-CD1 3.51Å; L144-I195 HydrophobicContact CD1-CD1 4.47Å; L144-I195 HydrophobicContact CD1-CG1 3.68Å; L144-I195 HydrophobicContact CD2-CG1 4.03Å; L144-I195 HydrophobicContact CG-CG1 4.42Å; M191-I195 HydrophobicContact CB-CD1 4.02Å; M191-I195 HydrophobicContact CB-CG1 4.39Å; M191-I195 WeakPolarHBondContact O-CG1 3.48Å; M191-I195 PolarHBondContact O-N 3.44Å; P192-I195 PolarHBondContact O-N 3.34Å; I195-S197 PolarHBondContact O-N 3.44Å; I195-V198 PolarHBondContact O-N 3.09Å; I195-W199 WeakPolarHBondContact O-CB 3.38Å; I195-W199 PolarHBondContact O-N 2.95Å; I195-F266 HydrophobicContact CD1-CE1 4.28Å; I195-F266 HydrophobicContact CD1-CZ 4.2Å |
| 196 | A | 81.1 | Confident | 80.4 | Confident | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.5 | -47.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | P192 S193 V198 F200 V205 A208 C209 | P192-A196 WeakPolarHBondContact O-CB 3.41Å; P192-A196 PolarHBondContact O-N 2.97Å; P192-A196 VanDerWaalsContact O-N 3.07Å; S193-A196 PolarHBondContact O-N 3.35Å; A196-V198 PolarHBondContact O-N 2.97Å; A196-V198 VanDerWaalsContact O-N 3.16Å; A196-F200 WeakPolarHBondContact O-CB 3.45Å; A196-F200 PolarHBondContact O-N 3.3Å; A196-V205 HydrophobicContact CB-CB 4.45Å; A196-V205 HydrophobicContact CB-CG1 3.77Å; A196-V205 WeakPolarHBondContact CB-O 3.39Å; A196-A208 HydrophobicContact CB-CB 4.03Å; A196-C209 HydrophobicContact CB-CB 4.09Å |
| 197 | S | 73.2 | Confident | 79.8 | Confident | 31 Ų | 31 | 36.7 Ų | 36.7 | 22% | 0.217 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -69.9 | -7.5 | -179.8 | 101.6 | 0 | 0 | 0 | 0 | 115.2 | S193 R194 I195 Q278 | S193-S197 WeakPolarHBondContact O-CB 3.4Å; S193-S197 PolarHBondContact O-N 3.38Å; R194-S197 PolarHBondContact NH1-OG 3.01Å; R194-S197 VanDerWaalsContact NH1-OG 3.16Å; I195-S197 PolarHBondContact O-N 3.44Å; S197-Q278 PolarHBondContact O-NE2 3.29Å |
| 198 | V | 75.9 | Confident | 79.4 | Confident | 12 Ų | 12 | 35.8 Ų | 35.8 | 7% | 0.073 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -115.1 | -26.2 | -177.1 | 172.1 | 0 | 0 | 0 | 0 | 112.7 | R194 I195 A196 K269 P270 P274 Y282 | R194-V198 VanDerWaalsContact O-CB 3.31Å; R194-V198 WeakPolarHBondContact O-CB 3.05Å; R194-V198 WeakPolarHBondContact O-CG2 3.28Å; R194-V198 PolarHBondContact O-N 2.93Å; I195-V198 PolarHBondContact O-N 3.09Å; A196-V198 PolarHBondContact O-N 2.97Å; A196-V198 VanDerWaalsContact O-N 3.16Å; V198-K269 HydrophobicContact CG1-CG 4.48Å; V198-P270 WeakPolarHBondContact O-CD 3.42Å; V198-P274 WeakPolarHBondContact O-CG 3.34Å; V198-Y282 WeakPolarHBondContact CG2-OH 3.43Å |
| 199 | W | 77.7 | Confident | 79 | Confident | 10 Ų | 10 | 37.4 Ų | 37.4 | 4% | 0.038 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -114.4 | -9 | -173.9 | -75.2 | 85.1 | 0 | 0 | 0 | 114.9 | R78 V81 I195 K267 P270 | R78-W199 HydrophobicContact CB-CB 4.1Å; R78-W199 HydrophobicContact CB-CE3 3.86Å; R78-W199 WeakPolarHBondContact CD-O 3.24Å; V81-W199 HydrophobicContact CG2-CD2 4.47Å; V81-W199 HydrophobicContact CG2-CE3 4.45Å; V81-W199 HydrophobicContact CG2-CH2 4.17Å; V81-W199 HydrophobicContact CG2-CZ2 4.19Å; V81-W199 HydrophobicContact CG2-CZ3 4.29Å; I195-W199 WeakPolarHBondContact O-CB 3.38Å; I195-W199 PolarHBondContact O-N 2.95Å; W199-K267 HydrophobicContact CH2-CB 4.33Å; W199-K267 HydrophobicContact CZ2-CB 4.31Å; W199-K267 WeakPolarHBondContact CZ2-O 3.43Å; W199-P270 HydrophobicContact CD2-CB 4.4Å; W199-P270 HydrophobicContact CD2-CG 4.41Å; W199-P270 HydrophobicContact CE3-CB 3.86Å; W199-P270 HydrophobicContact CE3-CG 4.33Å; W199-P270 HydrophobicContact CH2-CB 4.29Å; W199-P270 HydrophobicContact CZ3-CB 3.81Å |
| 200 | F | 81.4 | Confident | 78.8 | Confident | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 24% | 0.236 | C | C | . | . | S | Bend | trans | -129.7 | 150 | -174.9 | -61.8 | -102.1 | 0 | 0 | 0 | 111.4 | R78 W79 V82 A196 E204 V205 A208 Q278 | R78-F200 HydrophobicContact CB-CE1 4.27Å; R78-F200 HydrophobicContact CB-CE2 4.02Å; R78-F200 HydrophobicContact CB-CZ 3.8Å; R78-F200 HydrophobicContact CG-CD1 4.31Å; R78-F200 HydrophobicContact CG-CE1 3.65Å; R78-F200 HydrophobicContact CG-CE2 4.3Å; R78-F200 HydrophobicContact CG-CZ 3.63Å; W79-F200 AromaticContact CD2-CE1 3.81Å; W79-F200 HydrophobicContact CD2-CE1 3.81Å; W79-F200 HydrophobicContact CD2-CZ 4.17Å; W79-F200 AromaticContact CE2-CE1 3.77Å; W79-F200 AromaticContact CE3-CE1 3.91Å; W79-F200 HydrophobicContact CE3-CE1 3.91Å; W79-F200 HydrophobicContact CE3-CZ 4.04Å; W79-F200 HydrophobicContact CG-CE1 4.5Å; W79-F200 AromaticContact CH2-CE1 3.93Å; W79-F200 HydrophobicContact CH2-CE1 3.93Å; W79-F200 HydrophobicContact CZ2-CD1 4.49Å; W79-F200 AromaticContact CZ2-CE1 3.84Å; W79-F200 HydrophobicContact CZ2-CE1 3.84Å; W79-F200 AromaticContact CZ3-CE1 3.97Å; W79-F200 HydrophobicContact CZ3-CE1 3.97Å; W79-F200 HydrophobicContact CZ3-CZ 4.33Å; V82-F200 HydrophobicContact CB-CZ 4.43Å; V82-F200 HydrophobicContact CG2-CE2 3.43Å; V82-F200 VanDerWaalsContact CG2-CE2 3.43Å; V82-F200 HydrophobicContact CG2-CZ 3.57Å; A196-F200 WeakPolarHBondContact O-CB 3.45Å; A196-F200 PolarHBondContact O-N 3.3Å; F200-E204 HydrophobicContact CB-CB 4.27Å; F200-E204 HydrophobicContact CD1-CB 4.05Å; F200-V205 HydrophobicContact CB-CG2 4.49Å; F200-A208 HydrophobicContact CB-CB 4.47Å; F200-A208 HydrophobicContact CD1-CB 3.8Å; F200-A208 HydrophobicContact CD2-CB 3.6Å; F200-A208 HydrophobicContact CE1-CB 3.84Å; F200-A208 HydrophobicContact CE2-CB 3.69Å; F200-A208 HydrophobicContact CG-CB 3.68Å; F200-A208 HydrophobicContact CZ-CB 3.8Å; F200-Q278 PolarHBondContact O-NE2 3.14Å |
| 201 | G | 72.8 | Confident | 79.1 | Confident | 18 Ų | 18 | 39.2 Ų | 39.2 | 19% | 0.186 | 24% | 0.239 | C | C | . | . | trans | -82.1 | 160.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | N203 E204 V205 | G201-N203 VanDerWaalsContact C-N 3.31Å; G201-N203 PolarHBondContact O-N 3.48Å; G201-N203 VanDerWaalsContact O-N 3.07Å; G201-E204 PolarHBondContact O-N 2.7Å; G201-V205 PolarHBondContact O-N 3.41Å | ||
| 202 | A | 68.9 | Low | 79.4 | Confident | 78 Ų | 78 | 39.2 Ų | 39.2 | 65% | 0.645 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -42.2 | -50.8 | -168.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | E204 V205 | A202-E204 PolarHBondContact O-N 3.49Å; A202-V205 PolarHBondContact O-N 2.87Å |
| 203 | N | 72.3 | Confident | 79.2 | Confident | 161 Ų | 161 | 41.4 Ų | 41.4 | 86% | 0.861 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -62 | -11.8 | -176.6 | -56.8 | 12.8 | 0 | 0 | 0 | 114.7 | G201 | G201-N203 VanDerWaalsContact C-N 3.31Å; G201-N203 PolarHBondContact O-N 3.48Å; G201-N203 VanDerWaalsContact O-N 3.07Å |
| 204 | E | 78.1 | Confident | 79.7 | Confident | 64 Ų | 64 | 42.5 Ų | 42.5 | 30% | 0.299 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -122.4 | -2.1 | -177.1 | -60.7 | 176.1 | 108.7 | 0 | 0 | 113 | R78 F200 G201 A202 T207 A208 | R78-E204 IonicContact CZ-OE1 3.97Å; R78-E204 IonicContact CZ-OE2 2.87Å; R78-E204 IonicContact NH1-OE1 2.68Å; R78-E204 IonicContact NH1-OE2 2.77Å; R78-E204 PolarHBondContact NH1-OE2 3.24Å; R78-E204 IonicContact NH2-OE1 3.47Å; R78-E204 PolarHBondContact NH2-OE1 2.92Å; R78-E204 IonicContact NH2-OE2 3.27Å; R78-E204 PolarHBondContact NH2-OE2 2.88Å; F200-E204 HydrophobicContact CB-CB 4.27Å; F200-E204 HydrophobicContact CD1-CB 4.05Å; G201-E204 PolarHBondContact O-N 2.7Å; A202-E204 PolarHBondContact O-N 3.49Å; E204-T207 PolarHBondContact O-N 3.37Å; E204-A208 WeakPolarHBondContact O-CB 3.44Å; E204-A208 PolarHBondContact O-N 3.26Å |
| 205 | V | 76.1 | Confident | 80.4 | Confident | 35 Ų | 35 | 38.7 Ų | 38.7 | 21% | 0.212 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.1 | -48.4 | 179.8 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | A196 F200 G201 A202 T207 A208 C209 | A196-V205 HydrophobicContact CB-CB 4.45Å; A196-V205 HydrophobicContact CB-CG1 3.77Å; A196-V205 WeakPolarHBondContact CB-O 3.39Å; F200-V205 HydrophobicContact CB-CG2 4.49Å; G201-V205 PolarHBondContact O-N 3.41Å; A202-V205 PolarHBondContact O-N 2.87Å; V205-T207 PolarHBondContact O-N 3.32Å; V205-A208 PolarHBondContact O-N 3.49Å; V205-C209 WeakPolarHBondContact O-CB 3.19Å; V205-C209 PolarHBondContact O-N 2.95Å |
| 206 | S | 75.5 | Confident | 80.9 | Confident | 71 Ų | 71 | 39.4 Ų | 39.4 | 50% | 0.497 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -59.4 | -47.2 | 178.8 | 174.8 | 0 | 0 | 0 | 0 | 111.9 | A208 C209 S210 | S206-A208 PolarHBondContact O-N 3.49Å; S206-C209 PolarHBondContact O-N 2.84Å; S206-S210 WeakPolarHBondContact O-CB 3.32Å; S206-S210 PolarHBondContact O-N 2.9Å; S206-S210 PolarHBondContact O-OG 3.27Å |
| 207 | T | 81.3 | Confident | 81.4 | Confident | 74 Ų | 74 | 40.3 Ų | 40.3 | 45% | 0.454 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -62.8 | -44 | 178.1 | -44 | 0 | 0 | 0 | 0 | 112.2 | W79 E204 V205 S210 V211 | W79-T207 HydrophobicContact CH2-CG2 4.22Å; E204-T207 PolarHBondContact O-N 3.37Å; V205-T207 PolarHBondContact O-N 3.32Å; T207-S210 PolarHBondContact O-N 3.38Å; T207-V211 WeakPolarHBondContact O-CG2 3.47Å; T207-V211 PolarHBondContact O-N 2.91Å |
| 208 | A | 83.4 | Confident | 82.4 | Confident | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.008 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.4 | -40.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | V82 A196 F200 E204 V205 S206 A212 | V82-A208 HydrophobicContact CG2-CB 4.36Å; A196-A208 HydrophobicContact CB-CB 4.03Å; F200-A208 HydrophobicContact CB-CB 4.47Å; F200-A208 HydrophobicContact CD1-CB 3.8Å; F200-A208 HydrophobicContact CD2-CB 3.6Å; F200-A208 HydrophobicContact CE1-CB 3.84Å; F200-A208 HydrophobicContact CE2-CB 3.69Å; F200-A208 HydrophobicContact CG-CB 3.68Å; F200-A208 HydrophobicContact CZ-CB 3.8Å; E204-A208 WeakPolarHBondContact O-CB 3.44Å; E204-A208 PolarHBondContact O-N 3.26Å; V205-A208 PolarHBondContact O-N 3.49Å; S206-A208 PolarHBondContact O-N 3.49Å; A208-A212 WeakPolarHBondContact O-CB 3.44Å; A208-A212 PolarHBondContact O-N 3.02Å; A208-A212 VanDerWaalsContact O-N 3.14Å |
| 209 | C | 83.5 | Confident | 83.4 | Confident | 33 Ų | 33 | 41.9 Ų | 41.9 | 22% | 0.223 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.1 | -45 | 175.6 | -167.2 | 0 | 0 | 0 | 0 | 111.3 | A196 V205 S206 V211 A212 V213 | A196-C209 HydrophobicContact CB-CB 4.09Å; V205-C209 WeakPolarHBondContact O-CB 3.19Å; V205-C209 PolarHBondContact O-N 2.95Å; S206-C209 PolarHBondContact O-N 2.84Å; C209-V211 PolarHBondContact O-N 3.5Å; C209-A212 WeakPolarHBondContact O-CB 3.49Å; C209-A212 PolarHBondContact O-N 2.92Å; C209-A212 VanDerWaalsContact O-N 3.16Å; C209-V213 WeakPolarHBondContact O-CG2 3.36Å; C209-V213 PolarHBondContact O-N 3.29Å |
| 210 | S | 83.2 | Confident | 84.3 | Confident | 45 Ų | 45 | 41.5 Ų | 41.5 | 32% | 0.315 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 178.1 | -59.8 | 0 | 0 | 0 | 0 | 112.4 | S206 T207 A212 V213 F214 | S206-S210 WeakPolarHBondContact O-CB 3.32Å; S206-S210 PolarHBondContact O-N 2.9Å; S206-S210 PolarHBondContact O-OG 3.27Å; T207-S210 PolarHBondContact O-N 3.38Å; S210-A212 VanDerWaalsContact C-N 3.32Å; S210-A212 PolarHBondContact O-N 3.42Å; S210-V213 PolarHBondContact O-N 2.97Å; S210-F214 WeakPolarHBondContact O-CB 3.23Å; S210-F214 WeakPolarHBondContact O-CD2 3.21Å; S210-F214 VanDerWaalsContact O-CG 3.24Å; S210-F214 WeakPolarHBondContact O-CG 3.19Å; S210-F214 PolarHBondContact O-N 2.98Å |
| 211 | V | 87.4 | Confident | 85 | Confident | 60 Ų | 60 | 41.6 Ų | 41.6 | 36% | 0.364 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -64 | -37.4 | 176.1 | 174.3 | 0 | 0 | 0 | 0 | 111.7 | V82 S86 T207 C209 G215 | V82-V211 HydrophobicContact CG1-CB 4.02Å; V82-V211 HydrophobicContact CG1-CG1 3.74Å; S86-V211 PolarHBondContact OG-O 3.22Å; T207-V211 WeakPolarHBondContact O-CG2 3.47Å; T207-V211 PolarHBondContact O-N 2.91Å; C209-V211 PolarHBondContact O-N 3.5Å; V211-G215 PolarHBondContact O-N 2.91Å |
| 212 | A | 88.4 | Confident | 86.1 | Confident | 1 Ų | 1 | 43.4 Ų | 43.4 | 1% | 0.008 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.4 | -44.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V82 F85 S86 P192 A208 C209 S210 G215 | V82-A212 HydrophobicContact CG1-CB 4.46Å; F85-A212 HydrophobicContact CD1-CB 3.53Å; F85-A212 HydrophobicContact CE1-CB 3.68Å; F85-A212 WeakPolarHBondContact CE1-O 3.39Å; S86-A212 WeakPolarHBondContact OG-CA 3.3Å; P192-A212 HydrophobicContact CB-CB 3.76Å; P192-A212 HydrophobicContact CG-CB 4.24Å; A208-A212 WeakPolarHBondContact O-CB 3.44Å; A208-A212 PolarHBondContact O-N 3.02Å; A208-A212 VanDerWaalsContact O-N 3.14Å; C209-A212 WeakPolarHBondContact O-CB 3.49Å; C209-A212 PolarHBondContact O-N 2.92Å; C209-A212 VanDerWaalsContact O-N 3.16Å; S210-A212 VanDerWaalsContact C-N 3.32Å; S210-A212 PolarHBondContact O-N 3.42Å; A212-G215 PolarHBondContact O-N 3.23Å |
| 213 | V | 84.9 | Confident | 87.4 | Confident | 56 Ų | 56 | 39.7 Ų | 39.7 | 34% | 0.339 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -69 | -43.5 | 177.4 | 172.9 | 0 | 0 | 0 | 0 | 111.9 | P192 C209 S210 G215 N216 Q217 | P192-V213 HydrophobicContact CB-CG2 3.9Å; P192-V213 HydrophobicContact CG-CG2 4.08Å; C209-V213 WeakPolarHBondContact O-CG2 3.36Å; C209-V213 PolarHBondContact O-N 3.29Å; S210-V213 PolarHBondContact O-N 2.97Å; V213-G215 PolarHBondContact O-N 3.49Å; V213-N216 VanDerWaalsContact O-CB 3.27Å; V213-N216 WeakPolarHBondContact O-CB 3.44Å; V213-N216 PolarHBondContact O-N 2.92Å; V213-Q217 PolarHBondContact O-N 2.96Å |
| 214 | F | 87.6 | Confident | 88.6 | Confident | 57 Ų | 57 | 32.2 Ų | 32.2 | 25% | 0.25 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -64 | -22.8 | 178.1 | -69.5 | -32.7 | 0 | 0 | 0 | 113.7 | S210 N216 Q217 L218 M352 A355 V356 | S210-F214 WeakPolarHBondContact O-CB 3.23Å; S210-F214 WeakPolarHBondContact O-CD2 3.21Å; S210-F214 VanDerWaalsContact O-CG 3.24Å; S210-F214 WeakPolarHBondContact O-CG 3.19Å; S210-F214 PolarHBondContact O-N 2.98Å; F214-N216 VanDerWaalsContact C-N 3.27Å; F214-N216 PolarHBondContact O-N 2.93Å; F214-Q217 PolarHBondContact O-N 2.95Å; F214-L218 WeakPolarHBondContact O-CB 3.4Å; F214-L218 PolarHBondContact O-N 2.92Å; F214-M352 HydrophobicContact CB-CE 3.91Å; F214-M352 HydrophobicContact CD1-CE 4.18Å; F214-M352 HydrophobicContact CD1-CG 4.47Å; F214-M352 HydrophobicContact CG-CE 4.13Å; F214-A355 HydrophobicContact CE1-CB 4.09Å; F214-A355 HydrophobicContact CZ-CB 4.5Å; F214-V356 HydrophobicContact CE1-CG2 4.49Å; F214-V356 HydrophobicContact CE2-CG2 3.76Å; F214-V356 HydrophobicContact CZ-CG2 3.49Å; F214-V356 VanDerWaalsContact CZ-CG2 3.49Å |
| 215 | G | 92.1 | Very high | 89.4 | Confident | 5 Ų | 5 | 31.9 Ų | 31.9 | 5% | 0.052 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -58 | -39.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | M90 V211 A212 V213 G219 | M90-G215 WeakPolarHBondContact CA-O 3.22Å; M90-G215 WeakPolarHBondContact CB-O 3.41Å; M90-G215 PolarHBondContact N-O 2.72Å; V211-G215 PolarHBondContact O-N 2.91Å; A212-G215 PolarHBondContact O-N 3.23Å; V213-G215 PolarHBondContact O-N 3.49Å; G215-G219 PolarHBondContact O-N 3.36Å |
| 216 | N | 93.3 | Very high | 90.3 | Very high | 15 Ų | 15 | 32.3 Ų | 32.3 | 8% | 0.08 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -65.9 | -50.7 | 176.8 | -158.1 | -92.8 | 0 | 0 | 0 | 111.1 | S89 A93 V213 F214 L218 G219 I220 | S89-N216 WeakPolarHBondContact OG-CB 3.45Å; S89-N216 PolarHBondContact OG-ND2 3.45Å; A93-N216 VanDerWaalsContact CB-O 3.31Å; A93-N216 WeakPolarHBondContact CB-O 3.48Å; V213-N216 VanDerWaalsContact O-CB 3.27Å; V213-N216 WeakPolarHBondContact O-CB 3.44Å; V213-N216 PolarHBondContact O-N 2.92Å; F214-N216 VanDerWaalsContact C-N 3.27Å; F214-N216 PolarHBondContact O-N 2.93Å; N216-L218 VanDerWaalsContact C-N 3.33Å; N216-L218 PolarHBondContact O-N 2.92Å; N216-G219 WeakPolarHBondContact O-CA 3.4Å; N216-G219 PolarHBondContact O-N 3.25Å; N216-I220 PolarHBondContact O-N 3.15Å; N216-I220 VanDerWaalsContact O-N 3.12Å |
| 217 | Q | 92.8 | Very high | 91.3 | Very high | 20 Ų | 20 | 28.9 Ų | 28.9 | 9% | 0.093 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.5 | -42 | 178 | -62.9 | -57.8 | 103.3 | 0 | 0 | 112.2 | V213 F214 G219 I220 A221 V348 M352 | V213-Q217 PolarHBondContact O-N 2.96Å; F214-Q217 PolarHBondContact O-N 2.95Å; Q217-G219 PolarHBondContact O-N 3.05Å; Q217-I220 WeakPolarHBondContact O-CB 3.38Å; Q217-I220 PolarHBondContact O-N 2.97Å; Q217-A221 PolarHBondContact O-N 2.67Å; Q217-V348 HydrophobicContact CB-CG1 4.33Å; Q217-V348 VanDerWaalsContact O-CG1 3.25Å; Q217-V348 WeakPolarHBondContact O-CG1 3.41Å; Q217-M352 HydrophobicContact CB-CE 4.42Å; Q217-M352 HydrophobicContact CB-CG 3.76Å; Q217-M352 HydrophobicContact CB-SD 3.68Å; Q217-M352 HydrophobicContact CG-CG 4.32Å |
| 218 | L | 94.6 | Very high | 91.9 | Very high | 76 Ų | 76 | 25.6 Ų | 25.6 | 40% | 0.398 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -61.5 | -32.8 | 175 | -175.3 | 59.3 | 0 | 0 | 0 | 111.9 | M90 F214 N216 A221 I222 | M90-L218 HydrophobicContact SD-CD2 3.91Å; M90-L218 HydrophobicContact SD-CG 4.03Å; F214-L218 WeakPolarHBondContact O-CB 3.4Å; F214-L218 PolarHBondContact O-N 2.92Å; N216-L218 VanDerWaalsContact C-N 3.33Å; N216-L218 PolarHBondContact O-N 2.92Å; L218-A221 PolarHBondContact O-N 3.4Å; L218-I222 HydrophobicContact CD1-CD1 4.11Å; L218-I222 HydrophobicContact CD1-CG1 4.3Å; L218-I222 HydrophobicContact CG-CD1 3.89Å; L218-I222 HydrophobicContact CG-CG1 4.49Å; L218-I222 VanDerWaalsContact O-CG1 3.23Å; L218-I222 WeakPolarHBondContact O-CG1 3.46Å; L218-I222 PolarHBondContact O-N 2.86Å |
| 219 | G | 96.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -66.3 | -41.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | M90 F94 G215 N216 Q217 G223 | M90-G219 VanDerWaalsContact CG-CA 3.5Å; M90-G219 VanDerWaalsContact O-CA 3.28Å; M90-G219 WeakPolarHBondContact O-CA 3.48Å; F94-G219 WeakPolarHBondContact CA-O 3.39Å; G215-G219 PolarHBondContact O-N 3.36Å; N216-G219 WeakPolarHBondContact O-CA 3.4Å; N216-G219 PolarHBondContact O-N 3.25Å; Q217-G219 PolarHBondContact O-N 3.05Å; G219-G223 PolarHBondContact O-N 2.93Å |
| 220 | I | 95.8 | Very high | 92.9 | Very high | 2 Ų | 2 | 30.6 Ų | 30.6 | 1% | 0.01 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.6 | -47.6 | 172.8 | -56.5 | 173.3 | 0 | 0 | 0 | 109.9 | A93 W96 I97 N216 Q217 I222 G223 F224 V348 | A93-I220 HydrophobicContact CB-CG1 4.03Å; W96-I220 HydrophobicContact CE3-CD1 4.43Å; W96-I220 HydrophobicContact CE3-CG1 4.27Å; W96-I220 HydrophobicContact CZ3-CD1 3.84Å; W96-I220 HydrophobicContact CZ3-CG1 4.1Å; I97-I220 HydrophobicContact CG1-CG2 4.07Å; N216-I220 PolarHBondContact O-N 3.15Å; N216-I220 VanDerWaalsContact O-N 3.12Å; Q217-I220 WeakPolarHBondContact O-CB 3.38Å; Q217-I220 PolarHBondContact O-N 2.97Å; I220-I222 PolarHBondContact O-N 3.38Å; I220-G223 CarbonylContact O-C 3.56Å; I220-G223 WeakPolarHBondContact O-CA 3.41Å; I220-G223 PolarHBondContact O-N 3.36Å; I220-F224 HydrophobicContact CG2-CD2 3.98Å; I220-F224 HydrophobicContact CG2-CE2 3.63Å; I220-F224 WeakPolarHBondContact O-CD2 3.41Å; I220-F224 PolarHBondContact O-N 3.07Å; I220-V348 HydrophobicContact CB-CG1 4.44Å; I220-V348 HydrophobicContact CB-CG2 4.37Å; I220-V348 HydrophobicContact CG2-CG2 3.67Å |
| 221 | A | 96.1 | Very high | 93.4 | Very high | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.008 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58 | -48.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q217 L218 G223 F224 L225 L345 V348 | Q217-A221 PolarHBondContact O-N 2.67Å; L218-A221 PolarHBondContact O-N 3.4Å; A221-G223 VanDerWaalsContact C-N 3.31Å; A221-G223 PolarHBondContact O-N 2.99Å; A221-F224 PolarHBondContact O-N 2.85Å; A221-L225 PolarHBondContact O-N 3.2Å; A221-L345 HydrophobicContact CB-CD1 3.75Å; A221-L345 WeakPolarHBondContact O-CD1 3.39Å; A221-V348 HydrophobicContact CB-CB 4.08Å; A221-V348 HydrophobicContact CB-CG1 3.72Å |
| 222 | I | 96.6 | Very high | 93.6 | Very high | 57 Ų | 57 | 27.9 Ų | 27.9 | 29% | 0.292 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -67.1 | -35.6 | 176.7 | -63 | 167.4 | 0 | 0 | 0 | 110.4 | M90 F94 L218 I220 F224 L225 V226 | M90-I222 HydrophobicContact CG-CD1 4.29Å; M90-I222 HydrophobicContact SD-CD1 3.79Å; F94-I222 HydrophobicContact CD2-CB 4.25Å; F94-I222 HydrophobicContact CD2-CG2 3.81Å; F94-I222 HydrophobicContact CE2-CG2 3.89Å; L218-I222 HydrophobicContact CD1-CD1 4.11Å; L218-I222 HydrophobicContact CD1-CG1 4.3Å; L218-I222 HydrophobicContact CG-CD1 3.89Å; L218-I222 HydrophobicContact CG-CG1 4.49Å; L218-I222 VanDerWaalsContact O-CG1 3.23Å; L218-I222 WeakPolarHBondContact O-CG1 3.46Å; L218-I222 PolarHBondContact O-N 2.86Å; I220-I222 PolarHBondContact O-N 3.38Å; I222-F224 VanDerWaalsContact C-N 3.29Å; I222-F224 PolarHBondContact O-N 3.33Å; I222-L225 PolarHBondContact O-N 2.88Å; I222-V226 HydrophobicContact CG2-CB 4.42Å; I222-V226 HydrophobicContact CG2-CG2 3.64Å; I222-V226 WeakPolarHBondContact O-CB 3.24Å; I222-V226 PolarHBondContact O-N 3.45Å |
| 223 | G | 96.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.3 | -27.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | F94 S101 G219 I220 A221 P227 | F94-G223 VanDerWaalsContact CD2-CA 3.47Å; S101-G223 WeakPolarHBondContact CB-O 3.33Å; S101-G223 PolarHBondContact OG-O 2.88Å; G219-G223 PolarHBondContact O-N 2.93Å; I220-G223 CarbonylContact O-C 3.56Å; I220-G223 WeakPolarHBondContact O-CA 3.41Å; I220-G223 PolarHBondContact O-N 3.36Å; A221-G223 VanDerWaalsContact C-N 3.31Å; A221-G223 PolarHBondContact O-N 2.99Å; G223-P227 WeakPolarHBondContact O-CD 3.31Å; G223-P227 VanDerWaalsContact O-CG 3.28Å; G223-P227 WeakPolarHBondContact O-CG 3.46Å |
| 224 | F | 96.2 | Very high | 93.9 | Very high | 3 Ų | 3 | 31 Ų | 31 | 1% | 0.013 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -79.6 | -37.5 | 169.7 | -78.8 | -61.2 | 0 | 0 | 0 | 113.3 | I97 I220 A221 I222 P228 S322 L325 G341 V348 | I97-F224 HydrophobicContact CD1-CZ 4.47Å; I97-F224 HydrophobicContact CG2-CD1 3.75Å; I97-F224 HydrophobicContact CG2-CD2 4.28Å; I97-F224 HydrophobicContact CG2-CE1 3.71Å; I97-F224 HydrophobicContact CG2-CE2 4.27Å; I97-F224 HydrophobicContact CG2-CG 4.03Å; I97-F224 HydrophobicContact CG2-CZ 3.98Å; I220-F224 HydrophobicContact CG2-CD2 3.98Å; I220-F224 HydrophobicContact CG2-CE2 3.63Å; I220-F224 WeakPolarHBondContact O-CD2 3.41Å; I220-F224 PolarHBondContact O-N 3.07Å; A221-F224 PolarHBondContact O-N 2.85Å; I222-F224 VanDerWaalsContact C-N 3.29Å; I222-F224 PolarHBondContact O-N 3.33Å; F224-P228 VanDerWaalsContact O-CD 3.29Å; F224-P228 WeakPolarHBondContact O-CD 3.46Å; F224-P228 WeakPolarHBondContact O-CG 3.36Å; F224-S322 WeakPolarHBondContact CE1-O 3.43Å; F224-S322 WeakPolarHBondContact CZ-O 3.44Å; F224-L325 HydrophobicContact CD1-CD2 4.33Å; F224-L325 HydrophobicContact CE1-CB 4.33Å; F224-L325 HydrophobicContact CE1-CD2 3.91Å; F224-L325 HydrophobicContact CZ-CD2 4.23Å; F224-G341 WeakPolarHBondContact CB-O 3.39Å; F224-G341 WeakPolarHBondContact O-CA 3.48Å; F224-V348 HydrophobicContact CD2-CG2 4.07Å; F224-V348 HydrophobicContact CE2-CG2 3.97Å |
| 225 | L | 94.8 | Very high | 93.9 | Very high | 57 Ų | 57 | 37 Ų | 37 | 30% | 0.298 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -80.5 | -45.7 | -173.5 | 178.1 | 63.4 | 0 | 0 | 0 | 113.9 | A221 I222 V229 R342 L345 | A221-L225 PolarHBondContact O-N 3.2Å; I222-L225 PolarHBondContact O-N 2.88Å; L225-V229 HydrophobicContact CD1-CG2 4.47Å; L225-V229 VanDerWaalsContact O-CG2 3.3Å; L225-V229 WeakPolarHBondContact O-CG2 3.26Å; L225-R342 HydrophobicContact CD1-CG 4.11Å; L225-L345 HydrophobicContact CB-CD1 4.42Å; L225-L345 HydrophobicContact CB-CD2 4.31Å; L225-L345 HydrophobicContact CD1-CD2 4.19Å; L225-L345 HydrophobicContact CD2-CD2 4Å; L225-L345 HydrophobicContact CG-CD2 4.38Å |
| 226 | V | 96.1 | Very high | 93.9 | Very high | 44 Ų | 44 | 39.6 Ų | 39.6 | 27% | 0.267 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -79.2 | -42.2 | -164.7 | 172.6 | 0 | 0 | 0 | 0 | 113.7 | F94 I222 V229 L230 | F94-V226 HydrophobicContact CE2-CB 4Å; F94-V226 HydrophobicContact CE2-CG1 4.38Å; F94-V226 HydrophobicContact CZ-CB 4.36Å; F94-V226 HydrophobicContact CZ-CG1 4.39Å; I222-V226 HydrophobicContact CG2-CB 4.42Å; I222-V226 HydrophobicContact CG2-CG2 3.64Å; I222-V226 WeakPolarHBondContact O-CB 3.24Å; I222-V226 PolarHBondContact O-N 3.45Å; V226-V229 PolarHBondContact O-N 3.35Å; V226-L230 HydrophobicContact CG1-CD1 3.47Å; V226-L230 VanDerWaalsContact CG1-CD1 3.47Å; V226-L230 HydrophobicContact CG1-CG 3.78Å; V226-L230 PolarHBondContact O-N 3.14Å |
| 227 | P | 96.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59 | -45.6 | 179.8 | -23 | 34 | 0 | 0 | 0 | 114 | F94 Q98 I102 G223 V229 L230 V231 M247 | F94-P227 HydrophobicContact CE1-CG 4.48Å; F94-P227 HydrophobicContact CE2-CG 4.41Å; F94-P227 HydrophobicContact CZ-CG 3.82Å; Q98-P227 HydrophobicContact CB-CG 4.09Å; I102-P227 HydrophobicContact CD1-CB 3.68Å; I102-P227 HydrophobicContact CG1-CB 3.92Å; I102-P227 HydrophobicContact CG2-CB 4.27Å; G223-P227 WeakPolarHBondContact O-CD 3.31Å; G223-P227 VanDerWaalsContact O-CG 3.28Å; G223-P227 WeakPolarHBondContact O-CG 3.46Å; P227-V229 PolarHBondContact O-N 2.84Å; P227-L230 PolarHBondContact O-N 3.16Å; P227-V231 WeakPolarHBondContact O-CA 3.46Å; P227-V231 WeakPolarHBondContact O-CB 3.4Å; P227-V231 PolarHBondContact O-N 3.45Å; P227-M247 HydrophobicContact CB-SD 3.66Å; P227-M247 HydrophobicContact CG-SD 3.91Å |
| 228 | P | 94.4 | Very high | 93.6 | Very high | 4 Ų | 4 | 49.2 Ų | 49.2 | 3% | 0.026 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.2 | -22.8 | 173.9 | -22.4 | 32.9 | 0 | 0 | 0 | 114.9 | I102 F224 E337 V338 | I102-P228 HydrophobicContact CG2-CB 4Å; I102-P228 HydrophobicContact CG2-CG 3.64Å; F224-P228 VanDerWaalsContact O-CD 3.29Å; F224-P228 WeakPolarHBondContact O-CD 3.46Å; F224-P228 WeakPolarHBondContact O-CG 3.36Å; P228-E337 HydrophobicContact CB-CB 4.45Å; P228-E337 WeakPolarHBondContact CB-O 3.49Å; P228-V338 HydrophobicContact CB-CG2 4.34Å |
| 229 | V | 93.9 | Very high | 93.4 | Very high | 89 Ų | 89 | 51.4 Ų | 51.4 | 54% | 0.539 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -90.4 | -34.1 | -178.9 | 172.9 | 0 | 0 | 0 | 0 | 112 | L225 V226 P227 V338 | L225-V229 HydrophobicContact CD1-CG2 4.47Å; L225-V229 VanDerWaalsContact O-CG2 3.3Å; L225-V229 WeakPolarHBondContact O-CG2 3.26Å; V226-V229 PolarHBondContact O-N 3.35Å; P227-V229 PolarHBondContact O-N 2.84Å; V229-V338 HydrophobicContact CG2-CG1 4.15Å |
| 230 | L | 93.6 | Very high | 93.3 | Very high | 50 Ų | 50 | 51.4 Ų | 51.4 | 26% | 0.262 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -83.9 | -30.1 | 175.8 | -68.7 | -176.3 | 0 | 0 | 0 | 113.3 | V226 P227 P232 H243 M247 I250 | V226-L230 HydrophobicContact CG1-CD1 3.47Å; V226-L230 VanDerWaalsContact CG1-CD1 3.47Å; V226-L230 HydrophobicContact CG1-CG 3.78Å; V226-L230 PolarHBondContact O-N 3.14Å; P227-L230 PolarHBondContact O-N 3.16Å; L230-P232 WeakPolarHBondContact O-CD 3.44Å; L230-H243 PolarHBondContact O-ND1 3.13Å; L230-M247 HydrophobicContact CD1-CB 4.17Å; L230-M247 HydrophobicContact CD1-CG 4.21Å; L230-I250 HydrophobicContact CD1-CD1 4.04Å |
| 231 | V | 94.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 27% | 0.269 | C | S | . | . | S | Bend | trans | -118.4 | 83 | -174.8 | -167.1 | 0 | 0 | 0 | 0 | 109.2 | I102 I105 P227 L240 H243 I244 M247 | I102-V231 HydrophobicContact CD1-CB 3.84Å; I102-V231 HydrophobicContact CD1-CG1 4.16Å; I102-V231 HydrophobicContact CD1-CG2 4.09Å; I105-V231 WeakPolarHBondContact CD1-O 3.22Å; I105-V231 HydrophobicContact CG2-CG1 3.98Å; P227-V231 WeakPolarHBondContact O-CA 3.46Å; P227-V231 WeakPolarHBondContact O-CB 3.4Å; P227-V231 PolarHBondContact O-N 3.45Å; V231-L240 HydrophobicContact CG1-CD1 3.43Å; V231-L240 VanDerWaalsContact CG1-CD1 3.43Å; V231-H243 HydrophobicContact CG1-CB 4.26Å; V231-I244 HydrophobicContact CG1-CG1 3.81Å; V231-I244 HydrophobicContact CG2-CG1 4.4Å; V231-M247 HydrophobicContact CG2-CB 4.28Å; V231-M247 HydrophobicContact CG2-CE 4.18Å; V231-M247 HydrophobicContact CG2-SD 4Å |
| 232 | P | 90.3 | Very high | 93 | Very high | 48 Ų | 48 | 59 Ų | 59 | 31% | 0.312 | 30% | 0.296 | S | S | . | . | trans | -66.3 | 149.2 | 175 | 29.4 | -34.8 | 0 | 0 | 0 | 110.8 | L230 V234 H243 | L230-P232 WeakPolarHBondContact O-CD 3.44Å; P232-V234 HydrophobicContact CB-CG1 4.43Å; P232-V234 HydrophobicContact CG-CG1 4.28Å; P232-V234 PolarHBondContact O-N 3.37Å; P232-H243 WeakPolarHBondContact CD-ND1 3.26Å | ||
| 233 | N | 89.1 | Confident | 93 | Very high | 84 Ų | 84 | 59 Ų | 59 | 45% | 0.449 | 29% | 0.294 | S | S | . | . | trans | -70.8 | 110.6 | 174.3 | -167.6 | -3.4 | 0 | 0 | 0 | 109.7 | I105 E337 | I105-N233 HydrophobicContact CD1-CB 3.86Å; I105-N233 HydrophobicContact CG1-CB 3.92Å; N233-E337 PolarHBondContact ND2-OE1 3.24Å | ||
| 234 | V | 91.3 | Very high | 92.9 | Very high | 40 Ų | 40 | 59 Ų | 59 | 24% | 0.242 | 29% | 0.294 | C | S | . | . | trans | -134.1 | 141.2 | -179.4 | -63 | 0 | 0 | 0 | 0 | 110.7 | P232 D236 K239 L240 | P232-V234 HydrophobicContact CB-CG1 4.43Å; P232-V234 HydrophobicContact CG-CG1 4.28Å; P232-V234 PolarHBondContact O-N 3.37Å; V234-D236 VanDerWaalsContact C-N 3.31Å; V234-D236 PolarHBondContact O-N 3.47Å; V234-K239 HydrophobicContact CG2-CB 4.29Å; V234-L240 HydrophobicContact CG2-CB 3.93Å; V234-L240 HydrophobicContact CG2-CD1 4.45Å | ||
| 235 | E | 87.6 | Confident | 92.8 | Very high | 182 Ų | 182 | 59.7 Ų | 59.7 | 85% | 0.85 | 30% | 0.3 | S | S | * | . | S | Bend | trans | -68.1 | -31.7 | 179.6 | -59.2 | -178.3 | 161.7 | 0 | 0 | 112.5 | H108 R237 | H108-E235 PolarHBondContact CE1-O 3.09Å; E235-R237 PolarHBondContact O-N 3.46Å |
| 236 | D | 91.8 | Very high | 92.9 | Very high | 60 Ų | 60 | 59.7 Ų | 59.7 | 32% | 0.321 | 30% | 0.3 | S | S | . | . | trans | -73.1 | 109.9 | 179.6 | -177.1 | -35.5 | 0 | 0 | 0 | 110.9 | V234 D238 K239 L240 | V234-D236 VanDerWaalsContact C-N 3.31Å; V234-D236 PolarHBondContact O-N 3.47Å; D236-D238 VanDerWaalsContact C-N 3.32Å; D236-D238 PolarHBondContact O-N 3.45Å; D236-D238 PolarHBondContact OD1-N 3.26Å; D236-K239 HydrophobicContact CB-CB 4.05Å; D236-K239 HydrophobicContact CB-CD 4.04Å; D236-K239 HydrophobicContact CB-CG 4.07Å; D236-K239 PolarHBondContact O-N 3.07Å; D236-K239 PolarHBondContact OD1-N 3.03Å; D236-K239 WeakPolarHBondContact OD2-CG 3.43Å; D236-K239 IonicContact OD2-NZ 3.19Å; D236-K239 PolarHBondContact OD2-NZ 3.16Å; D236-L240 WeakPolarHBondContact O-CB 3.46Å; D236-L240 PolarHBondContact O-N 3.16Å | ||
| 237 | R | 89.3 | Confident | 92.9 | Very high | 101 Ų | 101 | 57.7 Ų | 57.7 | 38% | 0.381 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -69.5 | -24.6 | -176.9 | -66.7 | -171.3 | 178.7 | -167.5 | 0.7 | 114.2 | H108 E235 A241 | H108-R237 PolarHBondContact NE2-NE 3Å; H108-R237 VanDerWaalsContact O-CZ 3.25Å; H108-R237 PolarHBondContact O-NH2 3.46Å; H108-R237 VanDerWaalsContact O-NH2 3.1Å; E235-R237 PolarHBondContact O-N 3.46Å; R237-A241 WeakPolarHBondContact O-CB 3.43Å; R237-A241 PolarHBondContact O-N 2.69Å |
| 238 | D | 89.9 | Confident | 92.9 | Very high | 136 Ų | 136 | 57.9 Ų | 57.9 | 73% | 0.727 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -80.7 | -38.4 | 178.4 | -68.1 | -36.1 | 0 | 0 | 0 | 110.5 | D236 L240 A241 Y242 | D236-D238 VanDerWaalsContact C-N 3.32Å; D236-D238 PolarHBondContact O-N 3.45Å; D236-D238 PolarHBondContact OD1-N 3.26Å; D238-L240 VanDerWaalsContact C-N 3.32Å; D238-A241 PolarHBondContact O-N 2.99Å; D238-Y242 PolarHBondContact O-N 3.34Å |
| 239 | K | 91.4 | Very high | 93 | Very high | 121 Ų | 121 | 64.3 Ų | 64.3 | 53% | 0.526 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.7 | -42.9 | 165.7 | -68 | -174.9 | -174.6 | 88.8 | 0 | 111 | V234 D236 Y242 H243 | V234-K239 HydrophobicContact CG2-CB 4.29Å; D236-K239 HydrophobicContact CB-CB 4.05Å; D236-K239 HydrophobicContact CB-CD 4.04Å; D236-K239 HydrophobicContact CB-CG 4.07Å; D236-K239 PolarHBondContact O-N 3.07Å; D236-K239 PolarHBondContact OD1-N 3.03Å; D236-K239 WeakPolarHBondContact OD2-CG 3.43Å; D236-K239 IonicContact OD2-NZ 3.19Å; D236-K239 PolarHBondContact OD2-NZ 3.16Å; K239-Y242 WeakPolarHBondContact O-CB 3.33Å; K239-Y242 PolarHBondContact O-N 3.38Å; K239-H243 PolarHBondContact O-CD2 3.35Å; K239-H243 VanDerWaalsContact O-CD2 3.25Å; K239-H243 PolarHBondContact O-N 2.75Å |
| 240 | L | 93.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.5 | -41.9 | 177.7 | -173.9 | 50.2 | 0 | 0 | 0 | 112.1 | I105 F109 V231 V234 D236 D238 Y242 H243 I244 | I105-L240 HydrophobicContact CG2-CD1 3.56Å; I105-L240 HydrophobicContact CG2-CD2 3.97Å; I105-L240 HydrophobicContact CG2-CG 4.34Å; F109-L240 HydrophobicContact CB-CD2 3.86Å; F109-L240 HydrophobicContact CB-CG 4.41Å; F109-L240 HydrophobicContact CD2-CB 4.26Å; F109-L240 HydrophobicContact CD2-CD2 3.98Å; F109-L240 HydrophobicContact CD2-CG 3.88Å; F109-L240 HydrophobicContact CG-CD2 4.34Å; F109-L240 HydrophobicContact CG-CG 4.43Å; V231-L240 HydrophobicContact CG1-CD1 3.43Å; V231-L240 VanDerWaalsContact CG1-CD1 3.43Å; V234-L240 HydrophobicContact CG2-CB 3.93Å; V234-L240 HydrophobicContact CG2-CD1 4.45Å; D236-L240 WeakPolarHBondContact O-CB 3.46Å; D236-L240 PolarHBondContact O-N 3.16Å; D238-L240 VanDerWaalsContact C-N 3.32Å; L240-Y242 VanDerWaalsContact C-N 3.31Å; L240-Y242 PolarHBondContact O-N 2.86Å; L240-H243 PolarHBondContact O-N 3.08Å; L240-I244 HydrophobicContact CD1-CD1 4.04Å; L240-I244 HydrophobicContact CD1-CG1 4.26Å; L240-I244 HydrophobicContact CG-CD1 3.91Å; L240-I244 VanDerWaalsContact O-CG1 3.29Å; L240-I244 WeakPolarHBondContact O-CG1 3.3Å; L240-I244 PolarHBondContact O-N 3.48Å |
| 241 | A | 93.5 | Very high | 93.3 | Very high | 16 Ų | 16 | 62.4 Ų | 62.4 | 13% | 0.132 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -57.8 | -42.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | F109 R237 D238 I244 S245 | F109-A241 HydrophobicContact CE2-CB 3.79Å; F109-A241 HydrophobicContact CZ-CB 3.98Å; R237-A241 WeakPolarHBondContact O-CB 3.43Å; R237-A241 PolarHBondContact O-N 2.69Å; D238-A241 PolarHBondContact O-N 2.99Å; A241-I244 PolarHBondContact O-N 3.17Å; A241-S245 WeakPolarHBondContact O-CB 3.47Å; A241-S245 PolarHBondContact O-N 3.22Å |
| 242 | Y | 94.1 | Very high | 93.4 | Very high | 148 Ų | 148 | 62.4 Ų | 62.4 | 58% | 0.58 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -61.4 | -47.7 | 176.5 | 177.1 | -106.3 | 0 | 0 | 0 | 112.1 | D238 K239 L240 S245 I246 | D238-Y242 PolarHBondContact O-N 3.34Å; K239-Y242 WeakPolarHBondContact O-CB 3.33Å; K239-Y242 PolarHBondContact O-N 3.38Å; L240-Y242 VanDerWaalsContact C-N 3.31Å; L240-Y242 PolarHBondContact O-N 2.86Å; Y242-S245 WeakPolarHBondContact O-CB 3.44Å; Y242-S245 PolarHBondContact O-N 2.98Å; Y242-S245 PolarHBondContact O-OG 3.48Å; Y242-I246 HydrophobicContact CD1-CD1 4.02Å; Y242-I246 HydrophobicContact CE1-CD1 3.54Å; Y242-I246 HydrophobicContact CE2-CD1 4.34Å; Y242-I246 PolarHBondContact O-N 3.47Å; Y242-I246 VanDerWaalsContact O-N 3.08Å |
| 243 | H | 94.7 | Very high | 93.8 | Very high | 55 Ų | 55 | 61.9 Ų | 61.9 | 26% | 0.255 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 176.3 | -80.6 | -80 | 0 | 0 | 0 | 113.1 | L230 V231 P232 K239 L240 S245 I246 M247 | L230-H243 PolarHBondContact O-ND1 3.13Å; V231-H243 HydrophobicContact CG1-CB 4.26Å; P232-H243 WeakPolarHBondContact CD-ND1 3.26Å; K239-H243 PolarHBondContact O-CD2 3.35Å; K239-H243 VanDerWaalsContact O-CD2 3.25Å; K239-H243 PolarHBondContact O-N 2.75Å; L240-H243 PolarHBondContact O-N 3.08Å; H243-S245 VanDerWaalsContact C-N 3.27Å; H243-S245 PolarHBondContact O-N 3.24Å; H243-I246 PolarHBondContact O-N 3Å; H243-M247 PolarHBondContact O-N 3.37Å |
| 244 | I | 95 | Very high | 94.2 | Very high | 0 Ų | 0 | 60.8 Ų | 60.8 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -61.3 | -38.7 | 174.4 | -66.1 | 165.7 | 0 | 0 | 0 | 110.4 | F106 F109 L166 V231 L240 A241 M247 F248 | F106-I244 HydrophobicContact CD1-CD1 4.31Å; F106-I244 HydrophobicContact CE1-CD1 3.82Å; F106-I244 HydrophobicContact CE1-CG1 4.16Å; F106-I244 HydrophobicContact CE1-CG2 4.15Å; F106-I244 HydrophobicContact CZ-CG1 4.47Å; F106-I244 HydrophobicContact CZ-CG2 4.45Å; F109-I244 HydrophobicContact CB-CD1 4.24Å; F109-I244 HydrophobicContact CD1-CD1 3.75Å; F109-I244 HydrophobicContact CD2-CD1 3.94Å; F109-I244 HydrophobicContact CE1-CD1 4.05Å; F109-I244 HydrophobicContact CE2-CD1 4.24Å; F109-I244 HydrophobicContact CG-CD1 3.69Å; F109-I244 HydrophobicContact CZ-CD1 4.28Å; L166-I244 HydrophobicContact CD2-CB 4.26Å; L166-I244 HydrophobicContact CD2-CG2 3.77Å; V231-I244 HydrophobicContact CG1-CG1 3.81Å; V231-I244 HydrophobicContact CG2-CG1 4.4Å; L240-I244 HydrophobicContact CD1-CD1 4.04Å; L240-I244 HydrophobicContact CD1-CG1 4.26Å; L240-I244 HydrophobicContact CG-CD1 3.91Å; L240-I244 VanDerWaalsContact O-CG1 3.29Å; L240-I244 WeakPolarHBondContact O-CG1 3.3Å; L240-I244 PolarHBondContact O-N 3.48Å; A241-I244 PolarHBondContact O-N 3.17Å; I244-M247 PolarHBondContact O-N 3.44Å; I244-F248 HydrophobicContact CG2-CD1 4.38Å; I244-F248 HydrophobicContact CG2-CD2 3.86Å; I244-F248 HydrophobicContact CG2-CE1 4.04Å; I244-F248 HydrophobicContact CG2-CE2 3.46Å; I244-F248 VanDerWaalsContact CG2-CE2 3.46Å; I244-F248 HydrophobicContact CG2-CG 4.31Å; I244-F248 HydrophobicContact CG2-CZ 3.55Å; I244-F248 WeakPolarHBondContact O-CG 3.38Å; I244-F248 PolarHBondContact O-N 2.67Å |
| 245 | S | 95.4 | Very high | 94.5 | Very high | 19 Ų | 19 | 59 Ų | 59 | 13% | 0.133 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -62.4 | -43.9 | 177.9 | 82.9 | 0 | 0 | 0 | 0 | 112.4 | A241 Y242 H243 M247 F248 Y249 | A241-S245 WeakPolarHBondContact O-CB 3.47Å; A241-S245 PolarHBondContact O-N 3.22Å; Y242-S245 WeakPolarHBondContact O-CB 3.44Å; Y242-S245 PolarHBondContact O-N 2.98Å; Y242-S245 PolarHBondContact O-OG 3.48Å; H243-S245 VanDerWaalsContact C-N 3.27Å; H243-S245 PolarHBondContact O-N 3.24Å; S245-M247 VanDerWaalsContact C-N 3.33Å; S245-M247 PolarHBondContact O-N 2.86Å; S245-F248 PolarHBondContact O-N 3.37Å; S245-Y249 WeakPolarHBondContact O-CB 3.42Å; S245-Y249 WeakPolarHBondContact O-CD2 3.35Å; S245-Y249 PolarHBondContact O-N 2.93Å |
| 246 | I | 95.8 | Very high | 95 | Very high | 57 Ų | 57 | 52.3 Ų | 52.3 | 29% | 0.292 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -58.9 | -47.8 | 176.8 | -68.9 | 163.3 | 0 | 0 | 0 | 110 | Y242 H243 F248 Y249 I250 | Y242-I246 HydrophobicContact CD1-CD1 4.02Å; Y242-I246 HydrophobicContact CE1-CD1 3.54Å; Y242-I246 HydrophobicContact CE2-CD1 4.34Å; Y242-I246 PolarHBondContact O-N 3.47Å; Y242-I246 VanDerWaalsContact O-N 3.08Å; H243-I246 PolarHBondContact O-N 3Å; I246-F248 PolarHBondContact O-N 3.34Å; I246-Y249 PolarHBondContact O-N 2.69Å; I246-I250 HydrophobicContact CG2-CD1 3.75Å; I246-I250 VanDerWaalsContact O-CG1 3.28Å; I246-I250 WeakPolarHBondContact O-CG1 3.46Å; I246-I250 PolarHBondContact O-N 3.25Å |
| 247 | M | 96.3 | Very high | 95.3 | Very high | 2 Ų | 2 | 54.4 Ų | 54.4 | 1% | 0.01 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -58.7 | -48.3 | 177.6 | -175.7 | 175.8 | 72.4 | 0 | 0 | 111.4 | I102 F106 P227 L230 V231 H243 I244 S245 I250 I251 | I102-M247 HydrophobicContact CD1-CE 4.49Å; F106-M247 HydrophobicContact CE2-CE 4.48Å; F106-M247 HydrophobicContact CZ-CE 4.07Å; P227-M247 HydrophobicContact CB-SD 3.66Å; P227-M247 HydrophobicContact CG-SD 3.91Å; L230-M247 HydrophobicContact CD1-CB 4.17Å; L230-M247 HydrophobicContact CD1-CG 4.21Å; V231-M247 HydrophobicContact CG2-CB 4.28Å; V231-M247 HydrophobicContact CG2-CE 4.18Å; V231-M247 HydrophobicContact CG2-SD 4Å; H243-M247 PolarHBondContact O-N 3.37Å; I244-M247 PolarHBondContact O-N 3.44Å; S245-M247 VanDerWaalsContact C-N 3.33Å; S245-M247 PolarHBondContact O-N 2.86Å; M247-I250 PolarHBondContact O-N 3.43Å; M247-I251 HydrophobicContact CG-CD1 3.81Å; M247-I251 VanDerWaalsContact O-CD1 3.24Å; M247-I251 WeakPolarHBondContact O-CD1 3.34Å; M247-I251 WeakPolarHBondContact O-CG1 3.3Å; M247-I251 PolarHBondContact O-N 3.09Å; M247-I251 VanDerWaalsContact O-N 3.08Å |
| 248 | F | 96.3 | Very high | 95.6 | Very high | 3 Ų | 3 | 50.2 Ų | 50.2 | 1% | 0.013 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65.5 | -40.7 | 179.2 | -69.4 | -6.5 | 0 | 0 | 0 | 113 | Y99 F106 K162 L163 L166 I244 S245 I246 I250 I251 G252 | Y99-F248 HydrophobicContact CE1-CZ 4.11Å; Y99-F248 WeakPolarHBondContact OH-CZ 3.38Å; F106-F248 HydrophobicContact CE1-CZ 4.39Å; F106-F248 HydrophobicContact CZ-CE1 4.47Å; F106-F248 HydrophobicContact CZ-CZ 4.31Å; K162-F248 HydrophobicContact CB-CD2 4.06Å; K162-F248 HydrophobicContact CB-CE2 4.03Å; K162-F248 HydrophobicContact CB-CG 4.4Å; K162-F248 HydrophobicContact CB-CZ 4.35Å; K162-F248 WeakPolarHBondContact O-CD2 2.89Å; K162-F248 VanDerWaalsContact O-CE2 3.29Å; K162-F248 WeakPolarHBondContact O-CE2 3.3Å; L163-F248 HydrophobicContact CD1-CB 3.83Å; L163-F248 HydrophobicContact CG-CB 3.98Å; L166-F248 HydrophobicContact CD2-CD2 3.86Å; L166-F248 HydrophobicContact CD2-CE2 4.22Å; I244-F248 HydrophobicContact CG2-CD1 4.38Å; I244-F248 HydrophobicContact CG2-CD2 3.86Å; I244-F248 HydrophobicContact CG2-CE1 4.04Å; I244-F248 HydrophobicContact CG2-CE2 3.46Å; I244-F248 VanDerWaalsContact CG2-CE2 3.46Å; I244-F248 HydrophobicContact CG2-CG 4.31Å; I244-F248 HydrophobicContact CG2-CZ 3.55Å; I244-F248 WeakPolarHBondContact O-CG 3.38Å; I244-F248 PolarHBondContact O-N 2.67Å; S245-F248 PolarHBondContact O-N 3.37Å; I246-F248 PolarHBondContact O-N 3.34Å; F248-I250 PolarHBondContact O-N 2.88Å; F248-I251 HydrophobicContact CD1-CD1 4.26Å; F248-I251 PolarHBondContact O-N 2.91Å; F248-G252 PolarHBondContact O-N 2.86Å |
| 249 | Y | 97.1 | Very high | 95.9 | Very high | 139 Ų | 139 | 45.9 Ų | 45.9 | 55% | 0.545 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -60.7 | -41.8 | 174.1 | -87.2 | -67.8 | 0 | 0 | 0 | 112.3 | L163 S245 I246 G252 G253 | L163-Y249 HydrophobicContact CD2-CD1 3.43Å; L163-Y249 VanDerWaalsContact CD2-CD1 3.43Å; L163-Y249 HydrophobicContact CD2-CD2 4.18Å; L163-Y249 HydrophobicContact CD2-CE1 3.34Å; L163-Y249 HydrophobicContact CD2-CE2 4.1Å; L163-Y249 HydrophobicContact CD2-CG 3.85Å; S245-Y249 WeakPolarHBondContact O-CB 3.42Å; S245-Y249 WeakPolarHBondContact O-CD2 3.35Å; S245-Y249 PolarHBondContact O-N 2.93Å; I246-Y249 PolarHBondContact O-N 2.69Å; Y249-G252 PolarHBondContact O-N 3.26Å; Y249-G253 PolarHBondContact O-N 3.27Å |
| 250 | I | 96.8 | Very high | 96.2 | Very high | 86 Ų | 86 | 44.4 Ų | 44.4 | 44% | 0.441 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.6 | -47.4 | 175.3 | -70 | 164.6 | 0 | 0 | 0 | 110.4 | L230 I246 M247 F248 G253 V254 | L230-I250 HydrophobicContact CD1-CD1 4.04Å; I246-I250 HydrophobicContact CG2-CD1 3.75Å; I246-I250 VanDerWaalsContact O-CG1 3.28Å; I246-I250 WeakPolarHBondContact O-CG1 3.46Å; I246-I250 PolarHBondContact O-N 3.25Å; M247-I250 PolarHBondContact O-N 3.43Å; F248-I250 PolarHBondContact O-N 2.88Å; I250-G253 PolarHBondContact O-N 3.49Å; I250-V254 HydrophobicContact CG2-CG2 4.46Å; I250-V254 WeakPolarHBondContact O-CB 3.43Å; I250-V254 VanDerWaalsContact O-CG2 3.3Å; I250-V254 WeakPolarHBondContact O-CG2 3.45Å; I250-V254 PolarHBondContact O-N 3.13Å |
| 251 | I | 96.3 | Very high | 96.3 | Very high | 13 Ų | 13 | 47.3 Ų | 47.3 | 7% | 0.067 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65 | -44.5 | -179.5 | -61.3 | 154.5 | 0 | 0 | 0 | 111.1 | F94 Q95 Q98 A159 M247 F248 V254 A255 | F94-I251 HydrophobicContact CD1-CD1 4.2Å; F94-I251 HydrophobicContact CD1-CG1 4.27Å; F94-I251 HydrophobicContact CE1-CD1 3.61Å; F94-I251 HydrophobicContact CE1-CG1 3.91Å; Q95-I251 HydrophobicContact CG-CG2 3.69Å; Q98-I251 VanDerWaalsContact OE1-CD1 3.29Å; A159-I251 HydrophobicContact CB-CG2 4Å; M247-I251 HydrophobicContact CG-CD1 3.81Å; M247-I251 VanDerWaalsContact O-CD1 3.24Å; M247-I251 WeakPolarHBondContact O-CD1 3.34Å; M247-I251 WeakPolarHBondContact O-CG1 3.3Å; M247-I251 PolarHBondContact O-N 3.09Å; M247-I251 VanDerWaalsContact O-N 3.08Å; F248-I251 HydrophobicContact CD1-CD1 4.26Å; F248-I251 PolarHBondContact O-N 2.91Å; I251-V254 PolarHBondContact O-N 3.31Å; I251-A255 VanDerWaalsContact O-CB 3.27Å; I251-A255 WeakPolarHBondContact O-CB 3.42Å; I251-A255 PolarHBondContact O-N 3.43Å |
| 252 | G | 97.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.8 | -44 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | F248 Y249 T256 | F248-G252 PolarHBondContact O-N 2.86Å; Y249-G252 PolarHBondContact O-N 3.26Å; G252-T256 WeakPolarHBondContact O-CB 3.4Å; G252-T256 PolarHBondContact O-N 3.19Å; G252-T256 PolarHBondContact O-OG1 2.91Å |
| 253 | G | 97.8 | Very high | 96.1 | Very high | 37 Ų | 37 | 45.7 Ų | 45.7 | 38% | 0.381 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.7 | -48 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y249 I250 T256 L257 | Y249-G253 PolarHBondContact O-N 3.27Å; I250-G253 PolarHBondContact O-N 3.49Å; G253-T256 PolarHBondContact O-N 3.38Å; G253-L257 PolarHBondContact O-N 3.08Å |
| 254 | V | 97.6 | Very high | 95.9 | Very high | 61 Ų | 61 | 48.1 Ų | 48.1 | 37% | 0.37 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -62.5 | -45.7 | 177.5 | 167.7 | 0 | 0 | 0 | 0 | 111.4 | I250 I251 T256 L257 L258 | I250-V254 HydrophobicContact CG2-CG2 4.46Å; I250-V254 WeakPolarHBondContact O-CB 3.43Å; I250-V254 VanDerWaalsContact O-CG2 3.3Å; I250-V254 WeakPolarHBondContact O-CG2 3.45Å; I250-V254 PolarHBondContact O-N 3.13Å; I251-V254 PolarHBondContact O-N 3.31Å; V254-T256 VanDerWaalsContact C-N 3.32Å; V254-T256 PolarHBondContact O-N 3.49Å; V254-L257 PolarHBondContact O-N 2.93Å; V254-L258 HydrophobicContact CG1-CD1 3.64Å; V254-L258 HydrophobicContact CG1-CG 4.44Å; V254-L258 WeakPolarHBondContact O-CB 3.43Å; V254-L258 WeakPolarHBondContact O-CD1 3.42Å; V254-L258 WeakPolarHBondContact O-CG 3.43Å; V254-L258 PolarHBondContact O-N 2.79Å |
| 255 | A | 97.5 | Very high | 95.6 | Very high | 3 Ų | 3 | 49.2 Ų | 49.2 | 3% | 0.025 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.7 | -35.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | C156 A159 I251 L258 L259 | C156-A255 HydrophobicContact CB-CB 4.11Å; A159-A255 HydrophobicContact CB-CB 4.25Å; I251-A255 VanDerWaalsContact O-CB 3.27Å; I251-A255 WeakPolarHBondContact O-CB 3.42Å; I251-A255 PolarHBondContact O-N 3.43Å; A255-L258 PolarHBondContact O-N 3.37Å; A255-L259 WeakPolarHBondContact O-CB 3.21Å; A255-L259 PolarHBondContact O-N 3.43Å |
| 256 | T | 98 | Very high | 94.9 | Very high | 42 Ų | 42 | 48.3 Ų | 48.3 | 26% | 0.258 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -66.8 | -47 | 175 | -55.3 | 0 | 0 | 0 | 0 | 111.6 | C156 W160 G252 G253 V254 L258 L259 I260 | C156-T256 PolarHBondContact SG-OG1 3.48Å; W160-T256 PolarHBondContact NE1-OG1 3.4Å; G252-T256 WeakPolarHBondContact O-CB 3.4Å; G252-T256 PolarHBondContact O-N 3.19Å; G252-T256 PolarHBondContact O-OG1 2.91Å; G253-T256 PolarHBondContact O-N 3.38Å; V254-T256 VanDerWaalsContact C-N 3.32Å; V254-T256 PolarHBondContact O-N 3.49Å; T256-L258 VanDerWaalsContact C-N 3.29Å; T256-L258 PolarHBondContact O-N 3.11Å; T256-L259 PolarHBondContact O-N 2.94Å; T256-I260 HydrophobicContact CG2-CD1 4.19Å; T256-I260 WeakPolarHBondContact O-CG1 3.33Å; T256-I260 PolarHBondContact O-N 3.34Å |
| 257 | L | 97.8 | Very high | 93.8 | Very high | 103 Ų | 103 | 51 Ų | 51 | 54% | 0.539 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -58.5 | -42.5 | 174.8 | 176.3 | 60.8 | 0 | 0 | 0 | 111.3 | G253 V254 I260 L261 | G253-L257 PolarHBondContact O-N 3.08Å; V254-L257 PolarHBondContact O-N 2.93Å; L257-I260 PolarHBondContact O-N 3.23Å; L257-L261 HydrophobicContact CD1-CD1 4.36Å; L257-L261 HydrophobicContact CD1-CG 4.44Å; L257-L261 HydrophobicContact CG-CD1 4.15Å; L257-L261 WeakPolarHBondContact O-CG 3.41Å; L257-L261 PolarHBondContact O-N 3.06Å |
| 258 | L | 96.4 | Very high | 92.2 | Very high | 14 Ų | 14 | 54.6 Ų | 54.6 | 7% | 0.073 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.1 | -38.1 | 179.1 | -71.2 | 165.9 | 0 | 0 | 0 | 112.7 | C87 C91 V254 A255 T256 L261 V262 | C87-L258 HydrophobicContact CB-CD2 3.52Å; C87-L258 WeakPolarHBondContact O-CD1 3.47Å; C91-L258 HydrophobicContact CB-CD1 3.75Å; V254-L258 HydrophobicContact CG1-CD1 3.64Å; V254-L258 HydrophobicContact CG1-CG 4.44Å; V254-L258 WeakPolarHBondContact O-CB 3.43Å; V254-L258 WeakPolarHBondContact O-CD1 3.42Å; V254-L258 WeakPolarHBondContact O-CG 3.43Å; V254-L258 PolarHBondContact O-N 2.79Å; A255-L258 PolarHBondContact O-N 3.37Å; T256-L258 VanDerWaalsContact C-N 3.29Å; T256-L258 PolarHBondContact O-N 3.11Å; L258-L261 HydrophobicContact CD2-CD1 4.38Å; L258-L261 PolarHBondContact O-N 2.78Å; L258-V262 WeakPolarHBondContact O-CG2 3.45Å; L258-V262 PolarHBondContact O-N 3Å |
| 259 | L | 97.3 | Very high | 90.6 | Very high | 45 Ų | 45 | 60.5 Ų | 60.5 | 24% | 0.236 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.5 | -43.9 | 171.9 | 174.5 | 59.1 | 0 | 0 | 0 | 111.7 | S152 A153 C156 A255 T256 V262 F263 | S152-L259 WeakPolarHBondContact OG-CD1 3.32Å; A153-L259 HydrophobicContact CB-CD1 4Å; A153-L259 HydrophobicContact CB-CD2 4.45Å; C156-L259 HydrophobicContact CB-CD2 4.14Å; A255-L259 WeakPolarHBondContact O-CB 3.21Å; A255-L259 PolarHBondContact O-N 3.43Å; T256-L259 PolarHBondContact O-N 2.94Å; L259-V262 PolarHBondContact O-N 3.18Å; L259-F263 PolarHBondContact O-N 3.23Å |
| 260 | I | 96.8 | Very high | 88.8 | Confident | 89 Ų | 89 | 55.1 Ų | 55.1 | 46% | 0.456 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 175.4 | -66.5 | 164.5 | 0 | 0 | 0 | 110.6 | T256 L257 F263 I264 | T256-I260 HydrophobicContact CG2-CD1 4.19Å; T256-I260 WeakPolarHBondContact O-CG1 3.33Å; T256-I260 PolarHBondContact O-N 3.34Å; L257-I260 PolarHBondContact O-N 3.23Å; I260-F263 PolarHBondContact O-N 3.45Å; I260-I264 HydrophobicContact CG2-CD1 3.79Å; I260-I264 WeakPolarHBondContact O-CG1 3.3Å; I260-I264 PolarHBondContact O-N 2.9Å; I260-I264 VanDerWaalsContact O-N 3.1Å |
| 261 | L | 94.3 | Very high | 86.5 | Confident | 62 Ų | 62 | 59.5 Ų | 59.5 | 33% | 0.325 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.5 | -40.4 | 175.9 | -72.6 | 170.8 | 0 | 0 | 0 | 112.3 | V84 L257 L258 I264 V265 | V84-L261 HydrophobicContact CG1-CB 4.16Å; V84-L261 HydrophobicContact CG2-CB 4.28Å; L257-L261 HydrophobicContact CD1-CD1 4.36Å; L257-L261 HydrophobicContact CD1-CG 4.44Å; L257-L261 HydrophobicContact CG-CD1 4.15Å; L257-L261 WeakPolarHBondContact O-CG 3.41Å; L257-L261 PolarHBondContact O-N 3.06Å; L258-L261 HydrophobicContact CD2-CD1 4.38Å; L258-L261 PolarHBondContact O-N 2.78Å; L261-I264 PolarHBondContact O-N 3.21Å; L261-V265 WeakPolarHBondContact O-CB 3.1Å; L261-V265 VanDerWaalsContact O-CG2 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.31Å; L261-V265 PolarHBondContact O-N 3.45Å |
| 262 | V | 92.6 | Very high | 84.3 | Confident | 0 Ų | 0 | 64.8 Ų | 64.8 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -59.9 | -48.8 | 173.1 | 170.9 | 0 | 0 | 0 | 0 | 110.5 | V84 Y88 A148 L149 L258 L259 I264 V265 F266 | V84-V262 HydrophobicContact CG1-CG2 3.64Å; Y88-V262 HydrophobicContact CD1-CG2 3.38Å; Y88-V262 HydrophobicContact CE1-CG2 3.4Å; Y88-V262 HydrophobicContact CG-CG2 4.44Å; A148-V262 HydrophobicContact CB-CG1 4.03Å; L149-V262 HydrophobicContact CD2-CG1 3.99Å; L149-V262 HydrophobicContact CG-CG1 4.21Å; L258-V262 WeakPolarHBondContact O-CG2 3.45Å; L258-V262 PolarHBondContact O-N 3Å; L259-V262 PolarHBondContact O-N 3.18Å; V262-I264 VanDerWaalsContact C-N 3.28Å; V262-I264 PolarHBondContact O-N 2.91Å; V262-V265 PolarHBondContact O-N 2.79Å; V262-F266 HydrophobicContact CB-CD2 4.38Å; V262-F266 HydrophobicContact CG1-CB 4.22Å; V262-F266 HydrophobicContact CG1-CD2 3.99Å; V262-F266 HydrophobicContact CG1-CG 4.16Å; V262-F266 HydrophobicContact CG2-CD2 4.28Å; V262-F266 HydrophobicContact CG2-CE2 4.36Å; V262-F266 WeakPolarHBondContact O-CB 3.45Å; V262-F266 PolarHBondContact O-N 3.46Å |
| 263 | F | 92.2 | Very high | 82.2 | Confident | 130 Ų | 130 | 68.6 Ų | 68.6 | 57% | 0.57 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -56.7 | -40.2 | -179.9 | -174.7 | -94.1 | 0 | 0 | 0 | 113.4 | R145 L149 L259 I260 | R145-F263 PolarHBondContact NH2-O 3.42Å; R145-F263 VanDerWaalsContact NH2-O 3.09Å; L149-F263 HydrophobicContact CD2-CB 4.1Å; L149-F263 HydrophobicContact CD2-CD2 4.01Å; L259-F263 PolarHBondContact O-N 3.23Å; I260-F263 PolarHBondContact O-N 3.45Å |
| 264 | I | 90.8 | Very high | 79.9 | Confident | 105 Ų | 105 | 68.1 Ų | 68.1 | 54% | 0.538 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -79 | -41.1 | 179.9 | -64.9 | 168.4 | 0 | 0 | 0 | 112.4 | R77 I260 L261 V262 | R77-I264 PolarHBondContact NH2-O 2.94Å; I260-I264 HydrophobicContact CG2-CD1 3.79Å; I260-I264 WeakPolarHBondContact O-CG1 3.3Å; I260-I264 PolarHBondContact O-N 2.9Å; I260-I264 VanDerWaalsContact O-N 3.1Å; L261-I264 PolarHBondContact O-N 3.21Å; V262-I264 VanDerWaalsContact C-N 3.28Å; V262-I264 PolarHBondContact O-N 2.91Å |
| 265 | V | 87.1 | Confident | 77.8 | Confident | 23 Ų | 23 | 66.4 Ų | 66.4 | 14% | 0.139 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -93.6 | -40.8 | -168.5 | 179.4 | 0 | 0 | 0 | 0 | 112.8 | R77 A80 V81 V84 L261 V262 | R77-V265 VanDerWaalsContact CZ-O 3.27Å; R77-V265 PolarHBondContact NE-O 3.4Å; R77-V265 VanDerWaalsContact NH2-C 3.29Å; R77-V265 PolarHBondContact NH2-O 3.47Å; A80-V265 HydrophobicContact CB-CG1 3.96Å; V81-V265 HydrophobicContact CG2-CG1 4.05Å; V84-V265 HydrophobicContact CG2-CB 4.28Å; V84-V265 HydrophobicContact CG2-CG1 4.23Å; V84-V265 HydrophobicContact CG2-CG2 4.22Å; L261-V265 WeakPolarHBondContact O-CB 3.1Å; L261-V265 VanDerWaalsContact O-CG2 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.31Å; L261-V265 PolarHBondContact O-N 3.45Å; V262-V265 PolarHBondContact O-N 2.79Å |
| 266 | F | 80.9 | Confident | 75.3 | Confident | 0 Ų | 0 | 74.9 Ų | 74.9 | 0% | 0 | 36% | 0.359 | C | S | . | . | trans | -70.9 | 135.1 | 179 | -87.6 | -111.4 | 0 | 0 | 0 | 112.1 | V81 V84 F85 Y88 L144 R145 A148 I195 V262 | V81-F266 HydrophobicContact CG1-CD1 4.18Å; V81-F266 HydrophobicContact CG1-CD2 4.35Å; V81-F266 HydrophobicContact CG1-CE1 3.83Å; V81-F266 HydrophobicContact CG1-CE2 4Å; V81-F266 HydrophobicContact CG1-CG 4.44Å; V81-F266 HydrophobicContact CG1-CZ 3.75Å; V84-F266 HydrophobicContact CB-CE2 4.38Å; V84-F266 HydrophobicContact CG1-CD2 4.41Å; V84-F266 HydrophobicContact CG1-CE2 4.11Å; F85-F266 HydrophobicContact CB-CZ 4.09Å; Y88-F266 HydrophobicContact CE1-CE2 4Å; Y88-F266 HydrophobicContact CE1-CZ 4.1Å; L144-F266 HydrophobicContact CG-CD1 4.43Å; L144-F266 HydrophobicContact CG-CE1 4.31Å; R145-F266 HydrophobicContact CG-CB 4.2Å; R145-F266 PolarHBondContact NE-O 3.03Å; A148-F266 HydrophobicContact CB-CD1 3.33Å; A148-F266 HydrophobicContact CB-CD2 4.47Å; A148-F266 HydrophobicContact CB-CE1 3.39Å; A148-F266 HydrophobicContact CB-CG 3.91Å; A148-F266 HydrophobicContact CB-CZ 4.01Å; I195-F266 HydrophobicContact CD1-CE1 4.28Å; I195-F266 HydrophobicContact CD1-CZ 4.2Å; V262-F266 HydrophobicContact CB-CD2 4.38Å; V262-F266 HydrophobicContact CG1-CB 4.22Å; V262-F266 HydrophobicContact CG1-CD2 3.99Å; V262-F266 HydrophobicContact CG1-CG 4.16Å; V262-F266 HydrophobicContact CG2-CD2 4.28Å; V262-F266 HydrophobicContact CG2-CE2 4.36Å; V262-F266 WeakPolarHBondContact O-CB 3.45Å; V262-F266 PolarHBondContact O-N 3.46Å | ||
| 267 | K | 73.1 | Confident | 72.8 | Confident | 114 Ų | 114 | 76.3 Ų | 76.3 | 50% | 0.496 | 37% | 0.374 | S | S | . | . | trans | -131.9 | 161.2 | 168.4 | -72.1 | -168.3 | 172.4 | -164.7 | 0 | 108.3 | W199 K269 | W199-K267 HydrophobicContact CH2-CB 4.33Å; W199-K267 HydrophobicContact CZ2-CB 4.31Å; W199-K267 WeakPolarHBondContact CZ2-O 3.43Å; K267-K269 PolarHBondContact O-N 3.39Å | ||
| 268 | E | 63.5 | Low | 70.5 | Confident | 77 Ų | 77 | 72.6 Ų | 72.6 | 36% | 0.36 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -57.3 | -49.3 | -175.6 | -139.2 | 58.2 | -107 | 0 | 0 | 113.1 | G143 L144 R145 | G143-E268 VanDerWaalsContact C-OE1 3.25Å; G143-E268 WeakPolarHBondContact CA-OE1 3.37Å; L144-E268 PolarHBondContact N-OE1 2.87Å; L144-E268 VanDerWaalsContact N-OE1 3.11Å; R145-E268 WeakPolarHBondContact CB-OE1 3.5Å; R145-E268 WeakPolarHBondContact CB-OE2 3.32Å; R145-E268 PolarHBondContact N-OE1 3.13Å |
| 269 | K | 62 | Low | 68.1 | Low | 128 Ų | 128 | 74.9 Ų | 74.9 | 56% | 0.557 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -145.8 | 157 | -178.7 | -61.5 | -175.8 | -177.7 | -179 | 0 | 108.2 | V198 K267 | V198-K269 HydrophobicContact CG1-CG 4.48Å; K267-K269 PolarHBondContact O-N 3.39Å |
| 270 | P | 58.4 | Low | 65.5 | Low | 25 Ų | 25 | 77.9 Ų | 77.9 | 16% | 0.162 | 39% | 0.387 | C | S | . | . | trans | -59.8 | 155.3 | 165.8 | 26.3 | -34.3 | 0 | 0 | 0 | 110.9 | V198 W199 Y272 P274 | V198-P270 WeakPolarHBondContact O-CD 3.42Å; W199-P270 HydrophobicContact CD2-CB 4.4Å; W199-P270 HydrophobicContact CD2-CG 4.41Å; W199-P270 HydrophobicContact CE3-CB 3.86Å; W199-P270 HydrophobicContact CE3-CG 4.33Å; W199-P270 HydrophobicContact CH2-CB 4.29Å; W199-P270 HydrophobicContact CZ3-CB 3.81Å; P270-Y272 WeakPolarHBondContact CB-O 3.31Å; P270-Y272 WeakPolarHBondContact CG-O 3.43Å; P270-Y272 PolarHBondContact O-N 2.79Å; P270-P274 HydrophobicContact CG-CG 4.24Å | ||
| 271 | K | 48.8 | Very low | 63.1 | Low | 179 Ų | 179 | 76.6 Ų | 76.6 | 78% | 0.778 | 39% | 0.386 | S | S | * | . | S | Bend | trans | -63.7 | -20.5 | 179.9 | -170.9 | -179.2 | 176.7 | -165.4 | 0 | 112.9 | ||
| 272 | Y | 50.2 | Low | 61 | Low | 123 Ų | 123 | 78 Ų | 78 | 48% | 0.482 | 39% | 0.387 | S | S | . | . | S | Bend | trans | -132.9 | 138.9 | 177.2 | -53.7 | -79.6 | 0 | 0 | 0 | 107.7 | P270 | P270-Y272 WeakPolarHBondContact CB-O 3.31Å; P270-Y272 WeakPolarHBondContact CG-O 3.43Å; P270-Y272 PolarHBondContact O-N 2.79Å |
| 273 | P | 52.3 | Low | 58.7 | Low | 80 Ų | 80 | 81.9 Ų | 81.9 | 52% | 0.519 | 42% | 0.419 | S | S | . | . | trans | -65.2 | 144.5 | 180 | 27.5 | -34.3 | 0 | 0 | 0 | 111.1 | S275 | P273-S275 PolarHBondContact O-N 3.03Š| ||
| 274 | P | 50.4 | Low | 56.4 | Low | 27 Ų | 27 | 81.8 Ų | 81.8 | 18% | 0.175 | 42% | 0.424 | C | S | . | . | S | Bend | trans | -73.7 | -20.9 | -176.8 | -10.7 | 24.4 | 0 | 0 | 0 | 114.6 | V198 P270 Q278 | V198-P274 WeakPolarHBondContact O-CG 3.34Å; P270-P274 HydrophobicContact CG-CG 4.24Å; P274-Q278 VanDerWaalsContact CB-OE1 3.31Å |
| 275 | S | 52.4 | Low | 54.3 | Low | 26 Ų | 26 | 81.2 Ų | 81.2 | 18% | 0.182 | 43% | 0.426 | C | S | . | . | trans | -158.4 | 155 | 178.4 | 66.8 | 0 | 0 | 0 | 0 | 113.3 | P273 A277 Q278 S279 | P273-S275 PolarHBondContact O-N 3.03Å; S275-A277 VanDerWaalsContact C-N 3.27Å; S275-A277 PolarHBondContact O-N 3.16Å; S275-Q278 PolarHBondContact O-N 3.21Å; S275-Q278 WeakPolarHBondContact OG-CB 3.32Å; S275-Q278 WeakPolarHBondContact OG-CG 3.3Å; S275-Q278 PolarHBondContact OG-N 2.87Å; S275-Q278 PolarHBondContact OG-OE1 2.85Å; S275-S279 PolarHBondContact O-N 3.46Å; S275-S279 PolarHBondContact O-OG 2.99Å | ||
| 276 | R | 46.6 | Very low | 52.1 | Low | 181 Ų | 181 | 83.7 Ų | 83.7 | 68% | 0.683 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -60.1 | -35.7 | 170.1 | -87.4 | -176 | 168.1 | -174.6 | -5.5 | 112.4 | S279 L280 | R276-S279 WeakPolarHBondContact CA-OG 3.24Å; R276-S279 PolarHBondContact O-N 3.25Å; R276-S279 PolarHBondContact O-OG 3.09Å; R276-L280 PolarHBondContact O-N 2.99Å; R276-L280 VanDerWaalsContact O-N 3.12Å |
| 277 | A | 44.8 | Very low | 50.6 | Low | 71 Ų | 71 | 89.6 Ų | 89.6 | 59% | 0.587 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.2 | -41.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S275 L280 S281 | S275-A277 VanDerWaalsContact C-N 3.27Å; S275-A277 PolarHBondContact O-N 3.16Å; A277-L280 PolarHBondContact O-N 3.13Å; A277-S281 PolarHBondContact O-N 3.42Å; A277-S281 PolarHBondContact O-OG 2.66Å |
| 278 | Q | 49.5 | Very low | 49.3 | Very low | 26 Ų | 26 | 91.3 Ų | 91.3 | 12% | 0.121 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -67.4 | -37.5 | 176.2 | -76.7 | 152.3 | -21.8 | 0 | 0 | 112.6 | S197 F200 P274 S275 L280 S281 Y282 | S197-Q278 PolarHBondContact O-NE2 3.29Å; F200-Q278 PolarHBondContact O-NE2 3.14Å; P274-Q278 VanDerWaalsContact CB-OE1 3.31Å; S275-Q278 PolarHBondContact O-N 3.21Å; S275-Q278 WeakPolarHBondContact OG-CB 3.32Å; S275-Q278 WeakPolarHBondContact OG-CG 3.3Å; S275-Q278 PolarHBondContact OG-N 2.87Å; S275-Q278 PolarHBondContact OG-OE1 2.85Å; Q278-L280 VanDerWaalsContact C-N 3.27Å; Q278-L280 PolarHBondContact O-N 3.45Å; Q278-S281 PolarHBondContact O-OG 3.45Å; Q278-Y282 WeakPolarHBondContact O-CB 3.42Å; Q278-Y282 VanDerWaalsContact O-CD2 3.26Å; Q278-Y282 WeakPolarHBondContact O-CD2 3.3Å; Q278-Y282 PolarHBondContact O-N 2.92Å |
| 279 | S | 45.1 | Very low | 48.8 | Very low | 61 Ų | 61 | 91 Ų | 91 | 43% | 0.427 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.5 | -34.1 | 172.5 | 38.4 | 0 | 0 | 0 | 0 | 112.5 | S275 R276 A283 | S275-S279 PolarHBondContact O-N 3.46Å; S275-S279 PolarHBondContact O-OG 2.99Å; R276-S279 WeakPolarHBondContact CA-OG 3.24Å; R276-S279 PolarHBondContact O-N 3.25Å; R276-S279 PolarHBondContact O-OG 3.09Å; S279-A283 PolarHBondContact O-N 3.35Å |
| 280 | L | 43.1 | Very low | 49 | Very low | 109 Ų | 109 | 88.6 Ų | 88.6 | 57% | 0.571 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -74.6 | -43.5 | 177.2 | -168.7 | 65.5 | 0 | 0 | 0 | 111.9 | R276 A277 Q278 Y282 A283 L284 | R276-L280 PolarHBondContact O-N 2.99Å; R276-L280 VanDerWaalsContact O-N 3.12Å; A277-L280 PolarHBondContact O-N 3.13Å; Q278-L280 VanDerWaalsContact C-N 3.27Å; Q278-L280 PolarHBondContact O-N 3.45Å; L280-Y282 VanDerWaalsContact C-N 3.33Å; L280-Y282 PolarHBondContact O-N 2.89Å; L280-A283 PolarHBondContact O-N 3.22Å; L280-L284 HydrophobicContact CD1-CD1 4.36Å; L280-L284 HydrophobicContact CD2-CD1 4.44Å; L280-L284 HydrophobicContact CG-CD1 3.9Å; L280-L284 HydrophobicContact CG-CG 4.44Å; L280-L284 WeakPolarHBondContact O-CG 3.19Å; L280-L284 PolarHBondContact O-N 3.42Å |
| 281 | S | 46.9 | Very low | 49.5 | Very low | 61 Ų | 61 | 89.9 Ų | 89.9 | 43% | 0.427 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.3 | -33.6 | 177.1 | 65.2 | 0 | 0 | 0 | 0 | 112.7 | A277 Q278 A283 L284 T285 | A277-S281 PolarHBondContact O-N 3.42Å; A277-S281 PolarHBondContact O-OG 2.66Å; Q278-S281 PolarHBondContact O-OG 3.45Å; S281-A283 VanDerWaalsContact C-N 3.3Å; S281-A283 PolarHBondContact O-N 3.22Å; S281-L284 PolarHBondContact O-N 3.46Å; S281-T285 PolarHBondContact O-N 3.1Å; S281-T285 PolarHBondContact O-OG1 2.8Å |
| 282 | Y | 49.7 | Very low | 50.7 | Low | 92 Ų | 92 | 86.9 Ų | 86.9 | 36% | 0.361 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.8 | -25.5 | 169.9 | -87.9 | -62.5 | 0 | 0 | 0 | 113.9 | R194 V198 Q278 L280 | R194-Y282 PolarHBondContact NH1-OH 2.98Å; V198-Y282 WeakPolarHBondContact CG2-OH 3.43Å; Q278-Y282 WeakPolarHBondContact O-CB 3.42Å; Q278-Y282 VanDerWaalsContact O-CD2 3.26Å; Q278-Y282 WeakPolarHBondContact O-CD2 3.3Å; Q278-Y282 PolarHBondContact O-N 2.92Å; L280-Y282 VanDerWaalsContact C-N 3.33Å; L280-Y282 PolarHBondContact O-N 2.89Å |
| 283 | A | 44.9 | Very low | 52.1 | Low | 81 Ų | 81 | 82.7 Ų | 82.7 | 67% | 0.669 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -83.6 | -25.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | S279 L280 S281 | S279-A283 PolarHBondContact O-N 3.35Å; L280-A283 PolarHBondContact O-N 3.22Å; S281-A283 VanDerWaalsContact C-N 3.3Å; S281-A283 PolarHBondContact O-N 3.22Å |
| 284 | L | 44.3 | Very low | 53.3 | Low | 128 Ų | 128 | 80.1 Ų | 80.1 | 67% | 0.67 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -93.4 | -10.6 | 179.2 | -67 | 173.8 | 0 | 0 | 0 | 114.1 | L280 S281 S286 | L280-L284 HydrophobicContact CD1-CD1 4.36Å; L280-L284 HydrophobicContact CD2-CD1 4.44Å; L280-L284 HydrophobicContact CG-CD1 3.9Å; L280-L284 HydrophobicContact CG-CG 4.44Å; L280-L284 WeakPolarHBondContact O-CG 3.19Å; L280-L284 PolarHBondContact O-N 3.42Å; S281-L284 PolarHBondContact O-N 3.46Å; L284-S286 PolarHBondContact O-N 3.05Å; L284-S286 VanDerWaalsContact O-N 3.07Å |
| 285 | T | 46.7 | Very low | 54.9 | Low | 94 Ų | 94 | 80 Ų | 80 | 58% | 0.577 | 48% | 0.477 | S | S | * | . | trans | -75.5 | 96.5 | 176.1 | -57.2 | 0 | 0 | 0 | 0 | 109.9 | S281 | S281-T285 PolarHBondContact O-N 3.1Å; S281-T285 PolarHBondContact O-OG1 2.8Å | ||
| 286 | S | 41.3 | Very low | 56.4 | Low | 74 Ų | 74 | 81.1 Ų | 81.1 | 52% | 0.517 | 49% | 0.488 | S | S | . | . | trans | -57.4 | 128.6 | 171.2 | -48.6 | 0 | 0 | 0 | 0 | 110.8 | L284 D288 A289 | L284-S286 PolarHBondContact O-N 3.05Å; L284-S286 VanDerWaalsContact O-N 3.07Å; S286-D288 PolarHBondContact O-N 3.27Å; S286-D288 VanDerWaalsContact O-N 3.14Å; S286-A289 PolarHBondContact O-N 3.05Å | ||
| 287 | P | 48.8 | Very low | 58.1 | Low | 125 Ų | 125 | 78 Ų | 78 | 81% | 0.812 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -22.5 | 175 | -25.3 | 35.7 | 0 | 0 | 0 | 114 | A289 | P287-A289 VanDerWaalsContact C-N 3.35Š|
| 288 | D | 44.7 | Very low | 60 | Low | 149 Ų | 149 | 74.8 Ų | 74.8 | 80% | 0.797 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | 9.1 | -173 | -49.8 | -70.4 | 0 | 0 | 0 | 114.2 | S286 S290 | S286-D288 PolarHBondContact O-N 3.27Å; S286-D288 VanDerWaalsContact O-N 3.14Å; D288-S290 VanDerWaalsContact C-N 3.33Å; D288-S290 PolarHBondContact O-N 2.67Å |
| 289 | A | 53 | Low | 61.8 | Low | 70 Ų | 70 | 78.4 Ų | 78.4 | 58% | 0.579 | 47% | 0.47 | S | S | * | . | trans | -66.8 | 89.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | S286 P287 Y291 | S286-A289 PolarHBondContact O-N 3.05Å; P287-A289 VanDerWaalsContact C-N 3.35Å; A289-Y291 PolarHBondContact O-N 3.03Å | ||
| 290 | S | 66.2 | Low | 63.8 | Low | 79 Ų | 79 | 83.5 Ų | 83.5 | 55% | 0.552 | 48% | 0.484 | S | S | * | . | trans | -57 | 108.9 | -176.4 | -178.2 | 0 | 0 | 0 | 0 | 111.5 | D288 L292 G293 S294 | D288-S290 VanDerWaalsContact C-N 3.33Å; D288-S290 PolarHBondContact O-N 2.67Å; S290-L292 PolarHBondContact O-N 2.92Å; S290-G293 VanDerWaalsContact O-CA 3.24Å; S290-G293 WeakPolarHBondContact O-CA 3.39Å; S290-G293 PolarHBondContact O-N 3.18Å; S290-S294 PolarHBondContact O-N 2.96Å; S290-S294 VanDerWaalsContact O-N 3.07Å | ||
| 291 | Y | 69.6 | Low | 65.9 | Low | 51 Ų | 51 | 79.2 Ų | 79.2 | 20% | 0.2 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -54.6 | -37.6 | -177.3 | -162.4 | -83.4 | 0 | 0 | 0 | 112.4 | L133 A136 A289 G293 S294 I295 I431 | L133-Y291 HydrophobicContact CD2-CD1 4.28Å; L133-Y291 HydrophobicContact CD2-CE1 3.69Å; A136-Y291 HydrophobicContact CB-CE2 4.18Å; A136-Y291 WeakPolarHBondContact CB-OH 3.27Å; A289-Y291 PolarHBondContact O-N 3.03Å; Y291-G293 VanDerWaalsContact C-N 3.33Å; Y291-S294 PolarHBondContact O-N 2.98Å; Y291-I295 HydrophobicContact CD1-CD1 3.7Å; Y291-I295 HydrophobicContact CD1-CG1 4.38Å; Y291-I295 HydrophobicContact CE1-CD1 3.75Å; Y291-I295 HydrophobicContact CE1-CG1 4.48Å; Y291-I295 WeakPolarHBondContact O-CG1 3.16Å; Y291-I295 PolarHBondContact O-N 2.83Å; Y291-I431 HydrophobicContact CD2-CD1 4.07Å; Y291-I431 HydrophobicContact CD2-CG1 4.37Å; Y291-I431 HydrophobicContact CE1-CG1 4.33Å; Y291-I431 HydrophobicContact CE2-CD1 3.98Å; Y291-I431 HydrophobicContact CE2-CG1 3.76Å; Y291-I431 HydrophobicContact CG-CD1 4.43Å |
| 292 | L | 74 | Confident | 68 | Low | 116 Ų | 116 | 82 Ų | 82 | 61% | 0.607 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -69.4 | -30.3 | 174.4 | -61.5 | 177.8 | 0 | 0 | 0 | 112.5 | S290 A296 | S290-L292 PolarHBondContact O-N 2.92Å; L292-A296 WeakPolarHBondContact O-CB 3.42Å; L292-A296 PolarHBondContact O-N 2.83Å |
| 293 | G | 78.8 | Confident | 70 | Confident | 36 Ų | 36 | 79 Ų | 79 | 37% | 0.371 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.7 | -48.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | S290 Y291 I295 A296 Q297 | S290-G293 VanDerWaalsContact O-CA 3.24Å; S290-G293 WeakPolarHBondContact O-CA 3.39Å; S290-G293 PolarHBondContact O-N 3.18Å; Y291-G293 VanDerWaalsContact C-N 3.33Å; G293-I295 PolarHBondContact O-N 2.69Å; G293-A296 CarbonylContact O-C 3.46Å; G293-A296 PolarHBondContact O-N 3.44Å; G293-Q297 WeakPolarHBondContact O-CB 3.39Å; G293-Q297 PolarHBondContact O-N 2.92Å |
| 294 | S | 78.8 | Confident | 72.2 | Confident | 25 Ų | 25 | 75.1 Ų | 75.1 | 18% | 0.175 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -58.4 | -44.5 | 172.1 | -81.8 | 0 | 0 | 0 | 0 | 111.7 | S290 Y291 A296 Q297 L298 E427 | S290-S294 PolarHBondContact O-N 2.96Å; S290-S294 VanDerWaalsContact O-N 3.07Å; Y291-S294 PolarHBondContact O-N 2.98Å; S294-A296 PolarHBondContact O-N 3.1Å; S294-Q297 WeakPolarHBondContact O-CB 3.34Å; S294-Q297 PolarHBondContact O-N 3.36Å; S294-Q297 VanDerWaalsContact O-N 3.14Å; S294-L298 VanDerWaalsContact O-CG 3.3Å; S294-L298 WeakPolarHBondContact O-CG 3.2Å; S294-L298 PolarHBondContact O-N 2.9Å; S294-E427 WeakPolarHBondContact CB-OE2 3.3Å; S294-E427 PolarHBondContact OG-OE2 3.4Å |
| 295 | I | 83.4 | Confident | 74.5 | Confident | 24 Ų | 24 | 70.5 Ų | 70.5 | 12% | 0.123 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -58.4 | -47.8 | 173.8 | -70.1 | 171 | 0 | 0 | 0 | 111.2 | L133 Y291 G293 Q297 L298 F299 I431 L435 | L133-I295 HydrophobicContact CD2-CD1 3.75Å; Y291-I295 HydrophobicContact CD1-CD1 3.7Å; Y291-I295 HydrophobicContact CD1-CG1 4.38Å; Y291-I295 HydrophobicContact CE1-CD1 3.75Å; Y291-I295 HydrophobicContact CE1-CG1 4.48Å; Y291-I295 WeakPolarHBondContact O-CG1 3.16Å; Y291-I295 PolarHBondContact O-N 2.83Å; G293-I295 PolarHBondContact O-N 2.69Å; I295-Q297 PolarHBondContact O-N 3.39Å; I295-L298 WeakPolarHBondContact O-CB 3.4Å; I295-L298 PolarHBondContact O-N 3.13Å; I295-F299 HydrophobicContact CG2-CD2 3.76Å; I295-F299 HydrophobicContact CG2-CE2 3.81Å; I295-F299 WeakPolarHBondContact O-CD2 3.41Å; I295-F299 PolarHBondContact O-N 3.14Å; I295-I431 HydrophobicContact CD1-CG2 4.46Å; I295-I431 HydrophobicContact CG1-CG2 3.66Å; I295-L435 HydrophobicContact CG1-CD1 4.44Å; I295-L435 HydrophobicContact CG2-CD1 4.48Å; I295-L435 HydrophobicContact CG2-CD2 4.46Å |
| 296 | A | 83.7 | Confident | 76.8 | Confident | 51 Ų | 51 | 67.3 Ų | 67.3 | 42% | 0.421 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -65.7 | -23.8 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | L292 G293 S294 K300 | L292-A296 WeakPolarHBondContact O-CB 3.42Å; L292-A296 PolarHBondContact O-N 2.83Å; G293-A296 CarbonylContact O-C 3.46Å; G293-A296 PolarHBondContact O-N 3.44Å; S294-A296 PolarHBondContact O-N 3.1Å; A296-K300 WeakPolarHBondContact O-CE 3.43Å; A296-K300 WeakPolarHBondContact O-CG 3.48Å |
| 297 | Q | 82.9 | Confident | 79.3 | Confident | 114 Ų | 114 | 63.8 Ų | 63.8 | 53% | 0.533 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -76.7 | -43.4 | 171.9 | -177.9 | 148.4 | -72.7 | 0 | 0 | 111.5 | G293 S294 I295 F299 K300 E427 | G293-Q297 WeakPolarHBondContact O-CB 3.39Å; G293-Q297 PolarHBondContact O-N 2.92Å; S294-Q297 WeakPolarHBondContact O-CB 3.34Å; S294-Q297 PolarHBondContact O-N 3.36Å; S294-Q297 VanDerWaalsContact O-N 3.14Å; I295-Q297 PolarHBondContact O-N 3.39Å; Q297-F299 PolarHBondContact O-N 3.22Å; Q297-K300 WeakPolarHBondContact O-CB 3.24Å; Q297-K300 PolarHBondContact O-N 3.5Å; Q297-K300 VanDerWaalsContact O-N 3.13Å; Q297-E427 PolarHBondContact NE2-OE1 3.06Å |
| 298 | L | 85.1 | Confident | 81.5 | Confident | 4 Ų | 4 | 58.4 Ų | 58.4 | 2% | 0.021 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -58.5 | -44.9 | 175 | -71.7 | 174.2 | 0 | 0 | 0 | 112.3 | S294 I295 K300 N301 F304 T424 E427 I431 L435 | S294-L298 VanDerWaalsContact O-CG 3.3Å; S294-L298 WeakPolarHBondContact O-CG 3.2Å; S294-L298 PolarHBondContact O-N 2.9Å; I295-L298 WeakPolarHBondContact O-CB 3.4Å; I295-L298 PolarHBondContact O-N 3.13Å; L298-K300 PolarHBondContact O-N 3.49Å; L298-K300 VanDerWaalsContact O-N 3.16Å; L298-N301 WeakPolarHBondContact O-CB 3.5Å; L298-N301 PolarHBondContact O-N 3.4Å; L298-F304 HydrophobicContact CB-CD1 3.98Å; L298-F304 HydrophobicContact CB-CE1 3.79Å; L298-F304 HydrophobicContact CD1-CE1 4.42Å; L298-F304 HydrophobicContact CD2-CD1 4.48Å; L298-F304 HydrophobicContact CD2-CE1 4.42Å; L298-F304 HydrophobicContact CG-CE1 4.46Å; L298-T424 HydrophobicContact CD2-CG2 3.35Å; L298-E427 HydrophobicContact CD2-CB 3.95Å; L298-E427 HydrophobicContact CD2-CG 3.77Å; L298-E427 HydrophobicContact CG-CG 4.24Å; L298-I431 HydrophobicContact CD1-CB 4.2Å; L298-I431 HydrophobicContact CD1-CG2 3.54Å; L298-L435 HydrophobicContact CB-CD1 4.36Å; L298-L435 HydrophobicContact CD1-CD1 3.79Å |
| 299 | F | 87.8 | Confident | 84 | Confident | 103 Ų | 103 | 54.1 Ų | 54.1 | 45% | 0.452 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -9.9 | 178 | -83.3 | -75.6 | 0 | 0 | 0 | 114.7 | I295 Q297 V305 L435 | I295-F299 HydrophobicContact CG2-CD2 3.76Å; I295-F299 HydrophobicContact CG2-CE2 3.81Å; I295-F299 WeakPolarHBondContact O-CD2 3.41Å; I295-F299 PolarHBondContact O-N 3.14Å; Q297-F299 PolarHBondContact O-N 3.22Å; F299-V305 HydrophobicContact CD1-CG2 3.82Å; F299-V305 WeakPolarHBondContact O-CG2 3.24Å; F299-L435 HydrophobicContact CE2-CD1 3.99Å; F299-L435 HydrophobicContact CE2-CD2 3.96Å; F299-L435 HydrophobicContact CZ-CD2 4.34Å |
| 300 | K | 86.4 | Confident | 86 | Confident | 168 Ų | 168 | 50.8 Ų | 50.8 | 73% | 0.73 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -17.8 | 168.9 | -65.7 | 167.3 | -171.6 | 173.7 | 0 | 112.8 | A296 Q297 L298 L302 | A296-K300 WeakPolarHBondContact O-CE 3.43Å; A296-K300 WeakPolarHBondContact O-CG 3.48Å; Q297-K300 WeakPolarHBondContact O-CB 3.24Å; Q297-K300 PolarHBondContact O-N 3.5Å; Q297-K300 VanDerWaalsContact O-N 3.13Å; L298-K300 PolarHBondContact O-N 3.49Å; L298-K300 VanDerWaalsContact O-N 3.16Å; K300-L302 PolarHBondContact O-N 3.43Å |
| 301 | N | 87.7 | Confident | 87.4 | Confident | 18 Ų | 18 | 47.1 Ų | 47.1 | 10% | 0.096 | 25% | 0.249 | C | C | . | . | trans | -84.9 | 97.2 | 177.2 | -177.3 | -4.2 | 0 | 0 | 0 | 110.3 | L298 N303 F304 V305 L423 | L298-N301 WeakPolarHBondContact O-CB 3.5Å; L298-N301 PolarHBondContact O-N 3.4Å; N301-N303 PolarHBondContact O-N 2.94Å; N301-N303 VanDerWaalsContact O-N 3.15Å; N301-N303 PolarHBondContact OD1-N 3.18Å; N301-F304 HydrophobicContact CB-CB 4.01Å; N301-F304 WeakPolarHBondContact O-CA 3.37Å; N301-F304 WeakPolarHBondContact O-CB 3.25Å; N301-F304 PolarHBondContact O-N 3.35Å; N301-V305 PolarHBondContact O-N 2.95Å; N301-L423 PolarHBondContact ND2-O 2.98Å | ||
| 302 | L | 90 | Very high | 88.7 | Confident | 121 Ų | 121 | 44.7 Ų | 44.7 | 63% | 0.634 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -54 | -35.1 | -179 | -177.8 | 62.2 | 0 | 0 | 0 | 113.6 | K300 F304 V305 L306 | K300-L302 PolarHBondContact O-N 3.43Å; L302-F304 VanDerWaalsContact C-N 3.35Å; L302-V305 PolarHBondContact O-N 2.97Å; L302-L306 HydrophobicContact CD1-CG 4.4Å; L302-L306 HydrophobicContact CG-CD1 4.26Å; L302-L306 WeakPolarHBondContact O-CB 3.47Å; L302-L306 VanDerWaalsContact O-CG 3.31Å; L302-L306 WeakPolarHBondContact O-CG 3.36Å; L302-L306 PolarHBondContact O-N 3.3Å |
| 303 | N | 91.1 | Very high | 89.8 | Confident | 27 Ų | 27 | 39.3 Ų | 39.3 | 14% | 0.144 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -65.8 | -39.2 | 176.8 | -64.8 | -50.5 | 0 | 0 | 0 | 111.6 | N301 L307 L423 I481 K482 | N301-N303 PolarHBondContact O-N 2.94Å; N301-N303 VanDerWaalsContact O-N 3.15Å; N301-N303 PolarHBondContact OD1-N 3.18Å; N303-L307 WeakPolarHBondContact O-CB 3.31Å; N303-L307 PolarHBondContact O-N 3.44Å; N303-L423 HydrophobicContact CB-CD1 4.18Å; N303-L423 HydrophobicContact CB-CD2 4Å; N303-I481 HydrophobicContact CB-CG2 4.02Å; N303-K482 PolarHBondContact OD1-N 3.05Å |
| 304 | F | 91.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -69.3 | -41.7 | 174.6 | 176.1 | -106.8 | 0 | 0 | 0 | 111.5 | L298 N301 L302 L306 L307 V308 A420 T424 S432 L435 L436 | L298-F304 HydrophobicContact CB-CD1 3.98Å; L298-F304 HydrophobicContact CB-CE1 3.79Å; L298-F304 HydrophobicContact CD1-CE1 4.42Å; L298-F304 HydrophobicContact CD2-CD1 4.48Å; L298-F304 HydrophobicContact CD2-CE1 4.42Å; L298-F304 HydrophobicContact CG-CE1 4.46Å; N301-F304 HydrophobicContact CB-CB 4.01Å; N301-F304 WeakPolarHBondContact O-CA 3.37Å; N301-F304 WeakPolarHBondContact O-CB 3.25Å; N301-F304 PolarHBondContact O-N 3.35Å; L302-F304 VanDerWaalsContact C-N 3.35Å; F304-L306 VanDerWaalsContact C-N 3.34Å; F304-L306 PolarHBondContact O-N 2.91Å; F304-L307 CarbonylContact O-C 3.55Å; F304-L307 WeakPolarHBondContact O-CA 3.37Å; F304-L307 WeakPolarHBondContact O-CB 3.18Å; F304-L307 PolarHBondContact O-N 3.12Å; F304-L307 VanDerWaalsContact O-N 3.09Å; F304-V308 HydrophobicContact CD1-CG2 3.99Å; F304-V308 HydrophobicContact CD2-CG2 4.25Å; F304-V308 HydrophobicContact CE1-CG2 3.53Å; F304-V308 HydrophobicContact CE2-CG2 3.83Å; F304-V308 HydrophobicContact CG-CG2 4.34Å; F304-V308 HydrophobicContact CZ-CG2 3.46Å; F304-V308 VanDerWaalsContact CZ-CG2 3.46Å; F304-V308 VanDerWaalsContact O-CG2 3.31Å; F304-V308 WeakPolarHBondContact O-CG2 3.46Å; F304-V308 PolarHBondContact O-N 3.44Å; F304-A420 HydrophobicContact CE2-CB 4.23Å; F304-T424 HydrophobicContact CB-CG2 4.26Å; F304-T424 HydrophobicContact CD1-CG2 4.37Å; F304-T424 HydrophobicContact CD2-CG2 3.21Å; F304-T424 HydrophobicContact CE2-CG2 3.51Å; F304-T424 HydrophobicContact CG-CG2 3.69Å; F304-T424 HydrophobicContact CZ-CG2 4.2Å; F304-S432 WeakPolarHBondContact CE2-OG 3.48Å; F304-L435 HydrophobicContact CE1-CD1 3.83Å; F304-L435 HydrophobicContact CZ-CB 4.09Å; F304-L435 HydrophobicContact CZ-CD1 4.01Å; F304-L436 HydrophobicContact CE2-CD1 3.6Å; F304-L436 HydrophobicContact CZ-CD1 4.07Å |
| 305 | V | 93.9 | Very high | 91.5 | Very high | 31 Ų | 31 | 36.4 Ų | 36.4 | 19% | 0.188 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -61.7 | -41.8 | 176.3 | 178.2 | 0 | 0 | 0 | 0 | 111.6 | F299 N301 L302 L307 V308 I309 | F299-V305 HydrophobicContact CD1-CG2 3.82Å; F299-V305 WeakPolarHBondContact O-CG2 3.24Å; N301-V305 PolarHBondContact O-N 2.95Å; L302-V305 PolarHBondContact O-N 2.97Å; V305-L307 VanDerWaalsContact C-N 3.35Å; V305-V308 PolarHBondContact O-N 3.42Å; V305-I309 HydrophobicContact CG1-CD1 4.06Å; V305-I309 WeakPolarHBondContact O-CG1 3.46Å; V305-I309 PolarHBondContact O-N 3.21Å |
| 306 | L | 94.2 | Very high | 92.1 | Very high | 28 Ų | 28 | 35.2 Ų | 35.2 | 15% | 0.147 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.2 | -39.4 | 172.1 | -71.7 | 170.5 | 0 | 0 | 0 | 111.9 | L302 F304 T310 L477 I481 | L302-L306 HydrophobicContact CD1-CG 4.4Å; L302-L306 HydrophobicContact CG-CD1 4.26Å; L302-L306 WeakPolarHBondContact O-CB 3.47Å; L302-L306 VanDerWaalsContact O-CG 3.31Å; L302-L306 WeakPolarHBondContact O-CG 3.36Å; L302-L306 PolarHBondContact O-N 3.3Å; F304-L306 VanDerWaalsContact C-N 3.34Å; F304-L306 PolarHBondContact O-N 2.91Å; L306-T310 WeakPolarHBondContact O-CB 3.23Å; L306-T310 VanDerWaalsContact O-CG2 3.24Å; L306-T310 WeakPolarHBondContact O-CG2 3.34Å; L306-T310 PolarHBondContact O-N 3.17Å; L306-T310 PolarHBondContact O-OG1 3.4Å; L306-L477 HydrophobicContact CD2-CD2 3.96Å; L306-I481 HydrophobicContact CB-CD1 4.23Å; L306-I481 HydrophobicContact CB-CG1 3.73Å; L306-I481 HydrophobicContact CD1-CG1 4.41Å |
| 307 | L | 94 | Very high | 92.7 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -65.5 | -43.3 | 174.8 | -175.2 | 58.9 | 0 | 0 | 0 | 112.1 | N303 F304 V305 I309 T310 Y311 F419 A420 L423 I481 | N303-L307 WeakPolarHBondContact O-CB 3.31Å; N303-L307 PolarHBondContact O-N 3.44Å; F304-L307 CarbonylContact O-C 3.55Å; F304-L307 WeakPolarHBondContact O-CA 3.37Å; F304-L307 WeakPolarHBondContact O-CB 3.18Å; F304-L307 PolarHBondContact O-N 3.12Å; F304-L307 VanDerWaalsContact O-N 3.09Å; V305-L307 VanDerWaalsContact C-N 3.35Å; L307-I309 PolarHBondContact O-N 3.49Å; L307-T310 WeakPolarHBondContact CA-OG1 3.34Å; L307-T310 PolarHBondContact O-N 3.27Å; L307-T310 PolarHBondContact O-OG1 3.14Å; L307-Y311 WeakPolarHBondContact O-CB 3.17Å; L307-Y311 PolarHBondContact O-N 2.83Å; L307-F419 HydrophobicContact CD1-CD1 3.88Å; L307-F419 HydrophobicContact CD1-CE1 4.44Å; L307-F419 HydrophobicContact CD2-CB 4.03Å; L307-F419 HydrophobicContact CD2-CD1 3.95Å; L307-F419 HydrophobicContact CD2-CG 4.01Å; L307-A420 HydrophobicContact CD2-CB 3.79Å; L307-L423 HydrophobicContact CB-CD1 4.28Å; L307-L423 HydrophobicContact CD2-CD1 3.86Å; L307-I481 HydrophobicContact CB-CD1 4.08Å; L307-I481 HydrophobicContact CD1-CD1 4.24Å |
| 308 | V | 95.1 | Very high | 93.3 | Very high | 11 Ų | 11 | 27.4 Ų | 27.4 | 7% | 0.067 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -56.4 | -50.3 | 175.3 | 169.9 | 0 | 0 | 0 | 0 | 110.4 | F304 V305 G312 L436 S439 | F304-V308 HydrophobicContact CD1-CG2 3.99Å; F304-V308 HydrophobicContact CD2-CG2 4.25Å; F304-V308 HydrophobicContact CE1-CG2 3.53Å; F304-V308 HydrophobicContact CE2-CG2 3.83Å; F304-V308 HydrophobicContact CG-CG2 4.34Å; F304-V308 HydrophobicContact CZ-CG2 3.46Å; F304-V308 VanDerWaalsContact CZ-CG2 3.46Å; F304-V308 VanDerWaalsContact O-CG2 3.31Å; F304-V308 WeakPolarHBondContact O-CG2 3.46Å; F304-V308 PolarHBondContact O-N 3.44Å; V305-V308 PolarHBondContact O-N 3.42Å; V308-G312 PolarHBondContact O-N 3.25Å; V308-L436 HydrophobicContact CG2-CD1 3.84Å; V308-S439 WeakPolarHBondContact O-CB 3.27Å; V308-S439 PolarHBondContact O-OG 2.94Å; V308-S439 VanDerWaalsContact O-OG 3.13Å |
| 309 | I | 96.8 | Very high | 93.8 | Very high | 59 Ų | 59 | 28.3 Ų | 28.3 | 30% | 0.303 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -62.6 | -50.7 | 179.3 | -67.6 | 165.8 | 0 | 0 | 0 | 110.9 | V305 L307 Y311 G312 L313 F443 L477 | V305-I309 HydrophobicContact CG1-CD1 4.06Å; V305-I309 WeakPolarHBondContact O-CG1 3.46Å; V305-I309 PolarHBondContact O-N 3.21Å; L307-I309 PolarHBondContact O-N 3.49Å; I309-Y311 VanDerWaalsContact C-N 3.34Å; I309-Y311 PolarHBondContact O-N 3.48Å; I309-G312 PolarHBondContact O-N 3.4Å; I309-L313 HydrophobicContact CG2-CD1 4.03Å; I309-L313 HydrophobicContact CG2-CG 4.41Å; I309-L313 VanDerWaalsContact O-CG 3.3Å; I309-L313 WeakPolarHBondContact O-CG 3.33Å; I309-L313 PolarHBondContact O-N 3.06Å; I309-F443 HydrophobicContact CG2-CZ 4.39Å; I309-L477 HydrophobicContact CG2-CD1 4.05Å |
| 310 | T | 96.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -67 | -35.9 | -177.3 | 53.6 | 0 | 0 | 0 | 0 | 112.5 | L306 L307 L313 N314 Y376 G474 L477 T478 | L306-T310 WeakPolarHBondContact O-CB 3.23Å; L306-T310 VanDerWaalsContact O-CG2 3.24Å; L306-T310 WeakPolarHBondContact O-CG2 3.34Å; L306-T310 PolarHBondContact O-N 3.17Å; L306-T310 PolarHBondContact O-OG1 3.4Å; L307-T310 WeakPolarHBondContact CA-OG1 3.34Å; L307-T310 PolarHBondContact O-N 3.27Å; L307-T310 PolarHBondContact O-OG1 3.14Å; T310-L313 PolarHBondContact O-N 3.5Å; T310-N314 PolarHBondContact O-N 2.86Å; T310-Y376 WeakPolarHBondContact O-CE2 3.22Å; T310-Y376 PolarHBondContact O-OH 3.17Å; T310-Y376 VanDerWaalsContact O-OH 3.06Å; T310-G474 VanDerWaalsContact CG2-O 3.3Å; T310-G474 WeakPolarHBondContact CG2-O 3.29Å; T310-L477 HydrophobicContact CG2-CB 3.36Å; T310-L477 HydrophobicContact CG2-CD1 4.44Å; T310-T478 WeakPolarHBondContact CB-OG1 3.5Å; T310-T478 WeakPolarHBondContact CG2-OG1 3.4Å |
| 311 | Y | 95.3 | Very high | 94.7 | Very high | 3 Ų | 3 | 15.4 Ų | 15.4 | 1% | 0.012 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -61.9 | -47.8 | 170.4 | -178.6 | -89.6 | 0 | 0 | 0 | 112 | L307 I309 L313 N314 A315 Y412 L413 F417 L436 A440 | L307-Y311 WeakPolarHBondContact O-CB 3.17Å; L307-Y311 PolarHBondContact O-N 2.83Å; I309-Y311 VanDerWaalsContact C-N 3.34Å; I309-Y311 PolarHBondContact O-N 3.48Å; Y311-L313 VanDerWaalsContact C-N 3.33Å; Y311-L313 PolarHBondContact O-N 2.86Å; Y311-N314 PolarHBondContact O-N 2.89Å; Y311-A315 HydrophobicContact CD1-CB 4.32Å; Y311-A315 HydrophobicContact CE1-CB 3.95Å; Y311-A315 VanDerWaalsContact O-CB 3.31Å; Y311-A315 WeakPolarHBondContact O-CB 3.35Å; Y311-A315 PolarHBondContact O-N 2.95Å; Y311-Y412 WeakPolarHBondContact CA-OH 3.34Å; Y311-Y412 HydrophobicContact CD2-CD1 4.45Å; Y311-Y412 AromaticContact CD2-CE1 3.72Å; Y311-Y412 HydrophobicContact CD2-CE1 3.72Å; Y311-Y412 HydrophobicContact CE2-CE1 4.44Å; Y311-Y412 HydrophobicContact CG-CE1 4.37Å; Y311-Y412 PolarHBondContact N-OH 3.01Å; Y311-L413 HydrophobicContact CE2-CD2 4.04Å; Y311-F417 HydrophobicContact CE2-CE1 4.46Å; Y311-F417 AromaticContact CZ-CE1 3.96Å; Y311-F417 AromaticContact CZ-CZ 3.98Å; Y311-F417 WeakPolarHBondContact OH-CZ 3.33Å; Y311-L436 HydrophobicContact CD1-CB 3.66Å; Y311-L436 HydrophobicContact CD1-CD2 4.07Å; Y311-L436 HydrophobicContact CD1-CG 3.82Å; Y311-L436 VanDerWaalsContact CD1-O 3.24Å; Y311-L436 WeakPolarHBondContact CD1-O 3.18Å; Y311-L436 HydrophobicContact CD2-CD2 3.71Å; Y311-L436 HydrophobicContact CD2-CG 4.34Å; Y311-L436 HydrophobicContact CE1-CB 3.8Å; Y311-L436 HydrophobicContact CE1-CD2 4.44Å; Y311-L436 HydrophobicContact CE1-CG 4.36Å; Y311-L436 WeakPolarHBondContact CE1-O 3.35Å; Y311-L436 HydrophobicContact CE2-CD2 4.09Å; Y311-L436 HydrophobicContact CG-CB 4.17Å; Y311-L436 HydrophobicContact CG-CD2 3.7Å; Y311-L436 HydrophobicContact CG-CG 3.81Å; Y311-A440 HydrophobicContact CD1-CB 4.4Å; Y311-A440 HydrophobicContact CE1-CB 3.96Å |
| 312 | G | 96.9 | Very high | 95 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -58.3 | -42.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | V308 I309 N314 G316 F443 | V308-G312 PolarHBondContact O-N 3.25Å; I309-G312 PolarHBondContact O-N 3.4Å; G312-N314 PolarHBondContact O-N 3.21Å; G312-G316 WeakPolarHBondContact O-CA 3.39Å; G312-G316 PolarHBondContact O-N 2.97Å; G312-F443 VanDerWaalsContact C-CD2 3.47Å; G312-F443 VanDerWaalsContact O-CB 3.27Å; G312-F443 WeakPolarHBondContact O-CB 3.37Å |
| 313 | L | 97.4 | Very high | 95.2 | Very high | 2 Ų | 2 | 8.9 Ų | 8.9 | 1% | 0.01 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -60.7 | -41.3 | 176 | -70.3 | 172.2 | 0 | 0 | 0 | 112.7 | I309 T310 Y311 A317 Y376 F443 F447 F470 L473 L477 | I309-L313 HydrophobicContact CG2-CD1 4.03Å; I309-L313 HydrophobicContact CG2-CG 4.41Å; I309-L313 VanDerWaalsContact O-CG 3.3Å; I309-L313 WeakPolarHBondContact O-CG 3.33Å; I309-L313 PolarHBondContact O-N 3.06Å; T310-L313 PolarHBondContact O-N 3.5Å; Y311-L313 VanDerWaalsContact C-N 3.33Å; Y311-L313 PolarHBondContact O-N 2.86Å; L313-A317 VanDerWaalsContact O-CB 3.3Å; L313-A317 WeakPolarHBondContact O-CB 3.14Å; L313-A317 PolarHBondContact O-N 3.25Å; L313-Y376 WeakPolarHBondContact CB-OH 3.35Å; L313-F443 HydrophobicContact CD2-CD1 3.72Å; L313-F443 HydrophobicContact CD2-CE1 3.47Å; L313-F443 VanDerWaalsContact CD2-CE1 3.47Å; L313-F443 HydrophobicContact CD2-CE2 4.41Å; L313-F443 HydrophobicContact CD2-CG 4.31Å; L313-F443 HydrophobicContact CD2-CZ 3.84Å; L313-F443 HydrophobicContact CG-CE1 4.26Å; L313-F443 HydrophobicContact CG-CE2 4.36Å; L313-F443 HydrophobicContact CG-CZ 4.15Å; L313-F447 HydrophobicContact CD2-CE2 4.32Å; L313-F447 HydrophobicContact CD2-CZ 3.69Å; L313-F470 HydrophobicContact CD2-CB 4.25Å; L313-F470 HydrophobicContact CD2-CD1 3.77Å; L313-F470 HydrophobicContact CD2-CG 4.44Å; L313-L473 HydrophobicContact CD1-CG 4.4Å; L313-L477 HydrophobicContact CD1-CD1 4.36Å |
| 314 | N | 96.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 7.6 Ų | 7.6 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -75.9 | -53.3 | 179.2 | -160.7 | -42.6 | 0 | 0 | 0 | 111.9 | T310 Y311 G312 G316 A317 F318 Y376 Y412 L471 | T310-N314 PolarHBondContact O-N 2.86Å; Y311-N314 PolarHBondContact O-N 2.89Å; G312-N314 PolarHBondContact O-N 3.21Å; N314-G316 PolarHBondContact O-N 3.27Å; N314-A317 WeakPolarHBondContact O-CB 3.27Å; N314-A317 PolarHBondContact O-N 3.44Å; N314-F318 PolarHBondContact O-N 3.25Å; N314-Y376 HydrophobicContact CB-CE1 4.4Å; N314-Y376 HydrophobicContact CB-CE2 3.94Å; N314-Y376 PolarHBondContact N-OH 3.47Å; N314-Y412 HydrophobicContact CB-CD1 3.67Å; N314-Y412 HydrophobicContact CB-CE1 3.59Å; N314-Y412 HydrophobicContact CB-CG 4.38Å; N314-L471 HydrophobicContact CB-CD2 4.44Å |
| 315 | A | 95.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 7.7 Ų | 7.7 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -66.2 | -37.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y311 F318 Y319 L413 A440 | Y311-A315 HydrophobicContact CD1-CB 4.32Å; Y311-A315 HydrophobicContact CE1-CB 3.95Å; Y311-A315 VanDerWaalsContact O-CB 3.31Å; Y311-A315 WeakPolarHBondContact O-CB 3.35Å; Y311-A315 PolarHBondContact O-N 2.95Å; A315-F318 WeakPolarHBondContact O-CB 3.19Å; A315-F318 PolarHBondContact O-N 2.95Å; A315-Y319 WeakPolarHBondContact O-CD1 3.27Å; A315-Y319 VanDerWaalsContact O-CG 3.31Å; A315-Y319 PolarHBondContact O-N 2.74Å; A315-L413 HydrophobicContact CB-CD2 3.58Å; A315-A440 HydrophobicContact CB-CB 3.46Å; A315-A440 VanDerWaalsContact CB-CB 3.46Å |
| 316 | G | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 6.3 Ų | 6.3 | 0% | 0 | 3% | 0.032 | C | C | . | . | H | α-helix | trans | -65.1 | -37.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G312 N314 F318 Y319 A320 A440 | G312-G316 WeakPolarHBondContact O-CA 3.39Å; G312-G316 PolarHBondContact O-N 2.97Å; N314-G316 PolarHBondContact O-N 3.27Å; G316-F318 VanDerWaalsContact C-N 3.32Å; G316-Y319 PolarHBondContact O-N 3.05Å; G316-A320 WeakPolarHBondContact O-CB 3.48Å; G316-A320 PolarHBondContact O-N 3.45Å; G316-A440 WeakPolarHBondContact CA-O 3.39Å |
| 317 | A | 97.2 | Very high | 95.6 | Very high | 0 Ų | 0 | 6 Ų | 6 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -65.9 | -36.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L313 N314 L321 M409 F447 L467 L471 | L313-A317 VanDerWaalsContact O-CB 3.3Å; L313-A317 WeakPolarHBondContact O-CB 3.14Å; L313-A317 PolarHBondContact O-N 3.25Å; N314-A317 WeakPolarHBondContact O-CB 3.27Å; N314-A317 PolarHBondContact O-N 3.44Å; A317-L321 WeakPolarHBondContact O-CB 3.41Å; A317-L321 PolarHBondContact O-N 2.87Å; A317-M409 HydrophobicContact CB-CE 3.65Å; A317-F447 HydrophobicContact CB-CD2 4.18Å; A317-F447 HydrophobicContact CB-CE2 4.31Å; A317-L467 HydrophobicContact CB-CD1 4.38Å; A317-L467 HydrophobicContact CB-CD2 3.97Å; A317-L471 HydrophobicContact CB-CD2 4.11Å; A317-L471 HydrophobicContact CB-CG 4.34Å |
| 318 | F | 95.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 6 Ų | 6 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -64.7 | -40.3 | 172.9 | 172 | -110.2 | 0 | 0 | 0 | 112.2 | N314 A315 G316 S322 I347 M409 L413 | N314-F318 PolarHBondContact O-N 3.25Å; A315-F318 WeakPolarHBondContact O-CB 3.19Å; A315-F318 PolarHBondContact O-N 2.95Å; G316-F318 VanDerWaalsContact C-N 3.32Å; F318-S322 WeakPolarHBondContact O-CB 3.48Å; F318-S322 PolarHBondContact O-N 2.89Å; F318-S322 PolarHBondContact O-OG 3.42Å; F318-I347 HydrophobicContact CE2-CG2 4.1Å; F318-M409 HydrophobicContact CB-CE 4.03Å; F318-M409 HydrophobicContact CB-CG 4.02Å; F318-M409 HydrophobicContact CB-SD 3.86Å; F318-M409 HydrophobicContact CD2-CG 4.38Å; F318-M409 HydrophobicContact CD2-SD 4.08Å; F318-M409 HydrophobicContact CG-SD 4.47Å; F318-M409 VanDerWaalsContact N-CE 3.33Å; F318-L413 HydrophobicContact CD1-CD1 4.47Å |
| 319 | Y | 95.5 | Very high | 95.5 | Very high | 24 Ų | 24 | 5.5 Ų | 5.5 | 9% | 0.094 | 3% | 0.026 | C | C | . | . | H | α-helix | trans | -67.5 | -40.8 | 176.3 | -65.3 | -12 | 0 | 0 | 0 | 112.8 | W96 A315 G316 S322 T323 A440 | W96-Y319 AromaticContact CH2-CD1 3.67Å; W96-Y319 HydrophobicContact CH2-CD1 3.67Å; W96-Y319 HydrophobicContact CH2-CE1 4.17Å; W96-Y319 HydrophobicContact CH2-CG 4.19Å; W96-Y319 HydrophobicContact CZ2-CD1 4.28Å; W96-Y319 HydrophobicContact CZ2-CG 4.35Å; A315-Y319 WeakPolarHBondContact O-CD1 3.27Å; A315-Y319 VanDerWaalsContact O-CG 3.31Å; A315-Y319 PolarHBondContact O-N 2.74Å; G316-Y319 PolarHBondContact O-N 3.05Å; Y319-S322 PolarHBondContact O-N 2.92Å; Y319-T323 WeakPolarHBondContact O-CB 3.23Å; Y319-T323 PolarHBondContact O-N 2.73Å; Y319-T323 PolarHBondContact O-OG1 3.31Å; Y319-A440 HydrophobicContact CE2-CB 3.82Å |
| 320 | A | 96.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 4.1 Ų | 4.1 | 0% | 0 | 2% | 0.018 | C | C | . | . | H | α-helix | trans | -66.6 | -48.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G316 S322 T323 L324 F447 T448 | G316-A320 WeakPolarHBondContact O-CB 3.48Å; G316-A320 PolarHBondContact O-N 3.45Å; A320-S322 VanDerWaalsContact C-N 3.3Å; A320-S322 PolarHBondContact O-N 3.41Å; A320-T323 PolarHBondContact O-N 3.38Å; A320-L324 WeakPolarHBondContact O-CB 3.46Å; A320-L324 WeakPolarHBondContact O-CG 3.42Å; A320-L324 PolarHBondContact O-N 3.46Å; A320-F447 HydrophobicContact CB-CB 3.65Å; A320-T448 WeakPolarHBondContact CA-OG1 3.45Å |
| 321 | L | 95.3 | Very high | 95.1 | Very high | 0 Ų | 0 | 11.1 Ų | 11.1 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -53.5 | -47.7 | 172.8 | -178.5 | 88.3 | 0 | 0 | 0 | 111.1 | A317 L324 L325 M328 I347 M383 Y386 M405 M409 | A317-L321 WeakPolarHBondContact O-CB 3.41Å; A317-L321 PolarHBondContact O-N 2.87Å; L321-L324 PolarHBondContact O-N 3.45Å; L321-L325 WeakPolarHBondContact O-CB 3.49Å; L321-L325 PolarHBondContact O-N 3.27Å; L321-M328 HydrophobicContact CD1-CE 3.98Å; L321-I347 HydrophobicContact CD2-CD1 4.36Å; L321-M383 HydrophobicContact CD1-CE 4.23Å; L321-M383 HydrophobicContact CD1-SD 4.16Å; L321-Y386 HydrophobicContact CD1-CE1 3.96Å; L321-M405 HydrophobicContact CD1-CE 4.05Å; L321-M405 HydrophobicContact CD2-CE 3.58Å; L321-M405 HydrophobicContact CD2-SD 4.36Å; L321-M405 HydrophobicContact CG-CE 4.46Å; L321-M409 HydrophobicContact CD2-SD 4.03Å |
| 322 | S | 93.6 | Very high | 95 | Very high | 2 Ų | 2 | 13.4 Ų | 13.4 | 1% | 0.014 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -64.4 | -40.1 | -178.6 | -65 | 0 | 0 | 0 | 0 | 112.7 | F224 F318 Y319 A320 | F224-S322 WeakPolarHBondContact CE1-O 3.43Å; F224-S322 WeakPolarHBondContact CZ-O 3.44Å; F318-S322 WeakPolarHBondContact O-CB 3.48Å; F318-S322 PolarHBondContact O-N 2.89Å; F318-S322 PolarHBondContact O-OG 3.42Å; Y319-S322 PolarHBondContact O-N 2.92Å; A320-S322 VanDerWaalsContact C-N 3.3Å; A320-S322 PolarHBondContact O-N 3.41Å |
| 323 | T | 94.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -69.1 | -42.9 | 178.7 | -57.7 | 0 | 0 | 0 | 0 | 111.5 | D118 S121 Y319 A320 T448 | D118-T323 HydrophobicContact CB-CG2 4.27Å; S121-T323 VanDerWaalsContact CB-CG2 3.47Å; S121-T323 PolarHBondContact OG-OG1 3.26Å; Y319-T323 WeakPolarHBondContact O-CB 3.23Å; Y319-T323 PolarHBondContact O-N 2.73Å; Y319-T323 PolarHBondContact O-OG1 3.31Å; A320-T323 PolarHBondContact O-N 3.38Å; T323-T448 HydrophobicContact CG2-CG2 3.86Å |
| 324 | L | 95.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -92.5 | 3.4 | -171.7 | -61 | 171 | 0 | 0 | 0 | 113.6 | A320 L321 N326 R327 M328 Q451 I455 | A320-L324 WeakPolarHBondContact O-CB 3.46Å; A320-L324 WeakPolarHBondContact O-CG 3.42Å; A320-L324 PolarHBondContact O-N 3.46Å; L321-L324 PolarHBondContact O-N 3.45Å; L324-N326 PolarHBondContact O-N 3.17Å; L324-R327 WeakPolarHBondContact O-CB 3.22Å; L324-R327 PolarHBondContact O-N 3.17Å; L324-M328 HydrophobicContact CB-CE 3.9Å; L324-M328 PolarHBondContact O-N 3.3Å; L324-Q451 HydrophobicContact CD1-CB 3.78Å; L324-Q451 HydrophobicContact CD1-CG 3.78Å; L324-I455 HydrophobicContact CB-CD1 4.34Å; L324-I455 HydrophobicContact CD1-CD1 4.22Å |
| 325 | L | 95.4 | Very high | 94.2 | Very high | 1 Ų | 1 | 22.2 Ų | 22.2 | 1% | 0.005 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -59.9 | -46.7 | -172.4 | -171.9 | 63.1 | 0 | 0 | 0 | 113.7 | F224 L321 R327 M328 V329 I343 I347 Y386 | F224-L325 HydrophobicContact CD1-CD2 4.33Å; F224-L325 HydrophobicContact CE1-CB 4.33Å; F224-L325 HydrophobicContact CE1-CD2 3.91Å; F224-L325 HydrophobicContact CZ-CD2 4.23Å; L321-L325 WeakPolarHBondContact O-CB 3.49Å; L321-L325 PolarHBondContact O-N 3.27Å; L325-R327 VanDerWaalsContact C-N 3.35Å; L325-R327 PolarHBondContact O-N 3.38Å; L325-M328 PolarHBondContact O-N 3.45Å; L325-V329 HydrophobicContact CD1-CG2 4.23Å; L325-V329 HydrophobicContact CG-CG2 4.49Å; L325-V329 WeakPolarHBondContact O-CG2 3.47Å; L325-V329 PolarHBondContact O-N 3.45Å; L325-I343 HydrophobicContact CD1-CG2 4.29Å; L325-I343 HydrophobicContact CD2-CG2 4.43Å; L325-I347 HydrophobicContact CD1-CD1 4.11Å; L325-I347 HydrophobicContact CD2-CD1 3.94Å; L325-Y386 WeakPolarHBondContact CD1-OH 3.48Å |
| 326 | N | 94.6 | Very high | 94.1 | Very high | 3 Ų | 3 | 25.2 Ų | 25.2 | 2% | 0.016 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -55.5 | -50.8 | 175.9 | 170.9 | -79.9 | 0 | 0 | 0 | 110.5 | G100 S101 N103 N104 L324 M328 V329 I330 | G100-N326 WeakPolarHBondContact O-CB 3.44Å; S101-N326 PolarHBondContact O-ND2 3.05Å; N103-N326 HydrophobicContact CB-CB 4.22Å; N104-N326 PolarHBondContact N-OD1 3.17Å; N104-N326 PolarHBondContact OD1-ND2 3.13Å; N104-N326 PolarHBondContact OD1-OD1 2.9Å; L324-N326 PolarHBondContact O-N 3.17Å; N326-M328 VanDerWaalsContact C-N 3.32Å; N326-M328 PolarHBondContact O-N 3.26Å; N326-V329 PolarHBondContact O-N 2.9Å; N326-I330 WeakPolarHBondContact O-CB 3.36Å; N326-I330 VanDerWaalsContact O-CG1 3.29Å; N326-I330 WeakPolarHBondContact O-CG1 3.27Å; N326-I330 PolarHBondContact O-N 3.36Å |
| 327 | R | 92.9 | Very high | 93.9 | Very high | 22 Ų | 22 | 26 Ų | 26 | 8% | 0.083 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.8 | -43.3 | 179.2 | -62.7 | 176.8 | 58.1 | -166.6 | -7.6 | 111.8 | N103 D118 L324 L325 W331 G452 D456 | N103-R327 HydrophobicContact CB-CG 4.22Å; D118-R327 IonicContact OD2-CZ 2.8Å; D118-R327 IonicContact OD2-NH1 2.89Å; D118-R327 PolarHBondContact OD2-NH1 2.82Å; L324-R327 WeakPolarHBondContact O-CB 3.22Å; L324-R327 PolarHBondContact O-N 3.17Å; L325-R327 VanDerWaalsContact C-N 3.35Å; L325-R327 PolarHBondContact O-N 3.38Å; R327-W331 WeakPolarHBondContact O-CB 3.35Å; R327-W331 PolarHBondContact O-N 3.47Å; R327-G452 PolarHBondContact NH2-O 3.12Å; R327-D456 IonicContact CZ-OD1 3.7Å; R327-D456 IonicContact CZ-OD2 3.91Å; R327-D456 IonicContact NH1-OD2 2.61Å; R327-D456 IonicContact NH2-OD1 2.67Å; R327-D456 PolarHBondContact NH2-OD1 2.92Å; R327-D456 IonicContact NH2-OD2 3.61Å; R327-D456 PolarHBondContact NH2-OD2 3.01Å |
| 328 | M | 94.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -66.7 | -42 | 179.4 | -77.4 | -175.4 | -84.3 | 0 | 0 | 114.1 | L321 L324 L325 N326 H332 L390 I455 T460 N464 | L321-M328 HydrophobicContact CD1-CE 3.98Å; L324-M328 HydrophobicContact CB-CE 3.9Å; L324-M328 PolarHBondContact O-N 3.3Å; L325-M328 PolarHBondContact O-N 3.45Å; N326-M328 VanDerWaalsContact C-N 3.32Å; N326-M328 PolarHBondContact O-N 3.26Å; M328-H332 PolarHBondContact O-ND1 2.71Å; M328-H332 VanDerWaalsContact O-ND1 3.13Å; M328-L390 HydrophobicContact CB-CD2 4.31Å; M328-I455 HydrophobicContact CG-CD1 3.85Å; M328-I455 HydrophobicContact SD-CD1 4.47Å; M328-T460 HydrophobicContact CB-CG2 4.14Å; M328-T460 HydrophobicContact CG-CG2 3.93Å; M328-N464 PolarHBondContact SD-OD1 3.33Å |
| 329 | V | 94.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -74.6 | -48.8 | -179.1 | 177.2 | 0 | 0 | 0 | 0 | 110.6 | L325 N326 W331 H332 Y333 A340 I343 | L325-V329 HydrophobicContact CD1-CG2 4.23Å; L325-V329 HydrophobicContact CG-CG2 4.49Å; L325-V329 WeakPolarHBondContact O-CG2 3.47Å; L325-V329 PolarHBondContact O-N 3.45Å; N326-V329 PolarHBondContact O-N 2.9Å; V329-W331 PolarHBondContact O-N 3.45Å; V329-H332 CarbonylContact O-C 3.57Å; V329-H332 PolarHBondContact O-N 3.04Å; V329-Y333 HydrophobicContact CG1-CD2 4.13Å; V329-Y333 PolarHBondContact O-N 3.3Å; V329-A340 HydrophobicContact CB-CB 3.77Å; V329-A340 HydrophobicContact CG1-CB 3.71Å; V329-A340 HydrophobicContact CG2-CB 4.24Å; V329-I343 HydrophobicContact CG1-CD1 4.19Å; V329-I343 HydrophobicContact CG2-CD1 4.1Å |
| 330 | I | 93.3 | Very high | 93.7 | Very high | 29 Ų | 29 | 28.6 Ų | 28.6 | 15% | 0.149 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63 | -29.8 | -177.4 | -64.6 | -61.4 | 0 | 0 | 0 | 112.5 | N326 H332 Y333 E337 | N326-I330 WeakPolarHBondContact O-CB 3.36Å; N326-I330 VanDerWaalsContact O-CG1 3.29Å; N326-I330 WeakPolarHBondContact O-CG1 3.27Å; N326-I330 PolarHBondContact O-N 3.36Å; I330-H332 PolarHBondContact O-N 2.9Å; I330-Y333 CarbonylContact O-C 3.56Å; I330-E337 HydrophobicContact CD1-CB 4.42Å; I330-E337 HydrophobicContact CD1-CG 3.8Å; I330-E337 HydrophobicContact CG1-CG 4.41Å |
| 331 | W | 91.8 | Very high | 93.6 | Very high | 148 Ų | 148 | 28.7 Ų | 28.7 | 56% | 0.561 | 16% | 0.157 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -32.3 | 171.4 | -173.3 | -73.9 | 0 | 0 | 0 | 113.4 | R327 V329 T460 | R327-W331 WeakPolarHBondContact O-CB 3.35Å; R327-W331 PolarHBondContact O-N 3.47Å; V329-W331 PolarHBondContact O-N 3.45Å; W331-T460 HydrophobicContact CB-CG2 4.27Å; W331-T460 HydrophobicContact CG-CG2 4.29Å |
| 332 | H | 92.1 | Very high | 93.7 | Very high | 50 Ų | 50 | 34 Ų | 34 | 23% | 0.231 | 18% | 0.177 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -102.1 | -23.8 | -178.2 | -68.7 | 82.3 | 0 | 0 | 0 | 113.3 | M328 V329 I330 T460 | M328-H332 PolarHBondContact O-ND1 2.71Å; M328-H332 VanDerWaalsContact O-ND1 3.13Å; V329-H332 CarbonylContact O-C 3.57Å; V329-H332 PolarHBondContact O-N 3.04Å; I330-H332 PolarHBondContact O-N 2.9Å; H332-T460 PolarHBondContact CE1-OG1 2.95Å |
| 333 | Y | 93.3 | Very high | 93.8 | Very high | 21 Ų | 21 | 33.9 Ų | 33.9 | 8% | 0.082 | 18% | 0.176 | C | C | . | . | S | Bend | trans | -138.1 | 79 | -176.1 | -53.7 | -85.5 | 0 | 0 | 0 | 109.2 | V329 I330 E336 L390 G393 H394 L395 V398 | V329-Y333 HydrophobicContact CG1-CD2 4.13Å; V329-Y333 PolarHBondContact O-N 3.3Å; I330-Y333 CarbonylContact O-C 3.56Å; Y333-E336 WeakPolarHBondContact O-CB 3.32Å; Y333-E336 PolarHBondContact O-N 2.95Å; Y333-L390 HydrophobicContact CE2-CD1 4.36Å; Y333-L390 WeakPolarHBondContact CE2-O 3.49Å; Y333-L390 PolarHBondContact OH-O 3.45Å; Y333-G393 WeakPolarHBondContact OH-CA 3.37Å; Y333-G393 PolarHBondContact OH-N 2.84Å; Y333-H394 PolarHBondContact OH-N 3.2Å; Y333-L395 HydrophobicContact CD1-CD1 4.4Å; Y333-L395 HydrophobicContact CD1-CD2 3.55Å; Y333-L395 HydrophobicContact CD1-CG 3.71Å; Y333-L395 HydrophobicContact CD2-CD2 3.77Å; Y333-L395 HydrophobicContact CE1-CD2 3.83Å; Y333-L395 HydrophobicContact CE1-CG 3.82Å; Y333-L395 HydrophobicContact CE2-CD2 4.06Å; Y333-L395 HydrophobicContact CG-CD2 3.53Å; Y333-L395 HydrophobicContact CG-CG 4.21Å; Y333-V398 HydrophobicContact CE2-CG2 4.06Å |
| 334 | P | 90.9 | Very high | 93.9 | Very high | 109 Ų | 109 | 33.9 Ų | 33.9 | 71% | 0.708 | 18% | 0.176 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | 137 | 179.2 | -22.7 | 34.8 | 0 | 0 | 0 | 111.8 | E336 | P334-E336 VanDerWaalsContact C-N 3.33Š|
| 335 | G | 89.2 | Confident | 93.9 | Very high | 58 Ų | 58 | 35.7 Ų | 35.7 | 60% | 0.598 | 19% | 0.185 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 79.2 | 9.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | E337 | G335-E337 VanDerWaalsContact CA-OE2 3.27Å; G335-E337 WeakPolarHBondContact CA-OE2 3.36Å |
| 336 | E | 93.2 | Very high | 94 | Very high | 62 Ų | 62 | 37.7 Ų | 37.7 | 29% | 0.29 | 20% | 0.198 | S | C | . | . | trans | -102.3 | 34.2 | -179.5 | -73.3 | -77.2 | -162.1 | 0 | 0 | 113.1 | Y333 P334 V338 N339 A340 L395 | Y333-E336 WeakPolarHBondContact O-CB 3.32Å; Y333-E336 PolarHBondContact O-N 2.95Å; P334-E336 VanDerWaalsContact C-N 3.33Å; E336-V338 VanDerWaalsContact C-N 3.26Å; E336-V338 PolarHBondContact O-N 3.29Å; E336-N339 HydrophobicContact CB-CB 4.35Å; E336-N339 CarbonylContact O-C 3.6Å; E336-N339 PolarHBondContact O-N 3.4Å; E336-N339 WeakPolarHBondContact OE2-CB 3.45Å; E336-N339 PolarHBondContact OE2-ND2 2.85Å; E336-A340 PolarHBondContact O-N 3.09Å; E336-L395 HydrophobicContact CG-CD1 4.16Å; E336-L395 WeakPolarHBondContact OE1-CD1 3.47Å | ||
| 337 | E | 93.3 | Very high | 94.1 | Very high | 16 Ų | 16 | 37.8 Ų | 37.8 | 8% | 0.075 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -55.7 | -39.8 | -177.4 | -70 | 83.9 | 167.4 | 0 | 0 | 112.4 | N104 I105 P228 N233 I330 G335 N339 A340 G341 | N104-E337 PolarHBondContact ND2-OE1 3.01Å; I105-E337 HydrophobicContact CD1-CG 4.21Å; P228-E337 HydrophobicContact CB-CB 4.45Å; P228-E337 WeakPolarHBondContact CB-O 3.49Å; N233-E337 PolarHBondContact ND2-OE1 3.24Å; I330-E337 HydrophobicContact CD1-CB 4.42Å; I330-E337 HydrophobicContact CD1-CG 3.8Å; I330-E337 HydrophobicContact CG1-CG 4.41Å; G335-E337 VanDerWaalsContact CA-OE2 3.27Å; G335-E337 WeakPolarHBondContact CA-OE2 3.36Å; E337-N339 VanDerWaalsContact C-N 3.33Å; E337-N339 PolarHBondContact O-N 2.98Å; E337-A340 PolarHBondContact O-N 3.28Å; E337-G341 PolarHBondContact O-N 3.26Å |
| 338 | V | 94.3 | Very high | 94.2 | Very high | 50 Ų | 50 | 36.7 Ų | 36.7 | 30% | 0.303 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -65.5 | -37.7 | 177.3 | -179.5 | 0 | 0 | 0 | 0 | 111.1 | P228 V229 E336 R342 | P228-V338 HydrophobicContact CB-CG2 4.34Å; V229-V338 HydrophobicContact CG2-CG1 4.15Å; E336-V338 VanDerWaalsContact C-N 3.26Å; E336-V338 PolarHBondContact O-N 3.29Å; V338-R342 WeakPolarHBondContact O-CD 3.5Å; V338-R342 VanDerWaalsContact O-CG 3.24Å; V338-R342 WeakPolarHBondContact O-CG 3.19Å; V338-R342 PolarHBondContact O-N 3.12Å |
| 339 | N | 94.9 | Very high | 94.2 | Very high | 28 Ų | 28 | 40.6 Ų | 40.6 | 15% | 0.15 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -78.7 | -31.2 | 176.8 | -78.9 | -31.4 | 0 | 0 | 0 | 112.4 | E336 E337 G341 R342 I343 F399 | E336-N339 HydrophobicContact CB-CB 4.35Å; E336-N339 CarbonylContact O-C 3.6Å; E336-N339 PolarHBondContact O-N 3.4Å; E336-N339 WeakPolarHBondContact OE2-CB 3.45Å; E336-N339 PolarHBondContact OE2-ND2 2.85Å; E337-N339 VanDerWaalsContact C-N 3.33Å; E337-N339 PolarHBondContact O-N 2.98Å; N339-G341 VanDerWaalsContact C-N 3.34Å; N339-R342 CarbonylContact O-C 3.49Å; N339-R342 PolarHBondContact O-N 2.93Å; N339-R342 WeakPolarHBondContact OD1-CD 3.46Å; N339-R342 PolarHBondContact OD1-NH1 3.11Å; N339-I343 VanDerWaalsContact O-CG1 3.27Å; N339-I343 WeakPolarHBondContact O-CG1 3.44Å; N339-I343 PolarHBondContact O-N 2.91Å; N339-F399 HydrophobicContact CB-CZ 4.43Å |
| 340 | A | 94.8 | Very high | 94.3 | Very high | 2 Ų | 2 | 41.4 Ų | 41.4 | 2% | 0.017 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.2 | -44.6 | 167.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | V329 E336 E337 I343 G344 | V329-A340 HydrophobicContact CB-CB 3.77Å; V329-A340 HydrophobicContact CG1-CB 3.71Å; V329-A340 HydrophobicContact CG2-CB 4.24Å; E336-A340 PolarHBondContact O-N 3.09Å; E337-A340 PolarHBondContact O-N 3.28Å; A340-I343 PolarHBondContact O-N 3.27Å; A340-G344 PolarHBondContact O-N 3.47Å |
| 341 | G | 95.2 | Very high | 94.4 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.01 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.4 | -43 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | F224 E337 N339 I343 G344 L345 | F224-G341 WeakPolarHBondContact CB-O 3.39Å; F224-G341 WeakPolarHBondContact O-CA 3.48Å; E337-G341 PolarHBondContact O-N 3.26Å; N339-G341 VanDerWaalsContact C-N 3.34Å; G341-I343 VanDerWaalsContact C-N 3.33Å; G341-I343 PolarHBondContact O-N 3.19Å; G341-G344 PolarHBondContact O-N 3.47Å; G341-L345 WeakPolarHBondContact O-CB 3.35Å; G341-L345 PolarHBondContact O-N 2.78Å |
| 342 | R | 96.6 | Very high | 94.4 | Very high | 112 Ų | 112 | 34.9 Ų | 34.9 | 42% | 0.423 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -65.9 | -31.9 | 174.8 | -69.7 | 160.4 | 172.8 | 171.1 | -0.5 | 112.8 | L225 V338 N339 L345 T346 F399 | L225-R342 HydrophobicContact CD1-CG 4.11Å; V338-R342 WeakPolarHBondContact O-CD 3.5Å; V338-R342 VanDerWaalsContact O-CG 3.24Å; V338-R342 WeakPolarHBondContact O-CG 3.19Å; V338-R342 PolarHBondContact O-N 3.12Å; N339-R342 CarbonylContact O-C 3.49Å; N339-R342 PolarHBondContact O-N 2.93Å; N339-R342 WeakPolarHBondContact OD1-CD 3.46Å; N339-R342 PolarHBondContact OD1-NH1 3.11Å; R342-L345 WeakPolarHBondContact O-CB 3.18Å; R342-T346 WeakPolarHBondContact O-CB 3.24Å; R342-T346 PolarHBondContact O-N 3.36Å; R342-T346 PolarHBondContact O-OG1 3.19Å; R342-F399 HydrophobicContact CB-CE1 3.67Å; R342-F399 HydrophobicContact CB-CZ 3.69Å |
| 343 | I | 96.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -65.3 | -43.9 | 172.2 | -70.9 | 159.8 | 0 | 0 | 0 | 109.7 | L325 V329 N339 A340 G341 T346 I347 V398 F399 A402 | L325-I343 HydrophobicContact CD1-CG2 4.29Å; L325-I343 HydrophobicContact CD2-CG2 4.43Å; V329-I343 HydrophobicContact CG1-CD1 4.19Å; V329-I343 HydrophobicContact CG2-CD1 4.1Å; N339-I343 VanDerWaalsContact O-CG1 3.27Å; N339-I343 WeakPolarHBondContact O-CG1 3.44Å; N339-I343 PolarHBondContact O-N 2.91Å; A340-I343 PolarHBondContact O-N 3.27Å; G341-I343 VanDerWaalsContact C-N 3.33Å; G341-I343 PolarHBondContact O-N 3.19Å; I343-T346 WeakPolarHBondContact O-CB 3.45Å; I343-T346 PolarHBondContact O-N 3.05Å; I343-T346 VanDerWaalsContact O-N 3.1Å; I343-I347 HydrophobicContact CG2-CD1 4.12Å; I343-I347 WeakPolarHBondContact O-CG1 3.45Å; I343-I347 PolarHBondContact O-N 2.97Å; I343-V398 HydrophobicContact CD1-CB 4.26Å; I343-V398 HydrophobicContact CD1-CG1 3.79Å; I343-V398 HydrophobicContact CG1-CG1 4.49Å; I343-F399 HydrophobicContact CG1-CD1 4.01Å; I343-F399 HydrophobicContact CG1-CD2 4.26Å; I343-F399 HydrophobicContact CG1-CE1 3.84Å; I343-F399 HydrophobicContact CG1-CE2 4.09Å; I343-F399 HydrophobicContact CG1-CG 4.21Å; I343-F399 HydrophobicContact CG1-CZ 3.88Å; I343-A402 HydrophobicContact CG2-CB 3.71Å |
| 344 | G | 96 | Very high | 94.5 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60.7 | -46 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A340 G341 T346 I347 V348 | A340-G344 PolarHBondContact O-N 3.47Å; G341-G344 PolarHBondContact O-N 3.47Å; G344-T346 VanDerWaalsContact C-N 3.27Å; G344-T346 PolarHBondContact O-N 3.38Å; G344-I347 PolarHBondContact O-N 2.86Å; G344-V348 WeakPolarHBondContact O-CG2 3.41Å; G344-V348 PolarHBondContact O-N 3.07Å; G344-V348 VanDerWaalsContact O-N 3.13Å |
| 345 | L | 96.3 | Very high | 94.4 | Very high | 37 Ų | 37 | 31.7 Ų | 31.7 | 19% | 0.194 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -54.1 | -43.6 | 170 | 179.2 | 70.8 | 0 | 0 | 0 | 112 | A221 L225 G341 R342 V348 I349 | A221-L345 HydrophobicContact CB-CD1 3.75Å; A221-L345 WeakPolarHBondContact O-CD1 3.39Å; L225-L345 HydrophobicContact CB-CD1 4.42Å; L225-L345 HydrophobicContact CB-CD2 4.31Å; L225-L345 HydrophobicContact CD1-CD2 4.19Å; L225-L345 HydrophobicContact CD2-CD2 4Å; L225-L345 HydrophobicContact CG-CD2 4.38Å; G341-L345 WeakPolarHBondContact O-CB 3.35Å; G341-L345 PolarHBondContact O-N 2.78Å; R342-L345 WeakPolarHBondContact O-CB 3.18Å; L345-V348 PolarHBondContact O-N 3.27Å; L345-I349 HydrophobicContact CD1-CD1 3.64Å; L345-I349 HydrophobicContact CD1-CG1 4.19Å; L345-I349 HydrophobicContact CG-CD1 3.89Å; L345-I349 WeakPolarHBondContact O-CB 3.32Å; L345-I349 WeakPolarHBondContact O-CG1 3.42Å; L345-I349 PolarHBondContact O-N 2.98Å |
| 346 | T | 96.7 | Very high | 94.4 | Very high | 44 Ų | 44 | 31.9 Ų | 31.9 | 27% | 0.27 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -66.2 | -44.9 | -179 | -56.4 | 0 | 0 | 0 | 0 | 111.7 | R342 I343 G344 V348 A350 F399 | R342-T346 WeakPolarHBondContact O-CB 3.24Å; R342-T346 PolarHBondContact O-N 3.36Å; R342-T346 PolarHBondContact O-OG1 3.19Å; I343-T346 WeakPolarHBondContact O-CB 3.45Å; I343-T346 PolarHBondContact O-N 3.05Å; I343-T346 VanDerWaalsContact O-N 3.1Å; G344-T346 VanDerWaalsContact C-N 3.27Å; G344-T346 PolarHBondContact O-N 3.38Å; T346-V348 VanDerWaalsContact C-N 3.31Å; T346-V348 PolarHBondContact O-N 2.8Å; T346-A350 WeakPolarHBondContact O-CB 3.48Å; T346-A350 PolarHBondContact O-N 3.26Å; T346-F399 HydrophobicContact CG2-CD1 4.48Å |
| 347 | I | 96 | Very high | 94.3 | Very high | 4 Ų | 4 | 33.4 Ų | 33.4 | 2% | 0.021 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -53.7 | -49.8 | 174 | -70.5 | 162.4 | 0 | 0 | 0 | 110.2 | F318 L321 L325 I343 G344 G351 A402 M405 | F318-I347 HydrophobicContact CE2-CG2 4.1Å; L321-I347 HydrophobicContact CD2-CD1 4.36Å; L325-I347 HydrophobicContact CD1-CD1 4.11Å; L325-I347 HydrophobicContact CD2-CD1 3.94Å; I343-I347 HydrophobicContact CG2-CD1 4.12Å; I343-I347 WeakPolarHBondContact O-CG1 3.45Å; I343-I347 PolarHBondContact O-N 2.97Å; G344-I347 PolarHBondContact O-N 2.86Å; I347-G351 PolarHBondContact O-N 3.24Å; I347-A402 HydrophobicContact CD1-CB 4.08Å; I347-A402 HydrophobicContact CG1-CB 3.77Å; I347-A402 WeakPolarHBondContact CG1-O 3.44Å; I347-M405 HydrophobicContact CD1-CE 4.45Å |
| 348 | V | 95.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -73 | -43.4 | -173.9 | 178.7 | 0 | 0 | 0 | 0 | 112.3 | Q217 I220 A221 F224 G344 L345 T346 G351 M352 | Q217-V348 HydrophobicContact CB-CG1 4.33Å; Q217-V348 VanDerWaalsContact O-CG1 3.25Å; Q217-V348 WeakPolarHBondContact O-CG1 3.41Å; I220-V348 HydrophobicContact CB-CG1 4.44Å; I220-V348 HydrophobicContact CB-CG2 4.37Å; I220-V348 HydrophobicContact CG2-CG2 3.67Å; A221-V348 HydrophobicContact CB-CB 4.08Å; A221-V348 HydrophobicContact CB-CG1 3.72Å; F224-V348 HydrophobicContact CD2-CG2 4.07Å; F224-V348 HydrophobicContact CE2-CG2 3.97Å; G344-V348 WeakPolarHBondContact O-CG2 3.41Å; G344-V348 PolarHBondContact O-N 3.07Å; G344-V348 VanDerWaalsContact O-N 3.13Å; L345-V348 PolarHBondContact O-N 3.27Å; T346-V348 VanDerWaalsContact C-N 3.31Å; T346-V348 PolarHBondContact O-N 2.8Å; V348-G351 CarbonylContact O-C 3.54Å; V348-G351 WeakPolarHBondContact O-CA 3.4Å; V348-G351 PolarHBondContact O-N 2.99Å; V348-M352 HydrophobicContact CG1-SD 4.44Å; V348-M352 WeakPolarHBondContact O-CG 3.42Å; V348-M352 PolarHBondContact O-N 3.41Å |
| 349 | I | 95.5 | Very high | 93.4 | Very high | 82 Ų | 82 | 31.9 Ų | 31.9 | 42% | 0.421 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -66.8 | -45.8 | 178.5 | -70.5 | 179.5 | 0 | 0 | 0 | 111.1 | L345 G351 M352 L353 | L345-I349 HydrophobicContact CD1-CD1 3.64Å; L345-I349 HydrophobicContact CD1-CG1 4.19Å; L345-I349 HydrophobicContact CG-CD1 3.89Å; L345-I349 WeakPolarHBondContact O-CB 3.32Å; L345-I349 WeakPolarHBondContact O-CG1 3.42Å; L345-I349 PolarHBondContact O-N 2.98Å; I349-G351 PolarHBondContact O-N 2.95Å; I349-M352 PolarHBondContact O-N 3.3Å; I349-L353 PolarHBondContact O-N 2.95Å; I349-L353 VanDerWaalsContact O-N 3.13Å |
| 350 | A | 96.3 | Very high | 92.9 | Very high | 17 Ų | 17 | 35.2 Ų | 35.2 | 14% | 0.14 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.9 | -39.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | T346 M352 L353 G354 G403 F407 | T346-A350 WeakPolarHBondContact O-CB 3.48Å; T346-A350 PolarHBondContact O-N 3.26Å; A350-M352 PolarHBondContact O-N 3.48Å; A350-L353 WeakPolarHBondContact O-CB 3.39Å; A350-L353 PolarHBondContact O-N 3.23Å; A350-G354 PolarHBondContact O-N 3.17Å; A350-G403 WeakPolarHBondContact CB-O 3.4Å; A350-F407 HydrophobicContact CB-CB 4.26Å; A350-F407 WeakPolarHBondContact O-CA 3.37Å; A350-F407 VanDerWaalsContact O-CD2 3.3Å; A350-F407 WeakPolarHBondContact O-CD2 3.37Å |
| 351 | G | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 42.7 Ų | 42.7 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58 | -42.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | I347 V348 I349 G354 A355 G406 T410 | I347-G351 PolarHBondContact O-N 3.24Å; V348-G351 CarbonylContact O-C 3.54Å; V348-G351 WeakPolarHBondContact O-CA 3.4Å; V348-G351 PolarHBondContact O-N 2.99Å; I349-G351 PolarHBondContact O-N 2.95Å; G351-G354 PolarHBondContact O-N 3.49Å; G351-A355 WeakPolarHBondContact O-CB 3.09Å; G351-A355 PolarHBondContact O-N 2.93Å; G351-G406 WeakPolarHBondContact CA-O 3.42Å; G351-T410 VanDerWaalsContact CA-CB 3.43Å |
| 352 | M | 92.3 | Very high | 91.8 | Very high | 40 Ų | 40 | 43 Ų | 43 | 20% | 0.197 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.4 | -38.1 | 174.9 | -70.6 | 173.8 | 67.3 | 0 | 0 | 111.8 | F214 Q217 V348 I349 A350 A355 V356 | F214-M352 HydrophobicContact CB-CE 3.91Å; F214-M352 HydrophobicContact CD1-CE 4.18Å; F214-M352 HydrophobicContact CD1-CG 4.47Å; F214-M352 HydrophobicContact CG-CE 4.13Å; Q217-M352 HydrophobicContact CB-CE 4.42Å; Q217-M352 HydrophobicContact CB-CG 3.76Å; Q217-M352 HydrophobicContact CB-SD 3.68Å; Q217-M352 HydrophobicContact CG-CG 4.32Å; V348-M352 HydrophobicContact CG1-SD 4.44Å; V348-M352 WeakPolarHBondContact O-CG 3.42Å; V348-M352 PolarHBondContact O-N 3.41Å; I349-M352 PolarHBondContact O-N 3.3Å; A350-M352 PolarHBondContact O-N 3.48Å; M352-A355 PolarHBondContact O-N 3.21Å; M352-V356 WeakPolarHBondContact O-CG2 3.43Å; M352-V356 PolarHBondContact O-N 2.93Å; M352-V356 VanDerWaalsContact O-N 3.1Å |
| 353 | L | 93.7 | Very high | 91 | Very high | 103 Ų | 103 | 42.1 Ų | 42.1 | 54% | 0.539 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -65.6 | -43 | 173.5 | -64.7 | 172.7 | 0 | 0 | 0 | 111.5 | I349 A350 A355 V356 I357 F407 | I349-L353 PolarHBondContact O-N 2.95Å; I349-L353 VanDerWaalsContact O-N 3.13Å; A350-L353 WeakPolarHBondContact O-CB 3.39Å; A350-L353 PolarHBondContact O-N 3.23Å; L353-A355 VanDerWaalsContact C-N 3.34Å; L353-A355 PolarHBondContact O-N 2.83Å; L353-V356 PolarHBondContact O-N 3.44Å; L353-I357 WeakPolarHBondContact O-CB 3.39Å; L353-I357 WeakPolarHBondContact O-CG1 3.29Å; L353-I357 PolarHBondContact O-N 2.96Å; L353-F407 HydrophobicContact CB-CD2 4.44Å; L353-F407 HydrophobicContact CB-CE2 4.3Å |
| 354 | G | 92.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 52.6 Ų | 52.6 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.8 | -41.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A350 G351 I357 S358 F407 | A350-G354 PolarHBondContact O-N 3.17Å; G351-G354 PolarHBondContact O-N 3.49Å; G354-I357 PolarHBondContact O-N 3.21Å; G354-S358 WeakPolarHBondContact O-CB 3.32Å; G354-S358 PolarHBondContact O-N 3.22Å; G354-S358 PolarHBondContact O-OG 3.44Å; G354-F407 VanDerWaalsContact CA-CE2 3.48Å |
| 355 | A | 89.5 | Confident | 89.5 | Confident | 9 Ų | 9 | 54.5 Ų | 54.5 | 7% | 0.074 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.7 | -46.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | F214 G351 M352 L353 G359 P414 | F214-A355 HydrophobicContact CE1-CB 4.09Å; F214-A355 HydrophobicContact CZ-CB 4.5Å; G351-A355 WeakPolarHBondContact O-CB 3.09Å; G351-A355 PolarHBondContact O-N 2.93Å; M352-A355 PolarHBondContact O-N 3.21Å; L353-A355 VanDerWaalsContact C-N 3.34Å; L353-A355 PolarHBondContact O-N 2.83Å; A355-G359 PolarHBondContact O-N 2.95Å; A355-P414 HydrophobicContact CB-CG 3.82Å |
| 356 | V | 89.1 | Confident | 88.9 | Confident | 62 Ų | 62 | 56.5 Ų | 56.5 | 38% | 0.376 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.1 | -48 | 176.9 | 171.8 | 0 | 0 | 0 | 0 | 111.4 | F214 M352 L353 G359 I360 | F214-V356 HydrophobicContact CE1-CG2 4.49Å; F214-V356 HydrophobicContact CE2-CG2 3.76Å; F214-V356 HydrophobicContact CZ-CG2 3.49Å; F214-V356 VanDerWaalsContact CZ-CG2 3.49Å; M352-V356 WeakPolarHBondContact O-CG2 3.43Å; M352-V356 PolarHBondContact O-N 2.93Å; M352-V356 VanDerWaalsContact O-N 3.1Å; L353-V356 PolarHBondContact O-N 3.44Å; V356-G359 PolarHBondContact O-N 3.13Å; V356-I360 HydrophobicContact CG1-CD1 3.71Å; V356-I360 WeakPolarHBondContact O-CG1 3.49Å; V356-I360 PolarHBondContact O-N 3.46Å |
| 357 | I | 90.8 | Very high | 88.2 | Confident | 94 Ų | 94 | 56.6 Ų | 56.6 | 48% | 0.482 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -65.8 | -43.3 | -177.7 | -70.1 | 165.3 | 0 | 0 | 0 | 111 | L353 G354 G359 I360 W361 F407 | L353-I357 WeakPolarHBondContact O-CB 3.39Å; L353-I357 WeakPolarHBondContact O-CG1 3.29Å; L353-I357 PolarHBondContact O-N 2.96Å; G354-I357 PolarHBondContact O-N 3.21Å; I357-G359 VanDerWaalsContact C-N 3.34Å; I357-G359 PolarHBondContact O-N 3.45Å; I357-I360 PolarHBondContact O-N 3.03Å; I357-W361 VanDerWaalsContact O-CB 3.29Å; I357-W361 WeakPolarHBondContact O-CB 3.31Å; I357-W361 PolarHBondContact O-N 3.42Å; I357-F407 HydrophobicContact CB-CZ 4.45Å; I357-F407 HydrophobicContact CD1-CE2 3.9Å; I357-F407 HydrophobicContact CD1-CZ 3.9Å |
| 358 | S | 86.6 | Confident | 87.6 | Confident | 10 Ų | 10 | 56.8 Ų | 56.8 | 7% | 0.07 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -66.1 | -36.5 | 178.1 | -56.4 | 0 | 0 | 0 | 0 | 112 | G354 L362 | G354-S358 WeakPolarHBondContact O-CB 3.32Å; G354-S358 PolarHBondContact O-N 3.22Å; G354-S358 PolarHBondContact O-OG 3.44Å; S358-L362 WeakPolarHBondContact O-CB 3.47Å; S358-L362 PolarHBondContact O-N 3.15Å |
| 359 | G | 82.3 | Confident | 87.2 | Confident | 25 Ų | 25 | 59.1 Ų | 59.1 | 26% | 0.258 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -62.7 | -53 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A355 V356 I357 W361 L362 D363 | A355-G359 PolarHBondContact O-N 2.95Å; V356-G359 PolarHBondContact O-N 3.13Å; I357-G359 VanDerWaalsContact C-N 3.34Å; I357-G359 PolarHBondContact O-N 3.45Å; G359-W361 VanDerWaalsContact C-N 3.29Å; G359-W361 PolarHBondContact O-N 3.24Å; G359-L362 PolarHBondContact O-N 3.29Å; G359-D363 WeakPolarHBondContact O-CB 3.45Å; G359-D363 PolarHBondContact O-N 3.16Å |
| 360 | I | 84.1 | Confident | 86.9 | Confident | 97 Ų | 97 | 61 Ų | 61 | 50% | 0.497 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.4 | -37.5 | 179.1 | -66.6 | 167.4 | 0 | 0 | 0 | 111.7 | V356 I357 R364 | V356-I360 HydrophobicContact CG1-CD1 3.71Å; V356-I360 WeakPolarHBondContact O-CG1 3.49Å; V356-I360 PolarHBondContact O-N 3.46Å; I357-I360 PolarHBondContact O-N 3.03Å; I360-R364 PolarHBondContact O-N 2.98Å |
| 361 | W | 85.8 | Confident | 86.6 | Confident | 159 Ų | 159 | 60.8 Ų | 60.8 | 60% | 0.602 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -62.7 | -54 | 173.9 | 177.8 | -92.3 | 0 | 0 | 0 | 111.1 | I357 G359 D363 R364 S365 T371 | I357-W361 VanDerWaalsContact O-CB 3.29Å; I357-W361 WeakPolarHBondContact O-CB 3.31Å; I357-W361 PolarHBondContact O-N 3.42Å; G359-W361 VanDerWaalsContact C-N 3.29Å; G359-W361 PolarHBondContact O-N 3.24Å; W361-D363 PolarHBondContact O-N 3.17Å; W361-R364 PolarHBondContact O-N 3.39Å; W361-R364 VanDerWaalsContact O-N 3.09Å; W361-S365 PolarHBondContact O-N 3.06Å; W361-S365 PolarHBondContact O-OG 3.49Å; W361-T371 PolarHBondContact NE1-OG1 3.35Å |
| 362 | L | 81.1 | Confident | 86.4 | Confident | 7 Ų | 7 | 60.8 Ų | 60.8 | 4% | 0.037 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59.1 | -37.7 | 179.8 | -179.8 | 62.6 | 0 | 0 | 0 | 111.8 | S358 G359 R364 K366 Y368 L415 E418 | S358-L362 WeakPolarHBondContact O-CB 3.47Å; S358-L362 PolarHBondContact O-N 3.15Å; G359-L362 PolarHBondContact O-N 3.29Å; L362-R364 PolarHBondContact O-N 3.45Å; L362-K366 WeakPolarHBondContact O-CA 3.49Å; L362-K366 PolarHBondContact O-N 3.11Å; L362-Y368 HydrophobicContact CD1-CD1 3.79Å; L362-Y368 HydrophobicContact CD1-CD2 3.97Å; L362-Y368 HydrophobicContact CD1-CE1 4.04Å; L362-Y368 HydrophobicContact CD1-CE2 4.11Å; L362-Y368 HydrophobicContact CD1-CG 3.73Å; L362-Y368 HydrophobicContact CD2-CD1 3.76Å; L362-Y368 HydrophobicContact CD2-CE1 3.71Å; L362-Y368 HydrophobicContact CG-CD1 4.18Å; L362-Y368 HydrophobicContact CG-CE1 4.03Å; L362-L415 HydrophobicContact CB-CD2 4.1Å; L362-L415 HydrophobicContact CD2-CD2 3.69Å; L362-L415 HydrophobicContact CG-CD2 4.42Å; L362-E418 HydrophobicContact CD2-CB 3.84Å; L362-E418 HydrophobicContact CD2-CG 4.31Å |
| 363 | D | 80 | Confident | 86.4 | Confident | 95 Ų | 95 | 60.7 Ų | 60.7 | 51% | 0.508 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.3 | -29.8 | 179.2 | -108.1 | -31.9 | 0 | 0 | 0 | 113.2 | G359 W361 K366 | G359-D363 WeakPolarHBondContact O-CB 3.45Å; G359-D363 PolarHBondContact O-N 3.16Å; W361-D363 PolarHBondContact O-N 3.17Å; D363-K366 WeakPolarHBondContact O-CE 3.3Å; D363-K366 PolarHBondContact O-NZ 3.08Å; D363-K366 IonicContact OD1-NZ 3.02Å; D363-K366 PolarHBondContact OD1-NZ 3.41Å |
| 364 | R | 79.4 | Confident | 86.5 | Confident | 220 Ų | 220 | 60 Ų | 60 | 83% | 0.83 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -92.8 | -44.9 | 176.7 | -69.1 | -177.6 | 175.2 | 177.3 | -0.9 | 113.2 | I360 W361 L362 | I360-R364 PolarHBondContact O-N 2.98Å; W361-R364 PolarHBondContact O-N 3.39Å; W361-R364 VanDerWaalsContact O-N 3.09Å; L362-R364 PolarHBondContact O-N 3.45Å |
| 365 | S | 83.1 | Confident | 86.6 | Confident | 40 Ų | 40 | 60.5 Ų | 60.5 | 28% | 0.28 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -75.7 | -31.9 | -175.3 | 74.3 | 0 | 0 | 0 | 0 | 112.6 | W361 T367 | W361-S365 PolarHBondContact O-N 3.06Å; W361-S365 PolarHBondContact O-OG 3.49Å; S365-T367 WeakPolarHBondContact CB-OG1 3.36Å; S365-T367 PolarHBondContact O-N 3.37Å; S365-T367 VanDerWaalsContact O-N 3.08Å; S365-T367 PolarHBondContact OG-N 3.29Å; S365-T367 VanDerWaalsContact OG-N 3.1Å; S365-T367 PolarHBondContact OG-OG1 2.85Å |
| 366 | K | 81.9 | Confident | 86.8 | Confident | 79 Ų | 79 | 60 Ų | 60 | 34% | 0.343 | 30% | 0.297 | S | S | . | . | trans | 51.7 | 21.1 | -166.7 | -57.1 | -51.1 | -171.3 | -159.5 | 0 | 113.7 | L362 D363 Y368 | L362-K366 WeakPolarHBondContact O-CA 3.49Å; L362-K366 PolarHBondContact O-N 3.11Å; D363-K366 WeakPolarHBondContact O-CE 3.3Å; D363-K366 PolarHBondContact O-NZ 3.08Å; D363-K366 IonicContact OD1-NZ 3.02Å; D363-K366 PolarHBondContact OD1-NZ 3.41Å; K366-Y368 VanDerWaalsContact C-N 3.34Å; K366-Y368 HydrophobicContact CB-CE2 4.09Å; K366-Y368 HydrophobicContact CD-CE2 4.16Å; K366-Y368 WeakPolarHBondContact O-CD2 3.42Å; K366-Y368 WeakPolarHBondContact O-CE2 3.28Å; K366-Y368 PolarHBondContact O-N 3.49Å; K366-Y368 VanDerWaalsContact O-N 3.13Å | ||
| 367 | T | 83.8 | Confident | 87.2 | Confident | 45 Ų | 45 | 60.9 Ų | 60.9 | 28% | 0.276 | 30% | 0.299 | S | S | . | . | trans | -89.7 | 61.5 | 180 | 56.1 | 0 | 0 | 0 | 0 | 112.2 | S365 K369 E370 T371 | S365-T367 WeakPolarHBondContact CB-OG1 3.36Å; S365-T367 PolarHBondContact O-N 3.37Å; S365-T367 VanDerWaalsContact O-N 3.08Å; S365-T367 PolarHBondContact OG-N 3.29Å; S365-T367 VanDerWaalsContact OG-N 3.1Å; S365-T367 PolarHBondContact OG-OG1 2.85Å; T367-K369 PolarHBondContact O-N 3.27Å; T367-E370 WeakPolarHBondContact CB-OE2 3.12Å; T367-E370 VanDerWaalsContact CG2-OE2 3.31Å; T367-E370 WeakPolarHBondContact CG2-OE2 3.46Å; T367-E370 PolarHBondContact O-N 3.32Å; T367-T371 WeakPolarHBondContact O-CB 3.44Å; T367-T371 PolarHBondContact O-N 2.8Å; T367-T371 PolarHBondContact O-OG1 2.84Å; T367-T371 PolarHBondContact OG1-OG1 2.92Å; T367-T371 VanDerWaalsContact OG1-OG1 3.14Å | ||
| 368 | Y | 82.1 | Confident | 87.5 | Confident | 8 Ų | 8 | 59.8 Ų | 59.8 | 3% | 0.031 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -48.6 | -55.5 | -174.4 | -66.8 | -99.9 | 0 | 0 | 0 | 113.1 | L362 K366 T372 E418 F419 E422 L485 R487 Q488 | L362-Y368 HydrophobicContact CD1-CD1 3.79Å; L362-Y368 HydrophobicContact CD1-CD2 3.97Å; L362-Y368 HydrophobicContact CD1-CE1 4.04Å; L362-Y368 HydrophobicContact CD1-CE2 4.11Å; L362-Y368 HydrophobicContact CD1-CG 3.73Å; L362-Y368 HydrophobicContact CD2-CD1 3.76Å; L362-Y368 HydrophobicContact CD2-CE1 3.71Å; L362-Y368 HydrophobicContact CG-CD1 4.18Å; L362-Y368 HydrophobicContact CG-CE1 4.03Å; K366-Y368 VanDerWaalsContact C-N 3.34Å; K366-Y368 HydrophobicContact CB-CE2 4.09Å; K366-Y368 HydrophobicContact CD-CE2 4.16Å; K366-Y368 WeakPolarHBondContact O-CD2 3.42Å; K366-Y368 WeakPolarHBondContact O-CE2 3.28Å; K366-Y368 PolarHBondContact O-N 3.49Å; K366-Y368 VanDerWaalsContact O-N 3.13Å; Y368-T372 WeakPolarHBondContact O-CB 3.35Å; Y368-T372 PolarHBondContact O-N 3.33Å; Y368-T372 VanDerWaalsContact O-N 3.09Å; Y368-T372 PolarHBondContact O-OG1 2.84Å; Y368-E418 HydrophobicContact CD1-CB 4.39Å; Y368-E418 HydrophobicContact CE1-CB 4.01Å; Y368-F419 HydrophobicContact CD1-CB 4.29Å; Y368-F419 HydrophobicContact CG-CD2 4.48Å; Y368-E422 HydrophobicContact CD1-CB 4.41Å; Y368-E422 HydrophobicContact CD2-CG 4.49Å; Y368-E422 HydrophobicContact CE1-CB 4.4Å; Y368-L485 HydrophobicContact CD2-CD2 3.91Å; Y368-L485 HydrophobicContact CG-CD2 4.34Å; Y368-R487 PolarHBondContact OH-NH2 3.39Å; Y368-Q488 VanDerWaalsContact CE2-NE2 3.3Å |
| 369 | K | 86.4 | Confident | 87.9 | Confident | 49 Ų | 49 | 59.3 Ų | 59.3 | 21% | 0.213 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.6 | -51.3 | -179.9 | 173.6 | 177.1 | -179.4 | 169.1 | 0 | 112.6 | T367 T372 L373 F419 A479 I481 P483 | T367-K369 PolarHBondContact O-N 3.27Å; K369-T372 PolarHBondContact O-N 3.41Å; K369-L373 WeakPolarHBondContact O-CB 3.43Å; K369-L373 PolarHBondContact O-N 3.1Å; K369-F419 HydrophobicContact CB-CE1 4.46Å; K369-F419 HydrophobicContact CB-CZ 4.11Å; K369-A479 WeakPolarHBondContact CE-O 3.29Å; K369-A479 PolarHBondContact NZ-O 2.83Å; K369-I481 VanDerWaalsContact CD-O 3.27Å; K369-I481 WeakPolarHBondContact CD-O 3.44Å; K369-I481 WeakPolarHBondContact CE-O 3.48Å; K369-I481 PolarHBondContact NZ-O 2.88Å; K369-P483 HydrophobicContact CB-CB 4.1Å; K369-P483 HydrophobicContact CD-CG 4.34Å |
| 370 | E | 89.7 | Confident | 88.6 | Confident | 123 Ų | 123 | 59.4 Ų | 59.4 | 58% | 0.575 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -68 | -45.1 | -170.1 | -59.5 | 173.7 | 159.4 | 0 | 0 | 110.8 | T367 T372 L373 V374 | T367-E370 WeakPolarHBondContact CB-OE2 3.12Å; T367-E370 VanDerWaalsContact CG2-OE2 3.31Å; T367-E370 WeakPolarHBondContact CG2-OE2 3.46Å; T367-E370 PolarHBondContact O-N 3.32Å; E370-T372 VanDerWaalsContact C-N 3.34Å; E370-T372 PolarHBondContact O-N 3Å; E370-L373 PolarHBondContact O-N 3.09Å; E370-V374 WeakPolarHBondContact O-CB 3.11Å; E370-V374 WeakPolarHBondContact O-CG2 3.34Å; E370-V374 PolarHBondContact O-N 3.47Å |
| 371 | T | 90.4 | Very high | 89.3 | Confident | 11 Ų | 11 | 58.2 Ų | 58.2 | 7% | 0.067 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.1 | -45.9 | 174.9 | -53 | 0 | 0 | 0 | 0 | 110.5 | W361 T367 L373 V374 V375 L415 | W361-T371 PolarHBondContact NE1-OG1 3.35Å; T367-T371 WeakPolarHBondContact O-CB 3.44Å; T367-T371 PolarHBondContact O-N 2.8Å; T367-T371 PolarHBondContact O-OG1 2.84Å; T367-T371 PolarHBondContact OG1-OG1 2.92Å; T367-T371 VanDerWaalsContact OG1-OG1 3.14Å; T371-L373 PolarHBondContact O-N 3.27Å; T371-V374 PolarHBondContact O-N 3.44Å; T371-V375 WeakPolarHBondContact O-CB 3.43Å; T371-V375 VanDerWaalsContact O-CG2 3.31Å; T371-V375 WeakPolarHBondContact O-CG2 3.44Å; T371-V375 PolarHBondContact O-N 2.9Å; T371-L415 HydrophobicContact CG2-CD1 3.94Å; T371-L415 HydrophobicContact CG2-CD2 3.99Å |
| 372 | T | 89.7 | Confident | 89.8 | Confident | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.006 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.1 | -45.3 | 177 | -58.8 | 0 | 0 | 0 | 0 | 111.9 | Y368 K369 E370 Y376 Y412 F419 T478 | Y368-T372 WeakPolarHBondContact O-CB 3.35Å; Y368-T372 PolarHBondContact O-N 3.33Å; Y368-T372 VanDerWaalsContact O-N 3.09Å; Y368-T372 PolarHBondContact O-OG1 2.84Å; K369-T372 PolarHBondContact O-N 3.41Å; E370-T372 VanDerWaalsContact C-N 3.34Å; E370-T372 PolarHBondContact O-N 3Å; T372-Y376 WeakPolarHBondContact O-CB 3.47Å; T372-Y376 PolarHBondContact O-N 2.85Å; T372-Y412 HydrophobicContact CG2-CD2 4.2Å; T372-Y412 HydrophobicContact CG2-CE2 3.52Å; T372-F419 HydrophobicContact CG2-CD1 4.38Å; T372-T478 HydrophobicContact CG2-CG2 4.12Å |
| 373 | L | 93.2 | Very high | 90.5 | Very high | 38 Ų | 38 | 50.7 Ų | 50.7 | 20% | 0.199 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.9 | -44.8 | 180 | -179.2 | 61 | 0 | 0 | 0 | 112.4 | K369 E370 T371 Y376 I377 A475 T478 A479 | K369-L373 WeakPolarHBondContact O-CB 3.43Å; K369-L373 PolarHBondContact O-N 3.1Å; E370-L373 PolarHBondContact O-N 3.09Å; T371-L373 PolarHBondContact O-N 3.27Å; L373-Y376 WeakPolarHBondContact O-CB 3.12Å; L373-Y376 PolarHBondContact O-N 2.93Å; L373-I377 HydrophobicContact CD1-CD1 4.07Å; L373-I377 HydrophobicContact CD1-CG1 4.4Å; L373-I377 HydrophobicContact CG-CD1 4Å; L373-I377 WeakPolarHBondContact O-CG1 3.4Å; L373-I377 PolarHBondContact O-N 2.98Å; L373-A475 WeakPolarHBondContact CD1-O 3.49Å; L373-T478 HydrophobicContact CB-CG2 4.15Å; L373-T478 HydrophobicContact CD1-CG2 4.04Å; L373-A479 HydrophobicContact CD1-CB 4.11Å; L373-A479 HydrophobicContact CD2-CB 4.16Å |
| 374 | V | 94.6 | Very high | 91.3 | Very high | 88 Ų | 88 | 48.8 Ų | 48.8 | 53% | 0.533 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.4 | -45.5 | 177.7 | 169.9 | 0 | 0 | 0 | 0 | 110.7 | E370 T371 Y376 I377 M378 | E370-V374 WeakPolarHBondContact O-CB 3.11Å; E370-V374 WeakPolarHBondContact O-CG2 3.34Å; E370-V374 PolarHBondContact O-N 3.47Å; T371-V374 PolarHBondContact O-N 3.44Å; V374-Y376 VanDerWaalsContact C-N 3.31Å; V374-Y376 PolarHBondContact O-N 3.35Å; V374-I377 PolarHBondContact O-N 3.39Å; V374-M378 HydrophobicContact CG1-CG 4.41Å; V374-M378 WeakPolarHBondContact O-CB 3.36Å; V374-M378 WeakPolarHBondContact O-CG 3.19Å; V374-M378 PolarHBondContact O-N 2.93Å |
| 375 | V | 94.3 | Very high | 92.1 | Very high | 10 Ų | 10 | 41.3 Ų | 41.3 | 6% | 0.061 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.9 | -33.2 | 177.3 | 175.3 | 0 | 0 | 0 | 0 | 111.5 | T371 T379 F408 L415 | T371-V375 WeakPolarHBondContact O-CB 3.43Å; T371-V375 VanDerWaalsContact O-CG2 3.31Å; T371-V375 WeakPolarHBondContact O-CG2 3.44Å; T371-V375 PolarHBondContact O-N 2.9Å; V375-T379 WeakPolarHBondContact O-CB 3.45Å; V375-T379 PolarHBondContact O-N 2.9Å; V375-T379 PolarHBondContact O-OG1 3.32Å; V375-F408 HydrophobicContact CG1-CB 4.19Å; V375-F408 HydrophobicContact CG1-CD1 4.36Å; V375-F408 WeakPolarHBondContact CG1-O 3.44Å; V375-L415 HydrophobicContact CB-CD1 3.99Å; V375-L415 HydrophobicContact CG1-CD1 4.23Å; V375-L415 HydrophobicContact CG2-CD1 3.86Å |
| 376 | Y | 94.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.8 | -48.8 | 171.5 | -146 | -50.7 | 0 | 0 | 0 | 111.7 | T310 L313 N314 T372 L373 V374 M378 T379 L380 Y412 L471 G474 A475 T478 | T310-Y376 WeakPolarHBondContact O-CE2 3.22Å; T310-Y376 PolarHBondContact O-OH 3.17Å; T310-Y376 VanDerWaalsContact O-OH 3.06Å; L313-Y376 WeakPolarHBondContact CB-OH 3.35Å; N314-Y376 HydrophobicContact CB-CE1 4.4Å; N314-Y376 HydrophobicContact CB-CE2 3.94Å; N314-Y376 PolarHBondContact N-OH 3.47Å; T372-Y376 WeakPolarHBondContact O-CB 3.47Å; T372-Y376 PolarHBondContact O-N 2.85Å; L373-Y376 WeakPolarHBondContact O-CB 3.12Å; L373-Y376 PolarHBondContact O-N 2.93Å; V374-Y376 VanDerWaalsContact C-N 3.31Å; V374-Y376 PolarHBondContact O-N 3.35Å; Y376-M378 VanDerWaalsContact C-N 3.33Å; Y376-M378 PolarHBondContact O-N 3.24Å; Y376-T379 VanDerWaalsContact O-CB 3.28Å; Y376-T379 WeakPolarHBondContact O-CB 3.35Å; Y376-T379 PolarHBondContact O-N 3.35Å; Y376-T379 VanDerWaalsContact O-N 3.11Å; Y376-L380 PolarHBondContact O-N 3.44Å; Y376-Y412 HydrophobicContact CD2-CD2 4.07Å; Y376-Y412 AromaticContact CD2-CE2 3.39Å; Y376-Y412 HydrophobicContact CD2-CE2 3.39Å; Y376-Y412 AromaticContact CD2-CZ 3.82Å; Y376-Y412 AromaticContact CE2-CE2 3.91Å; Y376-Y412 HydrophobicContact CE2-CE2 3.91Å; Y376-Y412 AromaticContact CE2-CZ 3.84Å; Y376-Y412 HydrophobicContact CG-CE2 4.24Å; Y376-L471 HydrophobicContact CE1-CB 4.33Å; Y376-L471 HydrophobicContact CE1-CD2 3.78Å; Y376-L471 VanDerWaalsContact CE1-O 3.26Å; Y376-L471 WeakPolarHBondContact CE1-O 3.39Å; Y376-G474 WeakPolarHBondContact OH-CA 3.43Å; Y376-A475 HydrophobicContact CD1-CB 3.84Å; Y376-A475 HydrophobicContact CE1-CB 4.41Å; Y376-A475 HydrophobicContact CG-CB 4.27Å; Y376-T478 WeakPolarHBondContact CD2-OG1 3.33Å |
| 377 | I | 96.5 | Very high | 93.4 | Very high | 79 Ų | 79 | 35.7 Ų | 35.7 | 41% | 0.405 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -62.1 | -42.1 | 179.1 | -68 | 166.3 | 0 | 0 | 0 | 110.6 | L373 V374 T379 L380 V381 A475 | L373-I377 HydrophobicContact CD1-CD1 4.07Å; L373-I377 HydrophobicContact CD1-CG1 4.4Å; L373-I377 HydrophobicContact CG-CD1 4Å; L373-I377 WeakPolarHBondContact O-CG1 3.4Å; L373-I377 PolarHBondContact O-N 2.98Å; V374-I377 PolarHBondContact O-N 3.39Å; I377-T379 VanDerWaalsContact C-N 3.31Å; I377-T379 PolarHBondContact O-N 3.49Å; I377-L380 PolarHBondContact O-N 2.83Å; I377-V381 WeakPolarHBondContact O-CG2 3.47Å; I377-V381 PolarHBondContact O-N 3.31Å; I377-A475 HydrophobicContact CG1-CB 4.33Å |
| 378 | M | 96.9 | Very high | 93.9 | Very high | 72 Ų | 72 | 39.4 Ų | 39.4 | 36% | 0.355 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -67 | -30.4 | 175.3 | -67.7 | -59.1 | -64.9 | 0 | 0 | 113 | V374 Y376 G382 F408 | V374-M378 HydrophobicContact CG1-CG 4.41Å; V374-M378 WeakPolarHBondContact O-CB 3.36Å; V374-M378 WeakPolarHBondContact O-CG 3.19Å; V374-M378 PolarHBondContact O-N 2.93Å; Y376-M378 VanDerWaalsContact C-N 3.33Å; Y376-M378 PolarHBondContact O-N 3.24Å; M378-G382 PolarHBondContact O-N 3.26Å; M378-F408 HydrophobicContact CB-CB 4.12Å; M378-F408 HydrophobicContact CB-CD1 3.55Å; M378-F408 HydrophobicContact CB-CD2 3.67Å; M378-F408 HydrophobicContact CB-CE1 3.8Å; M378-F408 HydrophobicContact CB-CE2 3.92Å; M378-F408 HydrophobicContact CB-CG 3.49Å; M378-F408 VanDerWaalsContact CB-CG 3.49Å; M378-F408 HydrophobicContact CB-CZ 3.99Å; M378-F408 HydrophobicContact CE-CD2 4.44Å; M378-F408 HydrophobicContact CE-CE1 4.46Å; M378-F408 HydrophobicContact CE-CE2 3.65Å; M378-F408 HydrophobicContact CE-CZ 3.67Å; M378-F408 HydrophobicContact CG-CD1 4.27Å; M378-F408 HydrophobicContact CG-CE1 4.06Å; M378-F408 HydrophobicContact CG-CE2 4.5Å; M378-F408 HydrophobicContact CG-CZ 4.19Å |
| 379 | T | 96.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.7 | -47.3 | 170.1 | -60.1 | 0 | 0 | 0 | 0 | 111.1 | V375 Y376 I377 G382 M383 F408 M409 L471 | V375-T379 WeakPolarHBondContact O-CB 3.45Å; V375-T379 PolarHBondContact O-N 2.9Å; V375-T379 PolarHBondContact O-OG1 3.32Å; Y376-T379 VanDerWaalsContact O-CB 3.28Å; Y376-T379 WeakPolarHBondContact O-CB 3.35Å; Y376-T379 PolarHBondContact O-N 3.35Å; Y376-T379 VanDerWaalsContact O-N 3.11Å; I377-T379 VanDerWaalsContact C-N 3.31Å; I377-T379 PolarHBondContact O-N 3.49Å; T379-G382 PolarHBondContact O-N 2.66Å; T379-M383 WeakPolarHBondContact O-CB 3.33Å; T379-M383 PolarHBondContact O-N 2.82Å; T379-F408 VanDerWaalsContact OG1-C 3.26Å; T379-F408 WeakPolarHBondContact OG1-CB 3.43Å; T379-F408 PolarHBondContact OG1-O 3Å; T379-M409 HydrophobicContact CG2-CB 3.71Å; T379-M409 HydrophobicContact CG2-CE 4.37Å; T379-M409 HydrophobicContact CG2-CG 3.69Å; T379-M409 WeakPolarHBondContact OG1-CA 3.37Å; T379-M409 PolarHBondContact OG1-N 3.23Å; T379-L471 HydrophobicContact CG2-CD2 4.44Å |
| 380 | L | 96.9 | Very high | 94.7 | Very high | 27 Ų | 27 | 37.6 Ų | 37.6 | 14% | 0.141 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.5 | -47 | 176.8 | 172.9 | 62.9 | 0 | 0 | 0 | 111.6 | Y376 I377 G382 M383 V384 C468 L471 T472 | Y376-L380 PolarHBondContact O-N 3.44Å; I377-L380 PolarHBondContact O-N 2.83Å; L380-G382 PolarHBondContact O-N 2.96Å; L380-M383 PolarHBondContact O-N 3.25Å; L380-V384 HydrophobicContact CD1-CG2 4.22Å; L380-V384 WeakPolarHBondContact O-CG2 3.24Å; L380-V384 PolarHBondContact O-N 3Å; L380-C468 HydrophobicContact CD1-CB 4.21Å; L380-C468 WeakPolarHBondContact CD1-O 3.24Å; L380-L471 HydrophobicContact CB-CB 4.45Å; L380-L471 HydrophobicContact CD1-CB 3.87Å; L380-T472 WeakPolarHBondContact CD1-OG1 3.14Å; L380-T472 HydrophobicContact CD2-CG2 4.47Å; L380-T472 WeakPolarHBondContact CD2-OG1 3.43Å |
| 381 | V | 97.6 | Very high | 94.6 | Very high | 72 Ų | 72 | 34.5 Ų | 34.5 | 44% | 0.436 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -60.9 | -44.3 | 176.2 | 172 | 0 | 0 | 0 | 0 | 110.9 | I377 M383 V384 V385 | I377-V381 WeakPolarHBondContact O-CG2 3.47Å; I377-V381 PolarHBondContact O-N 3.31Å; V381-M383 VanDerWaalsContact C-N 3.35Å; V381-M383 PolarHBondContact O-N 2.99Å; V381-V384 PolarHBondContact O-N 3.31Å; V381-V385 HydrophobicContact CG1-CG2 4.39Å; V381-V385 WeakPolarHBondContact O-CB 3.46Å; V381-V385 VanDerWaalsContact O-CG2 3.31Å; V381-V385 WeakPolarHBondContact O-CG2 3.04Å; V381-V385 PolarHBondContact O-N 3.01Å |
| 382 | G | 96.8 | Very high | 94.5 | Very high | 7 Ų | 7 | 38.3 Ų | 38.3 | 7% | 0.072 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -58.4 | -43.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | M378 T379 L380 V385 Y386 | M378-G382 PolarHBondContact O-N 3.26Å; T379-G382 PolarHBondContact O-N 2.66Å; L380-G382 PolarHBondContact O-N 2.96Å; G382-V385 PolarHBondContact O-N 2.97Å; G382-Y386 VanDerWaalsContact O-CB 3.29Å; G382-Y386 WeakPolarHBondContact O-CB 3.37Å; G382-Y386 PolarHBondContact O-N 2.74Å |
| 383 | M | 96.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -68 | -40.7 | 177.9 | -175 | 57.4 | 179.7 | 0 | 0 | 112.7 | L321 T379 L380 V381 Y386 T387 M405 N464 L467 L471 | L321-M383 HydrophobicContact CD1-CE 4.23Å; L321-M383 HydrophobicContact CD1-SD 4.16Å; T379-M383 WeakPolarHBondContact O-CB 3.33Å; T379-M383 PolarHBondContact O-N 2.82Å; L380-M383 PolarHBondContact O-N 3.25Å; V381-M383 VanDerWaalsContact C-N 3.35Å; V381-M383 PolarHBondContact O-N 2.99Å; M383-Y386 HydrophobicContact SD-CD1 4.01Å; M383-T387 WeakPolarHBondContact O-CB 3.3Å; M383-T387 PolarHBondContact O-N 2.89Å; M383-T387 PolarHBondContact O-OG1 3.43Å; M383-M405 HydrophobicContact CB-SD 3.98Å; M383-M405 HydrophobicContact CG-SD 4.34Å; M383-M405 HydrophobicContact SD-SD 3.45Å; M383-N464 HydrophobicContact CE-CB 3.68Å; M383-L467 HydrophobicContact CE-CB 3.81Å; M383-L467 HydrophobicContact CE-CD1 3.65Å; M383-L467 HydrophobicContact CE-CG 4.29Å; M383-L471 HydrophobicContact CB-CD1 4Å; M383-L471 HydrophobicContact CG-CD1 3.98Å |
| 384 | V | 96.9 | Very high | 93.9 | Very high | 55 Ų | 55 | 43.8 Ų | 43.8 | 33% | 0.333 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61 | -48.5 | 173.1 | 168.7 | 0 | 0 | 0 | 0 | 110.5 | L380 V381 T387 F388 C468 | L380-V384 HydrophobicContact CD1-CG2 4.22Å; L380-V384 WeakPolarHBondContact O-CG2 3.24Å; L380-V384 PolarHBondContact O-N 3Å; V381-V384 PolarHBondContact O-N 3.31Å; V384-T387 WeakPolarHBondContact O-CB 3.35Å; V384-T387 PolarHBondContact O-N 2.99Å; V384-F388 HydrophobicContact CG1-CD2 4.07Å; V384-F388 HydrophobicContact CG1-CE2 4.1Å; V384-F388 VanDerWaalsContact O-CD2 3.27Å; V384-F388 WeakPolarHBondContact O-CD2 3.39Å; V384-F388 PolarHBondContact O-N 3.39Å; V384-C468 HydrophobicContact CG2-CB 4.24Å |
| 385 | V | 96.8 | Very high | 93.7 | Very high | 63 Ų | 63 | 41.2 Ų | 41.2 | 38% | 0.382 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -60.6 | -51.1 | 178.2 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | V381 G382 T387 F388 T389 T401 | V381-V385 HydrophobicContact CG1-CG2 4.39Å; V381-V385 WeakPolarHBondContact O-CB 3.46Å; V381-V385 VanDerWaalsContact O-CG2 3.31Å; V381-V385 WeakPolarHBondContact O-CG2 3.04Å; V381-V385 PolarHBondContact O-N 3.01Å; G382-V385 PolarHBondContact O-N 2.97Å; V385-T387 PolarHBondContact O-N 3.4Å; V385-F388 PolarHBondContact O-N 3.19Å; V385-F388 VanDerWaalsContact O-N 3.09Å; V385-T389 HydrophobicContact CG1-CG2 4.13Å; V385-T389 WeakPolarHBondContact O-CG2 3.5Å; V385-T389 PolarHBondContact O-N 3.26Å; V385-T389 PolarHBondContact O-OG1 3.23Å; V385-T389 VanDerWaalsContact O-OG1 3.05Å; V385-T401 HydrophobicContact CG1-CG2 3.54Å |
| 386 | Y | 95.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -53.8 | -39.7 | 175.8 | 173.4 | -106.5 | 0 | 0 | 0 | 112.7 | L321 L325 G382 M383 F388 T389 L390 V398 A402 M405 | L321-Y386 HydrophobicContact CD1-CE1 3.96Å; L325-Y386 WeakPolarHBondContact CD1-OH 3.48Å; G382-Y386 VanDerWaalsContact O-CB 3.29Å; G382-Y386 WeakPolarHBondContact O-CB 3.37Å; G382-Y386 PolarHBondContact O-N 2.74Å; M383-Y386 HydrophobicContact SD-CD1 4.01Å; Y386-F388 PolarHBondContact O-N 3.46Å; Y386-T389 WeakPolarHBondContact CA-OG1 3.39Å; Y386-T389 PolarHBondContact O-N 3.48Å; Y386-T389 PolarHBondContact O-OG1 3.42Å; Y386-L390 HydrophobicContact CE2-CD1 4.37Å; Y386-L390 WeakPolarHBondContact O-CB 3.43Å; Y386-L390 PolarHBondContact O-N 3.03Å; Y386-V398 HydrophobicContact CD2-CG1 4.44Å; Y386-V398 HydrophobicContact CE2-CG1 3.82Å; Y386-A402 HydrophobicContact CD2-CB 4.03Å; Y386-A402 HydrophobicContact CE2-CB 3.99Å; Y386-M405 HydrophobicContact CD1-CE 3.81Å; Y386-M405 HydrophobicContact CD1-SD 4.02Å; Y386-M405 HydrophobicContact CD2-CE 4.2Å; Y386-M405 HydrophobicContact CE1-CE 4.18Å; Y386-M405 HydrophobicContact CG-CE 3.83Å; Y386-M405 HydrophobicContact CG-SD 4.11Å |
| 387 | T | 95 | Very high | 93.6 | Very high | 2 Ų | 2 | 50 Ų | 50 | 1% | 0.012 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.9 | -39.7 | 177.9 | -58.7 | 0 | 0 | 0 | 0 | 113 | M383 V384 V385 N464 I465 | M383-T387 WeakPolarHBondContact O-CB 3.3Å; M383-T387 PolarHBondContact O-N 2.89Å; M383-T387 PolarHBondContact O-OG1 3.43Å; V384-T387 WeakPolarHBondContact O-CB 3.35Å; V384-T387 PolarHBondContact O-N 2.99Å; V385-T387 PolarHBondContact O-N 3.4Å; T387-N464 HydrophobicContact CG2-CB 3.69Å; T387-N464 VanDerWaalsContact OG1-CB 3.3Å; T387-N464 WeakPolarHBondContact OG1-CB 3.34Å; T387-I465 HydrophobicContact CG2-CG1 4.37Å |
| 388 | F | 93.9 | Very high | 93.5 | Very high | 122 Ų | 122 | 46.2 Ų | 46.2 | 54% | 0.535 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -89.2 | -18.4 | -179.6 | -71.3 | -70.6 | 0 | 0 | 0 | 113.7 | V384 V385 Y386 N391 | V384-F388 HydrophobicContact CG1-CD2 4.07Å; V384-F388 HydrophobicContact CG1-CE2 4.1Å; V384-F388 VanDerWaalsContact O-CD2 3.27Å; V384-F388 WeakPolarHBondContact O-CD2 3.39Å; V384-F388 PolarHBondContact O-N 3.39Å; V385-F388 PolarHBondContact O-N 3.19Å; V385-F388 VanDerWaalsContact O-N 3.09Å; Y386-F388 PolarHBondContact O-N 3.46Å; F388-N391 PolarHBondContact O-OD1 3.15Å |
| 389 | T | 93.7 | Very high | 93.4 | Very high | 19 Ų | 19 | 45.2 Ų | 45.2 | 12% | 0.117 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -90.6 | -26.6 | 176 | 56.4 | 0 | 0 | 0 | 0 | 114.5 | V385 Y386 N391 L392 V397 T401 | V385-T389 HydrophobicContact CG1-CG2 4.13Å; V385-T389 WeakPolarHBondContact O-CG2 3.5Å; V385-T389 PolarHBondContact O-N 3.26Å; V385-T389 PolarHBondContact O-OG1 3.23Å; V385-T389 VanDerWaalsContact O-OG1 3.05Å; Y386-T389 WeakPolarHBondContact CA-OG1 3.39Å; Y386-T389 PolarHBondContact O-N 3.48Å; Y386-T389 PolarHBondContact O-OG1 3.42Å; T389-N391 PolarHBondContact O-N 3.38Å; T389-N391 VanDerWaalsContact O-N 3.11Å; T389-L392 HydrophobicContact CG2-CD1 4.03Å; T389-L392 WeakPolarHBondContact O-CB 3.44Å; T389-L392 WeakPolarHBondContact O-CG 3.37Å; T389-L392 PolarHBondContact O-N 3.37Å; T389-L392 VanDerWaalsContact O-N 3.08Å; T389-V397 HydrophobicContact CG2-CG1 3.75Å; T389-T401 HydrophobicContact CG2-CG2 4.02Å; T389-T401 PolarHBondContact OG1-OG1 3.47Å |
| 390 | L | 91.4 | Very high | 93.4 | Very high | 1 Ų | 1 | 49.9 Ų | 49.9 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -50.6 | -40.9 | -177 | 179.7 | 63.1 | 0 | 0 | 0 | 112.8 | M328 Y333 Y386 L392 V398 | M328-L390 HydrophobicContact CB-CD2 4.31Å; Y333-L390 HydrophobicContact CE2-CD1 4.36Å; Y333-L390 WeakPolarHBondContact CE2-O 3.49Å; Y333-L390 PolarHBondContact OH-O 3.45Å; Y386-L390 HydrophobicContact CE2-CD1 4.37Å; Y386-L390 WeakPolarHBondContact O-CB 3.43Å; Y386-L390 PolarHBondContact O-N 3.03Å; L390-L392 PolarHBondContact O-N 3Å; L390-V398 HydrophobicContact CD1-CG1 3.92Å; L390-V398 HydrophobicContact CD1-CG2 4.45Å |
| 391 | N | 89 | Confident | 93.4 | Very high | 57 Ų | 57 | 49.3 Ų | 49.3 | 31% | 0.305 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 8.8 | -175.5 | 79 | -91.8 | 0 | 0 | 0 | 115.6 | F388 T389 G393 K461 | F388-N391 PolarHBondContact O-OD1 3.15Å; T389-N391 PolarHBondContact O-N 3.38Å; T389-N391 VanDerWaalsContact O-N 3.11Å; N391-G393 VanDerWaalsContact C-N 3.27Å; N391-G393 PolarHBondContact O-N 2.9Å; N391-K461 PolarHBondContact ND2-NZ 3.16Å; N391-K461 WeakPolarHBondContact OD1-CE 3.24Å; N391-K461 PolarHBondContact OD1-NZ 3.18Å |
| 392 | L | 87.3 | Confident | 93.3 | Very high | 91 Ų | 91 | 45.9 Ų | 45.9 | 48% | 0.476 | 24% | 0.24 | S | C | . | . | S | Bend | trans | -79.2 | -1.4 | -174.5 | -64.9 | 178.1 | 0 | 0 | 0 | 114.6 | T389 L390 H394 | T389-L392 HydrophobicContact CG2-CD1 4.03Å; T389-L392 WeakPolarHBondContact O-CB 3.44Å; T389-L392 WeakPolarHBondContact O-CG 3.37Å; T389-L392 PolarHBondContact O-N 3.37Å; T389-L392 VanDerWaalsContact O-N 3.08Å; L390-L392 PolarHBondContact O-N 3Å; L392-H394 PolarHBondContact O-N 2.99Å |
| 393 | G | 83.3 | Confident | 93.3 | Very high | 53 Ų | 53 | 46 Ų | 46 | 55% | 0.546 | 24% | 0.241 | S | C | . | . | S | Bend | trans | 72.2 | 16.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114 | Y333 N391 | Y333-G393 WeakPolarHBondContact OH-CA 3.37Å; Y333-G393 PolarHBondContact OH-N 2.84Å; N391-G393 VanDerWaalsContact C-N 3.27Å; N391-G393 PolarHBondContact O-N 2.9Å |
| 394 | H | 88.7 | Confident | 93.3 | Very high | 102 Ų | 102 | 49.3 Ų | 49.3 | 47% | 0.472 | 26% | 0.261 | S | S | . | . | trans | -127.2 | 88.8 | -175.6 | -67 | -18.7 | 0 | 0 | 0 | 110.8 | Y333 L392 W396 V397 V398 | Y333-H394 PolarHBondContact OH-N 3.2Å; L392-H394 PolarHBondContact O-N 2.99Å; H394-W396 PolarHBondContact O-N 3.46Å; H394-W396 VanDerWaalsContact O-N 3.09Å; H394-V397 HydrophobicContact CB-CB 4.4Å; H394-V397 HydrophobicContact CB-CG2 3.72Å; H394-V397 WeakPolarHBondContact O-CB 3.49Å; H394-V397 PolarHBondContact O-N 2.95Å; H394-V398 PolarHBondContact O-N 2.86Å | ||
| 395 | L | 89.9 | Confident | 93.2 | Very high | 34 Ų | 34 | 46.7 Ų | 46.7 | 18% | 0.178 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -49.4 | -38.7 | -178.2 | -76.4 | 172 | 0 | 0 | 0 | 113.7 | Y333 E336 V397 V398 F399 | Y333-L395 HydrophobicContact CD1-CD1 4.4Å; Y333-L395 HydrophobicContact CD1-CD2 3.55Å; Y333-L395 HydrophobicContact CD1-CG 3.71Å; Y333-L395 HydrophobicContact CD2-CD2 3.77Å; Y333-L395 HydrophobicContact CE1-CD2 3.83Å; Y333-L395 HydrophobicContact CE1-CG 3.82Å; Y333-L395 HydrophobicContact CE2-CD2 4.06Å; Y333-L395 HydrophobicContact CG-CD2 3.53Å; Y333-L395 HydrophobicContact CG-CG 4.21Å; E336-L395 HydrophobicContact CG-CD1 4.16Å; E336-L395 WeakPolarHBondContact OE1-CD1 3.47Å; L395-V397 VanDerWaalsContact C-N 3.26Å; L395-V397 PolarHBondContact O-N 3.15Å; L395-V398 WeakPolarHBondContact O-CA 3.27Å; L395-V398 VanDerWaalsContact O-CB 3.32Å; L395-V398 WeakPolarHBondContact O-CB 3.34Å; L395-V398 PolarHBondContact O-N 3.4Å; L395-F399 VanDerWaalsContact O-CD2 3.3Å; L395-F399 WeakPolarHBondContact O-CD2 3.08Å; L395-F399 PolarHBondContact O-N 3.36Å |
| 396 | W | 92.4 | Very high | 93.2 | Very high | 171 Ų | 171 | 43.7 Ų | 43.7 | 65% | 0.648 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -61.7 | -32.1 | 179.2 | 71.9 | -95.6 | 0 | 0 | 0 | 113.2 | H394 F399 I400 | H394-W396 PolarHBondContact O-N 3.46Å; H394-W396 VanDerWaalsContact O-N 3.09Å; W396-F399 PolarHBondContact O-N 3.37Å; W396-I400 HydrophobicContact CE3-CD1 3.71Å; W396-I400 HydrophobicContact CZ3-CD1 3.8Å; W396-I400 WeakPolarHBondContact O-CG1 3.49Å; W396-I400 PolarHBondContact O-N 3.09Å; W396-I400 VanDerWaalsContact O-N 3.15Å |
| 397 | V | 94.1 | Very high | 93.2 | Very high | 22 Ų | 22 | 46.1 Ų | 46.1 | 13% | 0.133 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -69.6 | -38.3 | 173.7 | -172.4 | 0 | 0 | 0 | 0 | 110 | T389 H394 L395 I400 T401 | T389-V397 HydrophobicContact CG2-CG1 3.75Å; H394-V397 HydrophobicContact CB-CB 4.4Å; H394-V397 HydrophobicContact CB-CG2 3.72Å; H394-V397 WeakPolarHBondContact O-CB 3.49Å; H394-V397 PolarHBondContact O-N 2.95Å; L395-V397 VanDerWaalsContact C-N 3.26Å; L395-V397 PolarHBondContact O-N 3.15Å; V397-I400 PolarHBondContact O-N 3.44Å; V397-T401 HydrophobicContact CG1-CG2 4.19Å; V397-T401 WeakPolarHBondContact O-CB 3.47Å; V397-T401 WeakPolarHBondContact O-CG2 3.43Å; V397-T401 PolarHBondContact O-N 2.88Å; V397-T401 PolarHBondContact O-OG1 3.41Å |
| 398 | V | 94.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.7 | -43.3 | 175.1 | -166.4 | 0 | 0 | 0 | 0 | 110.5 | Y333 I343 Y386 L390 H394 L395 T401 A402 | Y333-V398 HydrophobicContact CE2-CG2 4.06Å; I343-V398 HydrophobicContact CD1-CB 4.26Å; I343-V398 HydrophobicContact CD1-CG1 3.79Å; I343-V398 HydrophobicContact CG1-CG1 4.49Å; Y386-V398 HydrophobicContact CD2-CG1 4.44Å; Y386-V398 HydrophobicContact CE2-CG1 3.82Å; L390-V398 HydrophobicContact CD1-CG1 3.92Å; L390-V398 HydrophobicContact CD1-CG2 4.45Å; H394-V398 PolarHBondContact O-N 2.86Å; L395-V398 WeakPolarHBondContact O-CA 3.27Å; L395-V398 VanDerWaalsContact O-CB 3.32Å; L395-V398 WeakPolarHBondContact O-CB 3.34Å; L395-V398 PolarHBondContact O-N 3.4Å; V398-T401 PolarHBondContact O-OG1 2.89Å; V398-A402 WeakPolarHBondContact O-CB 3.29Å; V398-A402 PolarHBondContact O-N 3.24Å |
| 399 | F | 95.6 | Very high | 93.2 | Very high | 51 Ų | 51 | 42 Ų | 42 | 22% | 0.224 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -57.4 | -50.5 | 173.9 | -85.5 | -78.1 | 0 | 0 | 0 | 113.1 | N339 R342 I343 T346 L395 W396 G403 | N339-F399 HydrophobicContact CB-CZ 4.43Å; R342-F399 HydrophobicContact CB-CE1 3.67Å; R342-F399 HydrophobicContact CB-CZ 3.69Å; I343-F399 HydrophobicContact CG1-CD1 4.01Å; I343-F399 HydrophobicContact CG1-CD2 4.26Å; I343-F399 HydrophobicContact CG1-CE1 3.84Å; I343-F399 HydrophobicContact CG1-CE2 4.09Å; I343-F399 HydrophobicContact CG1-CG 4.21Å; I343-F399 HydrophobicContact CG1-CZ 3.88Å; T346-F399 HydrophobicContact CG2-CD1 4.48Å; L395-F399 VanDerWaalsContact O-CD2 3.3Å; L395-F399 WeakPolarHBondContact O-CD2 3.08Å; L395-F399 PolarHBondContact O-N 3.36Å; W396-F399 PolarHBondContact O-N 3.37Å; F399-G403 PolarHBondContact O-N 2.95Å |
| 400 | I | 96.3 | Very high | 93 | Very high | 98 Ų | 98 | 41.3 Ų | 41.3 | 50% | 0.503 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -63.2 | -51.5 | 179.9 | -66.9 | 175 | 0 | 0 | 0 | 110.4 | W396 V397 A402 G403 T404 | W396-I400 HydrophobicContact CE3-CD1 3.71Å; W396-I400 HydrophobicContact CZ3-CD1 3.8Å; W396-I400 WeakPolarHBondContact O-CG1 3.49Å; W396-I400 PolarHBondContact O-N 3.09Å; W396-I400 VanDerWaalsContact O-N 3.15Å; V397-I400 PolarHBondContact O-N 3.44Å; I400-A402 PolarHBondContact O-N 3.12Å; I400-G403 PolarHBondContact O-N 3.21Å; I400-T404 PolarHBondContact O-N 3.07Å; I400-T404 PolarHBondContact O-OG1 3.38Å; I400-T404 VanDerWaalsContact O-OG1 3.09Å |
| 401 | T | 96.1 | Very high | 92.8 | Very high | 16 Ų | 16 | 41.2 Ų | 41.2 | 10% | 0.098 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -68.8 | -36.8 | -174.4 | 53 | 0 | 0 | 0 | 0 | 112.9 | V385 T389 V397 V398 M405 | V385-T401 HydrophobicContact CG1-CG2 3.54Å; T389-T401 HydrophobicContact CG2-CG2 4.02Å; T389-T401 PolarHBondContact OG1-OG1 3.47Å; V397-T401 HydrophobicContact CG1-CG2 4.19Å; V397-T401 WeakPolarHBondContact O-CB 3.47Å; V397-T401 WeakPolarHBondContact O-CG2 3.43Å; V397-T401 PolarHBondContact O-N 2.88Å; V397-T401 PolarHBondContact O-OG1 3.41Å; V398-T401 PolarHBondContact O-OG1 2.89Å; T401-M405 VanDerWaalsContact O-CB 3.28Å; T401-M405 WeakPolarHBondContact O-CB 3.46Å; T401-M405 PolarHBondContact O-N 3.45Å |
| 402 | A | 95.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -68 | -38.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.4 | I343 I347 Y386 V398 I400 M405 G406 | I343-A402 HydrophobicContact CG2-CB 3.71Å; I347-A402 HydrophobicContact CD1-CB 4.08Å; I347-A402 HydrophobicContact CG1-CB 3.77Å; I347-A402 WeakPolarHBondContact CG1-O 3.44Å; Y386-A402 HydrophobicContact CD2-CB 4.03Å; Y386-A402 HydrophobicContact CE2-CB 3.99Å; V398-A402 WeakPolarHBondContact O-CB 3.29Å; V398-A402 PolarHBondContact O-N 3.24Å; I400-A402 PolarHBondContact O-N 3.12Å; A402-M405 PolarHBondContact O-N 3.01Å; A402-G406 PolarHBondContact O-N 3.33Å |
| 403 | G | 96.6 | Very high | 92.8 | Very high | 9 Ų | 9 | 35 Ų | 35 | 9% | 0.093 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.1 | -47.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A350 F399 I400 M405 G406 F407 | A350-G403 WeakPolarHBondContact CB-O 3.4Å; F399-G403 PolarHBondContact O-N 2.95Å; I400-G403 PolarHBondContact O-N 3.21Å; G403-M405 PolarHBondContact O-N 2.89Å; G403-G406 PolarHBondContact O-N 3.39Å; G403-F407 WeakPolarHBondContact O-CB 3.23Å; G403-F407 PolarHBondContact O-N 3.15Å |
| 404 | T | 96 | Very high | 92.8 | Very high | 69 Ų | 69 | 34.7 Ų | 34.7 | 42% | 0.423 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -61.7 | -43 | 175.6 | -56.3 | 0 | 0 | 0 | 0 | 111.8 | I400 F408 | I400-T404 PolarHBondContact O-N 3.07Å; I400-T404 PolarHBondContact O-OG1 3.38Å; I400-T404 VanDerWaalsContact O-OG1 3.09Å; T404-F408 HydrophobicContact CG2-CD2 4.41Å; T404-F408 HydrophobicContact CG2-CE2 3.96Å; T404-F408 WeakPolarHBondContact O-CD2 3.32Å |
| 405 | M | 95.7 | Very high | 92.7 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.7 | -49.8 | 174 | 177.4 | -177.8 | 61.1 | 0 | 0 | 111.5 | L321 I347 M383 Y386 T401 A402 G403 F407 F408 M409 | L321-M405 HydrophobicContact CD1-CE 4.05Å; L321-M405 HydrophobicContact CD2-CE 3.58Å; L321-M405 HydrophobicContact CD2-SD 4.36Å; L321-M405 HydrophobicContact CG-CE 4.46Å; I347-M405 HydrophobicContact CD1-CE 4.45Å; M383-M405 HydrophobicContact CB-SD 3.98Å; M383-M405 HydrophobicContact CG-SD 4.34Å; M383-M405 HydrophobicContact SD-SD 3.45Å; Y386-M405 HydrophobicContact CD1-CE 3.81Å; Y386-M405 HydrophobicContact CD1-SD 4.02Å; Y386-M405 HydrophobicContact CD2-CE 4.2Å; Y386-M405 HydrophobicContact CE1-CE 4.18Å; Y386-M405 HydrophobicContact CG-CE 3.83Å; Y386-M405 HydrophobicContact CG-SD 4.11Å; T401-M405 VanDerWaalsContact O-CB 3.28Å; T401-M405 WeakPolarHBondContact O-CB 3.46Å; T401-M405 PolarHBondContact O-N 3.45Å; A402-M405 PolarHBondContact O-N 3.01Å; G403-M405 PolarHBondContact O-N 2.89Å; M405-F407 VanDerWaalsContact C-N 3.33Å; M405-F407 PolarHBondContact O-N 2.85Å; M405-F408 PolarHBondContact O-N 3.11Å; M405-M409 VanDerWaalsContact O-CB 3.24Å; M405-M409 WeakPolarHBondContact O-CB 3.36Å; M405-M409 PolarHBondContact O-N 3.5Å |
| 406 | G | 95.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.3 | -40.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | G351 A402 G403 F408 M409 T410 | G351-G406 WeakPolarHBondContact CA-O 3.42Å; A402-G406 PolarHBondContact O-N 3.33Å; G403-G406 PolarHBondContact O-N 3.39Å; G406-F408 PolarHBondContact O-N 2.9Å; G406-M409 PolarHBondContact O-N 3.31Å; G406-T410 WeakPolarHBondContact O-CB 3.27Å; G406-T410 PolarHBondContact O-N 3.1Å |
| 407 | F | 96.1 | Very high | 92.3 | Very high | 51 Ų | 51 | 22.7 Ų | 22.7 | 22% | 0.224 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -50.4 | -52.9 | 174.6 | -175.9 | -85.7 | 0 | 0 | 0 | 112.4 | A350 L353 G354 I357 G403 M405 G411 | A350-F407 HydrophobicContact CB-CB 4.26Å; A350-F407 WeakPolarHBondContact O-CA 3.37Å; A350-F407 VanDerWaalsContact O-CD2 3.3Å; A350-F407 WeakPolarHBondContact O-CD2 3.37Å; L353-F407 HydrophobicContact CB-CD2 4.44Å; L353-F407 HydrophobicContact CB-CE2 4.3Å; G354-F407 VanDerWaalsContact CA-CE2 3.48Å; I357-F407 HydrophobicContact CB-CZ 4.45Å; I357-F407 HydrophobicContact CD1-CE2 3.9Å; I357-F407 HydrophobicContact CD1-CZ 3.9Å; G403-F407 WeakPolarHBondContact O-CB 3.23Å; G403-F407 PolarHBondContact O-N 3.15Å; M405-F407 VanDerWaalsContact C-N 3.33Å; M405-F407 PolarHBondContact O-N 2.85Å; F407-G411 WeakPolarHBondContact O-CA 3.3Å; F407-G411 PolarHBondContact O-N 3.42Å; F407-G411 VanDerWaalsContact O-N 3.07Å |
| 408 | F | 95.8 | Very high | 91.8 | Very high | 38 Ų | 38 | 24.9 Ų | 24.9 | 17% | 0.167 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -76.4 | -42.6 | 179.3 | -61.6 | -68.6 | 0 | 0 | 0 | 112.1 | V375 M378 T379 T404 M405 G406 T410 G411 Y412 | V375-F408 HydrophobicContact CG1-CB 4.19Å; V375-F408 HydrophobicContact CG1-CD1 4.36Å; V375-F408 WeakPolarHBondContact CG1-O 3.44Å; M378-F408 HydrophobicContact CB-CB 4.12Å; M378-F408 HydrophobicContact CB-CD1 3.55Å; M378-F408 HydrophobicContact CB-CD2 3.67Å; M378-F408 HydrophobicContact CB-CE1 3.8Å; M378-F408 HydrophobicContact CB-CE2 3.92Å; M378-F408 HydrophobicContact CB-CG 3.49Å; M378-F408 VanDerWaalsContact CB-CG 3.49Å; M378-F408 HydrophobicContact CB-CZ 3.99Å; M378-F408 HydrophobicContact CE-CD2 4.44Å; M378-F408 HydrophobicContact CE-CE1 4.46Å; M378-F408 HydrophobicContact CE-CE2 3.65Å; M378-F408 HydrophobicContact CE-CZ 3.67Å; M378-F408 HydrophobicContact CG-CD1 4.27Å; M378-F408 HydrophobicContact CG-CE1 4.06Å; M378-F408 HydrophobicContact CG-CE2 4.5Å; M378-F408 HydrophobicContact CG-CZ 4.19Å; T379-F408 VanDerWaalsContact OG1-C 3.26Å; T379-F408 WeakPolarHBondContact OG1-CB 3.43Å; T379-F408 PolarHBondContact OG1-O 3Å; T404-F408 HydrophobicContact CG2-CD2 4.41Å; T404-F408 HydrophobicContact CG2-CE2 3.96Å; T404-F408 WeakPolarHBondContact O-CD2 3.32Å; M405-F408 PolarHBondContact O-N 3.11Å; G406-F408 PolarHBondContact O-N 2.9Å; F408-T410 PolarHBondContact O-N 3.48Å; F408-G411 PolarHBondContact O-N 2.85Å; F408-Y412 WeakPolarHBondContact O-CB 3.44Å; F408-Y412 PolarHBondContact O-N 3.45Å |
| 409 | M | 93.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64.4 | -44.8 | -174.4 | -165.4 | 176.1 | -145.7 | 0 | 0 | 113.2 | A317 F318 L321 T379 M405 G406 L471 | A317-M409 HydrophobicContact CB-CE 3.65Å; F318-M409 HydrophobicContact CB-CE 4.03Å; F318-M409 HydrophobicContact CB-CG 4.02Å; F318-M409 HydrophobicContact CB-SD 3.86Å; F318-M409 HydrophobicContact CD2-CG 4.38Å; F318-M409 HydrophobicContact CD2-SD 4.08Å; F318-M409 HydrophobicContact CG-SD 4.47Å; F318-M409 VanDerWaalsContact N-CE 3.33Å; L321-M409 HydrophobicContact CD2-SD 4.03Å; T379-M409 HydrophobicContact CG2-CB 3.71Å; T379-M409 HydrophobicContact CG2-CE 4.37Å; T379-M409 HydrophobicContact CG2-CG 3.69Å; T379-M409 WeakPolarHBondContact OG1-CA 3.37Å; T379-M409 PolarHBondContact OG1-N 3.23Å; M405-M409 VanDerWaalsContact O-CB 3.24Å; M405-M409 WeakPolarHBondContact O-CB 3.36Å; M405-M409 PolarHBondContact O-N 3.5Å; G406-M409 PolarHBondContact O-N 3.31Å; M409-L471 HydrophobicContact CE-CD1 4.45Å |
| 410 | T | 89.1 | Confident | 90.9 | Very high | 4 Ų | 4 | 22.5 Ų | 22.5 | 3% | 0.025 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -80.6 | -32 | 173.7 | -64.3 | 0 | 0 | 0 | 0 | 111.4 | G351 G406 F408 Y412 L413 P414 | G351-T410 VanDerWaalsContact CA-CB 3.43Å; G406-T410 WeakPolarHBondContact O-CB 3.27Å; G406-T410 PolarHBondContact O-N 3.1Å; F408-T410 PolarHBondContact O-N 3.48Å; T410-Y412 PolarHBondContact O-N 3.22Å; T410-L413 HydrophobicContact CG2-CD1 4.35Å; T410-L413 WeakPolarHBondContact O-CB 3.49Å; T410-L413 WeakPolarHBondContact O-CG 3.12Å; T410-L413 PolarHBondContact O-N 2.96Å; T410-P414 WeakPolarHBondContact O-CD 3.28Å |
| 411 | G | 87.4 | Confident | 90.2 | Very high | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -62 | -25.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | F407 F408 L413 P414 | F407-G411 WeakPolarHBondContact O-CA 3.3Å; F407-G411 PolarHBondContact O-N 3.42Å; F407-G411 VanDerWaalsContact O-N 3.07Å; F408-G411 PolarHBondContact O-N 2.85Å; G411-L413 VanDerWaalsContact C-N 3.35Å; G411-P414 WeakPolarHBondContact O-CD 3.48Å; G411-P414 WeakPolarHBondContact O-CG 3.39Å |
| 412 | Y | 90.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -64.1 | -32.4 | 171.4 | 176.8 | -91.6 | 0 | 0 | 0 | 113.8 | Y311 N314 T372 Y376 F408 T410 L415 G416 | Y311-Y412 WeakPolarHBondContact CA-OH 3.34Å; Y311-Y412 HydrophobicContact CD2-CD1 4.45Å; Y311-Y412 AromaticContact CD2-CE1 3.72Å; Y311-Y412 HydrophobicContact CD2-CE1 3.72Å; Y311-Y412 HydrophobicContact CE2-CE1 4.44Å; Y311-Y412 HydrophobicContact CG-CE1 4.37Å; Y311-Y412 PolarHBondContact N-OH 3.01Å; N314-Y412 HydrophobicContact CB-CD1 3.67Å; N314-Y412 HydrophobicContact CB-CE1 3.59Å; N314-Y412 HydrophobicContact CB-CG 4.38Å; T372-Y412 HydrophobicContact CG2-CD2 4.2Å; T372-Y412 HydrophobicContact CG2-CE2 3.52Å; Y376-Y412 HydrophobicContact CD2-CD2 4.07Å; Y376-Y412 AromaticContact CD2-CE2 3.39Å; Y376-Y412 HydrophobicContact CD2-CE2 3.39Å; Y376-Y412 AromaticContact CD2-CZ 3.82Å; Y376-Y412 AromaticContact CE2-CE2 3.91Å; Y376-Y412 HydrophobicContact CE2-CE2 3.91Å; Y376-Y412 AromaticContact CE2-CZ 3.84Å; Y376-Y412 HydrophobicContact CG-CE2 4.24Å; F408-Y412 WeakPolarHBondContact O-CB 3.44Å; F408-Y412 PolarHBondContact O-N 3.45Å; T410-Y412 PolarHBondContact O-N 3.22Å; Y412-L415 WeakPolarHBondContact O-CB 3.32Å; Y412-L415 PolarHBondContact O-N 3.05Å; Y412-G416 PolarHBondContact O-N 3.5Å |
| 413 | L | 86.9 | Confident | 88.9 | Confident | 17 Ų | 17 | 17.9 Ų | 17.9 | 9% | 0.089 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -59 | -51.5 | -172.8 | -57.7 | 177.3 | 0 | 0 | 0 | 114.1 | Y311 A315 F318 T410 G411 L415 G416 F417 | Y311-L413 HydrophobicContact CE2-CD2 4.04Å; A315-L413 HydrophobicContact CB-CD2 3.58Å; F318-L413 HydrophobicContact CD1-CD1 4.47Å; T410-L413 HydrophobicContact CG2-CD1 4.35Å; T410-L413 WeakPolarHBondContact O-CB 3.49Å; T410-L413 WeakPolarHBondContact O-CG 3.12Å; T410-L413 PolarHBondContact O-N 2.96Å; G411-L413 VanDerWaalsContact C-N 3.35Å; L413-L415 VanDerWaalsContact C-N 3.34Å; L413-L415 PolarHBondContact O-N 3.45Å; L413-G416 PolarHBondContact O-N 2.86Å; L413-F417 PolarHBondContact O-N 2.91Å |
| 414 | P | 82.9 | Confident | 88.2 | Confident | 46 Ų | 46 | 17.6 Ų | 17.6 | 30% | 0.299 | 9% | 0.091 | S | C | . | . | H | α-helix | trans | -66.6 | -32.3 | 176.1 | 28 | -37.6 | 0 | 0 | 0 | 113.3 | A355 T410 G411 G416 F417 E418 | A355-P414 HydrophobicContact CB-CG 3.82Å; T410-P414 WeakPolarHBondContact O-CD 3.28Å; G411-P414 WeakPolarHBondContact O-CD 3.48Å; G411-P414 WeakPolarHBondContact O-CG 3.39Å; P414-G416 VanDerWaalsContact C-N 3.27Å; P414-G416 PolarHBondContact O-N 3.5Å; P414-F417 PolarHBondContact O-N 2.69Å; P414-E418 PolarHBondContact O-N 3.22Å |
| 415 | L | 86.5 | Confident | 87.3 | Confident | 2 Ų | 2 | 18.8 Ų | 18.8 | 1% | 0.01 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -60.7 | -40.3 | 175.2 | -63.9 | 177.2 | 0 | 0 | 0 | 110.9 | L362 T371 V375 Y412 L413 F419 | L362-L415 HydrophobicContact CB-CD2 4.1Å; L362-L415 HydrophobicContact CD2-CD2 3.69Å; L362-L415 HydrophobicContact CG-CD2 4.42Å; T371-L415 HydrophobicContact CG2-CD1 3.94Å; T371-L415 HydrophobicContact CG2-CD2 3.99Å; V375-L415 HydrophobicContact CB-CD1 3.99Å; V375-L415 HydrophobicContact CG1-CD1 4.23Å; V375-L415 HydrophobicContact CG2-CD1 3.86Å; Y412-L415 WeakPolarHBondContact O-CB 3.32Å; Y412-L415 PolarHBondContact O-N 3.05Å; L413-L415 VanDerWaalsContact C-N 3.34Å; L413-L415 PolarHBondContact O-N 3.45Å; L415-F419 VanDerWaalsContact O-CB 3.26Å; L415-F419 WeakPolarHBondContact O-CB 3.48Å; L415-F419 PolarHBondContact O-N 2.74Å |
| 416 | G | 87.9 | Confident | 86.1 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58 | -47.1 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y412 L413 P414 A420 L436 | Y412-G416 PolarHBondContact O-N 3.5Å; L413-G416 PolarHBondContact O-N 2.86Å; P414-G416 VanDerWaalsContact C-N 3.27Å; P414-G416 PolarHBondContact O-N 3.5Å; G416-A420 WeakPolarHBondContact O-CB 3.42Å; G416-A420 PolarHBondContact O-N 3.13Å; G416-L436 WeakPolarHBondContact O-CD2 3.44Å |
| 417 | F | 85.3 | Confident | 85.1 | Confident | 54 Ų | 54 | 25.5 Ų | 25.5 | 24% | 0.237 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.6 | -45.8 | 178.2 | -63.6 | -45 | 0 | 0 | 0 | 112.9 | Y311 L413 P414 A420 V421 L436 N437 | Y311-F417 HydrophobicContact CE2-CE1 4.46Å; Y311-F417 AromaticContact CZ-CE1 3.96Å; Y311-F417 AromaticContact CZ-CZ 3.98Å; Y311-F417 WeakPolarHBondContact OH-CZ 3.33Å; L413-F417 PolarHBondContact O-N 2.91Å; P414-F417 PolarHBondContact O-N 2.69Å; F417-A420 WeakPolarHBondContact O-CB 3.35Å; F417-A420 PolarHBondContact O-N 2.92Å; F417-V421 WeakPolarHBondContact O-CG2 3.22Å; F417-V421 PolarHBondContact O-N 2.83Å; F417-L436 HydrophobicContact CD1-CB 4.37Å; F417-L436 HydrophobicContact CD1-CD2 3.91Å; F417-L436 HydrophobicContact CE1-CB 4.07Å; F417-L436 HydrophobicContact CE1-CD2 4.33Å; F417-N437 WeakPolarHBondContact CE1-ND2 3.31Å; F417-N437 WeakPolarHBondContact CZ-ND2 3.34Å |
| 418 | E | 83.3 | Confident | 83.8 | Confident | 68 Ų | 68 | 26.2 Ų | 26.2 | 32% | 0.318 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -62.8 | -43.1 | 178.3 | -94.5 | -61.2 | 142 | 0 | 0 | 112.2 | L362 Y368 P414 A420 E422 R487 | L362-E418 HydrophobicContact CD2-CB 3.84Å; L362-E418 HydrophobicContact CD2-CG 4.31Å; Y368-E418 HydrophobicContact CD1-CB 4.39Å; Y368-E418 HydrophobicContact CE1-CB 4.01Å; P414-E418 PolarHBondContact O-N 3.22Å; E418-A420 VanDerWaalsContact C-N 3.32Å; E418-A420 PolarHBondContact O-N 3.43Å; E418-E422 WeakPolarHBondContact O-CB 3.31Å; E418-E422 PolarHBondContact O-N 2.94Å; E418-E422 VanDerWaalsContact O-N 3.14Å; E418-R487 IonicContact OE1-NH1 2.81Å; E418-R487 IonicContact OE2-CZ 2.69Å; E418-R487 IonicContact OE2-NH1 2.87Å; E418-R487 PolarHBondContact OE2-NH1 3.4Å; E418-R487 IonicContact OE2-NH2 3.28Å; E418-R487 PolarHBondContact OE2-NH2 2.95Å |
| 419 | F | 85.7 | Confident | 82.7 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -68.8 | -31.8 | 175.9 | -170 | -159.8 | 0 | 0 | 0 | 112 | L307 Y368 K369 T372 L415 E422 L423 I481 | L307-F419 HydrophobicContact CD1-CD1 3.88Å; L307-F419 HydrophobicContact CD1-CE1 4.44Å; L307-F419 HydrophobicContact CD2-CB 4.03Å; L307-F419 HydrophobicContact CD2-CD1 3.95Å; L307-F419 HydrophobicContact CD2-CG 4.01Å; Y368-F419 HydrophobicContact CD1-CB 4.29Å; Y368-F419 HydrophobicContact CG-CD2 4.48Å; K369-F419 HydrophobicContact CB-CE1 4.46Å; K369-F419 HydrophobicContact CB-CZ 4.11Å; T372-F419 HydrophobicContact CG2-CD1 4.38Å; L415-F419 VanDerWaalsContact O-CB 3.26Å; L415-F419 WeakPolarHBondContact O-CB 3.48Å; L415-F419 PolarHBondContact O-N 2.74Å; F419-E422 PolarHBondContact O-N 3.37Å; F419-L423 HydrophobicContact CD2-CD1 4.03Å; F419-L423 HydrophobicContact CD2-CG 3.91Å; F419-L423 HydrophobicContact CE1-CD1 4.46Å; F419-L423 HydrophobicContact CE2-CD1 3.8Å; F419-L423 HydrophobicContact CE2-CD2 3.95Å; F419-L423 HydrophobicContact CE2-CG 3.73Å; F419-L423 HydrophobicContact CG-CD1 4.46Å; F419-L423 HydrophobicContact CZ-CD1 4.04Å; F419-L423 HydrophobicContact CZ-CG 4.43Å; F419-L423 WeakPolarHBondContact O-CB 3.28Å; F419-L423 WeakPolarHBondContact O-CG 3.3Å; F419-L423 PolarHBondContact O-N 3.41Å; F419-I481 HydrophobicContact CE1-CD1 4.36Å; F419-I481 HydrophobicContact CE1-CG2 3.88Å; F419-I481 HydrophobicContact CZ-CB 4.5Å; F419-I481 HydrophobicContact CZ-CG2 3.6Å |
| 420 | A | 86.6 | Confident | 81.6 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.2 | -50.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | F304 L307 G416 F417 E418 E422 L423 T424 S432 L436 | F304-A420 HydrophobicContact CE2-CB 4.23Å; L307-A420 HydrophobicContact CD2-CB 3.79Å; G416-A420 WeakPolarHBondContact O-CB 3.42Å; G416-A420 PolarHBondContact O-N 3.13Å; F417-A420 WeakPolarHBondContact O-CB 3.35Å; F417-A420 PolarHBondContact O-N 2.92Å; E418-A420 VanDerWaalsContact C-N 3.32Å; E418-A420 PolarHBondContact O-N 3.43Å; A420-E422 VanDerWaalsContact C-N 3.25Å; A420-E422 PolarHBondContact O-N 2.94Å; A420-L423 PolarHBondContact O-N 3.25Å; A420-L423 VanDerWaalsContact O-N 3.13Å; A420-T424 WeakPolarHBondContact O-CB 3.4Å; A420-T424 VanDerWaalsContact O-CG2 3.3Å; A420-T424 WeakPolarHBondContact O-CG2 3.36Å; A420-T424 PolarHBondContact O-N 2.95Å; A420-T424 PolarHBondContact O-OG1 3.33Å; A420-S432 WeakPolarHBondContact CB-OG 3.11Å; A420-L436 HydrophobicContact CB-CD1 3.74Å; A420-L436 HydrophobicContact CB-CD2 3.82Å; A420-L436 HydrophobicContact CB-CG 4.48Å |
| 421 | V | 80.4 | Confident | 81.1 | Confident | 16 Ų | 16 | 30.4 Ų | 30.4 | 10% | 0.097 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -54.8 | -43.4 | 175.8 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | F417 L423 T424 Y425 E429 | F417-V421 WeakPolarHBondContact O-CG2 3.22Å; F417-V421 PolarHBondContact O-N 2.83Å; V421-L423 PolarHBondContact O-N 2.86Å; V421-T424 PolarHBondContact O-N 3.36Å; V421-Y425 PolarHBondContact O-N 3.34Å; V421-Y425 VanDerWaalsContact O-N 3.1Å; V421-E429 HydrophobicContact CG1-CG 4.09Å; V421-E429 HydrophobicContact CG2-CB 4.03Å; V421-E429 HydrophobicContact CG2-CG 3.88Å |
| 422 | E | 82 | Confident | 80.9 | Confident | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.005 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -66.5 | -33.4 | -179.8 | -167.2 | 61 | -127.5 | 0 | 0 | 113.4 | Y368 E418 F419 A420 L485 R486 R487 Q488 | Y368-E422 HydrophobicContact CD1-CB 4.41Å; Y368-E422 HydrophobicContact CD2-CG 4.49Å; Y368-E422 HydrophobicContact CE1-CB 4.4Å; E418-E422 WeakPolarHBondContact O-CB 3.31Å; E418-E422 PolarHBondContact O-N 2.94Å; E418-E422 VanDerWaalsContact O-N 3.14Å; F419-E422 PolarHBondContact O-N 3.37Å; A420-E422 VanDerWaalsContact C-N 3.25Å; A420-E422 PolarHBondContact O-N 2.94Å; E422-L485 HydrophobicContact CG-CB 4.22Å; E422-L485 HydrophobicContact CG-CD2 3.59Å; E422-L485 WeakPolarHBondContact OE1-CA 3.2Å; E422-R486 PolarHBondContact O-N 3.49Å; E422-R486 VanDerWaalsContact O-N 3.16Å; E422-R486 PolarHBondContact OE1-N 2.66Å; E422-R487 WeakPolarHBondContact OE1-CA 3.36Å; E422-R487 WeakPolarHBondContact OE1-CB 3.32Å; E422-R487 PolarHBondContact OE1-N 2.86Å; E422-R487 IonicContact OE2-CZ 2.65Å; E422-R487 VanDerWaalsContact OE2-CZ 3.28Å; E422-R487 IonicContact OE2-NE 3.82Å; E422-R487 PolarHBondContact OE2-NE 3.3Å; E422-R487 IonicContact OE2-NH2 3.59Å; E422-R487 PolarHBondContact OE2-NH2 3.45Å; E422-Q488 PolarHBondContact OE1-N 3.44Å |
| 423 | L | 83.3 | Confident | 80.5 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -81.2 | -25.6 | 174 | -73 | 175.5 | 0 | 0 | 0 | 113.9 | N301 N303 L307 F419 A420 V421 I481 D484 | N301-L423 PolarHBondContact ND2-O 2.98Å; N303-L423 HydrophobicContact CB-CD1 4.18Å; N303-L423 HydrophobicContact CB-CD2 4Å; L307-L423 HydrophobicContact CB-CD1 4.28Å; L307-L423 HydrophobicContact CD2-CD1 3.86Å; F419-L423 HydrophobicContact CD2-CD1 4.03Å; F419-L423 HydrophobicContact CD2-CG 3.91Å; F419-L423 HydrophobicContact CE1-CD1 4.46Å; F419-L423 HydrophobicContact CE2-CD1 3.8Å; F419-L423 HydrophobicContact CE2-CD2 3.95Å; F419-L423 HydrophobicContact CE2-CG 3.73Å; F419-L423 HydrophobicContact CG-CD1 4.46Å; F419-L423 HydrophobicContact CZ-CD1 4.04Å; F419-L423 HydrophobicContact CZ-CG 4.43Å; F419-L423 WeakPolarHBondContact O-CB 3.28Å; F419-L423 WeakPolarHBondContact O-CG 3.3Å; F419-L423 PolarHBondContact O-N 3.41Å; A420-L423 PolarHBondContact O-N 3.25Å; A420-L423 VanDerWaalsContact O-N 3.13Å; V421-L423 PolarHBondContact O-N 2.86Å; L423-I481 HydrophobicContact CD1-CG2 4.2Å; L423-D484 HydrophobicContact CD2-CB 4.15Å |
| 424 | T | 82.9 | Confident | 80.4 | Confident | 4 Ų | 4 | 31.2 Ų | 31.2 | 3% | 0.025 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -100 | -11.3 | -172.4 | 60.3 | 0 | 0 | 0 | 0 | 115 | L298 F304 A420 V421 E427 S432 | L298-T424 HydrophobicContact CD2-CG2 3.35Å; F304-T424 HydrophobicContact CB-CG2 4.26Å; F304-T424 HydrophobicContact CD1-CG2 4.37Å; F304-T424 HydrophobicContact CD2-CG2 3.21Å; F304-T424 HydrophobicContact CE2-CG2 3.51Å; F304-T424 HydrophobicContact CG-CG2 3.69Å; F304-T424 HydrophobicContact CZ-CG2 4.2Å; A420-T424 WeakPolarHBondContact O-CB 3.4Å; A420-T424 VanDerWaalsContact O-CG2 3.3Å; A420-T424 WeakPolarHBondContact O-CG2 3.36Å; A420-T424 PolarHBondContact O-N 2.95Å; A420-T424 PolarHBondContact O-OG1 3.33Å; V421-T424 PolarHBondContact O-N 3.36Å; T424-E427 VanDerWaalsContact O-CB 3.23Å; T424-E427 WeakPolarHBondContact O-CB 3.27Å; T424-E427 WeakPolarHBondContact O-CG 3.45Å; T424-E427 PolarHBondContact O-N 2.95Å; T424-S432 WeakPolarHBondContact CG2-OG 3.4Å; T424-S432 WeakPolarHBondContact OG1-CB 3.42Å; T424-S432 PolarHBondContact OG1-OG 3.26Å |
| 425 | Y | 75.4 | Confident | 80.7 | Confident | 93 Ų | 93 | 29.7 Ų | 29.7 | 37% | 0.365 | 17% | 0.166 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -48.8 | 132.9 | 177.5 | -174.1 | -87.3 | 0 | 0 | 0 | 112.2 | V421 R486 R487 A490 | V421-Y425 PolarHBondContact O-N 3.34Å; V421-Y425 VanDerWaalsContact O-N 3.1Å; Y425-R486 HydrophobicContact CD1-CB 4.49Å; Y425-R487 HydrophobicContact CD2-CB 3.86Å; Y425-R487 HydrophobicContact CD2-CG 4.08Å; Y425-R487 HydrophobicContact CE2-CG 4.43Å; Y425-R487 HydrophobicContact CG-CB 3.85Å; Y425-A490 HydrophobicContact CD1-CB 4.1Å; Y425-A490 HydrophobicContact CE1-CB 3.39Å |
| 426 | P | 71.1 | Confident | 80.9 | Confident | 109 Ų | 109 | 29.6 Ų | 29.6 | 71% | 0.708 | 17% | 0.165 | S | C | * | . | T | Hydrogen-bonded Turn | cis | -92.8 | 15.3 | 9.9 | 38.2 | -37.5 | 0 | 0 | 0 | 115.9 | ||
| 427 | E | 73.7 | Confident | 81.1 | Confident | 33 Ų | 33 | 30.4 Ų | 30.4 | 15% | 0.154 | 17% | 0.169 | C | C | . | . | S | Bend | trans | -64.2 | 154.8 | -179.7 | -61.1 | -71.7 | 166.7 | 0 | 0 | 113.1 | S294 Q297 L298 T424 E429 | S294-E427 WeakPolarHBondContact CB-OE2 3.3Å; S294-E427 PolarHBondContact OG-OE2 3.4Å; Q297-E427 PolarHBondContact NE2-OE1 3.06Å; L298-E427 HydrophobicContact CD2-CB 3.95Å; L298-E427 HydrophobicContact CD2-CG 3.77Å; L298-E427 HydrophobicContact CG-CG 4.24Å; T424-E427 VanDerWaalsContact O-CB 3.23Å; T424-E427 WeakPolarHBondContact O-CB 3.27Å; T424-E427 WeakPolarHBondContact O-CG 3.45Å; T424-E427 PolarHBondContact O-N 2.95Å; E427-E429 PolarHBondContact O-N 2.98Å |
| 428 | S | 69.8 | Low | 81.4 | Confident | 65 Ų | 65 | 29.4 Ų | 29.4 | 46% | 0.455 | 17% | 0.166 | S | C | . | . | trans | -60.6 | 125.5 | -178 | 175.5 | 0 | 0 | 0 | 0 | 113.3 | G430 I431 S432 | S428-G430 PolarHBondContact O-N 3.3Å; S428-G430 VanDerWaalsContact O-N 3.1Å; S428-G430 PolarHBondContact OG-N 2.94Å; S428-I431 PolarHBondContact O-N 3.46Å; S428-S432 PolarHBondContact O-N 3.49Å | ||
| 429 | E | 71.6 | Confident | 82 | Confident | 93 Ų | 93 | 26.8 Ų | 26.8 | 44% | 0.435 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -52.5 | -33.3 | 176.5 | -54.8 | -177.3 | 153.5 | 0 | 0 | 112.7 | V421 E427 S433 | V421-E429 HydrophobicContact CG1-CG 4.09Å; V421-E429 HydrophobicContact CG2-CB 4.03Å; V421-E429 HydrophobicContact CG2-CG 3.88Å; E427-E429 PolarHBondContact O-N 2.98Å; E429-S433 WeakPolarHBondContact O-CB 3.41Å; E429-S433 PolarHBondContact O-N 2.83Å; E429-S433 PolarHBondContact O-OG 3.27Å |
| 430 | G | 72.1 | Confident | 82.5 | Confident | 29 Ų | 29 | 26.8 Ų | 26.8 | 30% | 0.299 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -69.1 | -32.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | S428 G434 | S428-G430 PolarHBondContact O-N 3.3Å; S428-G430 VanDerWaalsContact O-N 3.1Å; S428-G430 PolarHBondContact OG-N 2.94Å; G430-G434 PolarHBondContact O-N 2.98Å |
| 431 | I | 78.4 | Confident | 82.9 | Confident | 9 Ų | 9 | 26.9 Ų | 26.9 | 5% | 0.046 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -74.8 | -46.5 | 175.1 | -53.2 | 178.9 | 0 | 0 | 0 | 109.2 | Y291 I295 L298 S428 G434 L435 | Y291-I431 HydrophobicContact CD2-CD1 4.07Å; Y291-I431 HydrophobicContact CD2-CG1 4.37Å; Y291-I431 HydrophobicContact CE1-CG1 4.33Å; Y291-I431 HydrophobicContact CE2-CD1 3.98Å; Y291-I431 HydrophobicContact CE2-CG1 3.76Å; Y291-I431 HydrophobicContact CG-CD1 4.43Å; I295-I431 HydrophobicContact CD1-CG2 4.46Å; I295-I431 HydrophobicContact CG1-CG2 3.66Å; L298-I431 HydrophobicContact CD1-CB 4.2Å; L298-I431 HydrophobicContact CD1-CG2 3.54Å; S428-I431 PolarHBondContact O-N 3.46Å; I431-G434 PolarHBondContact O-N 2.82Å; I431-L435 HydrophobicContact CG2-CD1 4.29Å; I431-L435 WeakPolarHBondContact O-CG 3.35Å; I431-L435 PolarHBondContact O-N 2.86Å |
| 432 | S | 82.6 | Confident | 83.7 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.1 | -54.1 | 179.7 | -169.1 | 0 | 0 | 0 | 0 | 111.7 | F304 A420 T424 S428 G434 L435 L436 | F304-S432 WeakPolarHBondContact CE2-OG 3.48Å; A420-S432 WeakPolarHBondContact CB-OG 3.11Å; T424-S432 WeakPolarHBondContact CG2-OG 3.4Å; T424-S432 WeakPolarHBondContact OG1-CB 3.42Å; T424-S432 PolarHBondContact OG1-OG 3.26Å; S428-S432 PolarHBondContact O-N 3.49Å; S432-G434 PolarHBondContact O-N 3.3Å; S432-L435 PolarHBondContact O-N 3.41Å; S432-L436 VanDerWaalsContact O-CD1 3.32Å; S432-L436 WeakPolarHBondContact O-CD1 3.48Å; S432-L436 PolarHBondContact O-N 3.47Å |
| 433 | S | 82.6 | Confident | 84.5 | Confident | 28 Ų | 28 | 30.6 Ų | 30.6 | 20% | 0.196 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.9 | -34 | 175.7 | 57.3 | 0 | 0 | 0 | 0 | 113.4 | E429 L436 N437 | E429-S433 WeakPolarHBondContact O-CB 3.41Å; E429-S433 PolarHBondContact O-N 2.83Å; E429-S433 PolarHBondContact O-OG 3.27Å; S433-L436 PolarHBondContact O-N 3.13Å; S433-N437 PolarHBondContact O-N 3.47Å; S433-N437 PolarHBondContact O-ND2 3.08Å |
| 434 | G | 85 | Confident | 85.1 | Confident | 5 Ų | 5 | 30.6 Ų | 30.6 | 5% | 0.052 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.7 | -45.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | L132 G430 I431 S432 N437 I438 | L132-G434 WeakPolarHBondContact CD2-O 3.36Å; G430-G434 PolarHBondContact O-N 2.98Å; I431-G434 PolarHBondContact O-N 2.82Å; S432-G434 PolarHBondContact O-N 3.3Å; G434-N437 PolarHBondContact O-N 2.68Å; G434-I438 PolarHBondContact O-N 3.34Å |
| 435 | L | 88.8 | Confident | 85.8 | Confident | 15 Ų | 15 | 31.8 Ų | 31.8 | 8% | 0.079 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.3 | -37.8 | 176.6 | -69.8 | 175.5 | 0 | 0 | 0 | 112.5 | I295 L298 F299 F304 I431 S432 I438 S439 | I295-L435 HydrophobicContact CG1-CD1 4.44Å; I295-L435 HydrophobicContact CG2-CD1 4.48Å; I295-L435 HydrophobicContact CG2-CD2 4.46Å; L298-L435 HydrophobicContact CB-CD1 4.36Å; L298-L435 HydrophobicContact CD1-CD1 3.79Å; F299-L435 HydrophobicContact CE2-CD1 3.99Å; F299-L435 HydrophobicContact CE2-CD2 3.96Å; F299-L435 HydrophobicContact CZ-CD2 4.34Å; F304-L435 HydrophobicContact CE1-CD1 3.83Å; F304-L435 HydrophobicContact CZ-CB 4.09Å; F304-L435 HydrophobicContact CZ-CD1 4.01Å; I431-L435 HydrophobicContact CG2-CD1 4.29Å; I431-L435 WeakPolarHBondContact O-CG 3.35Å; I431-L435 PolarHBondContact O-N 2.86Å; S432-L435 PolarHBondContact O-N 3.41Å; L435-I438 PolarHBondContact O-N 2.72Å; L435-S439 PolarHBondContact O-N 2.99Å; L435-S439 VanDerWaalsContact O-N 3.12Å |
| 436 | L | 91.1 | Very high | 86.9 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.5 | -47 | 171.2 | -97.3 | 73 | 0 | 0 | 0 | 111.1 | F304 V308 Y311 G416 F417 A420 S432 S433 S439 A440 | F304-L436 HydrophobicContact CE2-CD1 3.6Å; F304-L436 HydrophobicContact CZ-CD1 4.07Å; V308-L436 HydrophobicContact CG2-CD1 3.84Å; Y311-L436 HydrophobicContact CD1-CB 3.66Å; Y311-L436 HydrophobicContact CD1-CD2 4.07Å; Y311-L436 HydrophobicContact CD1-CG 3.82Å; Y311-L436 VanDerWaalsContact CD1-O 3.24Å; Y311-L436 WeakPolarHBondContact CD1-O 3.18Å; Y311-L436 HydrophobicContact CD2-CD2 3.71Å; Y311-L436 HydrophobicContact CD2-CG 4.34Å; Y311-L436 HydrophobicContact CE1-CB 3.8Å; Y311-L436 HydrophobicContact CE1-CD2 4.44Å; Y311-L436 HydrophobicContact CE1-CG 4.36Å; Y311-L436 WeakPolarHBondContact CE1-O 3.35Å; Y311-L436 HydrophobicContact CE2-CD2 4.09Å; Y311-L436 HydrophobicContact CG-CB 4.17Å; Y311-L436 HydrophobicContact CG-CD2 3.7Å; Y311-L436 HydrophobicContact CG-CG 3.81Å; G416-L436 WeakPolarHBondContact O-CD2 3.44Å; F417-L436 HydrophobicContact CD1-CB 4.37Å; F417-L436 HydrophobicContact CD1-CD2 3.91Å; F417-L436 HydrophobicContact CE1-CB 4.07Å; F417-L436 HydrophobicContact CE1-CD2 4.33Å; A420-L436 HydrophobicContact CB-CD1 3.74Å; A420-L436 HydrophobicContact CB-CD2 3.82Å; A420-L436 HydrophobicContact CB-CG 4.48Å; S432-L436 VanDerWaalsContact O-CD1 3.32Å; S432-L436 WeakPolarHBondContact O-CD1 3.48Å; S432-L436 PolarHBondContact O-N 3.47Å; S433-L436 PolarHBondContact O-N 3.13Å; L436-S439 PolarHBondContact O-N 3.42Å; L436-A440 PolarHBondContact O-N 2.67Å; L436-A440 VanDerWaalsContact O-N 3.09Å |
| 437 | N | 90.8 | Very high | 88.2 | Confident | 16 Ų | 16 | 25.8 Ų | 25.8 | 9% | 0.086 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.3 | -43.2 | 176.6 | -78.2 | -81.4 | 0 | 0 | 0 | 112.3 | Y128 F417 S433 G434 S439 A440 Q441 | Y128-N437 HydrophobicContact CE1-CB 3.58Å; Y128-N437 VanDerWaalsContact OH-CB 3.32Å; Y128-N437 WeakPolarHBondContact OH-CB 3.17Å; F417-N437 WeakPolarHBondContact CE1-ND2 3.31Å; F417-N437 WeakPolarHBondContact CZ-ND2 3.34Å; S433-N437 PolarHBondContact O-N 3.47Å; S433-N437 PolarHBondContact O-ND2 3.08Å; G434-N437 PolarHBondContact O-N 2.68Å; N437-S439 VanDerWaalsContact C-N 3.25Å; N437-S439 PolarHBondContact O-N 3.04Å; N437-A440 WeakPolarHBondContact O-CB 3.47Å; N437-A440 PolarHBondContact O-N 2.79Å; N437-A440 VanDerWaalsContact O-N 3.11Å; N437-Q441 WeakPolarHBondContact O-CG 3.48Å; N437-Q441 PolarHBondContact O-N 3.25Å |
| 438 | I | 93.2 | Very high | 89.3 | Confident | 34 Ų | 34 | 24.2 Ų | 24.2 | 17% | 0.174 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -53.5 | -44.8 | 174.4 | -75.9 | 177.1 | 0 | 0 | 0 | 111 | Y128 I129 L132 G434 L435 Q441 V442 | Y128-I438 HydrophobicContact CD1-CG1 4.33Å; Y128-I438 HydrophobicContact CE1-CG1 4.12Å; I129-I438 HydrophobicContact CG2-CG2 4.42Å; L132-I438 HydrophobicContact CB-CD1 4.4Å; L132-I438 HydrophobicContact CD2-CD1 3.72Å; L132-I438 HydrophobicContact CD2-CG1 3.84Å; G434-I438 PolarHBondContact O-N 3.34Å; L435-I438 PolarHBondContact O-N 2.72Å; I438-Q441 PolarHBondContact O-N 3.38Å; I438-V442 HydrophobicContact CG2-CG2 4.41Å; I438-V442 WeakPolarHBondContact O-CG2 3.46Å; I438-V442 PolarHBondContact O-N 3.42Å |
| 439 | S | 95.5 | Very high | 90.5 | Very high | 13 Ų | 13 | 23.9 Ų | 23.9 | 9% | 0.091 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -65.1 | -41.2 | 178.9 | -160.8 | 0 | 0 | 0 | 0 | 112.5 | V308 L435 L436 N437 Q441 V442 F443 | V308-S439 WeakPolarHBondContact O-CB 3.27Å; V308-S439 PolarHBondContact O-OG 2.94Å; V308-S439 VanDerWaalsContact O-OG 3.13Å; L435-S439 PolarHBondContact O-N 2.99Å; L435-S439 VanDerWaalsContact O-N 3.12Å; L436-S439 PolarHBondContact O-N 3.42Å; N437-S439 VanDerWaalsContact C-N 3.25Å; N437-S439 PolarHBondContact O-N 3.04Å; S439-Q441 VanDerWaalsContact C-N 3.32Å; S439-Q441 PolarHBondContact O-N 3.37Å; S439-V442 PolarHBondContact O-N 3.01Å; S439-F443 WeakPolarHBondContact O-CD2 3.48Å; S439-F443 PolarHBondContact O-N 3.3Å |
| 440 | A | 95.3 | Very high | 91.7 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -58.2 | -41.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y311 A315 G316 Y319 L436 N437 G444 | Y311-A440 HydrophobicContact CD1-CB 4.4Å; Y311-A440 HydrophobicContact CE1-CB 3.96Å; A315-A440 HydrophobicContact CB-CB 3.46Å; A315-A440 VanDerWaalsContact CB-CB 3.46Å; G316-A440 WeakPolarHBondContact CA-O 3.39Å; Y319-A440 HydrophobicContact CE2-CB 3.82Å; L436-A440 PolarHBondContact O-N 2.67Å; L436-A440 VanDerWaalsContact O-N 3.09Å; N437-A440 WeakPolarHBondContact O-CB 3.47Å; N437-A440 PolarHBondContact O-N 2.79Å; N437-A440 VanDerWaalsContact O-N 3.11Å; A440-G444 WeakPolarHBondContact O-CA 3.23Å; A440-G444 PolarHBondContact O-N 2.75Å |
| 441 | Q | 96 | Very high | 92.9 | Very high | 2 Ų | 2 | 20 Ų | 20 | 1% | 0.009 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -68.3 | -42.9 | 176.6 | -57.4 | -62.3 | 14.1 | 0 | 0 | 112.1 | M125 Y128 I129 N437 I438 S439 G444 I445 | M125-Q441 VanDerWaalsContact CA-OE1 3.31Å; M125-Q441 HydrophobicContact CB-CB 4Å; M125-Q441 VanDerWaalsContact CG-OE1 3.28Å; Y128-Q441 HydrophobicContact CD1-CG 3.66Å; Y128-Q441 HydrophobicContact CE1-CG 4.44Å; Y128-Q441 HydrophobicContact CG-CG 4.02Å; I129-Q441 HydrophobicContact CD1-CB 4.02Å; I129-Q441 HydrophobicContact CG1-CB 3.9Å; N437-Q441 WeakPolarHBondContact O-CG 3.48Å; N437-Q441 PolarHBondContact O-N 3.25Å; I438-Q441 PolarHBondContact O-N 3.38Å; S439-Q441 VanDerWaalsContact C-N 3.32Å; S439-Q441 PolarHBondContact O-N 3.37Å; Q441-G444 PolarHBondContact O-N 2.97Å; Q441-I445 WeakPolarHBondContact O-CG1 3.2Å; Q441-I445 PolarHBondContact O-N 3.27Å |
| 442 | V | 97.3 | Very high | 93.6 | Very high | 56 Ų | 56 | 19.7 Ų | 19.7 | 34% | 0.339 | 11% | 0.112 | S | C | . | . | H | α-helix | trans | -61 | -51.6 | 178.4 | 169.3 | 0 | 0 | 0 | 0 | 111.2 | I129 I438 S439 G444 I445 I446 | I129-V442 HydrophobicContact CD1-CG2 3.6Å; I129-V442 HydrophobicContact CG1-CG2 4.13Å; I438-V442 HydrophobicContact CG2-CG2 4.41Å; I438-V442 WeakPolarHBondContact O-CG2 3.46Å; I438-V442 PolarHBondContact O-N 3.42Å; S439-V442 PolarHBondContact O-N 3.01Å; V442-G444 VanDerWaalsContact C-N 3.33Å; V442-G444 PolarHBondContact O-N 2.93Å; V442-I445 PolarHBondContact O-N 3.2Å; V442-I446 HydrophobicContact CG1-CD1 3.94Å; V442-I446 WeakPolarHBondContact O-CG1 3.39Å; V442-I446 PolarHBondContact O-N 2.96Å; V442-I446 VanDerWaalsContact O-N 3.17Å |
| 443 | F | 97.8 | Very high | 94.2 | Very high | 39 Ų | 39 | 23.8 Ų | 23.8 | 17% | 0.171 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -68.2 | -32.7 | 176.8 | -77.4 | -70.8 | 0 | 0 | 0 | 112.3 | I309 G312 L313 S439 I445 I446 F447 | I309-F443 HydrophobicContact CG2-CZ 4.39Å; G312-F443 VanDerWaalsContact C-CD2 3.47Å; G312-F443 VanDerWaalsContact O-CB 3.27Å; G312-F443 WeakPolarHBondContact O-CB 3.37Å; L313-F443 HydrophobicContact CD2-CD1 3.72Å; L313-F443 HydrophobicContact CD2-CE1 3.47Å; L313-F443 VanDerWaalsContact CD2-CE1 3.47Å; L313-F443 HydrophobicContact CD2-CE2 4.41Å; L313-F443 HydrophobicContact CD2-CG 4.31Å; L313-F443 HydrophobicContact CD2-CZ 3.84Å; L313-F443 HydrophobicContact CG-CE1 4.26Å; L313-F443 HydrophobicContact CG-CE2 4.36Å; L313-F443 HydrophobicContact CG-CZ 4.15Å; S439-F443 WeakPolarHBondContact O-CD2 3.48Å; S439-F443 PolarHBondContact O-N 3.3Å; F443-I445 PolarHBondContact O-N 3.14Å; F443-I446 HydrophobicContact CD1-CD1 4.48Å; F443-I446 PolarHBondContact O-N 3.38Å; F443-F447 HydrophobicContact CB-CD2 4.38Å; F443-F447 HydrophobicContact CB-CE2 4.09Å; F443-F447 HydrophobicContact CB-CZ 4.43Å; F443-F447 HydrophobicContact CD1-CE1 4.2Å; F443-F447 HydrophobicContact CD1-CE2 4.3Å; F443-F447 AromaticContact CD1-CZ 3.81Å; F443-F447 HydrophobicContact CD1-CZ 3.81Å; F443-F447 HydrophobicContact CG-CZ 4.48Å; F443-F447 VanDerWaalsContact O-CB 3.3Å; F443-F447 WeakPolarHBondContact O-CB 3.37Å; F443-F447 WeakPolarHBondContact O-CD2 3.48Å; F443-F447 VanDerWaalsContact O-CG 3.22Å; F443-F447 WeakPolarHBondContact O-CG 3.3Å; F443-F447 PolarHBondContact O-N 3.19Å |
| 444 | G | 97.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -57.9 | -44.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A440 Q441 V442 T448 | A440-G444 WeakPolarHBondContact O-CA 3.23Å; A440-G444 PolarHBondContact O-N 2.75Å; Q441-G444 PolarHBondContact O-N 2.97Å; V442-G444 VanDerWaalsContact C-N 3.33Å; V442-G444 PolarHBondContact O-N 2.93Å; G444-T448 VanDerWaalsContact O-CB 3.24Å; G444-T448 WeakPolarHBondContact O-CB 3.01Å; G444-T448 PolarHBondContact O-N 3.45Å; G444-T448 PolarHBondContact O-OG1 3.36Å |
| 445 | I | 97.3 | Very high | 95.2 | Very high | 28 Ų | 28 | 24.1 Ų | 24.1 | 14% | 0.144 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64.1 | -53 | 174.8 | -64.4 | 163.7 | 0 | 0 | 0 | 110.2 | M122 M125 L126 I129 Q441 V442 F443 F447 T448 I449 | M122-I445 HydrophobicContact SD-CG2 4.46Å; M125-I445 HydrophobicContact CB-CD1 3.86Å; M125-I445 HydrophobicContact CB-CG1 3.55Å; M125-I445 HydrophobicContact CG-CG1 4.34Å; M125-I445 HydrophobicContact SD-CG1 3.99Å; L126-I445 HydrophobicContact CB-CD1 4.22Å; L126-I445 HydrophobicContact CD1-CD1 4.45Å; I129-I445 HydrophobicContact CD1-CD1 3.94Å; Q441-I445 WeakPolarHBondContact O-CG1 3.2Å; Q441-I445 PolarHBondContact O-N 3.27Å; V442-I445 PolarHBondContact O-N 3.2Å; F443-I445 PolarHBondContact O-N 3.14Å; I445-F447 VanDerWaalsContact C-N 3.3Å; I445-F447 PolarHBondContact O-N 2.97Å; I445-T448 PolarHBondContact O-N 2.87Å; I445-I449 HydrophobicContact CG2-CD1 3.79Å; I445-I449 HydrophobicContact CG2-CG1 4.45Å; I445-I449 WeakPolarHBondContact O-CG1 3.34Å; I445-I449 PolarHBondContact O-N 3.38Å |
| 446 | I | 97.5 | Very high | 95.3 | Very high | 76 Ų | 76 | 27.2 Ų | 27.2 | 39% | 0.39 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -54.6 | -48.9 | -178.1 | -66.7 | 165.3 | 0 | 0 | 0 | 110.2 | V442 F443 S450 | V442-I446 HydrophobicContact CG1-CD1 3.94Å; V442-I446 WeakPolarHBondContact O-CG1 3.39Å; V442-I446 PolarHBondContact O-N 2.96Å; V442-I446 VanDerWaalsContact O-N 3.17Å; F443-I446 HydrophobicContact CD1-CD1 4.48Å; F443-I446 PolarHBondContact O-N 3.38Å; I446-S450 WeakPolarHBondContact O-CB 3.23Å; I446-S450 PolarHBondContact O-N 3.18Å; I446-S450 PolarHBondContact O-OG 2.93Å; I446-S450 VanDerWaalsContact O-OG 3.13Å |
| 447 | F | 97.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -72.6 | -37.8 | -178.2 | -64.2 | -17.6 | 0 | 0 | 0 | 113.2 | L313 A317 A320 F443 I445 I449 S450 Q451 F466 L467 F470 | L313-F447 HydrophobicContact CD2-CE2 4.32Å; L313-F447 HydrophobicContact CD2-CZ 3.69Å; A317-F447 HydrophobicContact CB-CD2 4.18Å; A317-F447 HydrophobicContact CB-CE2 4.31Å; A320-F447 HydrophobicContact CB-CB 3.65Å; F443-F447 HydrophobicContact CB-CD2 4.38Å; F443-F447 HydrophobicContact CB-CE2 4.09Å; F443-F447 HydrophobicContact CB-CZ 4.43Å; F443-F447 HydrophobicContact CD1-CE1 4.2Å; F443-F447 HydrophobicContact CD1-CE2 4.3Å; F443-F447 AromaticContact CD1-CZ 3.81Å; F443-F447 HydrophobicContact CD1-CZ 3.81Å; F443-F447 HydrophobicContact CG-CZ 4.48Å; F443-F447 VanDerWaalsContact O-CB 3.3Å; F443-F447 WeakPolarHBondContact O-CB 3.37Å; F443-F447 WeakPolarHBondContact O-CD2 3.48Å; F443-F447 VanDerWaalsContact O-CG 3.22Å; F443-F447 WeakPolarHBondContact O-CG 3.3Å; F443-F447 PolarHBondContact O-N 3.19Å; I445-F447 VanDerWaalsContact C-N 3.3Å; I445-F447 PolarHBondContact O-N 2.97Å; F447-I449 VanDerWaalsContact C-N 3.32Å; F447-I449 PolarHBondContact O-N 3.41Å; F447-S450 PolarHBondContact O-N 3.28Å; F447-Q451 WeakPolarHBondContact O-CA 3.41Å; F447-Q451 WeakPolarHBondContact O-CB 3.18Å; F447-Q451 PolarHBondContact O-N 2.93Å; F447-F466 HydrophobicContact CB-CE1 4.32Å; F447-F466 AromaticContact CD1-CE1 3.58Å; F447-F466 HydrophobicContact CD1-CE1 3.58Å; F447-F466 AromaticContact CD1-CZ 3.75Å; F447-F466 HydrophobicContact CD1-CZ 3.75Å; F447-F466 HydrophobicContact CE1-CE1 4.26Å; F447-F466 HydrophobicContact CE1-CZ 4.21Å; F447-F466 HydrophobicContact CG-CE1 4.19Å; F447-L467 HydrophobicContact CB-CD2 3.9Å; F447-L467 HydrophobicContact CD2-CD2 3.83Å; F447-L467 HydrophobicContact CG-CD2 3.85Å; F447-F470 HydrophobicContact CD1-CD2 4.49Å; F447-F470 HydrophobicContact CE1-CB 3.97Å; F447-F470 AromaticContact CE1-CD1 3.82Å; F447-F470 HydrophobicContact CE1-CD1 3.82Å; F447-F470 AromaticContact CE1-CD2 3.66Å; F447-F470 HydrophobicContact CE1-CD2 3.66Å; F447-F470 HydrophobicContact CE1-CE1 4.22Å; F447-F470 HydrophobicContact CE1-CE2 4.1Å; F447-F470 AromaticContact CE1-CG 3.51Å; F447-F470 HydrophobicContact CE1-CG 3.51Å; F447-F470 HydrophobicContact CE1-CZ 4.35Å; F447-F470 HydrophobicContact CE2-CB 4.27Å; F447-F470 HydrophobicContact CZ-CB 3.51Å; F447-F470 AromaticContact CZ-CD1 3.78Å; F447-F470 HydrophobicContact CZ-CD1 3.78Å; F447-F470 HydrophobicContact CZ-CD2 4.13Å; F447-F470 AromaticContact CZ-CG 3.52Å; F447-F470 HydrophobicContact CZ-CG 3.52Å |
| 448 | T | 96.9 | Very high | 95.5 | Very high | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.006 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.7 | -42.8 | 176 | -56.6 | 0 | 0 | 0 | 0 | 110.8 | D118 M122 A320 T323 G444 I445 G452 | D118-T448 HydrophobicContact CB-CG2 4.3Å; M122-T448 HydrophobicContact CE-CG2 4Å; M122-T448 HydrophobicContact CG-CG2 3.83Å; M122-T448 HydrophobicContact SD-CG2 3.84Å; A320-T448 WeakPolarHBondContact CA-OG1 3.45Å; T323-T448 HydrophobicContact CG2-CG2 3.86Å; G444-T448 VanDerWaalsContact O-CB 3.24Å; G444-T448 WeakPolarHBondContact O-CB 3.01Å; G444-T448 PolarHBondContact O-N 3.45Å; G444-T448 PolarHBondContact O-OG1 3.36Å; I445-T448 PolarHBondContact O-N 2.87Å; T448-G452 PolarHBondContact O-N 3.39Å |
| 449 | I | 96.3 | Very high | 95.5 | Very high | 57 Ų | 57 | 38.8 Ų | 38.8 | 29% | 0.292 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -65.8 | -55.9 | 175.8 | -61.7 | 175.6 | 0 | 0 | 0 | 110.6 | F115 M122 I445 F447 G452 Q453 | F115-I449 HydrophobicContact CE2-CG1 4.21Å; F115-I449 HydrophobicContact CE2-CG2 4.33Å; M122-I449 HydrophobicContact CE-CG1 4.17Å; M122-I449 HydrophobicContact SD-CD1 4.13Å; M122-I449 HydrophobicContact SD-CG1 3.47Å; M122-I449 WeakPolarHBondContact SD-CG1 3.4Å; I445-I449 HydrophobicContact CG2-CD1 3.79Å; I445-I449 HydrophobicContact CG2-CG1 4.45Å; I445-I449 WeakPolarHBondContact O-CG1 3.34Å; I445-I449 PolarHBondContact O-N 3.38Å; F447-I449 VanDerWaalsContact C-N 3.32Å; F447-I449 PolarHBondContact O-N 3.41Å; I449-G452 PolarHBondContact O-N 2.77Å; I449-Q453 WeakPolarHBondContact O-CB 3.32Å; I449-Q453 VanDerWaalsContact O-CG 3.31Å; I449-Q453 WeakPolarHBondContact O-CG 3.24Å; I449-Q453 PolarHBondContact O-N 3.14Å |
| 450 | S | 96.7 | Very high | 95.3 | Very high | 40 Ų | 40 | 38.3 Ų | 38.3 | 28% | 0.28 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -64.8 | -47.8 | -174.7 | -65.3 | 0 | 0 | 0 | 0 | 112.6 | I446 F447 Q453 I454 | I446-S450 WeakPolarHBondContact O-CB 3.23Å; I446-S450 PolarHBondContact O-N 3.18Å; I446-S450 PolarHBondContact O-OG 2.93Å; I446-S450 VanDerWaalsContact O-OG 3.13Å; F447-S450 PolarHBondContact O-N 3.28Å; S450-Q453 PolarHBondContact O-N 2.93Å; S450-I454 WeakPolarHBondContact O-CB 3.32Å; S450-I454 WeakPolarHBondContact O-CD1 3.33Å; S450-I454 WeakPolarHBondContact O-CG1 3.47Å; S450-I454 PolarHBondContact O-N 2.96Å |
| 451 | Q | 96.4 | Very high | 95.3 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.3 | -42.1 | 177.4 | -173.8 | -177.3 | 12.3 | 0 | 0 | 111 | L324 F447 I454 I455 N464 F466 L467 | L324-Q451 HydrophobicContact CD1-CB 3.78Å; L324-Q451 HydrophobicContact CD1-CG 3.78Å; F447-Q451 WeakPolarHBondContact O-CA 3.41Å; F447-Q451 WeakPolarHBondContact O-CB 3.18Å; F447-Q451 PolarHBondContact O-N 2.93Å; Q451-I454 PolarHBondContact O-N 2.93Å; Q451-I455 HydrophobicContact CG-CD1 3.87Å; Q451-I455 HydrophobicContact CG-CG1 4.36Å; Q451-I455 WeakPolarHBondContact O-CB 3.12Å; Q451-I455 VanDerWaalsContact O-CG1 3.24Å; Q451-I455 WeakPolarHBondContact O-CG1 3.34Å; Q451-I455 PolarHBondContact O-N 3.44Å; Q451-N464 PolarHBondContact NE2-OD1 3.24Å; Q451-F466 HydrophobicContact CB-CD1 4.4Å; Q451-L467 VanDerWaalsContact OE1-CD1 3.26Å |
| 452 | G | 94.3 | Very high | 95.3 | Very high | 4 Ų | 4 | 44.4 Ų | 44.4 | 4% | 0.041 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -58.8 | -48.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | R327 T448 I449 I454 I455 D456 | R327-G452 PolarHBondContact NH2-O 3.12Å; T448-G452 PolarHBondContact O-N 3.39Å; I449-G452 PolarHBondContact O-N 2.77Å; G452-I454 PolarHBondContact O-N 2.77Å; G452-I455 PolarHBondContact O-N 2.84Å; G452-D456 PolarHBondContact O-N 3.19Å; G452-D456 VanDerWaalsContact O-N 3.08Å; G452-D456 VanDerWaalsContact O-OD2 3.1Å |
| 453 | Q | 94.4 | Very high | 95.2 | Very high | 86 Ų | 86 | 41.8 Ų | 41.8 | 40% | 0.402 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64.3 | -37 | 176.5 | -69.8 | -66.4 | -37 | 0 | 0 | 112.6 | I449 S450 N457 | I449-Q453 WeakPolarHBondContact O-CB 3.32Å; I449-Q453 VanDerWaalsContact O-CG 3.31Å; I449-Q453 WeakPolarHBondContact O-CG 3.24Å; I449-Q453 PolarHBondContact O-N 3.14Å; S450-Q453 PolarHBondContact O-N 2.93Å; Q453-N457 PolarHBondContact O-N 3.19Å; Q453-N457 PolarHBondContact O-ND2 2.85Å |
| 454 | I | 95.6 | Very high | 95.1 | Very high | 38 Ų | 38 | 40 Ų | 40 | 20% | 0.195 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -69.5 | -37.6 | 175.8 | -65.6 | 163.3 | 0 | 0 | 0 | 110.9 | S450 Q451 G452 N457 Y458 G459 P462 G463 F466 | S450-I454 WeakPolarHBondContact O-CB 3.32Å; S450-I454 WeakPolarHBondContact O-CD1 3.33Å; S450-I454 WeakPolarHBondContact O-CG1 3.47Å; S450-I454 PolarHBondContact O-N 2.96Å; Q451-I454 PolarHBondContact O-N 2.93Å; G452-I454 PolarHBondContact O-N 2.77Å; I454-N457 PolarHBondContact O-N 3.44Å; I454-Y458 HydrophobicContact CG2-CD2 4.3Å; I454-Y458 WeakPolarHBondContact O-CA 3.24Å; I454-Y458 WeakPolarHBondContact O-CB 3.41Å; I454-Y458 PolarHBondContact O-N 3.18Å; I454-G459 PolarHBondContact O-N 3.21Å; I454-P462 HydrophobicContact CG2-CB 3.63Å; I454-G463 VanDerWaalsContact CG2-N 3.29Å; I454-F466 HydrophobicContact CD1-CB 3.92Å; I454-F466 HydrophobicContact CD1-CD2 3.78Å; I454-F466 HydrophobicContact CD1-CE2 4.46Å; I454-F466 HydrophobicContact CD1-CG 3.86Å |
| 455 | I | 93.9 | Very high | 95 | Very high | 2 Ų | 2 | 43.5 Ų | 43.5 | 1% | 0.01 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.5 | -47.8 | 175.1 | -73.5 | 167.8 | 0 | 0 | 0 | 111 | L324 M328 Q451 G452 N457 G459 | L324-I455 HydrophobicContact CB-CD1 4.34Å; L324-I455 HydrophobicContact CD1-CD1 4.22Å; M328-I455 HydrophobicContact CG-CD1 3.85Å; M328-I455 HydrophobicContact SD-CD1 4.47Å; Q451-I455 HydrophobicContact CG-CD1 3.87Å; Q451-I455 HydrophobicContact CG-CG1 4.36Å; Q451-I455 WeakPolarHBondContact O-CB 3.12Å; Q451-I455 VanDerWaalsContact O-CG1 3.24Å; Q451-I455 WeakPolarHBondContact O-CG1 3.34Å; Q451-I455 PolarHBondContact O-N 3.44Å; G452-I455 PolarHBondContact O-N 2.84Å; I455-N457 VanDerWaalsContact C-N 3.33Å; I455-N457 PolarHBondContact O-N 3.29Å; I455-G459 VanDerWaalsContact O-CA 3.24Å; I455-G459 WeakPolarHBondContact O-CA 3.28Å; I455-G459 PolarHBondContact O-N 3.48Å |
| 456 | D | 90.7 | Very high | 95 | Very high | 79 Ų | 79 | 43.9 Ų | 43.9 | 42% | 0.422 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -66.1 | -32.9 | -177.1 | -70.3 | -44.4 | 0 | 0 | 0 | 113.4 | R327 G452 | R327-D456 IonicContact CZ-OD1 3.7Å; R327-D456 IonicContact CZ-OD2 3.91Å; R327-D456 IonicContact NH1-OD2 2.61Å; R327-D456 IonicContact NH2-OD1 2.67Å; R327-D456 PolarHBondContact NH2-OD1 2.92Å; R327-D456 IonicContact NH2-OD2 3.61Å; R327-D456 PolarHBondContact NH2-OD2 3.01Å; G452-D456 PolarHBondContact O-N 3.19Å; G452-D456 VanDerWaalsContact O-N 3.08Å; G452-D456 VanDerWaalsContact O-OD2 3.1Å |
| 457 | N | 92.7 | Very high | 95 | Very high | 107 Ų | 107 | 40.2 Ų | 40.2 | 57% | 0.572 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -97.2 | -27.6 | -175.5 | -69.1 | -83.8 | 0 | 0 | 0 | 114.2 | Q453 I454 I455 | Q453-N457 PolarHBondContact O-N 3.19Å; Q453-N457 PolarHBondContact O-ND2 2.85Å; I454-N457 PolarHBondContact O-N 3.44Å; I455-N457 VanDerWaalsContact C-N 3.33Å; I455-N457 PolarHBondContact O-N 3.29Å |
| 458 | Y | 93 | Very high | 95 | Very high | 176 Ų | 176 | 40.9 Ų | 40.9 | 69% | 0.69 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -135.9 | 3.9 | -170.9 | -52.2 | -80.6 | 0 | 0 | 0 | 114.2 | I454 P462 | I454-Y458 HydrophobicContact CG2-CD2 4.3Å; I454-Y458 WeakPolarHBondContact O-CA 3.24Å; I454-Y458 WeakPolarHBondContact O-CB 3.41Å; I454-Y458 PolarHBondContact O-N 3.18Å; Y458-P462 WeakPolarHBondContact O-CD 3.46Å |
| 459 | G | 92.4 | Very high | 95 | Very high | 10 Ų | 10 | 46.3 Ų | 46.3 | 10% | 0.103 | 24% | 0.236 | C | C | . | . | trans | 78 | -179.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | I454 I455 K461 P462 | I454-G459 PolarHBondContact O-N 3.21Å; I455-G459 VanDerWaalsContact O-CA 3.24Å; I455-G459 WeakPolarHBondContact O-CA 3.28Å; I455-G459 PolarHBondContact O-N 3.48Å; G459-K461 PolarHBondContact O-N 3.2Å; G459-P462 WeakPolarHBondContact O-CD 3.33Å | ||
| 460 | T | 92.9 | Very high | 95 | Very high | 4 Ų | 4 | 46.7 Ų | 46.7 | 3% | 0.025 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -71 | -32 | -168.5 | 71.7 | 0 | 0 | 0 | 0 | 114.6 | M328 W331 H332 G463 N464 | M328-T460 HydrophobicContact CB-CG2 4.14Å; M328-T460 HydrophobicContact CG-CG2 3.93Å; W331-T460 HydrophobicContact CB-CG2 4.27Å; W331-T460 HydrophobicContact CG-CG2 4.29Å; H332-T460 PolarHBondContact CE1-OG1 2.95Å; T460-G463 PolarHBondContact O-N 3.35Å; T460-N464 WeakPolarHBondContact O-CB 3.42Å; T460-N464 PolarHBondContact O-N 2.86Å |
| 461 | K | 94.5 | Very high | 95.1 | Very high | 77 Ų | 77 | 44.8 Ų | 44.8 | 34% | 0.335 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63 | -50.3 | -175.1 | -60.7 | -179.6 | -177.4 | -174 | 0 | 111.9 | N391 G459 G463 N464 I465 | N391-K461 PolarHBondContact ND2-NZ 3.16Å; N391-K461 WeakPolarHBondContact OD1-CE 3.24Å; N391-K461 PolarHBondContact OD1-NZ 3.18Å; G459-K461 PolarHBondContact O-N 3.2Å; K461-G463 VanDerWaalsContact C-N 3.32Å; K461-G463 PolarHBondContact O-N 3.38Å; K461-N464 PolarHBondContact O-N 3.25Å; K461-I465 WeakPolarHBondContact O-CB 3.46Å; K461-I465 WeakPolarHBondContact O-CD1 3.46Å; K461-I465 VanDerWaalsContact O-CG1 3.23Å; K461-I465 WeakPolarHBondContact O-CG1 3.4Å; K461-I465 PolarHBondContact O-N 2.94Å |
| 462 | P | 95.2 | Very high | 95.1 | Very high | 53 Ų | 53 | 48.1 Ų | 48.1 | 34% | 0.344 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -61.6 | -37.1 | 174.6 | -26.8 | 39.5 | 0 | 0 | 0 | 113.3 | I454 Y458 G459 N464 I465 F466 | I454-P462 HydrophobicContact CG2-CB 3.63Å; Y458-P462 WeakPolarHBondContact O-CD 3.46Å; G459-P462 WeakPolarHBondContact O-CD 3.33Å; P462-N464 VanDerWaalsContact C-N 3.33Å; P462-N464 PolarHBondContact O-N 3.4Å; P462-I465 PolarHBondContact O-N 3.25Å; P462-F466 WeakPolarHBondContact O-CB 3.38Å; P462-F466 PolarHBondContact O-N 3.08Å |
| 463 | G | 94.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64 | -37.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | I454 T460 K461 F466 L467 | I454-G463 VanDerWaalsContact CG2-N 3.29Å; T460-G463 PolarHBondContact O-N 3.35Å; K461-G463 VanDerWaalsContact C-N 3.32Å; K461-G463 PolarHBondContact O-N 3.38Å; G463-F466 WeakPolarHBondContact O-CB 3.45Å; G463-L467 PolarHBondContact O-N 3.32Å |
| 464 | N | 96.1 | Very high | 95.3 | Very high | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.005 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -79.3 | -33.9 | 177.3 | -70.3 | 4.8 | 0 | 0 | 0 | 112.3 | M328 M383 T387 Q451 T460 K461 P462 F466 L467 C468 | M328-N464 PolarHBondContact SD-OD1 3.33Å; M383-N464 HydrophobicContact CE-CB 3.68Å; T387-N464 HydrophobicContact CG2-CB 3.69Å; T387-N464 VanDerWaalsContact OG1-CB 3.3Å; T387-N464 WeakPolarHBondContact OG1-CB 3.34Å; Q451-N464 PolarHBondContact NE2-OD1 3.24Å; T460-N464 WeakPolarHBondContact O-CB 3.42Å; T460-N464 PolarHBondContact O-N 2.86Å; K461-N464 PolarHBondContact O-N 3.25Å; P462-N464 VanDerWaalsContact C-N 3.33Å; P462-N464 PolarHBondContact O-N 3.4Å; N464-F466 VanDerWaalsContact C-N 3.29Å; N464-F466 PolarHBondContact O-N 3.47Å; N464-L467 PolarHBondContact O-N 3.43Å; N464-L467 VanDerWaalsContact O-N 3.17Å; N464-C468 PolarHBondContact O-N 3.21Å; N464-C468 PolarHBondContact O-SG 2.86Å |
| 465 | I | 96.4 | Very high | 95.2 | Very high | 75 Ų | 75 | 46.6 Ų | 46.6 | 39% | 0.385 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -60.6 | -39.4 | 169.8 | -71.3 | 163.8 | 0 | 0 | 0 | 110.7 | T387 K461 P462 L467 C468 L469 | T387-I465 HydrophobicContact CG2-CG1 4.37Å; K461-I465 WeakPolarHBondContact O-CB 3.46Å; K461-I465 WeakPolarHBondContact O-CD1 3.46Å; K461-I465 VanDerWaalsContact O-CG1 3.23Å; K461-I465 WeakPolarHBondContact O-CG1 3.4Å; K461-I465 PolarHBondContact O-N 2.94Å; P462-I465 PolarHBondContact O-N 3.25Å; I465-L467 PolarHBondContact O-N 3.08Å; I465-C468 WeakPolarHBondContact O-CB 3.32Å; I465-C468 PolarHBondContact O-N 3.33Å; I465-C468 VanDerWaalsContact O-N 3.13Å; I465-L469 HydrophobicContact CG2-CD1 4.46Å; I465-L469 WeakPolarHBondContact O-CG 3.49Å; I465-L469 PolarHBondContact O-N 3.28Å |
| 466 | F | 97.4 | Very high | 95.3 | Very high | 35 Ų | 35 | 48.7 Ų | 48.7 | 15% | 0.154 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -55.8 | -46.8 | 171.9 | 165.1 | -85.9 | 0 | 0 | 0 | 111.8 | F447 Q451 I454 P462 G463 N464 L469 F470 | F447-F466 HydrophobicContact CB-CE1 4.32Å; F447-F466 AromaticContact CD1-CE1 3.58Å; F447-F466 HydrophobicContact CD1-CE1 3.58Å; F447-F466 AromaticContact CD1-CZ 3.75Å; F447-F466 HydrophobicContact CD1-CZ 3.75Å; F447-F466 HydrophobicContact CE1-CE1 4.26Å; F447-F466 HydrophobicContact CE1-CZ 4.21Å; F447-F466 HydrophobicContact CG-CE1 4.19Å; Q451-F466 HydrophobicContact CB-CD1 4.4Å; I454-F466 HydrophobicContact CD1-CB 3.92Å; I454-F466 HydrophobicContact CD1-CD2 3.78Å; I454-F466 HydrophobicContact CD1-CE2 4.46Å; I454-F466 HydrophobicContact CD1-CG 3.86Å; P462-F466 WeakPolarHBondContact O-CB 3.38Å; P462-F466 PolarHBondContact O-N 3.08Å; G463-F466 WeakPolarHBondContact O-CB 3.45Å; N464-F466 VanDerWaalsContact C-N 3.29Å; N464-F466 PolarHBondContact O-N 3.47Å; F466-L469 PolarHBondContact O-N 3Å; F466-F470 HydrophobicContact CD2-CD2 4.36Å; F466-F470 HydrophobicContact CD2-CE2 4.08Å; F466-F470 HydrophobicContact CE1-CD2 4.28Å; F466-F470 HydrophobicContact CE1-CE2 4.46Å; F466-F470 HydrophobicContact CE2-CD2 4.04Å; F466-F470 AromaticContact CE2-CE2 3.5Å; F466-F470 HydrophobicContact CE2-CE2 3.5Å; F466-F470 AromaticContact CZ-CD2 3.97Å; F466-F470 HydrophobicContact CZ-CD2 3.97Å; F466-F470 AromaticContact CZ-CE2 3.7Å; F466-F470 HydrophobicContact CZ-CE2 3.7Å; F466-F470 WeakPolarHBondContact O-CD2 3.44Å; F466-F470 PolarHBondContact O-N 2.9Å |
| 467 | L | 96.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.2 | -40.9 | 172.8 | -71.9 | -170.7 | 0 | 0 | 0 | 112.5 | A317 M383 F447 Q451 G463 N464 I465 L469 F470 L471 | A317-L467 HydrophobicContact CB-CD1 4.38Å; A317-L467 HydrophobicContact CB-CD2 3.97Å; M383-L467 HydrophobicContact CE-CB 3.81Å; M383-L467 HydrophobicContact CE-CD1 3.65Å; M383-L467 HydrophobicContact CE-CG 4.29Å; F447-L467 HydrophobicContact CB-CD2 3.9Å; F447-L467 HydrophobicContact CD2-CD2 3.83Å; F447-L467 HydrophobicContact CG-CD2 3.85Å; Q451-L467 VanDerWaalsContact OE1-CD1 3.26Å; G463-L467 PolarHBondContact O-N 3.32Å; N464-L467 PolarHBondContact O-N 3.43Å; N464-L467 VanDerWaalsContact O-N 3.17Å; I465-L467 PolarHBondContact O-N 3.08Å; L467-L469 VanDerWaalsContact C-N 3.3Å; L467-L469 PolarHBondContact O-N 3.36Å; L467-F470 PolarHBondContact O-N 3.35Å; L467-L471 WeakPolarHBondContact O-CB 3.47Å; L467-L471 WeakPolarHBondContact O-CG 3.22Å; L467-L471 PolarHBondContact O-N 3.42Å |
| 468 | C | 97.3 | Very high | 95.4 | Very high | 13 Ų | 13 | 41.9 Ų | 41.9 | 9% | 0.088 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.3 | -38.4 | 176.4 | -66.5 | 0 | 0 | 0 | 0 | 112.6 | L380 V384 N464 I465 L471 T472 | L380-C468 HydrophobicContact CD1-CB 4.21Å; L380-C468 WeakPolarHBondContact CD1-O 3.24Å; V384-C468 HydrophobicContact CG2-CB 4.24Å; N464-C468 PolarHBondContact O-N 3.21Å; N464-C468 PolarHBondContact O-SG 2.86Å; I465-C468 WeakPolarHBondContact O-CB 3.32Å; I465-C468 PolarHBondContact O-N 3.33Å; I465-C468 VanDerWaalsContact O-N 3.13Å; C468-L471 PolarHBondContact O-N 3.37Å; C468-T472 WeakPolarHBondContact O-CB 3.38Å; C468-T472 PolarHBondContact O-N 3.21Å; C468-T472 PolarHBondContact O-OG1 2.87Å |
| 469 | L | 97.4 | Very high | 95.4 | Very high | 116 Ų | 116 | 35.5 Ų | 35.5 | 61% | 0.607 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -63.3 | -46.2 | 176.3 | -69.5 | 170 | 0 | 0 | 0 | 111.5 | I465 F466 L467 T472 L473 | I465-L469 HydrophobicContact CG2-CD1 4.46Å; I465-L469 WeakPolarHBondContact O-CG 3.49Å; I465-L469 PolarHBondContact O-N 3.28Å; F466-L469 PolarHBondContact O-N 3Å; L467-L469 VanDerWaalsContact C-N 3.3Å; L467-L469 PolarHBondContact O-N 3.36Å; L469-T472 WeakPolarHBondContact O-CB 3.29Å; L469-T472 PolarHBondContact O-N 3.49Å; L469-L473 PolarHBondContact O-N 3.27Å |
| 470 | F | 97.4 | Very high | 95.4 | Very high | 64 Ų | 64 | 42.4 Ų | 42.4 | 28% | 0.281 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -70.7 | -33.5 | 177.9 | -82.2 | -76.7 | 0 | 0 | 0 | 113.4 | L313 F447 F466 L467 T472 L473 G474 | L313-F470 HydrophobicContact CD2-CB 4.25Å; L313-F470 HydrophobicContact CD2-CD1 3.77Å; L313-F470 HydrophobicContact CD2-CG 4.44Å; F447-F470 HydrophobicContact CD1-CD2 4.49Å; F447-F470 HydrophobicContact CE1-CB 3.97Å; F447-F470 AromaticContact CE1-CD1 3.82Å; F447-F470 HydrophobicContact CE1-CD1 3.82Å; F447-F470 AromaticContact CE1-CD2 3.66Å; F447-F470 HydrophobicContact CE1-CD2 3.66Å; F447-F470 HydrophobicContact CE1-CE1 4.22Å; F447-F470 HydrophobicContact CE1-CE2 4.1Å; F447-F470 AromaticContact CE1-CG 3.51Å; F447-F470 HydrophobicContact CE1-CG 3.51Å; F447-F470 HydrophobicContact CE1-CZ 4.35Å; F447-F470 HydrophobicContact CE2-CB 4.27Å; F447-F470 HydrophobicContact CZ-CB 3.51Å; F447-F470 AromaticContact CZ-CD1 3.78Å; F447-F470 HydrophobicContact CZ-CD1 3.78Å; F447-F470 HydrophobicContact CZ-CD2 4.13Å; F447-F470 AromaticContact CZ-CG 3.52Å; F447-F470 HydrophobicContact CZ-CG 3.52Å; F466-F470 HydrophobicContact CD2-CD2 4.36Å; F466-F470 HydrophobicContact CD2-CE2 4.08Å; F466-F470 HydrophobicContact CE1-CD2 4.28Å; F466-F470 HydrophobicContact CE1-CE2 4.46Å; F466-F470 HydrophobicContact CE2-CD2 4.04Å; F466-F470 AromaticContact CE2-CE2 3.5Å; F466-F470 HydrophobicContact CE2-CE2 3.5Å; F466-F470 AromaticContact CZ-CD2 3.97Å; F466-F470 HydrophobicContact CZ-CD2 3.97Å; F466-F470 AromaticContact CZ-CE2 3.7Å; F466-F470 HydrophobicContact CZ-CE2 3.7Å; F466-F470 WeakPolarHBondContact O-CD2 3.44Å; F466-F470 PolarHBondContact O-N 2.9Å; L467-F470 PolarHBondContact O-N 3.35Å; F470-T472 VanDerWaalsContact C-N 3.33Å; F470-L473 HydrophobicContact CD1-CD2 4.3Å; F470-L473 PolarHBondContact O-N 3.47Å; F470-G474 PolarHBondContact O-N 2.94Å |
| 471 | L | 96.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.6 | -32.9 | 170.2 | -71.6 | 171.6 | 0 | 0 | 0 | 112.1 | N314 A317 Y376 T379 L380 M383 M409 L467 C468 G474 A475 | N314-L471 HydrophobicContact CB-CD2 4.44Å; A317-L471 HydrophobicContact CB-CD2 4.11Å; A317-L471 HydrophobicContact CB-CG 4.34Å; Y376-L471 HydrophobicContact CE1-CB 4.33Å; Y376-L471 HydrophobicContact CE1-CD2 3.78Å; Y376-L471 VanDerWaalsContact CE1-O 3.26Å; Y376-L471 WeakPolarHBondContact CE1-O 3.39Å; T379-L471 HydrophobicContact CG2-CD2 4.44Å; L380-L471 HydrophobicContact CB-CB 4.45Å; L380-L471 HydrophobicContact CD1-CB 3.87Å; M383-L471 HydrophobicContact CB-CD1 4Å; M383-L471 HydrophobicContact CG-CD1 3.98Å; M409-L471 HydrophobicContact CE-CD1 4.45Å; L467-L471 WeakPolarHBondContact O-CB 3.47Å; L467-L471 WeakPolarHBondContact O-CG 3.22Å; L467-L471 PolarHBondContact O-N 3.42Å; C468-L471 PolarHBondContact O-N 3.37Å; L471-G474 PolarHBondContact O-N 3.41Å; L471-A475 PolarHBondContact O-N 3.01Å |
| 472 | T | 97.3 | Very high | 94.6 | Very high | 71 Ų | 71 | 45.6 Ų | 45.6 | 44% | 0.436 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -67.3 | -45.4 | 173.5 | -55.9 | 0 | 0 | 0 | 0 | 111.2 | L380 C468 L469 F470 G474 A475 A476 | L380-T472 WeakPolarHBondContact CD1-OG1 3.14Å; L380-T472 HydrophobicContact CD2-CG2 4.47Å; L380-T472 WeakPolarHBondContact CD2-OG1 3.43Å; C468-T472 WeakPolarHBondContact O-CB 3.38Å; C468-T472 PolarHBondContact O-N 3.21Å; C468-T472 PolarHBondContact O-OG1 2.87Å; L469-T472 WeakPolarHBondContact O-CB 3.29Å; L469-T472 PolarHBondContact O-N 3.49Å; F470-T472 VanDerWaalsContact C-N 3.33Å; T472-G474 VanDerWaalsContact C-N 3.29Å; T472-G474 PolarHBondContact O-N 3.39Å; T472-A475 PolarHBondContact O-N 3.08Å; T472-A476 WeakPolarHBondContact O-CB 3.38Å; T472-A476 PolarHBondContact O-N 3.48Å |
| 473 | L | 96.7 | Very high | 93.7 | Very high | 86 Ų | 86 | 46.5 Ų | 46.5 | 45% | 0.45 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -57.5 | -43.5 | 171.6 | 176.1 | 61.9 | 0 | 0 | 0 | 111.2 | L313 L469 F470 A476 L477 | L313-L473 HydrophobicContact CD1-CG 4.4Å; L469-L473 PolarHBondContact O-N 3.27Å; F470-L473 HydrophobicContact CD1-CD2 4.3Å; F470-L473 PolarHBondContact O-N 3.47Å; L473-A476 PolarHBondContact O-N 2.66Å; L473-L477 HydrophobicContact CD1-CD1 3.97Å; L473-L477 HydrophobicContact CD1-CG 4.14Å; L473-L477 HydrophobicContact CG-CD1 3.98Å; L473-L477 WeakPolarHBondContact O-CB 3.31Å; L473-L477 VanDerWaalsContact O-CG 3.3Å; L473-L477 WeakPolarHBondContact O-CG 3.35Å; L473-L477 PolarHBondContact O-N 2.99Å |
| 474 | G | 95.5 | Very high | 92.5 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.1 | -53.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | T310 Y376 F470 L471 T472 A476 L477 T478 | T310-G474 VanDerWaalsContact CG2-O 3.3Å; T310-G474 WeakPolarHBondContact CG2-O 3.29Å; Y376-G474 WeakPolarHBondContact OH-CA 3.43Å; F470-G474 PolarHBondContact O-N 2.94Å; L471-G474 PolarHBondContact O-N 3.41Å; T472-G474 VanDerWaalsContact C-N 3.29Å; T472-G474 PolarHBondContact O-N 3.39Å; G474-A476 VanDerWaalsContact C-N 3.3Å; G474-A476 PolarHBondContact O-N 2.87Å; G474-L477 PolarHBondContact O-N 3.46Å; G474-T478 PolarHBondContact O-N 2.94Å; G474-T478 PolarHBondContact O-OG1 3.02Å; G474-T478 VanDerWaalsContact O-OG1 3.08Å |
| 475 | A | 94.6 | Very high | 91.4 | Very high | 9 Ų | 9 | 50 Ų | 50 | 7% | 0.074 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.1 | -40.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L373 Y376 I377 L471 T472 T478 A479 | L373-A475 WeakPolarHBondContact CD1-O 3.49Å; Y376-A475 HydrophobicContact CD1-CB 3.84Å; Y376-A475 HydrophobicContact CE1-CB 4.41Å; Y376-A475 HydrophobicContact CG-CB 4.27Å; I377-A475 HydrophobicContact CG1-CB 4.33Å; L471-A475 PolarHBondContact O-N 3.01Å; T472-A475 PolarHBondContact O-N 3.08Å; A475-T478 PolarHBondContact O-N 2.83Å; A475-A479 PolarHBondContact O-N 3.27Å; A475-A479 VanDerWaalsContact O-N 3.12Å |
| 476 | A | 95.2 | Very high | 90 | Very high | 47 Ų | 47 | 50.8 Ų | 50.8 | 39% | 0.388 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.5 | -46.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | T472 L473 G474 T478 A479 F480 | T472-A476 WeakPolarHBondContact O-CB 3.38Å; T472-A476 PolarHBondContact O-N 3.48Å; L473-A476 PolarHBondContact O-N 2.66Å; G474-A476 VanDerWaalsContact C-N 3.3Å; G474-A476 PolarHBondContact O-N 2.87Å; A476-T478 VanDerWaalsContact C-N 3.34Å; A476-T478 PolarHBondContact O-N 3.49Å; A476-A479 WeakPolarHBondContact O-CB 3.44Å; A476-A479 PolarHBondContact O-N 3.23Å; A476-F480 WeakPolarHBondContact O-CD2 3.32Å |
| 477 | L | 94.4 | Very high | 88.4 | Confident | 42 Ų | 42 | 51.5 Ų | 51.5 | 22% | 0.22 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.7 | -37.2 | 175.8 | -71.4 | 172.4 | 0 | 0 | 0 | 112.1 | L306 I309 T310 L313 L473 G474 A479 F480 | L306-L477 HydrophobicContact CD2-CD2 3.96Å; I309-L477 HydrophobicContact CG2-CD1 4.05Å; T310-L477 HydrophobicContact CG2-CB 3.36Å; T310-L477 HydrophobicContact CG2-CD1 4.44Å; L313-L477 HydrophobicContact CD1-CD1 4.36Å; L473-L477 HydrophobicContact CD1-CD1 3.97Å; L473-L477 HydrophobicContact CD1-CG 4.14Å; L473-L477 HydrophobicContact CG-CD1 3.98Å; L473-L477 WeakPolarHBondContact O-CB 3.31Å; L473-L477 VanDerWaalsContact O-CG 3.3Å; L473-L477 WeakPolarHBondContact O-CG 3.35Å; L473-L477 PolarHBondContact O-N 2.99Å; G474-L477 PolarHBondContact O-N 3.46Å; L477-A479 VanDerWaalsContact C-N 3.28Å; L477-A479 PolarHBondContact O-N 2.97Å; L477-F480 PolarHBondContact O-N 3.11Å; L477-F480 VanDerWaalsContact O-N 3.14Å |
| 478 | T | 92.5 | Very high | 86.8 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.4 | -35.4 | 175.1 | -60.5 | 0 | 0 | 0 | 0 | 111.6 | T310 T372 L373 Y376 G474 A475 A476 F480 I481 | T310-T478 WeakPolarHBondContact CB-OG1 3.5Å; T310-T478 WeakPolarHBondContact CG2-OG1 3.4Å; T372-T478 HydrophobicContact CG2-CG2 4.12Å; L373-T478 HydrophobicContact CB-CG2 4.15Å; L373-T478 HydrophobicContact CD1-CG2 4.04Å; Y376-T478 WeakPolarHBondContact CD2-OG1 3.33Å; G474-T478 PolarHBondContact O-N 2.94Å; G474-T478 PolarHBondContact O-OG1 3.02Å; G474-T478 VanDerWaalsContact O-OG1 3.08Å; A475-T478 PolarHBondContact O-N 2.83Å; A476-T478 VanDerWaalsContact C-N 3.34Å; A476-T478 PolarHBondContact O-N 3.49Å; T478-F480 VanDerWaalsContact C-N 3.26Å; T478-F480 PolarHBondContact O-N 3.3Å; T478-I481 HydrophobicContact CG2-CD1 4.45Å; T478-I481 PolarHBondContact O-N 2.9Å |
| 479 | A | 91.8 | Very high | 85.3 | Confident | 43 Ų | 43 | 58.5 Ų | 58.5 | 36% | 0.355 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64.1 | -28.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | K369 L373 A475 A476 L477 | K369-A479 WeakPolarHBondContact CE-O 3.29Å; K369-A479 PolarHBondContact NZ-O 2.83Å; L373-A479 HydrophobicContact CD1-CB 4.11Å; L373-A479 HydrophobicContact CD2-CB 4.16Å; A475-A479 PolarHBondContact O-N 3.27Å; A475-A479 VanDerWaalsContact O-N 3.12Å; A476-A479 WeakPolarHBondContact O-CB 3.44Å; A476-A479 PolarHBondContact O-N 3.23Å; L477-A479 VanDerWaalsContact C-N 3.28Å; L477-A479 PolarHBondContact O-N 2.97Å |
| 480 | F | 91.8 | Very high | 83.6 | Confident | 154 Ų | 154 | 54.5 Ų | 54.5 | 68% | 0.675 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -80.7 | -18.3 | 177.6 | -69.5 | -68.5 | 0 | 0 | 0 | 114.7 | A476 L477 T478 K482 | A476-F480 WeakPolarHBondContact O-CD2 3.32Å; L477-F480 PolarHBondContact O-N 3.11Å; L477-F480 VanDerWaalsContact O-N 3.14Å; T478-F480 VanDerWaalsContact C-N 3.26Å; T478-F480 PolarHBondContact O-N 3.3Å; F480-K482 PolarHBondContact O-N 3.36Å |
| 481 | I | 88.8 | Confident | 82 | Confident | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 29% | 0.291 | C | S | . | . | trans | -59.6 | 130.7 | 177.3 | -54.9 | 176.4 | 0 | 0 | 0 | 109.4 | N303 L306 L307 K369 F419 L423 T478 | N303-I481 HydrophobicContact CB-CG2 4.02Å; L306-I481 HydrophobicContact CB-CD1 4.23Å; L306-I481 HydrophobicContact CB-CG1 3.73Å; L306-I481 HydrophobicContact CD1-CG1 4.41Å; L307-I481 HydrophobicContact CB-CD1 4.08Å; L307-I481 HydrophobicContact CD1-CD1 4.24Å; K369-I481 VanDerWaalsContact CD-O 3.27Å; K369-I481 WeakPolarHBondContact CD-O 3.44Å; K369-I481 WeakPolarHBondContact CE-O 3.48Å; K369-I481 PolarHBondContact NZ-O 2.88Å; F419-I481 HydrophobicContact CE1-CD1 4.36Å; F419-I481 HydrophobicContact CE1-CG2 3.88Å; F419-I481 HydrophobicContact CZ-CB 4.5Å; F419-I481 HydrophobicContact CZ-CG2 3.6Å; L423-I481 HydrophobicContact CD1-CG2 4.2Å; T478-I481 HydrophobicContact CG2-CD1 4.45Å; T478-I481 PolarHBondContact O-N 2.9Å | ||
| 482 | K | 83.3 | Confident | 80.2 | Confident | 149 Ų | 149 | 62.7 Ų | 62.7 | 65% | 0.648 | 32% | 0.321 | S | S | * | . | trans | -88.8 | 134.9 | 173 | -64.3 | -175.6 | 178.9 | -178.7 | 0 | 110.1 | N303 F480 D484 | N303-K482 PolarHBondContact OD1-N 3.05Å; F480-K482 PolarHBondContact O-N 3.36Å; K482-D484 VanDerWaalsContact C-N 3.31Å; K482-D484 PolarHBondContact O-N 3.46Å | ||
| 483 | P | 75.6 | Confident | 78.2 | Confident | 72 Ų | 72 | 64.8 Ų | 64.8 | 47% | 0.468 | 33% | 0.326 | S | S | . | . | trans | -77.5 | 80.3 | 178.4 | 32.4 | -32.7 | 0 | 0 | 0 | 110.4 | K369 L485 | K369-P483 HydrophobicContact CB-CB 4.1Å; K369-P483 HydrophobicContact CD-CG 4.34Å; P483-L485 HydrophobicContact CB-CD2 4.41Å; P483-L485 PolarHBondContact O-N 3.33Å | ||
| 484 | D | 70.5 | Confident | 76.2 | Confident | 37 Ų | 37 | 63.2 Ų | 63.2 | 20% | 0.198 | 32% | 0.319 | C | S | . | . | trans | -86.1 | 84.2 | 173.4 | -170.9 | 21.2 | 0 | 0 | 0 | 109.7 | L423 K482 R486 K489 | L423-D484 HydrophobicContact CD2-CB 4.15Å; K482-D484 VanDerWaalsContact C-N 3.31Å; K482-D484 PolarHBondContact O-N 3.46Å; D484-R486 PolarHBondContact O-N 2.88Å; D484-R486 IonicContact OD2-CZ 3.79Å; D484-R486 VanDerWaalsContact OD2-CZ 3.27Å; D484-R486 IonicContact OD2-NE 3.79Å; D484-R486 PolarHBondContact OD2-NE 3.5Å; D484-R486 IonicContact OD2-NH2 2.72Å; D484-R486 PolarHBondContact OD2-NH2 3.3Å; D484-K489 IonicContact OD1-NZ 2.65Å; D484-K489 PolarHBondContact OD1-NZ 3.17Å | ||
| 485 | L | 72.6 | Confident | 74.1 | Confident | 37 Ų | 37 | 67.7 Ų | 67.7 | 19% | 0.194 | 35% | 0.348 | C | S | . | . | trans | -77.3 | 78.2 | -172.9 | -53.5 | 177.5 | 0 | 0 | 0 | 111.7 | Y368 E422 P483 Q488 K489 | Y368-L485 HydrophobicContact CD2-CD2 3.91Å; Y368-L485 HydrophobicContact CG-CD2 4.34Å; E422-L485 HydrophobicContact CG-CB 4.22Å; E422-L485 HydrophobicContact CG-CD2 3.59Å; E422-L485 WeakPolarHBondContact OE1-CA 3.2Å; P483-L485 HydrophobicContact CB-CD2 4.41Å; P483-L485 PolarHBondContact O-N 3.33Å; L485-Q488 HydrophobicContact CB-CB 4.16Å; L485-Q488 HydrophobicContact CB-CG 4.45Å; L485-K489 VanDerWaalsContact O-CG 3.29Å; L485-K489 WeakPolarHBondContact O-CG 3.35Å; L485-K489 PolarHBondContact O-N 3.19Å; L485-K489 VanDerWaalsContact O-N 3.14Å | ||
| 486 | R | 66.4 | Low | 72.2 | Confident | 92 Ų | 92 | 74.4 Ų | 74.4 | 35% | 0.347 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -73.6 | -40.8 | -168.8 | -68.7 | 178.1 | -177.9 | -165.5 | -3.4 | 113.7 | E422 Y425 D484 Q488 K489 A490 | E422-R486 PolarHBondContact O-N 3.49Å; E422-R486 VanDerWaalsContact O-N 3.16Å; E422-R486 PolarHBondContact OE1-N 2.66Å; Y425-R486 HydrophobicContact CD1-CB 4.49Å; D484-R486 PolarHBondContact O-N 2.88Å; D484-R486 IonicContact OD2-CZ 3.79Å; D484-R486 VanDerWaalsContact OD2-CZ 3.27Å; D484-R486 IonicContact OD2-NE 3.79Å; D484-R486 PolarHBondContact OD2-NE 3.5Å; D484-R486 IonicContact OD2-NH2 2.72Å; D484-R486 PolarHBondContact OD2-NH2 3.3Å; R486-Q488 VanDerWaalsContact C-N 3.31Å; R486-K489 PolarHBondContact O-N 3.46Å; R486-A490 WeakPolarHBondContact O-CB 3.48Å; R486-A490 PolarHBondContact O-N 3.41Å |
| 487 | R | 63.8 | Low | 70.2 | Confident | 49 Ų | 49 | 75.1 Ų | 75.1 | 19% | 0.185 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -66.8 | -36.6 | 178.1 | 174.3 | -179 | 62.5 | 170.2 | -1.5 | 110.1 | Y368 E418 E422 Y425 N491 | Y368-R487 PolarHBondContact OH-NH2 3.39Å; E418-R487 IonicContact OE1-NH1 2.81Å; E418-R487 IonicContact OE2-CZ 2.69Å; E418-R487 IonicContact OE2-NH1 2.87Å; E418-R487 PolarHBondContact OE2-NH1 3.4Å; E418-R487 IonicContact OE2-NH2 3.28Å; E418-R487 PolarHBondContact OE2-NH2 2.95Å; E422-R487 WeakPolarHBondContact OE1-CA 3.36Å; E422-R487 WeakPolarHBondContact OE1-CB 3.32Å; E422-R487 PolarHBondContact OE1-N 2.86Å; E422-R487 IonicContact OE2-CZ 2.65Å; E422-R487 VanDerWaalsContact OE2-CZ 3.28Å; E422-R487 IonicContact OE2-NE 3.82Å; E422-R487 PolarHBondContact OE2-NE 3.3Å; E422-R487 IonicContact OE2-NH2 3.59Å; E422-R487 PolarHBondContact OE2-NH2 3.45Å; Y425-R487 HydrophobicContact CD2-CB 3.86Å; Y425-R487 HydrophobicContact CD2-CG 4.08Å; Y425-R487 HydrophobicContact CE2-CG 4.43Å; Y425-R487 HydrophobicContact CG-CB 3.85Å; R487-N491 WeakPolarHBondContact O-CB 3.45Å; R487-N491 VanDerWaalsContact O-CG 3.22Å; R487-N491 PolarHBondContact O-N 2.85Å; R487-N491 PolarHBondContact O-OD1 2.85Å |
| 488 | Q | 63.1 | Low | 68.2 | Low | 59 Ų | 59 | 77.2 Ų | 77.2 | 28% | 0.276 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -66.7 | -42.9 | 173 | -69.4 | -174.6 | 19.4 | 0 | 0 | 113.7 | Y368 E422 L485 R486 N491 K492 | Y368-Q488 VanDerWaalsContact CE2-NE2 3.3Å; E422-Q488 PolarHBondContact OE1-N 3.44Å; L485-Q488 HydrophobicContact CB-CB 4.16Å; L485-Q488 HydrophobicContact CB-CG 4.45Å; R486-Q488 VanDerWaalsContact C-N 3.31Å; Q488-N491 PolarHBondContact O-N 3Å; Q488-K492 PolarHBondContact O-N 3.04Å; Q488-K492 VanDerWaalsContact O-N 3.11Å |
| 489 | K | 66.7 | Low | 66.3 | Low | 102 Ų | 102 | 82.4 Ų | 82.4 | 44% | 0.443 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -59.1 | -51.1 | 174.3 | -70.7 | 165.4 | -176.4 | -179.6 | 0 | 110.9 | D484 L485 R486 N491 K492 E493 | D484-K489 IonicContact OD1-NZ 2.65Å; D484-K489 PolarHBondContact OD1-NZ 3.17Å; L485-K489 VanDerWaalsContact O-CG 3.29Å; L485-K489 WeakPolarHBondContact O-CG 3.35Å; L485-K489 PolarHBondContact O-N 3.19Å; L485-K489 VanDerWaalsContact O-N 3.14Å; R486-K489 PolarHBondContact O-N 3.46Å; K489-N491 VanDerWaalsContact C-N 3.33Å; K489-N491 PolarHBondContact O-N 2.95Å; K489-K492 WeakPolarHBondContact O-CB 3.19Å; K489-K492 PolarHBondContact O-N 3.3Å; K489-K492 VanDerWaalsContact O-N 3.08Å; K489-E493 WeakPolarHBondContact O-CG 3.29Å; K489-E493 PolarHBondContact O-N 3.3Å |
| 490 | A | 59.9 | Low | 64.4 | Low | 31 Ų | 31 | 86.3 Ų | 86.3 | 26% | 0.256 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -57.9 | -42.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y425 R486 K492 E493 T494 | Y425-A490 HydrophobicContact CD1-CB 4.1Å; Y425-A490 HydrophobicContact CE1-CB 3.39Å; R486-A490 WeakPolarHBondContact O-CB 3.48Å; R486-A490 PolarHBondContact O-N 3.41Å; A490-K492 VanDerWaalsContact C-N 3.33Å; A490-K492 PolarHBondContact O-N 3.4Å; A490-E493 PolarHBondContact O-N 3.16Å; A490-T494 PolarHBondContact O-N 3.03Å |
| 491 | N | 63.8 | Low | 62.6 | Low | 93 Ų | 93 | 84.1 Ų | 84.1 | 50% | 0.497 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -63.6 | -35.7 | 176.7 | -75.8 | -2.9 | 0 | 0 | 0 | 112.7 | R487 Q488 K489 T494 N497 | R487-N491 WeakPolarHBondContact O-CB 3.45Å; R487-N491 VanDerWaalsContact O-CG 3.22Å; R487-N491 PolarHBondContact O-N 2.85Å; R487-N491 PolarHBondContact O-OD1 2.85Å; Q488-N491 PolarHBondContact O-N 3Å; K489-N491 VanDerWaalsContact C-N 3.33Å; K489-N491 PolarHBondContact O-N 2.95Å; N491-T494 PolarHBondContact O-OG1 3.22Å; N491-N497 PolarHBondContact O-ND2 3.3Å |
| 492 | K | 59.7 | Low | 61 | Low | 143 Ų | 143 | 90 Ų | 90 | 62% | 0.622 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -66.7 | -43 | 173.2 | -74.6 | -167.1 | 169.3 | -151.2 | 0 | 112 | Q488 K489 A490 T494 N497 | Q488-K492 PolarHBondContact O-N 3.04Å; Q488-K492 VanDerWaalsContact O-N 3.11Å; K489-K492 WeakPolarHBondContact O-CB 3.19Å; K489-K492 PolarHBondContact O-N 3.3Å; K489-K492 VanDerWaalsContact O-N 3.08Å; A490-K492 VanDerWaalsContact C-N 3.33Å; A490-K492 PolarHBondContact O-N 3.4Å; K492-T494 PolarHBondContact O-N 3.18Å; K492-N497 WeakPolarHBondContact O-CB 3.45Å; K492-N497 PolarHBondContact O-ND2 2.91Å |
| 493 | E | 55.2 | Low | 59.6 | Low | 116 Ų | 116 | 89.1 Ų | 89.1 | 54% | 0.542 | 44% | 0.439 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | 1.4 | -175.2 | -69.4 | 174.1 | -140 | 0 | 0 | 115.5 | K489 A490 K498 | K489-E493 WeakPolarHBondContact O-CG 3.29Å; K489-E493 PolarHBondContact O-N 3.3Å; A490-E493 PolarHBondContact O-N 3.16Å; E493-K498 WeakPolarHBondContact O-CD 3.44Å; E493-K498 VanDerWaalsContact O-CE 3.27Å; E493-K498 WeakPolarHBondContact O-CE 3.31Å; E493-K498 PolarHBondContact O-NZ 3.45Å |
| 494 | T | 54.3 | Low | 58.5 | Low | 52 Ų | 52 | 92.5 Ų | 92.5 | 32% | 0.319 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -57 | 138 | 176.5 | -50.3 | 0 | 0 | 0 | 0 | 112 | A490 N491 K492 E496 N497 K498 | A490-T494 PolarHBondContact O-N 3.03Å; N491-T494 PolarHBondContact O-OG1 3.22Å; K492-T494 PolarHBondContact O-N 3.18Å; T494-E496 VanDerWaalsContact C-N 3.28Å; T494-E496 PolarHBondContact O-N 3.04Å; T494-E496 VanDerWaalsContact O-N 3.15Å; T494-N497 PolarHBondContact O-N 3.34Å; T494-K498 PolarHBondContact O-N 3Å; T494-K498 VanDerWaalsContact O-N 3.09Å |
| 495 | P | 53 | Low | 57.7 | Low | 94 Ų | 94 | 97.9 Ų | 97.9 | 61% | 0.61 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -55.5 | -34.1 | -177.2 | -29.3 | 36.3 | 0 | 0 | 0 | 115.7 | N497 K498 L499 | P495-N497 VanDerWaalsContact C-N 3.33Å; P495-N497 PolarHBondContact O-N 3.28Å; P495-K498 PolarHBondContact O-N 3.19Å; P495-L499 WeakPolarHBondContact O-CG 3.28Å; P495-L499 PolarHBondContact O-N 2.66Å |
| 496 | E | 54.7 | Low | 56.7 | Low | 151 Ų | 151 | 98.7 Ų | 98.7 | 71% | 0.706 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64 | -37.3 | 177.7 | -64.1 | 179.2 | 143.1 | 0 | 0 | 112.2 | T494 Q500 | T494-E496 VanDerWaalsContact C-N 3.28Å; T494-E496 PolarHBondContact O-N 3.04Å; T494-E496 VanDerWaalsContact O-N 3.15Å; E496-Q500 PolarHBondContact O-N 3.4Å |
| 497 | N | 52.3 | Low | 56.1 | Low | 61 Ų | 61 | 99.3 Ų | 99.3 | 33% | 0.326 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -76 | -39.6 | 175.3 | -66.3 | -22.1 | 0 | 0 | 0 | 111.3 | N491 K492 T494 P495 L499 Q500 E501 | N491-N497 PolarHBondContact O-ND2 3.3Å; K492-N497 WeakPolarHBondContact O-CB 3.45Å; K492-N497 PolarHBondContact O-ND2 2.91Å; T494-N497 PolarHBondContact O-N 3.34Å; P495-N497 VanDerWaalsContact C-N 3.33Å; P495-N497 PolarHBondContact O-N 3.28Å; N497-L499 VanDerWaalsContact C-N 3.31Å; N497-L499 PolarHBondContact O-N 2.86Å; N497-Q500 CarbonylContact O-C 3.6Å; N497-Q500 WeakPolarHBondContact O-CA 3.46Å; N497-Q500 WeakPolarHBondContact O-CB 3.41Å; N497-Q500 PolarHBondContact O-N 3.46Å; N497-E501 PolarHBondContact O-N 3.1Å |
| 498 | K | 52.3 | Low | 55.6 | Low | 87 Ų | 87 | 101.9 Ų | 101.9 | 38% | 0.378 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.6 | -38.9 | 177 | -75.9 | -177.2 | 171.9 | 161.1 | 0 | 112.4 | E493 T494 P495 Q500 E501 E502 | E493-K498 WeakPolarHBondContact O-CD 3.44Å; E493-K498 VanDerWaalsContact O-CE 3.27Å; E493-K498 WeakPolarHBondContact O-CE 3.31Å; E493-K498 PolarHBondContact O-NZ 3.45Å; T494-K498 PolarHBondContact O-N 3Å; T494-K498 VanDerWaalsContact O-N 3.09Å; P495-K498 PolarHBondContact O-N 3.19Å; K498-Q500 VanDerWaalsContact C-N 3.29Å; K498-Q500 PolarHBondContact O-N 3.42Å; K498-E501 PolarHBondContact O-N 3.03Å; K498-E502 VanDerWaalsContact O-CB 3.27Å; K498-E502 WeakPolarHBondContact O-CB 3.28Å; K498-E502 VanDerWaalsContact O-CG 3.28Å; K498-E502 WeakPolarHBondContact O-CG 3.4Å; K498-E502 PolarHBondContact O-N 3Å |
| 499 | L | 53.1 | Low | 55 | Low | 109 Ų | 109 | 104.1 Ų | 104.1 | 57% | 0.571 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.4 | -34.9 | 173.2 | -73.3 | 165.7 | 0 | 0 | 0 | 112.1 | P495 N497 E503 | P495-L499 WeakPolarHBondContact O-CG 3.28Å; P495-L499 PolarHBondContact O-N 2.66Å; N497-L499 VanDerWaalsContact C-N 3.31Å; N497-L499 PolarHBondContact O-N 2.86Å; L499-E503 WeakPolarHBondContact O-CB 3.36Å; L499-E503 WeakPolarHBondContact O-CG 3.36Å; L499-E503 PolarHBondContact O-N 2.96Å |
| 500 | Q | 51.7 | Low | 54.2 | Low | 125 Ų | 125 | 105.7 Ų | 105.7 | 58% | 0.584 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -72.9 | -42.9 | 174.5 | -71.1 | -177.6 | -19.7 | 0 | 0 | 112.6 | E496 N497 K498 E503 E504 | E496-Q500 PolarHBondContact O-N 3.4Å; N497-Q500 CarbonylContact O-C 3.6Å; N497-Q500 WeakPolarHBondContact O-CA 3.46Å; N497-Q500 WeakPolarHBondContact O-CB 3.41Å; N497-Q500 PolarHBondContact O-N 3.46Å; K498-Q500 VanDerWaalsContact C-N 3.29Å; K498-Q500 PolarHBondContact O-N 3.42Å; Q500-E503 PolarHBondContact O-N 3.45Å; Q500-E504 PolarHBondContact O-N 3.49Å |
| 501 | E | 53.6 | Low | 53.3 | Low | 108 Ų | 108 | 109.5 Ų | 109.5 | 51% | 0.505 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.3 | -41.8 | 175 | -70.1 | 178.8 | 155.6 | 0 | 0 | 110.9 | N497 K498 E504 E505 | N497-E501 PolarHBondContact O-N 3.1Å; K498-E501 PolarHBondContact O-N 3.03Å; E501-E504 PolarHBondContact O-N 3.2Å; E501-E505 PolarHBondContact O-N 3.29Å |
| 502 | E | 55.3 | Low | 52.2 | Low | 123 Ų | 123 | 110.3 Ų | 110.3 | 58% | 0.575 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.6 | -35.3 | 173.2 | -74 | 174.9 | -165 | 0 | 0 | 112.4 | K498 S506 | K498-E502 VanDerWaalsContact O-CB 3.27Å; K498-E502 WeakPolarHBondContact O-CB 3.28Å; K498-E502 VanDerWaalsContact O-CG 3.28Å; K498-E502 WeakPolarHBondContact O-CG 3.4Å; K498-E502 PolarHBondContact O-N 3Å; E502-S506 WeakPolarHBondContact O-CB 3.35Å; E502-S506 PolarHBondContact O-N 3.25Å |
| 503 | E | 53.7 | Low | 51.6 | Low | 131 Ų | 131 | 109.9 Ų | 109.9 | 61% | 0.612 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.8 | -36.9 | 172.3 | -80.7 | -171.7 | 155.2 | 0 | 0 | 112.8 | L499 Q500 N507 | L499-E503 WeakPolarHBondContact O-CB 3.36Å; L499-E503 WeakPolarHBondContact O-CG 3.36Å; L499-E503 PolarHBondContact O-N 2.96Å; Q500-E503 PolarHBondContact O-N 3.45Å; E503-N507 WeakPolarHBondContact O-CB 3.34Å; E503-N507 VanDerWaalsContact O-CG 3.26Å; E503-N507 PolarHBondContact O-N 3.41Å; E503-N507 PolarHBondContact O-ND2 2.97Å |
| 504 | E | 53.1 | Low | 50.7 | Low | 143 Ų | 143 | 109 Ų | 109 | 67% | 0.668 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -71.3 | -41.9 | 176 | -72.7 | -164 | 144.4 | 0 | 0 | 112.7 | Q500 E501 N507 T508 | Q500-E504 PolarHBondContact O-N 3.49Å; E501-E504 PolarHBondContact O-N 3.2Å; E504-N507 PolarHBondContact O-N 2.91Å; E504-T508 PolarHBondContact O-N 3.4Å; E504-T508 PolarHBondContact O-OG1 2.87Å |
| 505 | E | 54.1 | Low | 50.4 | Low | 149 Ų | 149 | 112.2 Ų | 112.2 | 70% | 0.696 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -64.3 | -41 | 171 | -72.3 | -160.9 | 148.3 | 0 | 0 | 111.4 | E501 N507 T508 S509 | E501-E505 PolarHBondContact O-N 3.29Å; E505-N507 VanDerWaalsContact C-N 3.28Å; E505-N507 PolarHBondContact O-N 2.87Å; E505-T508 WeakPolarHBondContact CA-OG1 3.41Å; E505-T508 PolarHBondContact O-N 2.94Å; E505-T508 PolarHBondContact O-OG1 2.61Å; E505-S509 WeakPolarHBondContact O-CB 3.4Å; E505-S509 PolarHBondContact O-N 2.92Å |
| 506 | S | 51.8 | Low | 49.5 | Very low | 55 Ų | 55 | 113.3 Ų | 113.3 | 39% | 0.385 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -62.4 | -31.5 | 175.3 | -177.8 | 0 | 0 | 0 | 0 | 112.7 | E502 K510 | E502-S506 WeakPolarHBondContact O-CB 3.35Å; E502-S506 PolarHBondContact O-N 3.25Å; S506-K510 VanDerWaalsContact O-CG 3.29Å; S506-K510 WeakPolarHBondContact O-CG 3.24Å; S506-K510 PolarHBondContact O-NZ 3.46Å; S506-K510 PolarHBondContact OG-NZ 2.93Å |
| 507 | N | 53.6 | Low | 49 | Very low | 105 Ų | 105 | 114.2 Ų | 114.2 | 56% | 0.561 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -84.5 | -38.7 | 177.9 | -76.3 | -40.4 | 0 | 0 | 0 | 113 | E503 E504 E505 K510 | E503-N507 WeakPolarHBondContact O-CB 3.34Å; E503-N507 VanDerWaalsContact O-CG 3.26Å; E503-N507 PolarHBondContact O-N 3.41Å; E503-N507 PolarHBondContact O-ND2 2.97Å; E504-N507 PolarHBondContact O-N 2.91Å; E505-N507 VanDerWaalsContact C-N 3.28Å; E505-N507 PolarHBondContact O-N 2.87Å; N507-K510 PolarHBondContact O-N 2.91Å |
| 508 | T | 53.3 | Low | 48.3 | Very low | 103 Ų | 103 | 118.1 Ų | 118.1 | 63% | 0.632 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -68.6 | -35.5 | 176.1 | 48.1 | 0 | 0 | 0 | 0 | 112.5 | E504 E505 K510 V511 | E504-T508 PolarHBondContact O-N 3.4Å; E504-T508 PolarHBondContact O-OG1 2.87Å; E505-T508 WeakPolarHBondContact CA-OG1 3.41Å; E505-T508 PolarHBondContact O-N 2.94Å; E505-T508 PolarHBondContact O-OG1 2.61Å; T508-K510 PolarHBondContact O-N 3.04Å; T508-V511 PolarHBondContact O-N 3.4Å |
| 509 | S | 50.8 | Low | 47.7 | Very low | 106 Ų | 106 | 122 Ų | 122 | 74% | 0.741 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | -16.6 | 174.1 | -171 | 0 | 0 | 0 | 0 | 114.2 | E505 | E505-S509 WeakPolarHBondContact O-CB 3.4Å; E505-S509 PolarHBondContact O-N 2.92Å |
| 510 | K | 48.2 | Very low | 47 | Very low | 134 Ų | 134 | 128.3 Ų | 128.3 | 58% | 0.583 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | 0.9 | -177.6 | -74.2 | -175.8 | -162.7 | 95.9 | 0 | 115.3 | S506 N507 T508 P512 | S506-K510 VanDerWaalsContact O-CG 3.29Å; S506-K510 WeakPolarHBondContact O-CG 3.24Å; S506-K510 PolarHBondContact O-NZ 3.46Å; S506-K510 PolarHBondContact OG-NZ 2.93Å; N507-K510 PolarHBondContact O-N 2.91Å; T508-K510 PolarHBondContact O-N 3.04Å; K510-P512 WeakPolarHBondContact O-CD 3.47Å |
| 511 | V | 42.6 | Very low | 46.8 | Very low | 112 Ų | 112 | 128.5 Ų | 128.5 | 68% | 0.679 | 71% | 0.706 | S | S | * | * | trans | -75.5 | 113 | 175.6 | -177.2 | 0 | 0 | 0 | 0 | 109.3 | T508 | T508-V511 PolarHBondContact O-N 3.4Š| ||
| 512 | P | 40.4 | Very low | 46.4 | Very low | 110 Ų | 110 | 129.6 Ų | 129.6 | 71% | 0.714 | 72% | 0.717 | S | S | * | * | trans | -72.7 | 135 | -178.6 | -14.2 | 30.9 | 0 | 0 | 0 | 110.5 | K510 A514 | K510-P512 WeakPolarHBondContact O-CD 3.47Å; P512-A514 PolarHBondContact O-N 2.94Å | ||
| 513 | T | 46.4 | Very low | 45.9 | Very low | 134 Ų | 134 | 129.9 Ų | 129.9 | 82% | 0.822 | 72% | 0.724 | S | S | * | * | trans | -67.1 | 92 | 174.7 | -43.3 | 0 | 0 | 0 | 0 | 110.2 | V515 | T513-V515 PolarHBondContact O-N 3.09Š| ||
| 514 | A | 37.3 | Very low | 45.5 | Very low | 96 Ų | 96 | 129.9 Ų | 129.9 | 79% | 0.793 | 73% | 0.731 | S | S | * | * | trans | -69.9 | 90.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | P512 S516 | P512-A514 PolarHBondContact O-N 2.94Å; A514-S516 PolarHBondContact O-N 2.91Å | ||
| 515 | V | 46.1 | Very low | 45 | Very low | 120 Ų | 120 | 129.1 Ų | 129.1 | 73% | 0.727 | 74% | 0.735 | S | S | * | * | trans | -63.1 | 122 | 167.6 | 177.8 | 0 | 0 | 0 | 0 | 108 | T513 E517 | T513-V515 PolarHBondContact O-N 3.09Å; V515-E517 HydrophobicContact CG1-CG 4.22Å | ||
| 516 | S | 35.9 | Very low | 44.4 | Very low | 117 Ų | 117 | 127.7 Ų | 127.7 | 82% | 0.818 | 74% | 0.738 | S | S | * | * | trans | -109.7 | 74.1 | 177.2 | -175.8 | 0 | 0 | 0 | 0 | 109.8 | A514 | A514-S516 PolarHBondContact O-N 2.91Š| ||
| 517 | E | 42.8 | Very low | 43.9 | Very low | 171 Ų | 171 | 132.9 Ų | 132.9 | 80% | 0.799 | 76% | 0.763 | S | S | * | * | trans | -74.5 | 116.4 | 153.9 | -69.5 | -178.2 | 118.2 | 0 | 0 | 107.4 | V515 | V515-E517 HydrophobicContact CG1-CG 4.22Š| ||
| 518 | D | 39 | Very low | 43.1 | Very low | 142 Ų | 142 | 135.1 Ų | 135.1 | 76% | 0.759 | 78% | 0.778 | S | S | * | * | -170.3 | 153.1 | 126 | -110.6 | -25.6 | 0 | 0 | 0 | 114.2 | |||||
| 519 | H | 39.7 | Very low | 42.3 | Very low | 169 Ų | 169 | 137.8 Ų | 137.8 | 78% | 0.782 | 79% | 0.79 | S | S | * | * | trans | -41.4 | 136.4 | -177.8 | -61.3 | -80.7 | 0 | 0 | 0 | 118.9 | ||||
| 520 | L | 38.1 | Very low | 41.5 | Very low | 242 Ų | 242 | 140.6 Ų | 140.6 | 100% | 1.267 | 80% | 0.795 | S | S | * | * | -161.5 | 0 | 96.6 | -121.5 | 160.2 | 0 | 0 | 0 | 113.4 |
Retrieved 520 of 520 residues in 3782.5 ms
(Link to these results)