| 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 | 34.5 | Very low | 225 Ų | 225 | 134.5 Ų | 134.5 | 100% | 1.108 | 81% | 0.81 | S | S | * | * | 0 | 80.6 | 0 | -68 | -179.4 | 178.8 | 0 | 0 | 111 | |||||
| 2 | D | 37.4 | Very low | 34 | Very low | 148 Ų | 148 | 135.3 Ų | 135.3 | 79% | 0.791 | 82% | 0.816 | S | S | * | * | cis | -162.9 | 155.4 | -30.3 | -87.6 | -38.5 | 0 | 0 | 0 | 109.7 | ||||
| 3 | N | 34.3 | Very low | 33.7 | Very low | 161 Ų | 161 | 132 Ų | 132 | 86% | 0.861 | 81% | 0.812 | S | S | * | * | trans | -94.4 | 138.1 | 179.1 | -76.9 | -20.3 | 0 | 0 | 0 | 112.4 | ||||
| 4 | V | 38.1 | Very low | 33.4 | Very low | 130 Ų | 130 | 132.8 Ų | 132.8 | 79% | 0.788 | 82% | 0.816 | S | S | * | * | trans | -151.6 | 88 | 162.7 | 177 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 5 | T | 38.2 | Very low | 33.2 | Very low | 119 Ų | 119 | 131.2 Ų | 131.2 | 73% | 0.73 | 81% | 0.811 | S | S | * | * | 68.1 | 146.8 | 97.3 | 63 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 6 | V | 36.5 | Very low | 33.3 | Very low | 131 Ų | 131 | 131.2 Ų | 131.2 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | cis | -170.8 | 156.1 | -4.8 | 128.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 7 | A | 32.9 | Very low | 33 | Very low | 88 Ų | 88 | 133.3 Ų | 133.3 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | trans | 57.5 | 144.7 | 163.7 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 8 | A | 33.1 | Very low | 32.9 | Very low | 93 Ų | 93 | 133.6 Ų | 133.6 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | cis | 90.4 | 127.8 | 18.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 9 | V | 32.7 | Very low | 32.8 | Very low | 141 Ų | 141 | 131.1 Ų | 131.1 | 86% | 0.855 | 81% | 0.813 | S | S | * | * | trans | 179.5 | 159 | 153.3 | 139 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 10 | E | 30.4 | Very low | 32.7 | Very low | 182 Ų | 182 | 134 Ų | 134 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | trans | -75.8 | -174.9 | 177.4 | -52.7 | 127 | 132.9 | 0 | 0 | 112.5 | ||||
| 11 | G | 28.8 | Very low | 32.6 | Very low | 62 Ų | 62 | 134.8 Ų | 134.8 | 64% | 0.639 | 82% | 0.816 | S | S | * | * | cis | 168.1 | 166.5 | -0.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 12 | T | 28.2 | Very low | 32.3 | Very low | 144 Ų | 144 | 131.6 Ų | 131.6 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | trans | 48.8 | 112.6 | 157.8 | 49.5 | 0 | 0 | 0 | 0 | 123 | ||||
| 13 | A | 29.8 | Very low | 32 | Very low | 92 Ų | 92 | 133.4 Ų | 133.4 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | 85.9 | 166.2 | 116.6 | 0 | 0 | 0 | 0 | 0 | 123.9 | |||||
| 14 | V | 30 | Very low | 31.7 | Very low | 143 Ų | 143 | 129.3 Ų | 129.3 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | 93.9 | 135.6 | 162.7 | -166.6 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 15 | C | 29.7 | Very low | 31.5 | Very low | 109 Ų | 109 | 131.7 Ų | 131.7 | 74% | 0.736 | 80% | 0.804 | S | S | * | * | trans | -89.3 | -172.4 | -179.5 | -44.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 16 | P | 35.5 | Very low | 31.1 | Very low | 131 Ų | 131 | 133.8 Ų | 133.8 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | trans | -113.2 | 157.1 | 140.1 | -2.8 | 23.4 | 0 | 0 | 0 | 113.2 | ||||
| 17 | L | 28.5 | Very low | 30.7 | Very low | 167 Ų | 167 | 131.1 Ų | 131.1 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -124.6 | 150.5 | 177 | -78.9 | 164.3 | 0 | 0 | 0 | 110.9 | ||||
| 18 | V | 30.6 | Very low | 30.6 | Very low | 138 Ų | 138 | 133.9 Ų | 133.9 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | trans | -170.1 | 133.7 | 151.4 | -94.7 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 19 | A | 30.6 | Very low | 30.2 | Very low | 87 Ų | 87 | 135.2 Ų | 135.2 | 72% | 0.719 | 81% | 0.808 | S | S | * | * | cis | 73 | 138.3 | 36.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 20 | E | 31.8 | Very low | 30 | Very low | 188 Ų | 188 | 134.6 Ų | 134.6 | 88% | 0.879 | 80% | 0.804 | S | S | * | * | cis | -154 | 169.7 | 13.3 | -58.8 | 171.8 | 141.6 | 0 | 0 | 109.3 | ||||
| 21 | D | 30.5 | Very low | 30.3 | Very low | 152 Ų | 152 | 134.3 Ų | 134.3 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | -165.3 | 169.3 | -51.7 | -141.4 | 117.9 | 0 | 0 | 0 | 112.3 | |||||
| 22 | M | 30.9 | Very low | 30.7 | Very low | 158 Ų | 158 | 137.4 Ų | 137.4 | 78% | 0.778 | 81% | 0.814 | S | S | * | * | trans | 81.1 | 149.5 | 145.6 | -135.7 | 175 | 178.5 | 0 | 0 | 125.5 | ||||
| 23 | E | 31.3 | Very low | 30.7 | Very low | 185 Ų | 185 | 137.8 Ų | 137.8 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | trans | 66 | 151.3 | 169.1 | -50 | -165.3 | 159.7 | 0 | 0 | 119.1 | ||||
| 24 | G | 28.6 | Very low | 30.9 | Very low | 75 Ų | 75 | 140.7 Ų | 140.7 | 77% | 0.773 | 81% | 0.813 | S | S | * | * | cis | 173.1 | 174.7 | -7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 25 | M | 32.6 | Very low | 30.8 | Very low | 180 Ų | 180 | 139.2 Ų | 139.2 | 89% | 0.887 | 81% | 0.809 | S | S | * | * | trans | 85 | 167.8 | 165.8 | -126.6 | 64.2 | -166.6 | 0 | 0 | 122.1 | ||||
| 26 | E | 29.4 | Very low | 30.7 | Very low | 163 Ų | 163 | 139.4 Ų | 139.4 | 76% | 0.762 | 81% | 0.811 | S | S | * | * | trans | -106.1 | 166.9 | -151.1 | -51.8 | 175.2 | 122.7 | 0 | 0 | 116.8 | ||||
| 27 | G | 29.5 | Very low | 30.4 | Very low | 76 Ų | 76 | 140.4 Ų | 140.4 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | trans | -161.6 | 134.8 | 165.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 28 | I | 29.4 | Very low | 30.6 | Very low | 145 Ų | 145 | 140.1 Ų | 140.1 | 74% | 0.744 | 80% | 0.8 | S | S | * | * | trans | -132.6 | 153.4 | -166.4 | -69.6 | 174.2 | 0 | 0 | 0 | 111.9 | ||||
| 29 | C | 24.9 | Very low | 30.5 | Very low | 121 Ų | 121 | 139 Ų | 139 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | 71.3 | 157.5 | 169.3 | -86.5 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 30 | V | 29.5 | Very low | 30.3 | Very low | 128 Ų | 128 | 140.1 Ų | 140.1 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | cis | -137.8 | 151.8 | 13.5 | 178.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 31 | M | 35.5 | Very low | 30.2 | Very low | 176 Ų | 176 | 138.9 Ų | 138.9 | 87% | 0.867 | 78% | 0.778 | S | S | * | * | trans | -101.9 | 137.1 | 159 | -68.7 | -124.8 | -61.6 | 0 | 0 | 111.4 | ||||
| 32 | P | 37.6 | Very low | 30 | Very low | 128 Ų | 128 | 136 Ų | 136 | 83% | 0.831 | 77% | 0.77 | S | S | * | * | trans | -88.5 | 137.1 | 169.7 | 33.9 | -30.8 | 0 | 0 | 0 | 111.9 | ||||
| 33 | D | 28.1 | Very low | 29.9 | Very low | 152 Ų | 152 | 135.3 Ų | 135.3 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | trans | -120.9 | 170.2 | 175.2 | -166.7 | 17.8 | 0 | 0 | 0 | 111.6 | ||||
| 34 | L | 33.4 | Very low | 29.7 | Very low | 152 Ų | 152 | 129.5 Ų | 129.5 | 80% | 0.796 | 76% | 0.764 | S | S | * | * | trans | -63 | 154 | -167.5 | -64 | 157.5 | 0 | 0 | 0 | 115.6 | ||||
| 35 | S | 29.1 | Very low | 30.2 | Very low | 112 Ų | 112 | 132.2 Ų | 132.2 | 78% | 0.783 | 77% | 0.768 | S | S | * | * | 159.8 | 142.6 | 106.6 | 55.9 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 36 | S | 27.2 | Very low | 30.1 | Very low | 113 Ų | 113 | 129.7 Ų | 129.7 | 79% | 0.79 | 76% | 0.763 | S | S | * | * | trans | 147.8 | 127.5 | 163.8 | -77.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 37 | I | 30.1 | Very low | 31.1 | Very low | 153 Ų | 153 | 126.9 Ų | 126.9 | 79% | 0.785 | 76% | 0.758 | S | S | * | * | cis | -149.5 | 129.8 | 10.6 | -91.9 | 147.3 | 0 | 0 | 0 | 105.5 | ||||
| 38 | K | 31.3 | Very low | 31 | Very low | 161 Ų | 161 | 130.7 Ų | 130.7 | 70% | 0.7 | 76% | 0.761 | S | S | * | * | 46.9 | 145.2 | 94.8 | -93.9 | -174.1 | 173.9 | -85.9 | 0 | 114.7 | E40 | K38-E40 IonicContact NZ-OE1 2.71Å; K38-E40 PolarHBondContact NZ-OE1 2.92Å | |||
| 39 | T | 29.2 | Very low | 30.9 | Very low | 113 Ų | 113 | 131.2 Ų | 131.2 | 69% | 0.693 | 76% | 0.76 | S | S | * | * | cis | -157 | 160.7 | 11.3 | 37.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 40 | E | 27.5 | Very low | 31.2 | Very low | 111 Ų | 111 | 131.2 Ų | 131.2 | 52% | 0.519 | 76% | 0.759 | S | S | . | * | cis | -177.9 | 150.8 | -30.1 | -114.2 | 174.8 | -99.2 | 0 | 0 | 108.9 | K38 | K38-E40 IonicContact NZ-OE1 2.71Å; K38-E40 PolarHBondContact NZ-OE1 2.92Å | ||
| 41 | Q | 28.6 | Very low | 31.1 | Very low | 163 Ų | 163 | 129.2 Ų | 129.2 | 76% | 0.762 | 75% | 0.75 | S | S | * | * | trans | 70.5 | 157.5 | 152.3 | -65 | 172.5 | 24.1 | 0 | 0 | 121.5 | ||||
| 42 | S | 26.3 | Very low | 31.6 | Very low | 92 Ų | 92 | 125.6 Ų | 125.6 | 64% | 0.643 | 74% | 0.74 | S | S | * | * | cis | -175.2 | 155.2 | -25.9 | 61.3 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 43 | V | 28 | Very low | 31.2 | Very low | 142 Ų | 142 | 128.3 Ų | 128.3 | 86% | 0.861 | 74% | 0.742 | S | S | * | * | trans | 73.5 | 144.2 | 144.6 | 166.1 | 0 | 0 | 0 | 0 | 121 | ||||
| 44 | G | 27.3 | Very low | 31.2 | Very low | 64 Ų | 64 | 128.4 Ų | 128.4 | 66% | 0.66 | 74% | 0.742 | S | S | * | * | trans | -101.9 | -140.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 45 | P | 39.4 | Very low | 31 | Very low | 131 Ų | 131 | 127.5 Ų | 127.5 | 85% | 0.851 | 74% | 0.743 | S | S | * | * | cis | -131.1 | -159.6 | 9.9 | 43.5 | -25.1 | 0 | 0 | 0 | 115.1 | ||||
| 46 | T | 30 | Very low | 31.1 | Very low | 128 Ų | 128 | 126.6 Ų | 126.6 | 79% | 0.785 | 74% | 0.742 | S | S | * | * | trans | -74.6 | 175.9 | 177.7 | 52.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 47 | P | 51.9 | Low | 31.3 | Very low | 103 Ų | 103 | 130.5 Ų | 130.5 | 67% | 0.669 | 75% | 0.75 | S | S | * | * | cis | -135.4 | -179.6 | 8.9 | 34.5 | -11.8 | 0 | 0 | 0 | 116.7 | ||||
| 48 | D | 26.3 | Very low | 31.4 | Very low | 156 Ų | 156 | 126.2 Ų | 126.2 | 83% | 0.834 | 74% | 0.744 | S | S | * | * | 155.9 | 144.9 | 127.9 | -81.1 | -18.7 | 0 | 0 | 0 | 115 | |||||
| 49 | E | 28.4 | Very low | 31.4 | Very low | 157 Ų | 157 | 126.6 Ų | 126.6 | 73% | 0.734 | 75% | 0.752 | S | S | * | * | trans | -88 | 152.6 | 165 | -99 | -95.7 | 155.8 | 0 | 0 | 108.7 | S51 | E49-S51 PolarHBondContact OE2-N 3.38Š| ||
| 50 | P | 30.5 | Very low | 31.4 | Very low | 120 Ų | 120 | 129.4 Ų | 129.4 | 78% | 0.779 | 75% | 0.754 | S | S | * | * | -146.3 | 166.1 | 54.1 | 40.9 | -21.4 | 0 | 0 | 0 | 119.2 | |||||
| 51 | S | 27.6 | Very low | 31.5 | Very low | 86 Ų | 86 | 133.3 Ų | 133.3 | 60% | 0.601 | 77% | 0.77 | S | S | * | * | trans | -73.8 | -179.6 | 162 | 74.6 | 0 | 0 | 0 | 0 | 113.1 | E49 | E49-S51 PolarHBondContact OE2-N 3.38Š| ||
| 52 | P | 46.5 | Very low | 31.8 | Very low | 101 Ų | 101 | 131.8 Ų | 131.8 | 66% | 0.656 | 77% | 0.766 | S | S | * | * | cis | -134.6 | 163.5 | -7 | 40.5 | -25.8 | 0 | 0 | 0 | 115.2 | ||||
| 53 | Q | 27.6 | Very low | 31.9 | Very low | 185 Ų | 185 | 135.2 Ų | 135.2 | 86% | 0.864 | 78% | 0.776 | S | S | * | * | trans | -176.8 | 162.7 | 131 | -102.7 | 157.9 | 69.9 | 0 | 0 | 114.9 | ||||
| 54 | N | 29.1 | Very low | 32.2 | Very low | 153 Ų | 153 | 133.1 Ų | 133.1 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -57.3 | 161.7 | -178.4 | -53.3 | -51.9 | 0 | 0 | 0 | 113.2 | ||||
| 55 | V | 28.8 | Very low | 32.7 | Very low | 134 Ų | 134 | 137 Ų | 137 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | cis | -142.2 | 140.2 | 31.2 | 177.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 56 | A | 30.8 | Very low | 32.8 | Very low | 93 Ų | 93 | 142.4 Ų | 142.4 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | -95.5 | 136 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 57 | M | 31.5 | Very low | 33.2 | Very low | 195 Ų | 195 | 145.2 Ų | 145.2 | 96% | 0.961 | 78% | 0.776 | S | S | * | * | trans | -122.8 | 67.9 | 162.5 | -89.5 | -74.5 | -76.7 | 0 | 0 | 108.9 | ||||
| 58 | G | 31.9 | Very low | 33 | Very low | 63 Ų | 63 | 144.4 Ų | 144.4 | 65% | 0.649 | 77% | 0.766 | S | S | * | * | trans | -109.1 | 148.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | K60 | G58-K60 PolarHBondContact O-N 2.91Š| ||
| 59 | I | 32.2 | Very low | 34 | Very low | 169 Ų | 169 | 144 Ų | 144 | 87% | 0.867 | 76% | 0.761 | S | S | * | * | trans | -64.4 | 120.7 | -174.3 | -64.2 | 167.8 | 0 | 0 | 0 | 110.4 | F61 | I59-F61 PolarHBondContact O-N 2.79Š| ||
| 60 | K | 29.3 | Very low | 34.8 | Very low | 171 Ų | 171 | 142 Ų | 142 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | trans | -83.5 | 96.6 | -174 | -173.1 | 179.9 | -178.7 | 178.7 | 0 | 111.8 | G58 I62 | G58-K60 PolarHBondContact O-N 2.91Å; K60-I62 HydrophobicContact CD-CG1 4.32Å; K60-I62 HydrophobicContact CG-CG1 4.12Å; K60-I62 PolarHBondContact O-N 3.2Å | ||
| 61 | F | 30.4 | Very low | 35.6 | Very low | 194 Ų | 194 | 140.8 Ų | 140.8 | 85% | 0.851 | 75% | 0.745 | S | S | * | * | trans | -60.1 | 124.4 | 159.2 | -95.5 | -99.1 | 0 | 0 | 0 | 109.4 | I59 | I59-F61 PolarHBondContact O-N 2.79Š| ||
| 62 | I | 33.5 | Very low | 36.2 | Very low | 131 Ų | 131 | 139.1 Ų | 139.1 | 67% | 0.672 | 73% | 0.733 | S | S | * | * | trans | -104.3 | 100.8 | 174.7 | -60.3 | 178.2 | 0 | 0 | 0 | 107.9 | K60 P64 | K60-I62 HydrophobicContact CD-CG1 4.32Å; K60-I62 HydrophobicContact CG-CG1 4.12Å; K60-I62 PolarHBondContact O-N 3.2Å; I62-P64 WeakPolarHBondContact O-CD 3.42Å | ||
| 63 | L | 29.7 | Very low | 36.2 | Very low | 163 Ų | 163 | 137.8 Ų | 137.8 | 85% | 0.853 | 73% | 0.726 | S | S | * | * | trans | -78 | 121.7 | 158.9 | -75.1 | 170.1 | 0 | 0 | 0 | 108.2 | ||||
| 64 | P | 33.8 | Very low | 37.2 | Very low | 99 Ų | 99 | 138.7 Ų | 138.7 | 64% | 0.643 | 72% | 0.722 | S | S | * | * | trans | -70 | 144.5 | 172.3 | -16.6 | 31.6 | 0 | 0 | 0 | 111.5 | I62 | I62-P64 WeakPolarHBondContact O-CD 3.42Š| ||
| 65 | N | 38.2 | Very low | 37.8 | Very low | 144 Ų | 144 | 137.8 Ų | 137.8 | 77% | 0.77 | 71% | 0.711 | S | S | * | * | trans | 58.9 | 103 | 156.3 | -55.2 | -15.3 | 0 | 0 | 0 | 117.8 | F67 | N65-F67 PolarHBondContact O-N 2.95Š| ||
| 66 | R | 40.7 | Very low | 38.8 | Very low | 245 Ų | 245 | 135.5 Ų | 135.5 | 93% | 0.925 | 70% | 0.697 | S | S | * | * | trans | -58 | 130.2 | 149.8 | -73.3 | -179.8 | 171.1 | -178.1 | -4 | 108.9 | D68 | R66-D68 PolarHBondContact O-N 3.44Š| ||
| 67 | F | 39.1 | Very low | 39.8 | Very low | 188 Ų | 188 | 137.5 Ų | 137.5 | 83% | 0.825 | 69% | 0.688 | S | S | * | * | trans | -69.7 | 113 | 163.1 | -87.4 | -101.4 | 0 | 0 | 0 | 109.2 | N65 M69 | N65-F67 PolarHBondContact O-N 2.95Å; F67-M69 PolarHBondContact O-N 2.79Å | ||
| 68 | D | 46.4 | Very low | 40.6 | Very low | 85 Ų | 85 | 130.9 Ų | 130.9 | 46% | 0.455 | 66% | 0.661 | S | S | . | * | trans | -87.8 | 103.2 | 172.3 | -169.8 | -21.6 | 0 | 0 | 0 | 109.7 | R66 N70 V71 C72 | R66-D68 PolarHBondContact O-N 3.44Å; D68-N70 PolarHBondContact O-N 2.93Å; D68-N70 VanDerWaalsContact OD1-CB 3.32Å; D68-N70 WeakPolarHBondContact OD1-CB 3.46Å; D68-N70 PolarHBondContact OD1-N 3.12Å; D68-N70 PolarHBondContact OD1-ND2 3.27Å; D68-V71 HydrophobicContact CB-CG2 4.03Å; D68-V71 WeakPolarHBondContact O-CB 3.47Å; D68-V71 PolarHBondContact O-N 3.19Å; D68-C72 PolarHBondContact O-N 3.24Å | ||
| 69 | M | 48 | Very low | 41.3 | Very low | 149 Ų | 149 | 131.3 Ų | 131.3 | 73% | 0.734 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -55.6 | -23.3 | 179.8 | -86.4 | -69.4 | -169.5 | 0 | 0 | 113.8 | F67 V71 C72 S73 | F67-M69 PolarHBondContact O-N 2.79Å; M69-V71 VanDerWaalsContact C-N 3.31Å; M69-V71 PolarHBondContact O-N 3.08Å; M69-C72 PolarHBondContact O-N 2.9Å; M69-S73 WeakPolarHBondContact O-CB 3.27Å; M69-S73 PolarHBondContact O-N 3.05Å |
| 70 | N | 44.8 | Very low | 42.2 | Very low | 113 Ų | 113 | 128.9 Ų | 128.9 | 60% | 0.604 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -70.8 | -29.2 | 176.5 | -57.5 | -73.8 | 0 | 0 | 0 | 112.2 | D68 R74 | D68-N70 PolarHBondContact O-N 2.93Å; D68-N70 VanDerWaalsContact OD1-CB 3.32Å; D68-N70 WeakPolarHBondContact OD1-CB 3.46Å; D68-N70 PolarHBondContact OD1-N 3.12Å; D68-N70 PolarHBondContact OD1-ND2 3.27Å; N70-R74 PolarHBondContact O-N 3.25Å |
| 71 | V | 47.6 | Very low | 43.4 | Very low | 96 Ų | 96 | 126.1 Ų | 126.1 | 58% | 0.582 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -72.4 | -45.4 | 173.9 | -177.9 | 0 | 0 | 0 | 0 | 109.7 | D68 M69 S73 R74 F75 | D68-V71 HydrophobicContact CB-CG2 4.03Å; D68-V71 WeakPolarHBondContact O-CB 3.47Å; D68-V71 PolarHBondContact O-N 3.19Å; M69-V71 VanDerWaalsContact C-N 3.31Å; M69-V71 PolarHBondContact O-N 3.08Å; V71-S73 VanDerWaalsContact C-N 3.34Å; V71-S73 PolarHBondContact O-N 3.05Å; V71-R74 PolarHBondContact O-N 2.99Å; V71-F75 WeakPolarHBondContact O-CB 3.42Å; V71-F75 PolarHBondContact O-N 3.09Å |
| 72 | C | 40 | Very low | 44.5 | Very low | 50 Ų | 50 | 122.6 Ų | 122.6 | 34% | 0.338 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -59 | -43.1 | 174.5 | -62.3 | 0 | 0 | 0 | 0 | 112.1 | D68 M69 R74 F75 V76 | D68-C72 PolarHBondContact O-N 3.24Å; M69-C72 PolarHBondContact O-N 2.9Å; C72-R74 PolarHBondContact O-N 3.05Å; C72-F75 PolarHBondContact O-N 3.23Å; C72-V76 WeakPolarHBondContact O-CG2 3.28Å; C72-V76 PolarHBondContact O-N 3.49Å |
| 73 | S | 47.6 | Very low | 45.3 | Very low | 74 Ų | 74 | 120.2 Ų | 120.2 | 52% | 0.517 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -62.1 | -39.7 | 177.5 | -174.5 | 0 | 0 | 0 | 0 | 112.9 | M69 V71 K77 | M69-S73 WeakPolarHBondContact O-CB 3.27Å; M69-S73 PolarHBondContact O-N 3.05Å; V71-S73 VanDerWaalsContact C-N 3.34Å; V71-S73 PolarHBondContact O-N 3.05Å; S73-K77 PolarHBondContact O-N 2.95Å; S73-K77 VanDerWaalsContact O-N 3.13Å |
| 74 | R | 48.6 | Very low | 46.3 | Very low | 203 Ų | 203 | 115.8 Ų | 115.8 | 77% | 0.766 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.4 | -39.6 | 172.8 | -76.8 | -178.2 | 174.9 | 149.1 | 0.6 | 112.9 | N70 V71 C72 K77 S78 | N70-R74 PolarHBondContact O-N 3.25Å; V71-R74 PolarHBondContact O-N 2.99Å; C72-R74 PolarHBondContact O-N 3.05Å; R74-K77 PolarHBondContact O-N 3.42Å; R74-S78 PolarHBondContact O-N 3Å |
| 75 | F | 41.3 | Very low | 47.2 | Very low | 135 Ų | 135 | 117.4 Ų | 117.4 | 59% | 0.592 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.9 | -46.7 | 178.4 | -171.4 | -107.7 | 0 | 0 | 0 | 111.7 | V71 C72 K77 S78 L79 | V71-F75 WeakPolarHBondContact O-CB 3.42Å; V71-F75 PolarHBondContact O-N 3.09Å; C72-F75 PolarHBondContact O-N 3.23Å; F75-K77 VanDerWaalsContact C-N 3.32Å; F75-K77 PolarHBondContact O-N 2.89Å; F75-S78 PolarHBondContact O-N 3.38Å; F75-L79 HydrophobicContact CD1-CD1 3.97Å; F75-L79 HydrophobicContact CE1-CD1 3.7Å; F75-L79 HydrophobicContact CE1-CG 4.48Å; F75-L79 HydrophobicContact CZ-CD1 4.26Å; F75-L79 WeakPolarHBondContact O-CG 3.44Å; F75-L79 PolarHBondContact O-N 3.12Å |
| 76 | V | 49.7 | Very low | 48 | Very low | 85 Ų | 85 | 115.7 Ų | 115.7 | 52% | 0.515 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -62.7 | -37.3 | 175.3 | 172.4 | 0 | 0 | 0 | 0 | 111.7 | C72 N80 | C72-V76 WeakPolarHBondContact O-CG2 3.28Å; C72-V76 PolarHBondContact O-N 3.49Å; V76-N80 WeakPolarHBondContact O-CB 3.37Å; V76-N80 PolarHBondContact O-N 2.9Å |
| 77 | K | 51.3 | Low | 48.6 | Very low | 135 Ų | 135 | 109.2 Ų | 109.2 | 59% | 0.587 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.6 | -40.4 | 171.9 | -82.5 | -161.6 | 169.1 | -159.1 | 0 | 113.7 | S73 R74 F75 N80 E81 | S73-K77 PolarHBondContact O-N 2.95Å; S73-K77 VanDerWaalsContact O-N 3.13Å; R74-K77 PolarHBondContact O-N 3.42Å; F75-K77 VanDerWaalsContact C-N 3.32Å; F75-K77 PolarHBondContact O-N 2.89Å; K77-N80 PolarHBondContact O-N 3.18Å; K77-E81 WeakPolarHBondContact O-CB 3.18Å; K77-E81 WeakPolarHBondContact O-CG 3.3Å; K77-E81 PolarHBondContact O-N 2.98Å |
| 78 | S | 49.3 | Very low | 49.1 | Very low | 56 Ų | 56 | 105.6 Ų | 105.6 | 39% | 0.392 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -58.8 | -49.1 | 176.4 | -157.7 | 0 | 0 | 0 | 0 | 110.7 | R74 F75 N80 E81 E82 | R74-S78 PolarHBondContact O-N 3Å; F75-S78 PolarHBondContact O-N 3.38Å; S78-N80 PolarHBondContact O-N 3.27Å; S78-E81 PolarHBondContact O-N 3.01Å; S78-E81 VanDerWaalsContact O-N 3.12Å; S78-E82 WeakPolarHBondContact O-CB 3.21Å; S78-E82 WeakPolarHBondContact O-CG 3.29Å; S78-E82 PolarHBondContact O-N 2.82Å; S78-E82 PolarHBondContact OG-OE2 3.37Å |
| 79 | L | 47.1 | Very low | 49.4 | Very low | 73 Ų | 73 | 106.5 Ų | 106.5 | 38% | 0.382 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -56.9 | -50.9 | 176 | -66.8 | 171.9 | 0 | 0 | 0 | 111.3 | F75 E81 E82 D83 | F75-L79 HydrophobicContact CD1-CD1 3.97Å; F75-L79 HydrophobicContact CE1-CD1 3.7Å; F75-L79 HydrophobicContact CE1-CG 4.48Å; F75-L79 HydrophobicContact CZ-CD1 4.26Å; F75-L79 WeakPolarHBondContact O-CG 3.44Å; F75-L79 PolarHBondContact O-N 3.12Å; L79-E81 VanDerWaalsContact C-N 3.26Å; L79-E81 PolarHBondContact O-N 2.84Å; L79-E82 PolarHBondContact O-N 3.46Å; L79-D83 VanDerWaalsContact O-CB 3.26Å; L79-D83 WeakPolarHBondContact O-CB 3.37Å; L79-D83 PolarHBondContact O-N 2.99Å |
| 80 | N | 50.3 | Low | 49.4 | Very low | 117 Ų | 117 | 104.1 Ų | 104.1 | 63% | 0.626 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.3 | -29.4 | 177.1 | -100 | 62.7 | 0 | 0 | 0 | 114.3 | V76 K77 S78 S84 | V76-N80 WeakPolarHBondContact O-CB 3.37Å; V76-N80 PolarHBondContact O-N 2.9Å; K77-N80 PolarHBondContact O-N 3.18Å; S78-N80 PolarHBondContact O-N 3.27Å; N80-S84 WeakPolarHBondContact O-CB 3.37Å; N80-S84 PolarHBondContact O-N 2.82Å |
| 81 | E | 53.4 | Low | 49.5 | Very low | 114 Ų | 114 | 102.4 Ų | 102.4 | 53% | 0.533 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -89.5 | -25.2 | 179.7 | -73 | 180 | -151.3 | 0 | 0 | 113.6 | K77 S78 L79 | K77-E81 WeakPolarHBondContact O-CB 3.18Å; K77-E81 WeakPolarHBondContact O-CG 3.3Å; K77-E81 PolarHBondContact O-N 2.98Å; S78-E81 PolarHBondContact O-N 3.01Å; S78-E81 VanDerWaalsContact O-N 3.12Å; L79-E81 VanDerWaalsContact C-N 3.26Å; L79-E81 PolarHBondContact O-N 2.84Å |
| 82 | E | 53.4 | Low | 49.5 | Very low | 119 Ų | 119 | 101.7 Ų | 101.7 | 56% | 0.556 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -81.9 | -49.4 | 172.8 | -72.1 | 177.1 | 101.5 | 0 | 0 | 111 | S78 L79 S84 K85 N86 | S78-E82 WeakPolarHBondContact O-CB 3.21Å; S78-E82 WeakPolarHBondContact O-CG 3.29Å; S78-E82 PolarHBondContact O-N 2.82Å; S78-E82 PolarHBondContact OG-OE2 3.37Å; L79-E82 PolarHBondContact O-N 3.46Å; E82-S84 VanDerWaalsContact C-N 3.31Å; E82-S84 PolarHBondContact O-N 3.04Å; E82-K85 PolarHBondContact O-N 3.35Å; E82-N86 WeakPolarHBondContact O-CB 3.36Å; E82-N86 PolarHBondContact O-N 3.39Å |
| 83 | D | 52.1 | Low | 50.2 | Low | 82 Ų | 82 | 102 Ų | 102 | 44% | 0.439 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.1 | -38 | 177.1 | -71.4 | -32.9 | 0 | 0 | 0 | 111.5 | L79 K85 N86 I87 | L79-D83 VanDerWaalsContact O-CB 3.26Å; L79-D83 WeakPolarHBondContact O-CB 3.37Å; L79-D83 PolarHBondContact O-N 2.99Å; D83-K85 PolarHBondContact O-N 3.48Å; D83-N86 PolarHBondContact O-N 3.44Å; D83-I87 WeakPolarHBondContact O-CB 3.33Å; D83-I87 WeakPolarHBondContact O-CD1 3.43Å; D83-I87 WeakPolarHBondContact O-CG1 3.46Å; D83-I87 PolarHBondContact O-N 2.89Å |
| 84 | S | 49.1 | Very low | 50.1 | Low | 70 Ų | 70 | 102.3 Ų | 102.3 | 49% | 0.49 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -41.3 | 176.6 | 177.9 | 0 | 0 | 0 | 0 | 112.7 | N80 E82 Q88 | N80-S84 WeakPolarHBondContact O-CB 3.37Å; N80-S84 PolarHBondContact O-N 2.82Å; E82-S84 VanDerWaalsContact C-N 3.31Å; E82-S84 PolarHBondContact O-N 3.04Å; S84-Q88 VanDerWaalsContact O-CB 3.31Å; S84-Q88 WeakPolarHBondContact O-CB 3.29Å; S84-Q88 PolarHBondContact O-N 3.29Å |
| 85 | K | 54.1 | Low | 50.4 | Low | 133 Ų | 133 | 98.5 Ų | 98.5 | 58% | 0.578 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -69.3 | -45.2 | 174.6 | -72 | 169.6 | -173.3 | 151.9 | 0 | 111.5 | E82 D83 I87 Q88 D89 | E82-K85 PolarHBondContact O-N 3.35Å; D83-K85 PolarHBondContact O-N 3.48Å; K85-I87 VanDerWaalsContact C-N 3.31Å; K85-I87 PolarHBondContact O-N 3.15Å; K85-Q88 PolarHBondContact O-N 3.1Å; K85-Q88 VanDerWaalsContact O-N 3.14Å; K85-D89 WeakPolarHBondContact O-CB 3.32Å; K85-D89 PolarHBondContact O-N 2.84Å |
| 86 | N | 54.5 | Low | 50.9 | Low | 108 Ų | 108 | 99 Ų | 99 | 58% | 0.578 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -58.3 | -43.7 | 179.1 | -162.4 | 16.7 | 0 | 0 | 0 | 111.2 | E82 D83 Q90 | E82-N86 WeakPolarHBondContact O-CB 3.36Å; E82-N86 PolarHBondContact O-N 3.39Å; D83-N86 PolarHBondContact O-N 3.44Å; N86-Q90 WeakPolarHBondContact O-CB 3.37Å; N86-Q90 PolarHBondContact O-N 3.46Å |
| 87 | I | 52.7 | Low | 51 | Low | 108 Ų | 108 | 98.4 Ų | 98.4 | 55% | 0.554 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.1 | -44.1 | 174 | -68.4 | 164.5 | 0 | 0 | 0 | 111.3 | D83 K85 Q90 V91 | D83-I87 WeakPolarHBondContact O-CB 3.33Å; D83-I87 WeakPolarHBondContact O-CD1 3.43Å; D83-I87 WeakPolarHBondContact O-CG1 3.46Å; D83-I87 PolarHBondContact O-N 2.89Å; K85-I87 VanDerWaalsContact C-N 3.31Å; K85-I87 PolarHBondContact O-N 3.15Å; I87-Q90 PolarHBondContact O-N 3.13Å; I87-V91 HydrophobicContact CG2-CG2 4.35Å; I87-V91 WeakPolarHBondContact O-CB 3.27Å; I87-V91 VanDerWaalsContact O-CG2 3.26Å; I87-V91 WeakPolarHBondContact O-CG2 3.4Å; I87-V91 PolarHBondContact O-N 3.05Å |
| 88 | Q | 50.4 | Low | 50.8 | Low | 112 Ų | 112 | 94.4 Ų | 94.4 | 52% | 0.523 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -44.1 | -179.8 | -165.1 | 73.6 | 49.5 | 0 | 0 | 111.9 | S84 K85 V91 N92 | S84-Q88 VanDerWaalsContact O-CB 3.31Å; S84-Q88 WeakPolarHBondContact O-CB 3.29Å; S84-Q88 PolarHBondContact O-N 3.29Å; K85-Q88 PolarHBondContact O-N 3.1Å; K85-Q88 VanDerWaalsContact O-N 3.14Å; Q88-V91 PolarHBondContact O-N 3.09Å; Q88-N92 WeakPolarHBondContact O-CB 3.15Å; Q88-N92 PolarHBondContact O-N 3.35Å; Q88-N92 PolarHBondContact O-ND2 3.35Å; Q88-N92 VanDerWaalsContact O-ND2 3.1Å |
| 89 | D | 52.3 | Low | 50.8 | Low | 105 Ų | 105 | 94.1 Ų | 94.1 | 56% | 0.561 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -71.7 | -36.1 | 179 | -69.8 | -27.2 | 0 | 0 | 0 | 111.8 | K85 N92 S93 | K85-D89 WeakPolarHBondContact O-CB 3.32Å; K85-D89 PolarHBondContact O-N 2.84Å; D89-N92 PolarHBondContact O-N 3.33Å; D89-S93 WeakPolarHBondContact O-CB 3.43Å; D89-S93 PolarHBondContact O-N 3.28Å |
| 90 | Q | 48.1 | Very low | 51 | Low | 98 Ų | 98 | 95 Ų | 95 | 46% | 0.458 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.3 | -45.7 | 171.1 | -175.3 | 63.1 | 55.5 | 0 | 0 | 111.5 | N86 I87 N92 S93 D94 | N86-Q90 WeakPolarHBondContact O-CB 3.37Å; N86-Q90 PolarHBondContact O-N 3.46Å; I87-Q90 PolarHBondContact O-N 3.13Å; Q90-N92 VanDerWaalsContact C-N 3.34Å; Q90-N92 PolarHBondContact O-N 2.83Å; Q90-S93 WeakPolarHBondContact O-CB 3.47Å; Q90-S93 PolarHBondContact O-N 3.06Å; Q90-D94 PolarHBondContact NE2-OD1 2.91Å; Q90-D94 PolarHBondContact NE2-OD2 2.93Å; Q90-D94 WeakPolarHBondContact O-CB 3.49Å; Q90-D94 VanDerWaalsContact O-CG 3.25Å; Q90-D94 PolarHBondContact O-N 3.44Å |
| 91 | V | 47.4 | Very low | 51 | Low | 78 Ų | 78 | 94 Ų | 94 | 47% | 0.473 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.2 | -38 | 176.6 | 167.7 | 0 | 0 | 0 | 0 | 111.7 | I87 Q88 L95 | I87-V91 HydrophobicContact CG2-CG2 4.35Å; I87-V91 WeakPolarHBondContact O-CB 3.27Å; I87-V91 VanDerWaalsContact O-CG2 3.26Å; I87-V91 WeakPolarHBondContact O-CG2 3.4Å; I87-V91 PolarHBondContact O-N 3.05Å; Q88-V91 PolarHBondContact O-N 3.09Å; V91-L95 VanDerWaalsContact O-CB 3.25Å; V91-L95 WeakPolarHBondContact O-CB 3.31Å; V91-L95 PolarHBondContact O-N 3.33Å |
| 92 | N | 46.6 | Very low | 50.6 | Low | 81 Ų | 81 | 95.4 Ų | 95.4 | 43% | 0.433 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63 | -45.4 | 173.2 | -70.5 | -29.7 | 0 | 0 | 0 | 111.3 | Q88 D89 Q90 E96 | Q88-N92 WeakPolarHBondContact O-CB 3.15Å; Q88-N92 PolarHBondContact O-N 3.35Å; Q88-N92 PolarHBondContact O-ND2 3.35Å; Q88-N92 VanDerWaalsContact O-ND2 3.1Å; D89-N92 PolarHBondContact O-N 3.33Å; Q90-N92 VanDerWaalsContact C-N 3.34Å; Q90-N92 PolarHBondContact O-N 2.83Å; N92-E96 PolarHBondContact O-N 3.48Å |
| 93 | S | 55.1 | Low | 50.4 | Low | 55 Ų | 55 | 96.6 Ų | 96.6 | 39% | 0.385 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60 | -48.9 | 175.4 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | D89 Q90 L95 E96 V97 | D89-S93 WeakPolarHBondContact O-CB 3.43Å; D89-S93 PolarHBondContact O-N 3.28Å; Q90-S93 WeakPolarHBondContact O-CB 3.47Å; Q90-S93 PolarHBondContact O-N 3.06Å; S93-L95 VanDerWaalsContact C-N 3.34Å; S93-L95 PolarHBondContact O-N 3.44Å; S93-E96 PolarHBondContact O-N 3.16Å; S93-V97 WeakPolarHBondContact O-CG2 3.27Å; S93-V97 PolarHBondContact O-N 2.94Å |
| 94 | D | 46.2 | Very low | 50.1 | Low | 82 Ų | 82 | 96.1 Ų | 96.1 | 44% | 0.439 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.4 | -33.2 | -177.2 | -67.4 | -24.7 | 0 | 0 | 0 | 112.1 | Q90 A98 | Q90-D94 PolarHBondContact NE2-OD1 2.91Å; Q90-D94 PolarHBondContact NE2-OD2 2.93Å; Q90-D94 WeakPolarHBondContact O-CB 3.49Å; Q90-D94 VanDerWaalsContact O-CG 3.25Å; Q90-D94 PolarHBondContact O-N 3.44Å; D94-A98 VanDerWaalsContact O-CB 3.27Å; D94-A98 WeakPolarHBondContact O-CB 3.45Å; D94-A98 PolarHBondContact O-N 2.88Å |
| 95 | L | 53.7 | Low | 49.9 | Very low | 123 Ų | 123 | 100.1 Ų | 100.1 | 64% | 0.644 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -68.6 | -37.1 | 172.6 | -174.4 | 63.6 | 0 | 0 | 0 | 112.2 | V91 S93 S99 | V91-L95 VanDerWaalsContact O-CB 3.25Å; V91-L95 WeakPolarHBondContact O-CB 3.31Å; V91-L95 PolarHBondContact O-N 3.33Å; S93-L95 VanDerWaalsContact C-N 3.34Å; S93-L95 PolarHBondContact O-N 3.44Å; L95-S99 WeakPolarHBondContact O-CB 3.39Å; L95-S99 PolarHBondContact O-N 3.13Å |
| 96 | E | 52.1 | Low | 49.3 | Very low | 144 Ų | 144 | 96.7 Ų | 96.7 | 67% | 0.673 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.2 | -43 | 174.2 | -171 | 163.2 | -136.2 | 0 | 0 | 111.4 | N92 S93 A98 S99 V100 | N92-E96 PolarHBondContact O-N 3.48Å; S93-E96 PolarHBondContact O-N 3.16Å; E96-A98 PolarHBondContact O-N 3.32Å; E96-S99 WeakPolarHBondContact O-CB 3.41Å; E96-S99 PolarHBondContact O-N 3.22Å; E96-V100 WeakPolarHBondContact O-CG2 3.22Å; E96-V100 PolarHBondContact O-N 3.1Å |
| 97 | V | 50.8 | Low | 48.8 | Very low | 74 Ų | 74 | 98 Ų | 98 | 45% | 0.448 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.6 | -45.8 | 173 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | S93 S99 V100 L101 | S93-V97 WeakPolarHBondContact O-CG2 3.27Å; S93-V97 PolarHBondContact O-N 2.94Å; V97-S99 VanDerWaalsContact C-N 3.33Å; V97-S99 PolarHBondContact O-N 3.32Å; V97-V100 PolarHBondContact O-N 3.17Å; V97-L101 HydrophobicContact CG1-CD1 3.91Å; V97-L101 WeakPolarHBondContact O-CG 3.39Å; V97-L101 PolarHBondContact O-N 3.2Å |
| 98 | A | 49 | Very low | 48.1 | Very low | 51 Ų | 51 | 98.9 Ų | 98.9 | 42% | 0.421 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.8 | -39.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | D94 E96 V100 L101 F102 | D94-A98 VanDerWaalsContact O-CB 3.27Å; D94-A98 WeakPolarHBondContact O-CB 3.45Å; D94-A98 PolarHBondContact O-N 2.88Å; E96-A98 PolarHBondContact O-N 3.32Å; A98-V100 VanDerWaalsContact C-N 3.32Å; A98-V100 PolarHBondContact O-N 3.08Å; A98-L101 PolarHBondContact O-N 3.4Å; A98-F102 WeakPolarHBondContact O-CB 2.86Å; A98-F102 PolarHBondContact O-N 2.93Å |
| 99 | S | 48.3 | Very low | 47.4 | Very low | 49 Ų | 49 | 102.2 Ų | 102.2 | 34% | 0.343 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63.2 | -36.2 | 175.1 | -163.5 | 0 | 0 | 0 | 0 | 112.7 | L95 E96 V97 K103 | L95-S99 WeakPolarHBondContact O-CB 3.39Å; L95-S99 PolarHBondContact O-N 3.13Å; E96-S99 WeakPolarHBondContact O-CB 3.41Å; E96-S99 PolarHBondContact O-N 3.22Å; V97-S99 VanDerWaalsContact C-N 3.33Å; V97-S99 PolarHBondContact O-N 3.32Å; S99-K103 WeakPolarHBondContact O-CB 3.46Å; S99-K103 VanDerWaalsContact O-CD 3.27Å; S99-K103 WeakPolarHBondContact O-CD 3.38Å; S99-K103 WeakPolarHBondContact O-CG 3.46Å; S99-K103 PolarHBondContact O-N 3.27Å; S99-K103 PolarHBondContact OG-NZ 3.3Å |
| 100 | V | 50.8 | Low | 46.5 | Very low | 91 Ų | 91 | 102.9 Ų | 102.9 | 55% | 0.552 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -74.1 | -43 | 177.1 | 171.6 | 0 | 0 | 0 | 0 | 111.5 | E96 V97 A98 K103 A104 | E96-V100 WeakPolarHBondContact O-CG2 3.22Å; E96-V100 PolarHBondContact O-N 3.1Å; V97-V100 PolarHBondContact O-N 3.17Å; A98-V100 VanDerWaalsContact C-N 3.32Å; A98-V100 PolarHBondContact O-N 3.08Å; V100-K103 PolarHBondContact O-N 2.69Å; V100-A104 PolarHBondContact O-N 3.26Å |
| 101 | L | 50.4 | Low | 45.7 | Very low | 98 Ų | 98 | 103.2 Ų | 103.2 | 51% | 0.513 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.4 | -48.7 | 175.9 | -75.2 | 167.1 | 0 | 0 | 0 | 111.7 | V97 A98 K103 A104 E105 | V97-L101 HydrophobicContact CG1-CD1 3.91Å; V97-L101 WeakPolarHBondContact O-CG 3.39Å; V97-L101 PolarHBondContact O-N 3.2Å; A98-L101 PolarHBondContact O-N 3.4Å; L101-K103 VanDerWaalsContact C-N 3.27Å; L101-K103 PolarHBondContact O-N 2.84Å; L101-A104 WeakPolarHBondContact O-CA 3.04Å; L101-A104 WeakPolarHBondContact O-CB 3.46Å; L101-A104 PolarHBondContact O-N 2.89Å; L101-E105 PolarHBondContact O-N 3.49Å |
| 102 | F | 46.4 | Very low | 45.1 | Very low | 142 Ų | 142 | 105.5 Ų | 105.5 | 62% | 0.623 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -60.6 | -36 | 178.5 | -166.3 | -94.5 | 0 | 0 | 0 | 112.5 | A98 C106 | A98-F102 WeakPolarHBondContact O-CB 2.86Å; A98-F102 PolarHBondContact O-N 2.93Å; F102-C106 PolarHBondContact O-N 2.92Å; F102-C106 PolarHBondContact O-SG 3.1Å |
| 103 | K | 48.3 | Very low | 44.3 | Very low | 144 Ų | 144 | 106.9 Ų | 106.9 | 63% | 0.626 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.9 | -31.9 | 173 | -75.4 | 166.6 | -173.9 | 141 | 0 | 113.2 | S99 V100 L101 | S99-K103 WeakPolarHBondContact O-CB 3.46Å; S99-K103 VanDerWaalsContact O-CD 3.27Å; S99-K103 WeakPolarHBondContact O-CD 3.38Å; S99-K103 WeakPolarHBondContact O-CG 3.46Å; S99-K103 PolarHBondContact O-N 3.27Å; S99-K103 PolarHBondContact OG-NZ 3.3Å; V100-K103 PolarHBondContact O-N 2.69Å; L101-K103 VanDerWaalsContact C-N 3.27Å; L101-K103 PolarHBondContact O-N 2.84Å |
| 104 | A | 46.7 | Very low | 43.5 | Very low | 72 Ų | 72 | 110.8 Ų | 110.8 | 60% | 0.595 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73 | -42 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | V100 L101 | V100-A104 PolarHBondContact O-N 3.26Å; L101-A104 WeakPolarHBondContact O-CA 3.04Å; L101-A104 WeakPolarHBondContact O-CB 3.46Å; L101-A104 PolarHBondContact O-N 2.89Å |
| 105 | E | 44.5 | Very low | 42.9 | Very low | 155 Ų | 155 | 110.1 Ų | 110.1 | 72% | 0.724 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -72.4 | -32.7 | -176.7 | -68.7 | -177.8 | 157.9 | 0 | 0 | 113.5 | L101 N107 | L101-E105 PolarHBondContact O-N 3.49Å; E105-N107 VanDerWaalsContact C-N 3.34Å; E105-N107 PolarHBondContact O-N 2.9Å |
| 106 | C | 41.5 | Very low | 41.9 | Very low | 60 Ų | 60 | 112.4 Ų | 112.4 | 41% | 0.405 | 65% | 0.651 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.8 | -8.9 | -178.5 | -72.4 | 0 | 0 | 0 | 0 | 115.5 | F102 I108 | F102-C106 PolarHBondContact O-N 2.92Å; F102-C106 PolarHBondContact O-SG 3.1Å; C106-I108 HydrophobicContact CB-CD1 4.11Å; C106-I108 HydrophobicContact CB-CG1 3.9Å; C106-I108 WeakPolarHBondContact O-CG1 3.47Å; C106-I108 PolarHBondContact O-N 3.17Å |
| 107 | N | 42.9 | Very low | 41 | Very low | 135 Ų | 135 | 113.6 Ų | 113.6 | 72% | 0.722 | 66% | 0.657 | S | S | * | * | trans | 47.2 | 35.8 | 174.1 | -162.2 | 18.9 | 0 | 0 | 0 | 115.8 | E105 Q109 | E105-N107 VanDerWaalsContact C-N 3.34Å; E105-N107 PolarHBondContact O-N 2.9Å; N107-Q109 PolarHBondContact O-N 3.02Å | ||
| 108 | I | 37.6 | Very low | 40.1 | Very low | 128 Ų | 128 | 116.7 Ų | 116.7 | 66% | 0.656 | 68% | 0.675 | S | S | * | * | trans | -80 | 104.2 | -174 | -52.1 | -177.5 | 0 | 0 | 0 | 110.5 | C106 T110 | C106-I108 HydrophobicContact CB-CD1 4.11Å; C106-I108 HydrophobicContact CB-CG1 3.9Å; C106-I108 WeakPolarHBondContact O-CG1 3.47Å; C106-I108 PolarHBondContact O-N 3.17Å; I108-T110 HydrophobicContact CG2-CG2 4Å; I108-T110 PolarHBondContact O-N 2.79Å; I108-T110 VanDerWaalsContact O-N 3.12Å | ||
| 109 | Q | 36.6 | Very low | 39.1 | Very low | 181 Ų | 181 | 124 Ų | 124 | 85% | 0.846 | 69% | 0.692 | S | S | * | * | trans | -74.1 | 95.1 | 168.1 | -67.3 | -171.7 | 8.8 | 0 | 0 | 111.3 | N107 | N107-Q109 PolarHBondContact O-N 3.02Š| ||
| 110 | T | 33.6 | Very low | 38.3 | Very low | 120 Ų | 120 | 130.2 Ų | 130.2 | 74% | 0.736 | 72% | 0.715 | S | S | * | * | trans | -96.2 | 97.8 | 161.3 | 54.8 | 0 | 0 | 0 | 0 | 110.3 | I108 | I108-T110 HydrophobicContact CG2-CG2 4Å; I108-T110 PolarHBondContact O-N 2.79Å; I108-T110 VanDerWaalsContact O-N 3.12Å | ||
| 111 | S | 31 | Very low | 37.2 | Very low | 105 Ų | 105 | 131.5 Ų | 131.5 | 73% | 0.734 | 72% | 0.723 | S | S | * | * | trans | -61.8 | 133.5 | 168.9 | 53.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 112 | P | 35.3 | Very low | 36.2 | Very low | 126 Ų | 126 | 137.1 Ų | 137.1 | 82% | 0.818 | 74% | 0.739 | S | S | * | * | trans | -70.7 | 139.5 | 178.1 | 29.3 | -34.2 | 0 | 0 | 0 | 111.1 | ||||
| 113 | S | 28.7 | Very low | 35.5 | Very low | 110 Ų | 110 | 136.4 Ų | 136.4 | 77% | 0.769 | 75% | 0.747 | S | S | * | * | trans | -142.2 | 147 | 162.6 | -80.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 114 | P | 39.3 | Very low | 35.1 | Very low | 137 Ų | 137 | 134.9 Ų | 134.9 | 89% | 0.89 | 75% | 0.751 | S | S | * | * | trans | -89.7 | 127.9 | -140.4 | 31.5 | -35.7 | 0 | 0 | 0 | 114.2 | ||||
| 115 | G | 32.6 | Very low | 34.2 | Very low | 68 Ų | 68 | 136.8 Ų | 136.8 | 70% | 0.701 | 76% | 0.76 | S | S | * | * | trans | -167.1 | 129.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 116 | I | 33.4 | Very low | 33.7 | Very low | 170 Ų | 170 | 135.5 Ų | 135.5 | 87% | 0.872 | 76% | 0.763 | S | S | * | * | trans | 66.2 | 116.1 | 164.9 | -52.3 | 176.8 | 0 | 0 | 0 | 115.9 | ||||
| 117 | Q | 33.7 | Very low | 33.3 | Very low | 170 Ų | 170 | 138.6 Ų | 138.6 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | trans | -90.9 | 136.1 | 171.6 | -55.5 | 170.4 | 20.2 | 0 | 0 | 110.3 | ||||
| 118 | V | 30.6 | Very low | 32.9 | Very low | 139 Ų | 139 | 141.6 Ų | 141.6 | 84% | 0.842 | 79% | 0.787 | S | S | * | * | trans | -135.1 | 120 | 144.1 | -175.3 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 119 | R | 28.8 | Very low | 32.7 | Very low | 205 Ų | 205 | 143.7 Ų | 143.7 | 77% | 0.774 | 79% | 0.794 | S | S | * | * | trans | -76.5 | 152.6 | 170.6 | -67.6 | 170 | 166.6 | 160.9 | -6 | 108.9 | ||||
| 120 | H | 31.2 | Very low | 32.3 | Very low | 178 Ų | 178 | 145 Ų | 145 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | -162.7 | 104.5 | 117.7 | -104.2 | -71.3 | 0 | 0 | 0 | 112.6 | |||||
| 121 | V | 29.1 | Very low | 32.3 | Very low | 118 Ų | 118 | 144.5 Ų | 144.5 | 72% | 0.715 | 80% | 0.798 | S | S | * | * | trans | 37.8 | 110.4 | 146.6 | -170.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 122 | Y | 27.6 | Very low | 32.4 | Very low | 216 Ų | 216 | 145.5 Ų | 145.5 | 85% | 0.847 | 80% | 0.802 | S | S | * | * | trans | -75.8 | 148.4 | 155.9 | -101.4 | -97.9 | 0 | 0 | 0 | 112.1 | ||||
| 123 | T | 32.1 | Very low | 32.6 | Very low | 128 Ų | 128 | 146 Ų | 146 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -138.3 | 109.9 | 151.6 | 48.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 124 | P | 39.4 | Very low | 33 | Very low | 112 Ų | 112 | 150.9 Ų | 150.9 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -94.4 | 151.4 | -176.2 | 36.1 | -34.3 | 0 | 0 | 0 | 113.4 | ||||
| 125 | S | 28.8 | Very low | 32.9 | Very low | 112 Ų | 112 | 152.8 Ų | 152.8 | 78% | 0.783 | 80% | 0.801 | S | S | * | * | trans | -137.5 | 96.9 | 175.1 | -72 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 126 | T | 33 | Very low | 33.1 | Very low | 127 Ų | 127 | 154.9 Ų | 154.9 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | trans | 49 | 93.8 | 144.3 | 60.2 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 127 | T | 34.9 | Very low | 33.4 | Very low | 125 Ų | 125 | 153.5 Ų | 153.5 | 77% | 0.767 | 80% | 0.804 | S | S | * | * | 16.1 | 116.8 | 125.8 | -46.2 | 0 | 0 | 0 | 0 | 119 | |||||
| 128 | K | 33.5 | Very low | 33.8 | Very low | 199 Ų | 199 | 151.3 Ų | 151.3 | 87% | 0.865 | 80% | 0.803 | S | S | * | * | trans | -137 | 140.4 | 138.4 | -74.6 | -166 | 177.4 | 177.9 | 0 | 110.4 | ||||
| 129 | H | 33.2 | Very low | 34 | Very low | 172 Ų | 172 | 152.6 Ų | 152.6 | 80% | 0.796 | 80% | 0.804 | S | S | * | * | trans | -71.3 | 143.9 | 177.3 | -77.5 | -110.5 | 0 | 0 | 0 | 111.7 | ||||
| 130 | F | 29.4 | Very low | 34.6 | Very low | 209 Ų | 209 | 148.9 Ų | 148.9 | 92% | 0.917 | 80% | 0.804 | S | S | * | * | trans | -131.8 | 148.9 | 146.9 | -94.9 | -84.8 | 0 | 0 | 0 | 110.4 | ||||
| 131 | S | 32.4 | Very low | 34.8 | Very low | 108 Ų | 108 | 148 Ų | 148 | 76% | 0.755 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 165.3 | -170 | -61 | 0 | 0 | 0 | 0 | 112.1 | ||
| 132 | P | 33.3 | Very low | 35.7 | Very low | 126 Ų | 126 | 151.4 Ų | 151.4 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 156.1 | -169.7 | 24.9 | -35.3 | 0 | 0 | 0 | 114.8 | ||
| 133 | I | 38.7 | Very low | 36.4 | Very low | 136 Ų | 136 | 149.9 Ų | 149.9 | 70% | 0.697 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 128.4 | -169.1 | -62.9 | 163.7 | 0 | 0 | 0 | 112.6 | Q135 | I133-Q135 HydrophobicContact CG2-CB 3.9Å; I133-Q135 HydrophobicContact CG2-CG 3.58Å |
| 134 | K | 37.3 | Very low | 36.9 | Very low | 213 Ų | 213 | 152.4 Ų | 152.4 | 93% | 0.926 | 81% | 0.806 | S | S | * | * | trans | -107.4 | 99.3 | 151.4 | -78.6 | -170.9 | 174.4 | -174.3 | 0 | 108.3 | S136 | K134-S136 PolarHBondContact O-N 2.84Š| ||
| 135 | Q | 37.8 | Very low | 36.8 | Very low | 177 Ų | 177 | 150.3 Ų | 150.3 | 83% | 0.827 | 81% | 0.805 | S | S | * | * | trans | -85.3 | 105.3 | 175.5 | -103.3 | 168.2 | -2.3 | 0 | 0 | 110 | I133 | I133-Q135 HydrophobicContact CG2-CB 3.9Å; I133-Q135 HydrophobicContact CG2-CG 3.58Å | ||
| 136 | S | 38 | Very low | 37.5 | Very low | 112 Ų | 112 | 151.5 Ų | 151.5 | 78% | 0.783 | 80% | 0.802 | S | S | * | * | trans | -154 | 88.3 | 157.2 | -172.6 | 0 | 0 | 0 | 0 | 108.9 | K134 | K134-S136 PolarHBondContact O-N 2.84Š| ||
| 137 | T | 39.5 | Very low | 37.8 | Very low | 141 Ų | 141 | 154 Ų | 154 | 87% | 0.865 | 81% | 0.805 | S | S | * | * | trans | -160 | 132 | 161.5 | 12.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 138 | T | 40.8 | Very low | 38.6 | Very low | 125 Ų | 125 | 151 Ų | 151 | 77% | 0.767 | 79% | 0.786 | S | S | * | * | trans | -65 | 135.3 | 178.7 | -44.6 | 0 | 0 | 0 | 0 | 112.1 | T140 | T138-T140 HydrophobicContact CG2-CG2 4.03Š| ||
| 139 | L | 35.3 | Very low | 39.1 | Very low | 166 Ų | 166 | 146.6 Ų | 146.6 | 87% | 0.869 | 78% | 0.781 | S | S | * | * | trans | -101.1 | 103.3 | 164.5 | -71.2 | 177.5 | 0 | 0 | 0 | 110 | N141 | L139-N141 PolarHBondContact O-N 3.08Š| ||
| 140 | T | 41.6 | Very low | 39.6 | Very low | 127 Ų | 127 | 142.5 Ų | 142.5 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | trans | -84.1 | 85.6 | 177.7 | 51.4 | 0 | 0 | 0 | 0 | 110.8 | T138 K142 | T138-T140 HydrophobicContact CG2-CG2 4.03Å; T140-K142 PolarHBondContact O-N 2.66Å | ||
| 141 | N | 35.8 | Very low | 40.4 | Very low | 158 Ų | 158 | 136.3 Ų | 136.3 | 85% | 0.845 | 75% | 0.751 | S | S | * | * | trans | -74.9 | 114.1 | -175.7 | -135.4 | -1.3 | 0 | 0 | 0 | 111.4 | L139 H143 | L139-N141 PolarHBondContact O-N 3.08Å; N141-H143 PolarHBondContact O-N 3.08Å | ||
| 142 | K | 46.9 | Very low | 41.3 | Very low | 191 Ų | 191 | 135.6 Ų | 135.6 | 83% | 0.83 | 74% | 0.743 | S | S | * | * | trans | -93.6 | 42.5 | -164.5 | -160.1 | -160.4 | 172.1 | -178.1 | 0 | 114.3 | T140 | T140-K142 PolarHBondContact O-N 2.66Š| ||
| 143 | H | 42.8 | Very low | 42 | Very low | 183 Ų | 183 | 136.9 Ų | 136.9 | 85% | 0.847 | 74% | 0.743 | S | S | * | * | trans | -142.5 | 121.6 | 167.1 | -71.5 | -72.2 | 0 | 0 | 0 | 108.9 | N141 | N141-H143 PolarHBondContact O-N 3.08Š| ||
| 144 | R | 42 | Very low | 42.8 | Very low | 182 Ų | 182 | 135.6 Ų | 135.6 | 69% | 0.687 | 74% | 0.737 | S | S | * | * | trans | -142.2 | 82.5 | 178.9 | -151.7 | 176 | -164.4 | -160.2 | 1.9 | 112.2 | ||||
| 145 | G | 37.4 | Very low | 43.6 | Very low | 67 Ų | 67 | 126.2 Ų | 126.2 | 69% | 0.691 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -67.4 | 154.6 | 133.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | E147 | G145-E147 VanDerWaalsContact C-N 3.3Å; G145-E147 PolarHBondContact O-N 3.24Å |
| 146 | N | 44.2 | Very low | 44.6 | Very low | 137 Ų | 137 | 124.4 Ų | 124.4 | 73% | 0.733 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -77.5 | 76.8 | -173.4 | -85 | -5.3 | 0 | 0 | 0 | 113 | ||
| 147 | E | 39.3 | Very low | 46.2 | Very low | 181 Ų | 181 | 123.4 Ų | 123.4 | 85% | 0.846 | 68% | 0.682 | S | S | * | * | trans | -99.5 | 92.5 | 149.1 | -71.1 | -173.8 | -158.1 | 0 | 0 | 107.7 | G145 S149 | G145-E147 VanDerWaalsContact C-N 3.3Å; G145-E147 PolarHBondContact O-N 3.24Å; E147-S149 PolarHBondContact O-N 2.65Å | ||
| 148 | V | 52.2 | Low | 48.4 | Very low | 60 Ų | 60 | 118.6 Ų | 118.6 | 36% | 0.364 | 65% | 0.65 | S | S | . | * | trans | -77 | 116 | 173.4 | -177.7 | 0 | 0 | 0 | 0 | 107.5 | S150 | V148-S150 PolarHBondContact O-N 3.19Š| ||
| 149 | S | 44.1 | Very low | 50.7 | Low | 107 Ų | 107 | 115.5 Ų | 115.5 | 75% | 0.748 | 63% | 0.634 | S | S | * | * | trans | -70.6 | 77.3 | 167.9 | 44.3 | 0 | 0 | 0 | 0 | 109.8 | E147 T151 | E147-S149 PolarHBondContact O-N 2.65Å; S149-T151 PolarHBondContact O-N 3.43Å | ||
| 150 | S | 42.4 | Very low | 53.3 | Low | 86 Ų | 86 | 107.9 Ų | 107.9 | 60% | 0.601 | 59% | 0.594 | S | S | * | * | trans | -67.7 | 75.7 | -177.1 | 43.8 | 0 | 0 | 0 | 0 | 111.7 | V148 P152 | V148-S150 PolarHBondContact O-N 3.19Å; S150-P152 VanDerWaalsContact O-CD 3.25Å; S150-P152 WeakPolarHBondContact O-CD 3.01Å | ||
| 151 | T | 46.1 | Very low | 55.8 | Low | 80 Ų | 80 | 102.4 Ų | 102.4 | 49% | 0.491 | 56% | 0.559 | S | S | . | * | trans | -66.1 | 108.3 | 166 | 47.1 | 0 | 0 | 0 | 0 | 108.2 | S149 L153 L154 | S149-T151 PolarHBondContact O-N 3.43Å; T151-L153 PolarHBondContact O-N 2.99Å; T151-L154 PolarHBondContact O-N 3.19Å | ||
| 152 | P | 51 | Low | 58.4 | Low | 92 Ų | 92 | 98.1 Ų | 98.1 | 60% | 0.597 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -67.1 | -17.5 | -162.7 | 25.6 | -35.1 | 0 | 0 | 0 | 113.5 | S150 L154 | S150-P152 VanDerWaalsContact O-CD 3.25Å; S150-P152 WeakPolarHBondContact O-CD 3.01Å; P152-L154 VanDerWaalsContact C-N 3.35Å; P152-L154 PolarHBondContact O-N 3.31Å |
| 153 | L | 49.4 | Very low | 60.6 | Low | 154 Ų | 154 | 89 Ų | 89 | 81% | 0.806 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -71.3 | -24.3 | 179.9 | -62.2 | 174 | 0 | 0 | 0 | 113.8 | T151 | T151-L153 PolarHBondContact O-N 2.99Å |
| 154 | L | 55 | Low | 63.1 | Low | 108 Ų | 108 | 80.3 Ų | 80.3 | 57% | 0.565 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -85.2 | -29.6 | -178.5 | -68.8 | -179.2 | 0 | 0 | 0 | 113.1 | T151 P152 H156 S157 | T151-L154 PolarHBondContact O-N 3.19Å; P152-L154 VanDerWaalsContact C-N 3.35Å; P152-L154 PolarHBondContact O-N 3.31Å; L154-H156 VanDerWaalsContact C-N 3.28Å; L154-H156 PolarHBondContact O-N 3.25Å; L154-S157 WeakPolarHBondContact O-CB 3.2Å; L154-S157 PolarHBondContact O-N 3.19Å; L154-S157 PolarHBondContact O-OG 3.31Å |
| 155 | V | 53.7 | Low | 65.5 | Low | 16 Ų | 16 | 71.9 Ų | 71.9 | 10% | 0.097 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -63.5 | -34.4 | -173.1 | -167.3 | 0 | 0 | 0 | 0 | 112.1 | S157 L158 L163 F171 | V155-S157 PolarHBondContact O-N 2.94Å; V155-L158 HydrophobicContact CG1-CD1 4.33Å; V155-L158 PolarHBondContact O-N 3.26Å; V155-L158 VanDerWaalsContact O-N 3.17Å; V155-L163 HydrophobicContact CG1-CD2 3.75Å; V155-F171 HydrophobicContact CB-CD1 4.36Å; V155-F171 HydrophobicContact CB-CE1 4.21Å; V155-F171 HydrophobicContact CB-CZ 4.29Å; V155-F171 HydrophobicContact CG1-CB 4.03Å; V155-F171 HydrophobicContact CG1-CD1 3.67Å; V155-F171 HydrophobicContact CG1-CD2 3.6Å; V155-F171 HydrophobicContact CG1-CE1 3.94Å; V155-F171 HydrophobicContact CG1-CE2 3.88Å; V155-F171 HydrophobicContact CG1-CG 3.48Å; V155-F171 VanDerWaalsContact CG1-CG 3.48Å; V155-F171 HydrophobicContact CG1-CZ 4.04Å; V155-F171 HydrophobicContact CG2-CZ 4.48Å |
| 156 | H | 58.6 | Low | 68.1 | Low | 139 Ų | 139 | 72.5 Ų | 72.5 | 64% | 0.644 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -22.3 | 173.7 | -68.3 | -74.3 | 0 | 0 | 0 | 114 | L154 | L154-H156 VanDerWaalsContact C-N 3.28Å; L154-H156 PolarHBondContact O-N 3.25Å |
| 157 | S | 72.9 | Confident | 70.4 | Confident | 92 Ų | 92 | 67.1 Ų | 67.1 | 64% | 0.643 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.1 | -4.4 | 178.2 | 71.2 | 0 | 0 | 0 | 0 | 114.5 | L154 V155 | L154-S157 WeakPolarHBondContact O-CB 3.2Å; L154-S157 PolarHBondContact O-N 3.19Å; L154-S157 PolarHBondContact O-OG 3.31Å; V155-S157 PolarHBondContact O-N 2.94Å |
| 158 | L | 84.4 | Confident | 72.9 | Confident | 40 Ų | 40 | 60.9 Ų | 60.9 | 21% | 0.209 | 36% | 0.356 | C | S | . | . | S | Bend | trans | -77.4 | 143.4 | 180 | -59.3 | -179.4 | 0 | 0 | 0 | 111.8 | V155 Q162 L163 R175 | V155-L158 HydrophobicContact CG1-CD1 4.33Å; V155-L158 PolarHBondContact O-N 3.26Å; V155-L158 VanDerWaalsContact O-N 3.17Å; L158-Q162 HydrophobicContact CD2-CG 4.13Å; L158-L163 HydrophobicContact CB-CD2 3.94Å; L158-L163 HydrophobicContact CB-CG 4.04Å; L158-L163 HydrophobicContact CD1-CD2 3.83Å; L158-L163 HydrophobicContact CG-CD2 4.49Å; L158-R175 PolarHBondContact O-NH1 3.26Å |
| 159 | S | 89.4 | Confident | 74.6 | Confident | 60 Ų | 60 | 61.6 Ų | 61.6 | 42% | 0.42 | 36% | 0.357 | S | S | . | . | trans | -66.8 | 154.4 | 167.6 | 60.6 | 0 | 0 | 0 | 0 | 110.4 | H161 Q162 L163 | S159-H161 PolarHBondContact O-N 2.64Å; S159-Q162 PolarHBondContact O-N 3.07Å; S159-Q162 VanDerWaalsContact O-N 3.1Å; S159-Q162 WeakPolarHBondContact OG-CB 3.45Å; S159-Q162 PolarHBondContact OG-N 3.24Å; S159-L163 PolarHBondContact O-N 2.94Å | ||
| 160 | I | 91.1 | Very high | 76.8 | Confident | 5 Ų | 5 | 62 Ų | 62 | 3% | 0.026 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -59.8 | -36.4 | 176.7 | -179.4 | 164.3 | 0 | 0 | 0 | 111.7 | Q162 L163 A164 L172 I176 V181 L184 P192 | I160-Q162 VanDerWaalsContact C-N 3.35Å; I160-Q162 PolarHBondContact O-N 3.13Å; I160-L163 PolarHBondContact O-N 3.1Å; I160-A164 WeakPolarHBondContact O-CB 3.46Å; I160-A164 PolarHBondContact O-N 3.09Å; I160-L172 HydrophobicContact CD1-CD1 3.86Å; I160-L172 HydrophobicContact CG1-CD1 3.51Å; I160-I176 HydrophobicContact CD1-CD1 4.08Å; I160-I176 HydrophobicContact CD1-CG1 3.68Å; I160-V181 HydrophobicContact CD1-CB 4.39Å; I160-V181 HydrophobicContact CD1-CG2 3.59Å; I160-V181 HydrophobicContact CG2-CB 4.48Å; I160-V181 HydrophobicContact CG2-CG2 4.38Å; I160-L184 HydrophobicContact CG2-CD2 4.29Å; I160-P192 HydrophobicContact CB-CG 4.39Å; I160-P192 HydrophobicContact CD1-CG 4.04Å; I160-P192 HydrophobicContact CG1-CB 4.1Å; I160-P192 HydrophobicContact CG1-CG 3.77Å; I160-P192 HydrophobicContact CG2-CG 3.91Å |
| 161 | H | 92.9 | Very high | 79 | Confident | 12 Ų | 12 | 61.1 Ų | 61.1 | 6% | 0.056 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -52.9 | -49 | 171.4 | -49.8 | 77.4 | 0 | 0 | 0 | 112.3 | S159 A164 A165 L184 D186 F190 W195 | S159-H161 PolarHBondContact O-N 2.64Å; H161-A164 PolarHBondContact O-N 2.97Å; H161-A165 WeakPolarHBondContact O-CB 3.34Å; H161-A165 PolarHBondContact O-N 2.83Å; H161-L184 PolarHBondContact CE1-O 3.43Å; H161-L184 PolarHBondContact NE2-O 2.72Å; H161-D186 IonicContact CD2-OD2 3.89Å; H161-D186 PolarHBondContact NE2-N 3.49Å; H161-F190 PolarHBondContact CD2-O 3.38Å; H161-F190 PolarHBondContact NE2-O 2.98Å; H161-F190 VanDerWaalsContact NE2-O 3.13Å; H161-W195 HydrophobicContact CB-CD2 4.17Å; H161-W195 HydrophobicContact CB-CG 3.92Å; H161-W195 AromaticContact CD2-CD1 3.7Å; H161-W195 AromaticContact CD2-NE1 3.8Å |
| 162 | Q | 91.8 | Very high | 81.1 | Confident | 68 Ų | 68 | 57.3 Ų | 57.3 | 32% | 0.318 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -75.8 | -30.5 | -177.3 | -176 | 65.4 | -25.8 | 0 | 0 | 112.6 | L158 S159 I160 Q166 | L158-Q162 HydrophobicContact CD2-CG 4.13Å; S159-Q162 PolarHBondContact O-N 3.07Å; S159-Q162 VanDerWaalsContact O-N 3.1Å; S159-Q162 WeakPolarHBondContact OG-CB 3.45Å; S159-Q162 PolarHBondContact OG-N 3.24Å; I160-Q162 VanDerWaalsContact C-N 3.35Å; I160-Q162 PolarHBondContact O-N 3.13Å; Q162-Q166 VanDerWaalsContact CD-NE2 3.32Å; Q162-Q166 WeakPolarHBondContact O-CB 3.46Å; Q162-Q166 VanDerWaalsContact O-CG 3.23Å; Q162-Q166 WeakPolarHBondContact O-CG 3.17Å; Q162-Q166 PolarHBondContact O-N 3.08Å; Q162-Q166 VanDerWaalsContact O-N 3.08Å |
| 163 | L | 92.6 | Very high | 83 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.7 | -43.7 | 169.3 | -66.9 | 173.5 | 0 | 0 | 0 | 111.1 | V155 L158 S159 I160 Q166 G167 E168 F171 L172 | V155-L163 HydrophobicContact CG1-CD2 3.75Å; L158-L163 HydrophobicContact CB-CD2 3.94Å; L158-L163 HydrophobicContact CB-CG 4.04Å; L158-L163 HydrophobicContact CD1-CD2 3.83Å; L158-L163 HydrophobicContact CG-CD2 4.49Å; S159-L163 PolarHBondContact O-N 2.94Å; I160-L163 PolarHBondContact O-N 3.1Å; L163-Q166 PolarHBondContact O-N 3.12Å; L163-G167 PolarHBondContact O-N 2.84Å; L163-G167 VanDerWaalsContact O-N 3.12Å; L163-E168 HydrophobicContact CB-CB 4.44Å; L163-E168 HydrophobicContact CD2-CB 3.89Å; L163-E168 HydrophobicContact CD2-CG 4.41Å; L163-E168 PolarHBondContact O-N 3.2Å; L163-E168 VanDerWaalsContact O-N 3.08Å; L163-F171 HydrophobicContact CD1-CB 4.15Å; L163-F171 HydrophobicContact CD2-CB 3.95Å; L163-L172 HydrophobicContact CB-CB 4.45Å |
| 164 | A | 93.8 | Very high | 84.9 | Confident | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.9 | -40 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | I160 H161 L172 P192 A196 V204 L208 | I160-A164 WeakPolarHBondContact O-CB 3.46Å; I160-A164 PolarHBondContact O-N 3.09Å; H161-A164 PolarHBondContact O-N 2.97Å; A164-L172 HydrophobicContact CB-CD1 4.34Å; A164-L172 HydrophobicContact CB-CD2 4.31Å; A164-P192 HydrophobicContact CB-CB 3.99Å; A164-P192 WeakPolarHBondContact CB-O 3.3Å; A164-A196 HydrophobicContact CB-CB 4.34Å; A164-V204 HydrophobicContact CB-CG1 3.93Å; A164-L208 HydrophobicContact CB-CD1 4.4Å |
| 165 | A | 93.8 | Very high | 86.4 | Confident | 6 Ų | 6 | 46.1 Ų | 46.1 | 5% | 0.05 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.3 | -35.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | H161 W195 Q201 | H161-A165 WeakPolarHBondContact O-CB 3.34Å; H161-A165 PolarHBondContact O-N 2.83Å; A165-W195 HydrophobicContact CB-CB 4.33Å; A165-W195 HydrophobicContact CB-CE3 3.73Å; A165-W195 HydrophobicContact CB-CZ3 4.5Å; A165-Q201 WeakPolarHBondContact O-CG 3.34Å; A165-Q201 PolarHBondContact O-NE2 3.23Å |
| 166 | Q | 92.1 | Very high | 88.1 | Confident | 80 Ų | 80 | 46.6 Ų | 46.6 | 37% | 0.374 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -83.3 | -19.8 | -178.2 | -71.7 | 179 | 19.7 | 0 | 0 | 113.9 | Q162 L163 E168 Q201 | Q162-Q166 VanDerWaalsContact CD-NE2 3.32Å; Q162-Q166 WeakPolarHBondContact O-CB 3.46Å; Q162-Q166 VanDerWaalsContact O-CG 3.23Å; Q162-Q166 WeakPolarHBondContact O-CG 3.17Å; Q162-Q166 PolarHBondContact O-N 3.08Å; Q162-Q166 VanDerWaalsContact O-N 3.08Å; L163-Q166 PolarHBondContact O-N 3.12Å; Q166-E168 HydrophobicContact CB-CG 4.03Å; Q166-Q201 PolarHBondContact O-NE2 3.18Å |
| 167 | G | 91.8 | Very high | 89.3 | Confident | 24 Ų | 24 | 47.9 Ų | 47.9 | 25% | 0.247 | 26% | 0.264 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 89.9 | 17.3 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | L163 M169 | L163-G167 PolarHBondContact O-N 2.84Å; L163-G167 VanDerWaalsContact O-N 3.12Å; G167-M169 PolarHBondContact O-N 3.17Å |
| 168 | E | 90.9 | Very high | 89.7 | Confident | 49 Ų | 49 | 50 Ų | 50 | 23% | 0.229 | 26% | 0.264 | C | S | . | . | trans | -78.5 | 59.3 | -172.2 | -72.9 | -67.7 | 169.3 | 0 | 0 | 112.6 | L163 Q166 V170 F171 L172 | L163-E168 HydrophobicContact CB-CB 4.44Å; L163-E168 HydrophobicContact CD2-CB 3.89Å; L163-E168 HydrophobicContact CD2-CG 4.41Å; L163-E168 PolarHBondContact O-N 3.2Å; L163-E168 VanDerWaalsContact O-N 3.08Å; Q166-E168 HydrophobicContact CB-CG 4.03Å; E168-V170 VanDerWaalsContact C-N 3.29Å; E168-V170 PolarHBondContact O-N 3.13Å; E168-V170 VanDerWaalsContact O-N 3.09Å; E168-F171 HydrophobicContact CB-CD2 4.38Å; E168-F171 PolarHBondContact O-N 2.89Å; E168-L172 WeakPolarHBondContact O-CB 3.27Å; E168-L172 PolarHBondContact O-N 3.33Å | ||
| 169 | M | 89.8 | Confident | 89.2 | Confident | 75 Ų | 75 | 53 Ų | 53 | 37% | 0.369 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -42 | -46.6 | -174.1 | -74.4 | -79.7 | -74.6 | 0 | 0 | 114.4 | G167 L172 A173 A203 V204 F207 | G167-M169 PolarHBondContact O-N 3.17Å; M169-L172 PolarHBondContact O-N 3.45Å; M169-A173 VanDerWaalsContact O-CB 3.29Å; M169-A173 WeakPolarHBondContact O-CB 3.3Å; M169-A173 PolarHBondContact O-N 2.81Å; M169-A203 HydrophobicContact SD-CB 4.48Å; M169-V204 HydrophobicContact CG-CG2 4.26Å; M169-V204 HydrophobicContact SD-CG2 3.83Å; M169-F207 HydrophobicContact CE-CB 4.19Å; M169-F207 HydrophobicContact CE-CD2 4.45Å; M169-F207 HydrophobicContact CE-CG 4.39Å; M169-F207 HydrophobicContact SD-CB 4.21Å |
| 170 | V | 89.8 | Confident | 88.4 | Confident | 115 Ų | 115 | 57.2 Ų | 57.2 | 70% | 0.697 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -66.6 | -42.6 | -175.8 | -179.2 | 0 | 0 | 0 | 0 | 111.5 | E168 S174 | E168-V170 VanDerWaalsContact C-N 3.29Å; E168-V170 PolarHBondContact O-N 3.13Å; E168-V170 VanDerWaalsContact O-N 3.09Å; V170-S174 VanDerWaalsContact O-CB 3.3Å; V170-S174 WeakPolarHBondContact O-CB 3.44Å; V170-S174 PolarHBondContact O-N 3.37Å; V170-S174 VanDerWaalsContact O-N 3.12Å |
| 171 | F | 88.2 | Confident | 88.1 | Confident | 69 Ų | 69 | 58.2 Ų | 58.2 | 30% | 0.303 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -77.1 | -33.9 | 179.1 | -64.2 | -80.9 | 0 | 0 | 0 | 111.9 | V155 L163 E168 R175 | V155-F171 HydrophobicContact CB-CD1 4.36Å; V155-F171 HydrophobicContact CB-CE1 4.21Å; V155-F171 HydrophobicContact CB-CZ 4.29Å; V155-F171 HydrophobicContact CG1-CB 4.03Å; V155-F171 HydrophobicContact CG1-CD1 3.67Å; V155-F171 HydrophobicContact CG1-CD2 3.6Å; V155-F171 HydrophobicContact CG1-CE1 3.94Å; V155-F171 HydrophobicContact CG1-CE2 3.88Å; V155-F171 HydrophobicContact CG1-CG 3.48Å; V155-F171 VanDerWaalsContact CG1-CG 3.48Å; V155-F171 HydrophobicContact CG1-CZ 4.04Å; V155-F171 HydrophobicContact CG2-CZ 4.48Å; L163-F171 HydrophobicContact CD1-CB 4.15Å; L163-F171 HydrophobicContact CD2-CB 3.95Å; E168-F171 HydrophobicContact CB-CD2 4.38Å; E168-F171 PolarHBondContact O-N 2.89Å; F171-R175 WeakPolarHBondContact O-CB 3.31Å; F171-R175 PolarHBondContact O-N 3.01Å |
| 172 | L | 90.8 | Very high | 88 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.5 | -52 | 173.7 | 178.6 | 62.3 | 0 | 0 | 0 | 111.5 | I160 L163 A164 E168 M169 S174 R175 I176 V204 F207 L208 | I160-L172 HydrophobicContact CD1-CD1 3.86Å; I160-L172 HydrophobicContact CG1-CD1 3.51Å; L163-L172 HydrophobicContact CB-CB 4.45Å; A164-L172 HydrophobicContact CB-CD1 4.34Å; A164-L172 HydrophobicContact CB-CD2 4.31Å; E168-L172 WeakPolarHBondContact O-CB 3.27Å; E168-L172 PolarHBondContact O-N 3.33Å; M169-L172 PolarHBondContact O-N 3.45Å; L172-S174 PolarHBondContact O-N 3.09Å; L172-R175 PolarHBondContact O-N 3.33Å; L172-I176 HydrophobicContact CD1-CD1 3.83Å; L172-I176 HydrophobicContact CG-CD1 3.99Å; L172-I176 WeakPolarHBondContact O-CG1 3.46Å; L172-I176 PolarHBondContact O-N 3.43Å; L172-V204 HydrophobicContact CD2-CB 4.43Å; L172-V204 HydrophobicContact CD2-CG1 3.5Å; L172-V204 VanDerWaalsContact CD2-CG1 3.5Å; L172-V204 HydrophobicContact CD2-CG2 4.24Å; L172-F207 HydrophobicContact CD2-CD1 4.37Å; L172-L208 HydrophobicContact CD1-CD2 4.49Å; L172-L208 HydrophobicContact CD2-CD2 4.36Å; L172-L208 HydrophobicContact CD2-CG 4.44Å |
| 173 | A | 90.6 | Very high | 88 | Confident | 21 Ų | 21 | 58.1 Ų | 58.1 | 17% | 0.174 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -58.2 | -48.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.2 | M169 R175 I176 E177 F207 | M169-A173 VanDerWaalsContact O-CB 3.29Å; M169-A173 WeakPolarHBondContact O-CB 3.3Å; M169-A173 PolarHBondContact O-N 2.81Å; A173-R175 VanDerWaalsContact C-N 3.25Å; A173-R175 PolarHBondContact O-N 3.24Å; A173-I176 PolarHBondContact O-N 2.91Å; A173-I176 VanDerWaalsContact O-N 3.09Å; A173-E177 WeakPolarHBondContact O-CG 3.48Å; A173-E177 PolarHBondContact O-N 3.23Å; A173-F207 HydrophobicContact CB-CE1 3.99Å; A173-F207 HydrophobicContact CB-CE2 4.26Å; A173-F207 HydrophobicContact CB-CZ 3.49Å; A173-F207 VanDerWaalsContact CB-CZ 3.49Å |
| 174 | S | 89.1 | Confident | 88 | Confident | 48 Ų | 48 | 62.1 Ų | 62.1 | 34% | 0.336 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.3 | -32.4 | 179.1 | -164.2 | 0 | 0 | 0 | 0 | 113.3 | V170 L172 Q178 | V170-S174 VanDerWaalsContact O-CB 3.3Å; V170-S174 WeakPolarHBondContact O-CB 3.44Å; V170-S174 PolarHBondContact O-N 3.37Å; V170-S174 VanDerWaalsContact O-N 3.12Å; L172-S174 PolarHBondContact O-N 3.09Å; S174-Q178 WeakPolarHBondContact O-CG 3.28Å; S174-Q178 PolarHBondContact O-N 3.08Å; S174-Q178 PolarHBondContact O-NE2 3.36Å; S174-Q178 PolarHBondContact OG-NE2 3.03Å |
| 175 | R | 87.4 | Confident | 88 | Confident | 50 Ų | 50 | 66.5 Ų | 66.5 | 19% | 0.189 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -71.9 | -42.2 | 173.7 | -171.4 | 66.4 | 58.7 | 79.5 | 6.8 | 112 | L158 F171 L172 A173 E177 Q178 E179 V181 | L158-R175 PolarHBondContact O-NH1 3.26Å; F171-R175 WeakPolarHBondContact O-CB 3.31Å; F171-R175 PolarHBondContact O-N 3.01Å; L172-R175 PolarHBondContact O-N 3.33Å; A173-R175 VanDerWaalsContact C-N 3.25Å; A173-R175 PolarHBondContact O-N 3.24Å; R175-E177 VanDerWaalsContact C-N 3.34Å; R175-Q178 PolarHBondContact O-N 3.18Å; R175-E179 WeakPolarHBondContact CD-OE2 3.44Å; R175-E179 PolarHBondContact O-N 3.29Å; R175-V181 HydrophobicContact CG-CG2 3.95Å |
| 176 | I | 88.2 | Confident | 87.9 | Confident | 25 Ų | 25 | 67.8 Ų | 67.8 | 13% | 0.128 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -68.6 | -31.8 | 179.9 | -70 | 166.2 | 0 | 0 | 0 | 111.8 | I160 L172 A173 I182 F207 L208 | I160-I176 HydrophobicContact CD1-CD1 4.08Å; I160-I176 HydrophobicContact CD1-CG1 3.68Å; L172-I176 HydrophobicContact CD1-CD1 3.83Å; L172-I176 HydrophobicContact CG-CD1 3.99Å; L172-I176 WeakPolarHBondContact O-CG1 3.46Å; L172-I176 PolarHBondContact O-N 3.43Å; A173-I176 PolarHBondContact O-N 2.91Å; A173-I176 VanDerWaalsContact O-N 3.09Å; I176-I182 HydrophobicContact CD1-CD1 4.29Å; I176-I182 HydrophobicContact CD1-CG1 4.12Å; I176-I182 HydrophobicContact CG1-CB 4.45Å; I176-I182 HydrophobicContact CG2-CD1 4.38Å; I176-F207 HydrophobicContact CD1-CE1 4.08Å; I176-L208 HydrophobicContact CD1-CD2 3.67Å |
| 177 | E | 84.9 | Confident | 88 | Confident | 166 Ų | 166 | 70.5 Ų | 70.5 | 78% | 0.776 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -69.4 | -30.5 | 171.5 | -72.3 | 178.6 | 166.8 | 0 | 0 | 113.2 | A173 R175 | A173-E177 WeakPolarHBondContact O-CG 3.48Å; A173-E177 PolarHBondContact O-N 3.23Å; R175-E177 VanDerWaalsContact C-N 3.34Å |
| 178 | Q | 79.8 | Confident | 88 | Confident | 137 Ų | 137 | 74.7 Ų | 74.7 | 64% | 0.64 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -87.8 | -36.5 | -177.6 | -72.9 | 166 | 36.7 | 0 | 0 | 112.9 | S174 R175 | S174-Q178 WeakPolarHBondContact O-CG 3.28Å; S174-Q178 PolarHBondContact O-N 3.08Å; S174-Q178 PolarHBondContact O-NE2 3.36Å; S174-Q178 PolarHBondContact OG-NE2 3.03Å; R175-Q178 PolarHBondContact O-N 3.18Å |
| 179 | E | 73.8 | Confident | 88.1 | Confident | 104 Ų | 104 | 72.5 Ų | 72.5 | 49% | 0.486 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -140.1 | 135.3 | -172.4 | -59.5 | 178.6 | 150.4 | 0 | 0 | 109.6 | R175 V181 | R175-E179 WeakPolarHBondContact CD-OE2 3.44Å; R175-E179 PolarHBondContact O-N 3.29Å; E179-V181 HydrophobicContact CB-CG1 3.9Å; E179-V181 HydrophobicContact CB-CG2 4.04Å; E179-V181 WeakPolarHBondContact O-CG2 3.36Å; E179-V181 PolarHBondContact O-N 3.19Å |
| 180 | T | 74.1 | Confident | 88.4 | Confident | 147 Ų | 147 | 70.6 Ų | 70.6 | 90% | 0.902 | 37% | 0.366 | S | S | * | . | trans | -77.9 | 54.2 | 179.6 | 58.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 181 | V | 85.1 | Confident | 88.7 | Confident | 26 Ų | 26 | 65.1 Ų | 65.1 | 16% | 0.158 | 33% | 0.333 | C | S | . | . | trans | -96.7 | 10.9 | -174.1 | -69.4 | 0 | 0 | 0 | 0 | 113.7 | I160 R175 E179 N183 L184 | I160-V181 HydrophobicContact CD1-CB 4.39Å; I160-V181 HydrophobicContact CD1-CG2 3.59Å; I160-V181 HydrophobicContact CG2-CB 4.48Å; I160-V181 HydrophobicContact CG2-CG2 4.38Å; R175-V181 HydrophobicContact CG-CG2 3.95Å; E179-V181 HydrophobicContact CB-CG1 3.9Å; E179-V181 HydrophobicContact CB-CG2 4.04Å; E179-V181 WeakPolarHBondContact O-CG2 3.36Å; E179-V181 PolarHBondContact O-N 3.19Å; V181-N183 PolarHBondContact O-N 3.09Å; V181-L184 HydrophobicContact CB-CB 4Å; V181-L184 HydrophobicContact CB-CD2 4.13Å; V181-L184 HydrophobicContact CG1-CB 4.49Å; V181-L184 HydrophobicContact CG1-CD2 4.05Å; V181-L184 WeakPolarHBondContact O-CB 3.45Å; V181-L184 PolarHBondContact O-N 3.14Å | ||
| 182 | I | 88.9 | Confident | 89 | Confident | 20 Ų | 20 | 61.9 Ų | 61.9 | 10% | 0.103 | 32% | 0.318 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -31.7 | -175.6 | -163.7 | 169.6 | 0 | 0 | 0 | 113.9 | I176 P192 L208 N211 A213 | I176-I182 HydrophobicContact CD1-CD1 4.29Å; I176-I182 HydrophobicContact CD1-CG1 4.12Å; I176-I182 HydrophobicContact CG1-CB 4.45Å; I176-I182 HydrophobicContact CG2-CD1 4.38Å; I182-P192 WeakPolarHBondContact O-CD 3.39Å; I182-L208 HydrophobicContact CD1-CD2 4.18Å; I182-L208 HydrophobicContact CG1-CD2 3.79Å; I182-N211 HydrophobicContact CD1-CB 3.51Å; I182-N211 WeakPolarHBondContact CD1-O 3.25Å; I182-A213 HydrophobicContact CD1-CB 4.08Å; I182-A213 HydrophobicContact CG1-CB 3.95Å |
| 183 | N | 92.4 | Very high | 89.3 | Confident | 59 Ų | 59 | 61.9 Ų | 61.9 | 32% | 0.316 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109 | 20.4 | 176.5 | -69 | -34.2 | 0 | 0 | 0 | 112.5 | V181 Q185 G212 A213 D214 L217 | V181-N183 PolarHBondContact O-N 3.09Å; N183-Q185 PolarHBondContact O-N 3.28Å; N183-G212 PolarHBondContact ND2-O 3.28Å; N183-A213 VanDerWaalsContact OD1-CA 3.29Å; N183-A213 WeakPolarHBondContact OD1-CA 3.39Å; N183-D214 PolarHBondContact OD1-N 2.77Å; N183-L217 HydrophobicContact CB-CD1 3.78Å |
| 184 | L | 92.3 | Very high | 89.6 | Confident | 83 Ų | 83 | 61 Ų | 61 | 44% | 0.435 | 31% | 0.311 | S | S | . | . | trans | -67.9 | 123.3 | 178 | -179.5 | 66.1 | 0 | 0 | 0 | 110.4 | I160 H161 V181 P192 | I160-L184 HydrophobicContact CG2-CD2 4.29Å; H161-L184 PolarHBondContact CE1-O 3.43Å; H161-L184 PolarHBondContact NE2-O 2.72Å; V181-L184 HydrophobicContact CB-CB 4Å; V181-L184 HydrophobicContact CB-CD2 4.13Å; V181-L184 HydrophobicContact CG1-CB 4.49Å; V181-L184 HydrophobicContact CG1-CD2 4.05Å; V181-L184 WeakPolarHBondContact O-CB 3.45Å; V181-L184 PolarHBondContact O-N 3.14Å; L184-P192 WeakPolarHBondContact O-CD 3.38Å | ||
| 185 | Q | 93.8 | Very high | 89.9 | Confident | 93 Ų | 93 | 62.1 Ų | 62.1 | 44% | 0.435 | 31% | 0.308 | S | S | . | . | trans | -82.9 | 146.7 | 171.9 | -67.3 | -173.6 | -56.1 | 0 | 0 | 111.3 | N183 G189 F190 T191 L218 | N183-Q185 PolarHBondContact O-N 3.28Å; Q185-G189 WeakPolarHBondContact CG-O 3.23Å; Q185-G189 PolarHBondContact NE2-O 2.66Å; Q185-F190 WeakPolarHBondContact CA-O 3.25Å; Q185-T191 HydrophobicContact CG-CG2 4.16Å; Q185-L218 PolarHBondContact NE2-O 2.97Å | ||
| 186 | D | 93.1 | Very high | 90.4 | Very high | 32 Ų | 32 | 59.8 Ų | 59.8 | 17% | 0.171 | 30% | 0.299 | C | S | . | . | trans | -87.4 | -170.7 | 170.7 | 60.4 | 22.5 | 0 | 0 | 0 | 112.8 | H161 E188 G189 F190 W195 | H161-D186 IonicContact CD2-OD2 3.89Å; H161-D186 PolarHBondContact NE2-N 3.49Å; D186-E188 PolarHBondContact O-N 2.9Å; D186-E188 WeakPolarHBondContact OD1-CA 3.37Å; D186-E188 PolarHBondContact OD1-N 3.41Å; D186-G189 PolarHBondContact O-N 3.12Å; D186-G189 VanDerWaalsContact O-N 3.08Å; D186-G189 PolarHBondContact OD1-N 3.4Å; D186-F190 PolarHBondContact N-O 2.86Å; D186-F190 VanDerWaalsContact N-O 3.1Å; D186-F190 PolarHBondContact OD1-N 3.16Å; D186-W195 PolarHBondContact OD2-NE1 3.07Å | ||
| 187 | D | 93.1 | Very high | 90.8 | Very high | 137 Ų | 137 | 58.6 Ų | 58.6 | 73% | 0.733 | 29% | 0.293 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -15.8 | 179.7 | -76.2 | -41.6 | 0 | 0 | 0 | 113.3 | K220 | D187-K220 WeakPolarHBondContact O-CE 3.36Å; D187-K220 PolarHBondContact O-NZ 3.09Å |
| 188 | E | 92.2 | Very high | 91.3 | Very high | 113 Ų | 113 | 51.8 Ų | 51.8 | 53% | 0.528 | 27% | 0.265 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.1 | -11.5 | 173.4 | -71.2 | 71.1 | -151.6 | 0 | 0 | 112.6 | D186 F190 K220 | D186-E188 PolarHBondContact O-N 2.9Å; D186-E188 WeakPolarHBondContact OD1-CA 3.37Å; D186-E188 PolarHBondContact OD1-N 3.41Å; E188-F190 HydrophobicContact CB-CD2 3.59Å; E188-F190 HydrophobicContact CB-CE2 3.6Å; E188-F190 HydrophobicContact CG-CE2 4.39Å; E188-K220 WeakPolarHBondContact O-CB 3.48Å; E188-K220 WeakPolarHBondContact O-CD 3.34Å; E188-K220 WeakPolarHBondContact O-CG 3.47Å; E188-K220 PolarHBondContact O-N 2.96Å; E188-K220 VanDerWaalsContact O-N 3.08Å |
| 189 | G | 93.2 | Very high | 92 | Very high | 2 Ų | 2 | 49.6 Ų | 49.6 | 2% | 0.021 | 26% | 0.255 | C | S | . | . | trans | 97.8 | 1.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | Q185 D186 | Q185-G189 WeakPolarHBondContact CG-O 3.23Å; Q185-G189 PolarHBondContact NE2-O 2.66Å; D186-G189 PolarHBondContact O-N 3.12Å; D186-G189 VanDerWaalsContact O-N 3.08Å; D186-G189 PolarHBondContact OD1-N 3.4Å | ||
| 190 | F | 95.8 | Very high | 93 | Very high | 35 Ų | 35 | 45.6 Ų | 45.6 | 15% | 0.154 | 24% | 0.241 | C | C | . | . | trans | -76.4 | 143.1 | -177.5 | -60.4 | -76.3 | 0 | 0 | 0 | 112 | H161 Q185 D186 E188 M194 A219 E223 L228 | H161-F190 PolarHBondContact CD2-O 3.38Å; H161-F190 PolarHBondContact NE2-O 2.98Å; H161-F190 VanDerWaalsContact NE2-O 3.13Å; Q185-F190 WeakPolarHBondContact CA-O 3.25Å; D186-F190 PolarHBondContact N-O 2.86Å; D186-F190 VanDerWaalsContact N-O 3.1Å; D186-F190 PolarHBondContact OD1-N 3.16Å; E188-F190 HydrophobicContact CB-CD2 3.59Å; E188-F190 HydrophobicContact CB-CE2 3.6Å; E188-F190 HydrophobicContact CG-CE2 4.39Å; F190-M194 VanDerWaalsContact CA-SD 3.56Å; F190-M194 HydrophobicContact CB-CB 4.19Å; F190-M194 HydrophobicContact CB-SD 4.06Å; F190-M194 HydrophobicContact CD1-CB 4.06Å; F190-M194 HydrophobicContact CD1-CG 4.46Å; F190-M194 HydrophobicContact CD1-SD 3.78Å; F190-M194 HydrophobicContact CG-SD 4.38Å; F190-A219 HydrophobicContact CD1-CB 3.46Å; F190-A219 VanDerWaalsContact CD1-CB 3.46Å; F190-A219 HydrophobicContact CE1-CB 3.46Å; F190-A219 VanDerWaalsContact CE1-CB 3.46Å; F190-A219 HydrophobicContact CG-CB 4.06Å; F190-A219 HydrophobicContact CZ-CB 4.06Å; F190-E223 HydrophobicContact CE1-CB 4.12Å; F190-E223 WeakPolarHBondContact CZ-OE2 3.18Å; F190-L228 HydrophobicContact CD1-CD1 4.12Å; F190-L228 HydrophobicContact CE1-CD1 4.08Å | ||
| 191 | T | 95.7 | Very high | 94.1 | Very high | 1 Ų | 1 | 41.2 Ų | 41.2 | 1% | 0.006 | 21% | 0.21 | C | C | . | . | trans | -91.4 | 163.1 | 173.3 | 66.2 | 0 | 0 | 0 | 0 | 111 | Q185 L193 M194 W195 L217 | Q185-T191 HydrophobicContact CG-CG2 4.16Å; T191-L193 PolarHBondContact O-N 3.25Å; T191-L193 VanDerWaalsContact O-N 3.16Å; T191-M194 HydrophobicContact CG2-CE 4.29Å; T191-M194 HydrophobicContact CG2-SD 4.28Å; T191-M194 PolarHBondContact N-SD 2.9Å; T191-M194 WeakPolarHBondContact O-CB 3.25Å; T191-M194 PolarHBondContact O-N 2.94Å; T191-M194 WeakPolarHBondContact OG1-CG 3.39Å; T191-M194 PolarHBondContact OG1-N 3.47Å; T191-W195 PolarHBondContact O-N 3.33Å; T191-W195 VanDerWaalsContact O-N 3.08Å; T191-L217 HydrophobicContact CG2-CB 3.98Å; T191-L217 HydrophobicContact CG2-CD1 3.8Å | ||
| 192 | P | 95.4 | Very high | 94.7 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -54.2 | -32.9 | 172.2 | -27 | 36.1 | 0 | 0 | 0 | 113.2 | I160 A164 I182 L184 W195 A196 L208 | I160-P192 HydrophobicContact CB-CG 4.39Å; I160-P192 HydrophobicContact CD1-CG 4.04Å; I160-P192 HydrophobicContact CG1-CB 4.1Å; I160-P192 HydrophobicContact CG1-CG 3.77Å; I160-P192 HydrophobicContact CG2-CG 3.91Å; A164-P192 HydrophobicContact CB-CB 3.99Å; A164-P192 WeakPolarHBondContact CB-O 3.3Å; I182-P192 WeakPolarHBondContact O-CD 3.39Å; L184-P192 WeakPolarHBondContact O-CD 3.38Å; P192-W195 PolarHBondContact O-N 3Å; P192-A196 WeakPolarHBondContact O-CB 3.33Å; P192-A196 PolarHBondContact O-N 3.26Å; P192-L208 HydrophobicContact CB-CD1 4.1Å; P192-L208 HydrophobicContact CB-CD2 4.35Å |
| 193 | L | 96.9 | Very high | 95 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.9 | -42.1 | 176.8 | -178.7 | 64.3 | 0 | 0 | 0 | 112 | T191 A196 A197 V205 L208 L209 A213 P215 A225 L241 | T191-L193 PolarHBondContact O-N 3.25Å; T191-L193 VanDerWaalsContact O-N 3.16Å; L193-A196 PolarHBondContact O-N 3.48Å; L193-A197 VanDerWaalsContact O-CB 3.25Å; L193-A197 WeakPolarHBondContact O-CB 3.48Å; L193-A197 PolarHBondContact O-N 3.02Å; L193-V205 HydrophobicContact CD1-CB 4.36Å; L193-V205 HydrophobicContact CD1-CG1 3.95Å; L193-V205 HydrophobicContact CD1-CG2 4.33Å; L193-L208 HydrophobicContact CB-CD1 4.25Å; L193-L208 HydrophobicContact CD1-CB 4.16Å; L193-L208 HydrophobicContact CD1-CD1 4.41Å; L193-L209 HydrophobicContact CD1-CD2 4.18Å; L193-L209 HydrophobicContact CD1-CG 4.1Å; L193-L209 HydrophobicContact CD2-CD2 3.83Å; L193-A213 HydrophobicContact CB-CB 4.34Å; L193-A213 HydrophobicContact CD2-CB 4.1Å; L193-P215 HydrophobicContact CD2-CB 3.89Å; L193-A225 HydrophobicContact CD2-CB 4.5Å; L193-A225 HydrophobicContact CG-CB 4.25Å; L193-L241 HydrophobicContact CD2-CD2 4.31Å |
| 194 | M | 96.8 | Very high | 95.2 | Very high | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.01 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.6 | -42.9 | 173.6 | -69.5 | 164 | -176.4 | 0 | 0 | 111.9 | F190 T191 A197 A198 L217 A219 A225 L228 | F190-M194 VanDerWaalsContact CA-SD 3.56Å; F190-M194 HydrophobicContact CB-CB 4.19Å; F190-M194 HydrophobicContact CB-SD 4.06Å; F190-M194 HydrophobicContact CD1-CB 4.06Å; F190-M194 HydrophobicContact CD1-CG 4.46Å; F190-M194 HydrophobicContact CD1-SD 3.78Å; F190-M194 HydrophobicContact CG-SD 4.38Å; T191-M194 HydrophobicContact CG2-CE 4.29Å; T191-M194 HydrophobicContact CG2-SD 4.28Å; T191-M194 PolarHBondContact N-SD 2.9Å; T191-M194 WeakPolarHBondContact O-CB 3.25Å; T191-M194 PolarHBondContact O-N 2.94Å; T191-M194 WeakPolarHBondContact OG1-CG 3.39Å; T191-M194 PolarHBondContact OG1-N 3.47Å; M194-A197 PolarHBondContact O-N 3.12Å; M194-A198 VanDerWaalsContact O-CB 3.31Å; M194-A198 WeakPolarHBondContact O-CB 3.31Å; M194-A198 PolarHBondContact O-N 3.02Å; M194-L217 HydrophobicContact CE-CB 4.34Å; M194-L217 WeakPolarHBondContact CE-O 3.43Å; M194-A219 HydrophobicContact SD-CB 4.22Å; M194-A225 HydrophobicContact CG-CB 4.14Å; M194-L228 HydrophobicContact CB-CD1 3.68Å; M194-L228 HydrophobicContact CG-CD1 4.04Å |
| 195 | W | 96.1 | Very high | 95.4 | Very high | 73 Ų | 73 | 38.4 Ų | 38.4 | 28% | 0.277 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -62.7 | -43.6 | 176 | -84 | 85.7 | 0 | 0 | 0 | 112.1 | H161 A165 D186 T191 P192 H199 | H161-W195 HydrophobicContact CB-CD2 4.17Å; H161-W195 HydrophobicContact CB-CG 3.92Å; H161-W195 AromaticContact CD2-CD1 3.7Å; H161-W195 AromaticContact CD2-NE1 3.8Å; A165-W195 HydrophobicContact CB-CB 4.33Å; A165-W195 HydrophobicContact CB-CE3 3.73Å; A165-W195 HydrophobicContact CB-CZ3 4.5Å; D186-W195 PolarHBondContact OD2-NE1 3.07Å; T191-W195 PolarHBondContact O-N 3.33Å; T191-W195 VanDerWaalsContact O-N 3.08Å; P192-W195 PolarHBondContact O-N 3Å; W195-H199 AromaticContact CE3-CE1 3.57Å; W195-H199 AromaticContact CZ3-CE1 3.89Å; W195-H199 PolarHBondContact O-N 3.49Å; W195-H199 PolarHBondContact O-ND1 3.05Å |
| 196 | A | 96.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.9 | -43.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A164 P192 L193 H199 G200 Q201 V204 V205 L208 | A164-A196 HydrophobicContact CB-CB 4.34Å; P192-A196 WeakPolarHBondContact O-CB 3.33Å; P192-A196 PolarHBondContact O-N 3.26Å; L193-A196 PolarHBondContact O-N 3.48Å; A196-H199 PolarHBondContact O-N 2.96Å; A196-G200 PolarHBondContact O-N 3.36Å; A196-G200 VanDerWaalsContact O-N 3.09Å; A196-Q201 HydrophobicContact CB-CB 4.21Å; A196-Q201 PolarHBondContact O-N 3.46Å; A196-V204 HydrophobicContact CB-CB 4.13Å; A196-V204 HydrophobicContact CB-CG1 3.55Å; A196-V205 HydrophobicContact CB-CG2 3.77Å; A196-L208 HydrophobicContact CB-CD1 4.22Å |
| 197 | A | 96.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.5 | -44.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L193 M194 H199 G200 V205 A225 A229 Y234 I237 | L193-A197 VanDerWaalsContact O-CB 3.25Å; L193-A197 WeakPolarHBondContact O-CB 3.48Å; L193-A197 PolarHBondContact O-N 3.02Å; M194-A197 PolarHBondContact O-N 3.12Å; A197-H199 PolarHBondContact O-N 2.95Å; A197-G200 PolarHBondContact O-N 2.88Å; A197-V205 HydrophobicContact CB-CG2 4.49Å; A197-A225 HydrophobicContact CB-CB 4.27Å; A197-A229 HydrophobicContact CB-CB 4.39Å; A197-Y234 WeakPolarHBondContact O-CD2 3.4Å; A197-Y234 WeakPolarHBondContact O-CE2 3.46Å; A197-I237 HydrophobicContact CB-CG2 3.96Å |
| 198 | A | 95.8 | Very high | 95.7 | Very high | 23 Ų | 23 | 32.3 Ų | 32.3 | 19% | 0.19 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.4 | -21.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114 | M194 L228 | M194-A198 VanDerWaalsContact O-CB 3.31Å; M194-A198 WeakPolarHBondContact O-CB 3.31Å; M194-A198 PolarHBondContact O-N 3.02Å; A198-L228 HydrophobicContact CB-CB 4.34Å |
| 199 | H | 95.4 | Very high | 95.8 | Very high | 92 Ų | 92 | 28.5 Ų | 28.5 | 43% | 0.426 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -104.6 | -1 | -180 | -70.1 | 81.6 | 0 | 0 | 0 | 114.4 | W195 A196 A197 Q201 | W195-H199 AromaticContact CE3-CE1 3.57Å; W195-H199 AromaticContact CZ3-CE1 3.89Å; W195-H199 PolarHBondContact O-N 3.49Å; W195-H199 PolarHBondContact O-ND1 3.05Å; A196-H199 PolarHBondContact O-N 2.96Å; A197-H199 PolarHBondContact O-N 2.95Å; H199-Q201 HydrophobicContact CB-CG 4Å |
| 200 | G | 95 | Very high | 95.9 | Very high | 19 Ų | 19 | 34.8 Ų | 34.8 | 20% | 0.196 | 18% | 0.179 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 77.6 | 21.5 | 177 | 0 | 0 | 0 | 0 | 0 | 114.6 | A196 A197 I202 Y234 | A196-G200 PolarHBondContact O-N 3.36Å; A196-G200 VanDerWaalsContact O-N 3.09Å; A197-G200 PolarHBondContact O-N 2.88Å; G200-I202 VanDerWaalsContact C-N 3.31Å; G200-I202 PolarHBondContact O-N 3.45Å; G200-Y234 VanDerWaalsContact CA-CZ 3.42Å |
| 201 | Q | 96.8 | Very high | 95.7 | Very high | 55 Ų | 55 | 36.8 Ų | 36.8 | 26% | 0.257 | 19% | 0.191 | S | C | . | . | trans | -83.1 | 70.7 | -172.1 | -61.9 | -74.2 | 9.2 | 0 | 0 | 111.5 | A165 Q166 A196 H199 A203 V204 V205 | A165-Q201 WeakPolarHBondContact O-CG 3.34Å; A165-Q201 PolarHBondContact O-NE2 3.23Å; Q166-Q201 PolarHBondContact O-NE2 3.18Å; A196-Q201 HydrophobicContact CB-CB 4.21Å; A196-Q201 PolarHBondContact O-N 3.46Å; H199-Q201 HydrophobicContact CB-CG 4Å; Q201-A203 PolarHBondContact O-N 2.95Å; Q201-V204 HydrophobicContact CB-CB 3.91Å; Q201-V204 HydrophobicContact CB-CG2 4.18Å; Q201-V204 WeakPolarHBondContact O-CA 3.41Å; Q201-V204 WeakPolarHBondContact O-CB 3.44Å; Q201-V204 PolarHBondContact O-N 2.99Å; Q201-V205 PolarHBondContact O-N 3.2Å | ||
| 202 | I | 96.3 | Very high | 95.5 | Very high | 75 Ų | 75 | 39.1 Ų | 39.1 | 39% | 0.385 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -46.8 | -54.2 | -173 | -59.5 | 172 | 0 | 0 | 0 | 112.4 | G200 V204 V205 E206 D236 I237 M240 | G200-I202 VanDerWaalsContact C-N 3.31Å; G200-I202 PolarHBondContact O-N 3.45Å; I202-V204 VanDerWaalsContact C-N 3.27Å; I202-V204 PolarHBondContact O-N 2.92Å; I202-V205 PolarHBondContact O-N 3.06Å; I202-E206 PolarHBondContact O-N 2.9Å; I202-D236 HydrophobicContact CD1-CB 4.2Å; I202-I237 HydrophobicContact CG1-CD1 4.18Å; I202-I237 HydrophobicContact CG1-CG1 4.05Å; I202-M240 HydrophobicContact CG2-CE 3.77Å |
| 203 | A | 96.1 | Very high | 95.4 | Very high | 53 Ų | 53 | 39.4 Ų | 39.4 | 44% | 0.438 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -65.7 | -27.8 | -178 | 0 | 0 | 0 | 0 | 0 | 113.6 | M169 Q201 F207 | M169-A203 HydrophobicContact SD-CB 4.48Å; Q201-A203 PolarHBondContact O-N 2.95Å; A203-F207 VanDerWaalsContact O-CB 3.27Å; A203-F207 WeakPolarHBondContact O-CB 3.39Å; A203-F207 PolarHBondContact O-N 3.44Å |
| 204 | V | 95.9 | Very high | 95.3 | Very high | 2 Ų | 2 | 42.3 Ų | 42.3 | 1% | 0.012 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -75.5 | -41.5 | 173.8 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | A164 M169 L172 A196 Q201 I202 F207 L208 | A164-V204 HydrophobicContact CB-CG1 3.93Å; M169-V204 HydrophobicContact CG-CG2 4.26Å; M169-V204 HydrophobicContact SD-CG2 3.83Å; L172-V204 HydrophobicContact CD2-CB 4.43Å; L172-V204 HydrophobicContact CD2-CG1 3.5Å; L172-V204 VanDerWaalsContact CD2-CG1 3.5Å; L172-V204 HydrophobicContact CD2-CG2 4.24Å; A196-V204 HydrophobicContact CB-CB 4.13Å; A196-V204 HydrophobicContact CB-CG1 3.55Å; Q201-V204 HydrophobicContact CB-CB 3.91Å; Q201-V204 HydrophobicContact CB-CG2 4.18Å; Q201-V204 WeakPolarHBondContact O-CA 3.41Å; Q201-V204 WeakPolarHBondContact O-CB 3.44Å; Q201-V204 PolarHBondContact O-N 2.99Å; I202-V204 VanDerWaalsContact C-N 3.27Å; I202-V204 PolarHBondContact O-N 2.92Å; V204-F207 PolarHBondContact O-N 3.02Å; V204-L208 HydrophobicContact CG1-CD1 3.65Å; V204-L208 HydrophobicContact CG1-CG 4.09Å; V204-L208 VanDerWaalsContact O-CB 3.31Å; V204-L208 WeakPolarHBondContact O-CB 3.48Å; V204-L208 WeakPolarHBondContact O-CG 3.39Å; V204-L208 PolarHBondContact O-N 3.41Å |
| 205 | V | 96.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58.9 | -48.9 | 174.1 | 170.1 | 0 | 0 | 0 | 0 | 110.1 | L193 A196 A197 Q201 I202 F207 L208 L209 I237 M240 | L193-V205 HydrophobicContact CD1-CB 4.36Å; L193-V205 HydrophobicContact CD1-CG1 3.95Å; L193-V205 HydrophobicContact CD1-CG2 4.33Å; A196-V205 HydrophobicContact CB-CG2 3.77Å; A197-V205 HydrophobicContact CB-CG2 4.49Å; Q201-V205 PolarHBondContact O-N 3.2Å; I202-V205 PolarHBondContact O-N 3.06Å; V205-F207 PolarHBondContact O-N 3.1Å; V205-L208 PolarHBondContact O-N 2.84Å; V205-L209 HydrophobicContact CG1-CD1 3.75Å; V205-L209 HydrophobicContact CG1-CG 4.42Å; V205-L209 WeakPolarHBondContact O-CB 3.35Å; V205-L209 VanDerWaalsContact O-CG 3.27Å; V205-L209 WeakPolarHBondContact O-CG 3.24Å; V205-L209 PolarHBondContact O-N 2.87Å; V205-I237 HydrophobicContact CB-CG1 4.4Å; V205-I237 HydrophobicContact CG1-CG2 4.23Å; V205-I237 HydrophobicContact CG2-CD1 3.99Å; V205-I237 HydrophobicContact CG2-CG1 4.12Å; V205-I237 HydrophobicContact CG2-CG2 4.14Å; V205-M240 HydrophobicContact CB-CE 4Å; V205-M240 HydrophobicContact CG1-CE 3.72Å |
| 206 | E | 96.3 | Very high | 95.1 | Very high | 92 Ų | 92 | 43.7 Ų | 43.7 | 43% | 0.43 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -56.3 | -51.1 | 175.5 | -178.7 | 178.3 | -169.2 | 0 | 0 | 111.5 | I202 L208 L209 Q210 M240 | I202-E206 PolarHBondContact O-N 2.9Å; E206-L208 PolarHBondContact O-N 2.82Å; E206-L209 PolarHBondContact O-N 3.09Å; E206-Q210 HydrophobicContact CG-CG 4.49Å; E206-Q210 WeakPolarHBondContact O-CB 3.39Å; E206-Q210 VanDerWaalsContact O-CG 3.27Å; E206-Q210 WeakPolarHBondContact O-CG 3.38Å; E206-Q210 PolarHBondContact O-N 3.26Å; E206-Q210 PolarHBondContact OE1-NE2 2.94Å; E206-M240 HydrophobicContact CB-SD 3.93Å |
| 207 | F | 95.4 | Very high | 95 | Very high | 42 Ų | 42 | 46 Ų | 46 | 18% | 0.184 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.8 | -43 | 179.4 | 179 | -97.9 | 0 | 0 | 0 | 112.8 | M169 L172 A173 I176 A203 V204 V205 Q210 N211 | M169-F207 HydrophobicContact CE-CB 4.19Å; M169-F207 HydrophobicContact CE-CD2 4.45Å; M169-F207 HydrophobicContact CE-CG 4.39Å; M169-F207 HydrophobicContact SD-CB 4.21Å; L172-F207 HydrophobicContact CD2-CD1 4.37Å; A173-F207 HydrophobicContact CB-CE1 3.99Å; A173-F207 HydrophobicContact CB-CE2 4.26Å; A173-F207 HydrophobicContact CB-CZ 3.49Å; A173-F207 VanDerWaalsContact CB-CZ 3.49Å; I176-F207 HydrophobicContact CD1-CE1 4.08Å; A203-F207 VanDerWaalsContact O-CB 3.27Å; A203-F207 WeakPolarHBondContact O-CB 3.39Å; A203-F207 PolarHBondContact O-N 3.44Å; V204-F207 PolarHBondContact O-N 3.02Å; V205-F207 PolarHBondContact O-N 3.1Å; F207-Q210 PolarHBondContact O-N 3.32Å; F207-N211 VanDerWaalsContact CE2-ND2 3.28Å; F207-N211 WeakPolarHBondContact CE2-ND2 3.38Å; F207-N211 WeakPolarHBondContact CZ-ND2 3.22Å; F207-N211 PolarHBondContact O-N 3.45Å; F207-N211 VanDerWaalsContact O-N 3.08Å; F207-N211 PolarHBondContact O-ND2 3.29Å |
| 208 | L | 95.1 | Very high | 94.9 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.8 | -45.5 | 179 | -74.5 | 172.3 | 0 | 0 | 0 | 111.5 | A164 L172 I176 I182 P192 L193 A196 V204 V205 E206 N211 G212 A213 | A164-L208 HydrophobicContact CB-CD1 4.4Å; L172-L208 HydrophobicContact CD1-CD2 4.49Å; L172-L208 HydrophobicContact CD2-CD2 4.36Å; L172-L208 HydrophobicContact CD2-CG 4.44Å; I176-L208 HydrophobicContact CD1-CD2 3.67Å; I182-L208 HydrophobicContact CD1-CD2 4.18Å; I182-L208 HydrophobicContact CG1-CD2 3.79Å; P192-L208 HydrophobicContact CB-CD1 4.1Å; P192-L208 HydrophobicContact CB-CD2 4.35Å; L193-L208 HydrophobicContact CB-CD1 4.25Å; L193-L208 HydrophobicContact CD1-CB 4.16Å; L193-L208 HydrophobicContact CD1-CD1 4.41Å; A196-L208 HydrophobicContact CB-CD1 4.22Å; V204-L208 HydrophobicContact CG1-CD1 3.65Å; V204-L208 HydrophobicContact CG1-CG 4.09Å; V204-L208 VanDerWaalsContact O-CB 3.31Å; V204-L208 WeakPolarHBondContact O-CB 3.48Å; V204-L208 WeakPolarHBondContact O-CG 3.39Å; V204-L208 PolarHBondContact O-N 3.41Å; V205-L208 PolarHBondContact O-N 2.84Å; E206-L208 PolarHBondContact O-N 2.82Å; L208-N211 CarbonylContact O-C 3.59Å; L208-N211 PolarHBondContact O-N 3.35Å; L208-G212 PolarHBondContact O-N 2.73Å; L208-A213 HydrophobicContact CB-CB 3.87Å; L208-A213 WeakPolarHBondContact O-CB 3.45Å; L208-A213 PolarHBondContact O-N 2.85Å |
| 209 | L | 94.9 | Very high | 94.9 | Very high | 32 Ų | 32 | 47.6 Ų | 47.6 | 17% | 0.168 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.6 | -43 | 176.5 | -67 | 169.5 | 0 | 0 | 0 | 111.3 | L193 V205 E206 N211 G212 P215 M240 L241 | L193-L209 HydrophobicContact CD1-CD2 4.18Å; L193-L209 HydrophobicContact CD1-CG 4.1Å; L193-L209 HydrophobicContact CD2-CD2 3.83Å; V205-L209 HydrophobicContact CG1-CD1 3.75Å; V205-L209 HydrophobicContact CG1-CG 4.42Å; V205-L209 WeakPolarHBondContact O-CB 3.35Å; V205-L209 VanDerWaalsContact O-CG 3.27Å; V205-L209 WeakPolarHBondContact O-CG 3.24Å; V205-L209 PolarHBondContact O-N 2.87Å; E206-L209 PolarHBondContact O-N 3.09Å; L209-N211 PolarHBondContact O-N 3.06Å; L209-G212 PolarHBondContact O-N 3.37Å; L209-G212 VanDerWaalsContact O-N 3.12Å; L209-P215 HydrophobicContact CD2-CB 4.07Å; L209-P215 HydrophobicContact CD2-CG 4.26Å; L209-M240 HydrophobicContact CD1-CB 4.23Å; L209-L241 HydrophobicContact CD1-CD2 4.38Å; L209-L241 HydrophobicContact CD2-CD2 4.41Å |
| 210 | Q | 93.8 | Very high | 94.8 | Very high | 134 Ų | 134 | 49.2 Ų | 49.2 | 63% | 0.626 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -62.3 | -27.1 | 175.5 | -73.5 | 176 | 10.1 | 0 | 0 | 113.7 | E206 F207 | E206-Q210 HydrophobicContact CG-CG 4.49Å; E206-Q210 WeakPolarHBondContact O-CB 3.39Å; E206-Q210 VanDerWaalsContact O-CG 3.27Å; E206-Q210 WeakPolarHBondContact O-CG 3.38Å; E206-Q210 PolarHBondContact O-N 3.26Å; E206-Q210 PolarHBondContact OE1-NE2 2.94Å; F207-Q210 PolarHBondContact O-N 3.32Å |
| 211 | N | 92.3 | Very high | 94.6 | Very high | 78 Ų | 78 | 49.1 Ų | 49.1 | 42% | 0.417 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | 7.2 | 177.2 | -75.4 | -92.5 | 0 | 0 | 0 | 113.8 | I182 F207 L208 L209 | I182-N211 HydrophobicContact CD1-CB 3.51Å; I182-N211 WeakPolarHBondContact CD1-O 3.25Å; F207-N211 VanDerWaalsContact CE2-ND2 3.28Å; F207-N211 WeakPolarHBondContact CE2-ND2 3.38Å; F207-N211 WeakPolarHBondContact CZ-ND2 3.22Å; F207-N211 PolarHBondContact O-N 3.45Å; F207-N211 VanDerWaalsContact O-N 3.08Å; F207-N211 PolarHBondContact O-ND2 3.29Å; L208-N211 CarbonylContact O-C 3.59Å; L208-N211 PolarHBondContact O-N 3.35Å; L209-N211 PolarHBondContact O-N 3.06Å |
| 212 | G | 90.8 | Very high | 94.5 | Very high | 49 Ų | 49 | 50.7 Ų | 50.7 | 51% | 0.505 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.9 | 29.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | N183 L208 L209 | N183-G212 PolarHBondContact ND2-O 3.28Å; L208-G212 PolarHBondContact O-N 2.73Å; L209-G212 PolarHBondContact O-N 3.37Å; L209-G212 VanDerWaalsContact O-N 3.12Å |
| 213 | A | 94.5 | Very high | 94.4 | Very high | 7 Ų | 7 | 49.8 Ų | 49.8 | 6% | 0.058 | 27% | 0.267 | C | S | . | . | trans | -62.3 | 135.8 | 162.2 | 0 | 0 | 0 | 0 | 0 | 110 | I182 N183 L193 L208 P215 | I182-A213 HydrophobicContact CD1-CB 4.08Å; I182-A213 HydrophobicContact CG1-CB 3.95Å; N183-A213 VanDerWaalsContact OD1-CA 3.29Å; N183-A213 WeakPolarHBondContact OD1-CA 3.39Å; L193-A213 HydrophobicContact CB-CB 4.34Å; L193-A213 HydrophobicContact CD2-CB 4.1Å; L208-A213 HydrophobicContact CB-CB 3.87Å; L208-A213 WeakPolarHBondContact O-CB 3.45Å; L208-A213 PolarHBondContact O-N 2.85Å; A213-P215 WeakPolarHBondContact O-CD 3.47Å | ||
| 214 | D | 94.7 | Very high | 94.3 | Very high | 61 Ų | 61 | 47.7 Ų | 47.7 | 33% | 0.326 | 25% | 0.249 | S | C | . | . | trans | -89.6 | 113.7 | 178.7 | -177.9 | 1.2 | 0 | 0 | 0 | 110.2 | N183 N216 L217 | N183-D214 PolarHBondContact OD1-N 2.77Å; D214-N216 VanDerWaalsContact C-N 3.26Å; D214-N216 PolarHBondContact O-N 2.67Å; D214-N216 WeakPolarHBondContact OD1-CB 3.18Å; D214-N216 PolarHBondContact OD1-N 3.12Å; D214-N216 PolarHBondContact OD1-ND2 2.78Å; D214-L217 HydrophobicContact CB-CD1 3.93Å; D214-L217 HydrophobicContact CB-CG 3.92Å | ||
| 215 | P | 94.7 | Very high | 94.3 | Very high | 15 Ų | 15 | 47.6 Ų | 47.6 | 10% | 0.097 | 25% | 0.249 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.1 | -8.6 | -178.6 | 35.6 | -38.1 | 0 | 0 | 0 | 113.6 | L193 L209 A213 L241 C244 V246 | L193-P215 HydrophobicContact CD2-CB 3.89Å; L209-P215 HydrophobicContact CD2-CB 4.07Å; L209-P215 HydrophobicContact CD2-CG 4.26Å; A213-P215 WeakPolarHBondContact O-CD 3.47Å; P215-L241 HydrophobicContact CB-CD2 3.79Å; P215-C244 HydrophobicContact CG-CB 4.06Å; P215-V246 HydrophobicContact CB-CG1 3.55Å; P215-V246 HydrophobicContact CG-CG1 3.71Å |
| 216 | N | 93.8 | Very high | 94.3 | Very high | 88 Ų | 88 | 47.7 Ų | 47.7 | 47% | 0.471 | 25% | 0.25 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | -5.1 | 179.9 | -49.7 | -81.2 | 0 | 0 | 0 | 113 | D214 | D214-N216 VanDerWaalsContact C-N 3.26Å; D214-N216 PolarHBondContact O-N 2.67Å; D214-N216 WeakPolarHBondContact OD1-CB 3.18Å; D214-N216 PolarHBondContact OD1-N 3.12Å; D214-N216 PolarHBondContact OD1-ND2 2.78Å |
| 217 | L | 94.3 | Very high | 94.2 | Very high | 48 Ų | 48 | 43.6 Ų | 43.6 | 25% | 0.251 | 23% | 0.231 | S | C | . | . | trans | -62.7 | 149.2 | 169.8 | -68.8 | 172.8 | 0 | 0 | 0 | 109.9 | N183 T191 M194 D214 | N183-L217 HydrophobicContact CB-CD1 3.78Å; T191-L217 HydrophobicContact CG2-CB 3.98Å; T191-L217 HydrophobicContact CG2-CD1 3.8Å; M194-L217 HydrophobicContact CE-CB 4.34Å; M194-L217 WeakPolarHBondContact CE-O 3.43Å; D214-L217 HydrophobicContact CB-CD1 3.93Å; D214-L217 HydrophobicContact CB-CG 3.92Å | ||
| 218 | L | 95.2 | Very high | 94.2 | Very high | 52 Ų | 52 | 42.6 Ų | 42.6 | 27% | 0.272 | 23% | 0.227 | S | C | . | . | B | Isolated β-bridge | trans | -127 | 142.7 | -176.4 | -54.5 | 173.9 | 0 | 0 | 0 | 110.1 | Q185 R222 E250 | Q185-L218 PolarHBondContact NE2-O 2.97Å; L218-R222 HydrophobicContact CD1-CG 4.18Å; L218-E250 WeakPolarHBondContact CD1-OE1 3Å; L218-E250 HydrophobicContact CD2-CG 3.88Å |
| 219 | A | 94.6 | Very high | 94.3 | Very high | 6 Ų | 6 | 42.6 Ų | 42.6 | 5% | 0.05 | 23% | 0.227 | C | C | . | . | trans | -72.8 | 176.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | F190 M194 G221 R222 E223 | F190-A219 HydrophobicContact CD1-CB 3.46Å; F190-A219 VanDerWaalsContact CD1-CB 3.46Å; F190-A219 HydrophobicContact CE1-CB 3.46Å; F190-A219 VanDerWaalsContact CE1-CB 3.46Å; F190-A219 HydrophobicContact CG-CB 4.06Å; F190-A219 HydrophobicContact CZ-CB 4.06Å; M194-A219 HydrophobicContact SD-CB 4.22Å; A219-G221 PolarHBondContact O-N 3.41Å; A219-G221 VanDerWaalsContact O-N 3.17Å; A219-R222 WeakPolarHBondContact O-CA 3.42Å; A219-R222 PolarHBondContact O-N 2.91Å; A219-E223 HydrophobicContact CB-CB 4.17Å; A219-E223 PolarHBondContact N-O 3.43Å | ||
| 220 | K | 93.4 | Very high | 94.4 | Very high | 126 Ų | 126 | 41.1 Ų | 41.1 | 55% | 0.548 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.7 | -26.3 | -179 | -70.6 | 174.4 | -173.5 | 179.5 | 0 | 113.4 | D187 E188 R222 W253 | D187-K220 WeakPolarHBondContact O-CE 3.36Å; D187-K220 PolarHBondContact O-NZ 3.09Å; E188-K220 WeakPolarHBondContact O-CB 3.48Å; E188-K220 WeakPolarHBondContact O-CD 3.34Å; E188-K220 WeakPolarHBondContact O-CG 3.47Å; E188-K220 PolarHBondContact O-N 2.96Å; E188-K220 VanDerWaalsContact O-N 3.08Å; K220-R222 VanDerWaalsContact C-N 3.28Å; K220-R222 PolarHBondContact O-N 2.71Å; K220-W253 VanDerWaalsContact O-CE3 3.23Å; K220-W253 WeakPolarHBondContact O-CZ3 3.38Å |
| 221 | G | 91.9 | Very high | 94.4 | Very high | 16 Ų | 16 | 36.3 Ų | 36.3 | 17% | 0.165 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | 4.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | A219 E223 D252 W253 | A219-G221 PolarHBondContact O-N 3.41Å; A219-G221 VanDerWaalsContact O-N 3.17Å; G221-E223 PolarHBondContact O-N 2.86Å; G221-D252 WeakPolarHBondContact O-CB 3.34Å; G221-W253 WeakPolarHBondContact O-CB 3.37Å; G221-W253 PolarHBondContact O-N 3.2Å |
| 222 | R | 93.6 | Very high | 94.6 | Very high | 88 Ų | 88 | 38 Ų | 38 | 33% | 0.332 | 21% | 0.205 | S | C | . | . | trans | 62.6 | 13.8 | -161.8 | -76.5 | -171.7 | 74.1 | -166.5 | 15.8 | 115.6 | L218 A219 K220 S224 E250 Y251 D252 | L218-R222 HydrophobicContact CD1-CG 4.18Å; A219-R222 WeakPolarHBondContact O-CA 3.42Å; A219-R222 PolarHBondContact O-N 2.91Å; K220-R222 VanDerWaalsContact C-N 3.28Å; K220-R222 PolarHBondContact O-N 2.71Å; R222-S224 PolarHBondContact O-N 2.83Å; R222-E250 IonicContact CZ-OE1 2.88Å; R222-E250 IonicContact CZ-OE2 2.65Å; R222-E250 IonicContact NE-OE1 3.08Å; R222-E250 PolarHBondContact NE-OE1 3.4Å; R222-E250 IonicContact NH2-OE1 3.65Å; R222-E250 PolarHBondContact NH2-OE1 3.04Å; R222-E250 IonicContact NH2-OE2 3.19Å; R222-E250 PolarHBondContact NH2-OE2 3.34Å; R222-Y251 PolarHBondContact NE-O 3.49Å; R222-Y251 PolarHBondContact NH1-O 2.86Å; R222-D252 HydrophobicContact CB-CB 4.2Å | ||
| 223 | E | 93.5 | Very high | 94.8 | Very high | 57 Ų | 57 | 36.5 Ų | 36.5 | 27% | 0.266 | 19% | 0.189 | S | C | . | . | trans | -62 | 133.4 | 172.1 | -62.2 | 156.1 | 94.4 | 0 | 0 | 110.7 | F190 A219 G221 | F190-E223 HydrophobicContact CE1-CB 4.12Å; F190-E223 WeakPolarHBondContact CZ-OE2 3.18Å; A219-E223 HydrophobicContact CB-CB 4.17Å; A219-E223 PolarHBondContact N-O 3.43Å; G221-E223 PolarHBondContact O-N 2.86Å | ||
| 224 | S | 95.1 | Very high | 94.9 | Very high | 8 Ų | 8 | 40 Ų | 40 | 6% | 0.056 | 20% | 0.201 | C | C | . | . | B | Isolated β-bridge | trans | -107.5 | 161.7 | 178.6 | 71.3 | 0 | 0 | 0 | 0 | 111 | R222 L226 S227 L228 | R222-S224 PolarHBondContact O-N 2.83Å; S224-L226 PolarHBondContact O-N 3.37Å; S224-L226 VanDerWaalsContact O-N 3.17Å; S224-L226 PolarHBondContact OG-N 2.71Å; S224-S227 PolarHBondContact N-OG 3.19Å; S224-S227 PolarHBondContact O-N 2.83Å; S224-S227 PolarHBondContact O-OG 3.39Å; S224-S227 PolarHBondContact OG-N 3.45Å; S224-S227 VanDerWaalsContact OG-N 3.09Å; S224-L228 WeakPolarHBondContact O-CG 3.45Å; S224-L228 PolarHBondContact O-N 2.93Å; S224-L228 VanDerWaalsContact O-N 3.14Å |
| 225 | A | 95.8 | Very high | 95 | Very high | 1 Ų | 1 | 38.9 Ų | 38.9 | 1% | 0.008 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.4 | -30.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L193 M194 A197 A229 L241 | L193-A225 HydrophobicContact CD2-CB 4.5Å; L193-A225 HydrophobicContact CG-CB 4.25Å; M194-A225 HydrophobicContact CG-CB 4.14Å; A197-A225 HydrophobicContact CB-CB 4.27Å; A225-A229 WeakPolarHBondContact O-CB 3.32Å; A225-A229 PolarHBondContact O-N 3.05Å; A225-A229 VanDerWaalsContact O-N 3.13Å; A225-L241 HydrophobicContact CB-CD1 3.88Å; A225-L241 HydrophobicContact CB-CD2 4.05Å; A225-L241 WeakPolarHBondContact O-CD1 3.34Å |
| 226 | L | 96.7 | Very high | 95.1 | Very high | 2 Ų | 2 | 42.5 Ų | 42.5 | 1% | 0.01 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -71.6 | -49 | 177.4 | -176.6 | 66.6 | 0 | 0 | 0 | 112.1 | S224 L228 A229 C230 V238 L241 I242 V246 V248 P258 L274 | S224-L226 PolarHBondContact O-N 3.37Å; S224-L226 VanDerWaalsContact O-N 3.17Å; S224-L226 PolarHBondContact OG-N 2.71Å; L226-L228 VanDerWaalsContact C-N 3.31Å; L226-L228 PolarHBondContact O-N 3.03Å; L226-A229 PolarHBondContact O-N 2.92Å; L226-C230 WeakPolarHBondContact O-CB 3.46Å; L226-C230 PolarHBondContact O-N 3.34Å; L226-C230 PolarHBondContact O-SG 2.87Å; L226-V238 HydrophobicContact CD1-CB 4.37Å; L226-V238 HydrophobicContact CD1-CG1 3.98Å; L226-V238 HydrophobicContact CD1-CG2 4.39Å; L226-L241 HydrophobicContact CB-CD1 4.38Å; L226-L241 HydrophobicContact CD1-CB 4.33Å; L226-I242 HydrophobicContact CD1-CD1 4.36Å; L226-I242 HydrophobicContact CD1-CG1 4.14Å; L226-V246 HydrophobicContact CB-CG2 4.38Å; L226-V246 HydrophobicContact CD2-CG2 3.82Å; L226-V248 HydrophobicContact CD2-CG1 4.34Å; L226-P258 HydrophobicContact CD2-CB 3.97Å; L226-P258 HydrophobicContact CD2-CG 3.79Å; L226-P258 HydrophobicContact CG-CB 4.02Å; L226-P258 HydrophobicContact CG-CG 4.01Å; L226-L274 HydrophobicContact CD1-CD2 4.42Å; L226-L274 HydrophobicContact CD2-CD2 4.33Å |
| 227 | S | 95 | Very high | 95.3 | Very high | 5 Ų | 5 | 38.3 Ų | 38.3 | 4% | 0.035 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.5 | -39.3 | -179.5 | 68.1 | 0 | 0 | 0 | 0 | 111.6 | S224 C230 S231 | S224-S227 PolarHBondContact N-OG 3.19Å; S224-S227 PolarHBondContact O-N 2.83Å; S224-S227 PolarHBondContact O-OG 3.39Å; S224-S227 PolarHBondContact OG-N 3.45Å; S224-S227 VanDerWaalsContact OG-N 3.09Å; S227-C230 PolarHBondContact O-N 2.93Å; S227-S231 PolarHBondContact O-N 3.07Å |
| 228 | L | 95.2 | Very high | 95.4 | Very high | 22 Ų | 22 | 36 Ų | 36 | 12% | 0.115 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.4 | -51.3 | 172.6 | -68.7 | 169.7 | 0 | 0 | 0 | 112 | F190 M194 A198 S224 L226 C230 S231 | F190-L228 HydrophobicContact CD1-CD1 4.12Å; F190-L228 HydrophobicContact CE1-CD1 4.08Å; M194-L228 HydrophobicContact CB-CD1 3.68Å; M194-L228 HydrophobicContact CG-CD1 4.04Å; A198-L228 HydrophobicContact CB-CB 4.34Å; S224-L228 WeakPolarHBondContact O-CG 3.45Å; S224-L228 PolarHBondContact O-N 2.93Å; S224-L228 VanDerWaalsContact O-N 3.14Å; L226-L228 VanDerWaalsContact C-N 3.31Å; L226-L228 PolarHBondContact O-N 3.03Å; L228-C230 VanDerWaalsContact C-N 3.35Å; L228-C230 PolarHBondContact O-N 3.2Å; L228-S231 PolarHBondContact O-N 3.17Å; L228-S231 PolarHBondContact O-OG 2.96Å |
| 229 | A | 96.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.1 | -38.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | A197 A225 L226 K232 G233 Y234 I237 V238 L241 | A197-A229 HydrophobicContact CB-CB 4.39Å; A225-A229 WeakPolarHBondContact O-CB 3.32Å; A225-A229 PolarHBondContact O-N 3.05Å; A225-A229 VanDerWaalsContact O-N 3.13Å; L226-A229 PolarHBondContact O-N 2.92Å; A229-K232 PolarHBondContact O-N 3.45Å; A229-G233 PolarHBondContact O-N 3.39Å; A229-Y234 PolarHBondContact O-N 3.41Å; A229-I237 HydrophobicContact CB-CB 4.28Å; A229-I237 HydrophobicContact CB-CG2 3.59Å; A229-V238 HydrophobicContact CB-CG2 3.79Å; A229-L241 HydrophobicContact CB-CD1 4.43Å |
| 230 | C | 96.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.5 | -39.7 | 176.9 | -68.6 | 0 | 0 | 0 | 0 | 112 | L226 S227 L228 K232 G233 V238 P258 A262 H267 | L226-C230 WeakPolarHBondContact O-CB 3.46Å; L226-C230 PolarHBondContact O-N 3.34Å; L226-C230 PolarHBondContact O-SG 2.87Å; S227-C230 PolarHBondContact O-N 2.93Å; L228-C230 VanDerWaalsContact C-N 3.35Å; L228-C230 PolarHBondContact O-N 3.2Å; C230-K232 PolarHBondContact O-N 3.01Å; C230-G233 PolarHBondContact O-N 3.48Å; C230-V238 VanDerWaalsContact SG-CG2 3.58Å; C230-P258 HydrophobicContact CB-CB 4.42Å; C230-P258 WeakPolarHBondContact CB-O 3.38Å; C230-A262 HydrophobicContact CB-CB 4.35Å; C230-H267 PolarHBondContact O-CD2 3.44Å |
| 231 | S | 95.1 | Very high | 95.7 | Very high | 34 Ų | 34 | 34.1 Ų | 34.1 | 24% | 0.238 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.3 | -28.9 | 176.9 | 81 | 0 | 0 | 0 | 0 | 113.5 | S227 L228 H267 | S227-S231 PolarHBondContact O-N 3.07Å; L228-S231 PolarHBondContact O-N 3.17Å; L228-S231 PolarHBondContact O-OG 2.96Å; S231-H267 PolarHBondContact O-NE2 3.09Å |
| 232 | K | 95.1 | Very high | 95.9 | Very high | 114 Ų | 114 | 34.8 Ų | 34.8 | 50% | 0.496 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -98.1 | -14 | -178.6 | -54.2 | -51.3 | -178.7 | -163.4 | 0 | 114 | A229 C230 Y234 H267 | A229-K232 PolarHBondContact O-N 3.45Å; C230-K232 PolarHBondContact O-N 3.01Å; K232-Y234 HydrophobicContact CB-CD1 4.5Å; K232-Y234 HydrophobicContact CB-CD2 3.47Å; K232-Y234 VanDerWaalsContact CB-CD2 3.47Å; K232-Y234 HydrophobicContact CB-CE1 4.3Å; K232-Y234 HydrophobicContact CB-CE2 3.21Å; K232-Y234 HydrophobicContact CB-CG 4.12Å; K232-Y234 HydrophobicContact CG-CD2 4.11Å; K232-Y234 HydrophobicContact CG-CE2 3.57Å; K232-H267 VanDerWaalsContact C-CE1 3.47Å; K232-H267 VanDerWaalsContact C-NE2 3.31Å; K232-H267 PolarHBondContact O-CE1 2.87Å |
| 233 | G | 95 | Very high | 96 | Very high | 17 Ų | 17 | 35.6 Ų | 35.6 | 18% | 0.175 | 18% | 0.181 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 81.5 | 22.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | A229 C230 T235 H267 | A229-G233 PolarHBondContact O-N 3.39Å; C230-G233 PolarHBondContact O-N 3.48Å; G233-T235 VanDerWaalsContact C-N 3.28Å; G233-T235 PolarHBondContact O-N 3.41Å; G233-H267 WeakPolarHBondContact CA-ND1 3.31Å; G233-H267 PolarHBondContact N-CD2 3.17Å; G233-H267 PolarHBondContact N-NE2 3.4Å |
| 234 | Y | 97.3 | Very high | 96 | Very high | 81 Ų | 81 | 36 Ų | 36 | 32% | 0.318 | 19% | 0.189 | S | C | . | . | trans | -77.9 | 76.2 | -178.8 | -60 | -48.3 | 0 | 0 | 0 | 111.5 | A197 G200 A229 K232 D236 I237 V238 | A197-Y234 WeakPolarHBondContact O-CD2 3.4Å; A197-Y234 WeakPolarHBondContact O-CE2 3.46Å; G200-Y234 VanDerWaalsContact CA-CZ 3.42Å; A229-Y234 PolarHBondContact O-N 3.41Å; K232-Y234 HydrophobicContact CB-CD1 4.5Å; K232-Y234 HydrophobicContact CB-CD2 3.47Å; K232-Y234 VanDerWaalsContact CB-CD2 3.47Å; K232-Y234 HydrophobicContact CB-CE1 4.3Å; K232-Y234 HydrophobicContact CB-CE2 3.21Å; K232-Y234 HydrophobicContact CB-CG 4.12Å; K232-Y234 HydrophobicContact CG-CD2 4.11Å; K232-Y234 HydrophobicContact CG-CE2 3.57Å; Y234-D236 PolarHBondContact O-N 3.42Å; Y234-I237 HydrophobicContact CD2-CD1 4.4Å; Y234-I237 HydrophobicContact CG-CD1 4.36Å; Y234-I237 PolarHBondContact O-N 3.26Å; Y234-V238 WeakPolarHBondContact O-CG2 3.26Å; Y234-V238 PolarHBondContact O-N 3.11Å | ||
| 235 | T | 96.8 | Very high | 95.8 | Very high | 37 Ų | 37 | 38.4 Ų | 38.4 | 23% | 0.227 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -45.5 | -40.6 | -175.5 | 50.1 | 0 | 0 | 0 | 0 | 114.2 | G233 V238 K239 R269 | G233-T235 VanDerWaalsContact C-N 3.28Å; G233-T235 PolarHBondContact O-N 3.41Å; T235-V238 PolarHBondContact O-N 2.92Å; T235-K239 WeakPolarHBondContact O-CB 3.29Å; T235-K239 PolarHBondContact O-N 3.42Å; T235-R269 HydrophobicContact CG2-CB 3.79Å; T235-R269 HydrophobicContact CG2-CG 3.66Å |
| 236 | D | 97.1 | Very high | 95.8 | Very high | 90 Ų | 90 | 39.1 Ų | 39.1 | 48% | 0.481 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -78.2 | -34.2 | -171.4 | -52.2 | -13.1 | 0 | 0 | 0 | 110.6 | I202 Y234 M240 | I202-D236 HydrophobicContact CD1-CB 4.2Å; Y234-D236 PolarHBondContact O-N 3.42Å; D236-M240 WeakPolarHBondContact O-CG 3.33Å; D236-M240 PolarHBondContact O-N 2.99Å |
| 237 | I | 97.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -70.8 | -44.3 | 171.6 | -67.3 | 173.7 | 0 | 0 | 0 | 110.3 | A197 I202 V205 A229 Y234 K239 M240 L241 | A197-I237 HydrophobicContact CB-CG2 3.96Å; I202-I237 HydrophobicContact CG1-CD1 4.18Å; I202-I237 HydrophobicContact CG1-CG1 4.05Å; V205-I237 HydrophobicContact CB-CG1 4.4Å; V205-I237 HydrophobicContact CG1-CG2 4.23Å; V205-I237 HydrophobicContact CG2-CD1 3.99Å; V205-I237 HydrophobicContact CG2-CG1 4.12Å; V205-I237 HydrophobicContact CG2-CG2 4.14Å; A229-I237 HydrophobicContact CB-CB 4.28Å; A229-I237 HydrophobicContact CB-CG2 3.59Å; Y234-I237 HydrophobicContact CD2-CD1 4.4Å; Y234-I237 HydrophobicContact CG-CD1 4.36Å; Y234-I237 PolarHBondContact O-N 3.26Å; I237-K239 VanDerWaalsContact C-N 3.27Å; I237-K239 PolarHBondContact O-N 2.85Å; I237-M240 HydrophobicContact CB-CE 4.48Å; I237-M240 HydrophobicContact CG1-CE 3.97Å; I237-M240 PolarHBondContact O-N 3.36Å; I237-L241 HydrophobicContact CG2-CD1 3.86Å; I237-L241 HydrophobicContact CG2-CG 4.42Å; I237-L241 VanDerWaalsContact O-CG 3.31Å; I237-L241 WeakPolarHBondContact O-CG 3.18Å; I237-L241 PolarHBondContact O-N 2.95Å |
| 238 | V | 97.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -54.8 | -46.2 | 173.5 | 168.8 | 0 | 0 | 0 | 0 | 110.2 | L226 A229 C230 Y234 T235 L241 I242 I273 L274 | L226-V238 HydrophobicContact CD1-CB 4.37Å; L226-V238 HydrophobicContact CD1-CG1 3.98Å; L226-V238 HydrophobicContact CD1-CG2 4.39Å; A229-V238 HydrophobicContact CB-CG2 3.79Å; C230-V238 VanDerWaalsContact SG-CG2 3.58Å; Y234-V238 WeakPolarHBondContact O-CG2 3.26Å; Y234-V238 PolarHBondContact O-N 3.11Å; T235-V238 PolarHBondContact O-N 2.92Å; V238-L241 PolarHBondContact O-N 3.44Å; V238-I242 HydrophobicContact CG1-CD1 3.78Å; V238-I242 WeakPolarHBondContact O-CD1 3.21Å; V238-I242 VanDerWaalsContact O-CG1 3.28Å; V238-I242 WeakPolarHBondContact O-CG1 3.36Å; V238-I242 PolarHBondContact O-N 3.46Å; V238-I242 VanDerWaalsContact O-N 3.1Å; V238-I273 HydrophobicContact CG1-CG2 4.15Å; V238-L274 HydrophobicContact CG1-CD2 4.31Å |
| 239 | K | 97 | Very high | 95.4 | Very high | 106 Ų | 106 | 45.2 Ų | 45.2 | 46% | 0.461 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63.3 | -49.3 | 176.3 | -166.1 | -172.5 | 179 | -71.9 | 0 | 112.4 | T235 I237 L241 I242 D243 | T235-K239 WeakPolarHBondContact O-CB 3.29Å; T235-K239 PolarHBondContact O-N 3.42Å; I237-K239 VanDerWaalsContact C-N 3.27Å; I237-K239 PolarHBondContact O-N 2.85Å; K239-L241 VanDerWaalsContact C-N 3.27Å; K239-L241 PolarHBondContact O-N 3.35Å; K239-I242 PolarHBondContact O-N 3.27Å; K239-D243 VanDerWaalsContact NZ-CG 3.35Å; K239-D243 IonicContact NZ-OD1 2.89Å; K239-D243 PolarHBondContact NZ-OD1 3.22Å; K239-D243 IonicContact NZ-OD2 2.69Å; K239-D243 PolarHBondContact NZ-OD2 3.28Å; K239-D243 WeakPolarHBondContact O-CB 3.3Å; K239-D243 VanDerWaalsContact O-CG 3.28Å; K239-D243 PolarHBondContact O-N 2.93Å |
| 240 | M | 96.7 | Very high | 95.1 | Very high | 38 Ų | 38 | 46.7 Ų | 46.7 | 19% | 0.187 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.5 | -38.3 | 179.8 | -75.2 | -174.4 | -63.5 | 0 | 0 | 112.8 | I202 V205 E206 L209 D236 I237 C244 | I202-M240 HydrophobicContact CG2-CE 3.77Å; V205-M240 HydrophobicContact CB-CE 4Å; V205-M240 HydrophobicContact CG1-CE 3.72Å; E206-M240 HydrophobicContact CB-SD 3.93Å; L209-M240 HydrophobicContact CD1-CB 4.23Å; D236-M240 WeakPolarHBondContact O-CG 3.33Å; D236-M240 PolarHBondContact O-N 2.99Å; I237-M240 HydrophobicContact CB-CE 4.48Å; I237-M240 HydrophobicContact CG1-CE 3.97Å; I237-M240 PolarHBondContact O-N 3.36Å; M240-C244 PolarHBondContact O-N 2.72Å; M240-C244 PolarHBondContact O-SG 3.36Å; M240-C244 VanDerWaalsContact O-SG 3.35Å |
| 241 | L | 96.3 | Very high | 94.9 | Very high | 1 Ų | 1 | 50.4 Ų | 50.4 | 1% | 0.005 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -69.5 | -41 | 177.4 | -67.5 | 168.8 | 0 | 0 | 0 | 111.9 | L193 L209 P215 A225 L226 A229 I237 V238 K239 C244 V246 | L193-L241 HydrophobicContact CD2-CD2 4.31Å; L209-L241 HydrophobicContact CD1-CD2 4.38Å; L209-L241 HydrophobicContact CD2-CD2 4.41Å; P215-L241 HydrophobicContact CB-CD2 3.79Å; A225-L241 HydrophobicContact CB-CD1 3.88Å; A225-L241 HydrophobicContact CB-CD2 4.05Å; A225-L241 WeakPolarHBondContact O-CD1 3.34Å; L226-L241 HydrophobicContact CB-CD1 4.38Å; L226-L241 HydrophobicContact CD1-CB 4.33Å; A229-L241 HydrophobicContact CB-CD1 4.43Å; I237-L241 HydrophobicContact CG2-CD1 3.86Å; I237-L241 HydrophobicContact CG2-CG 4.42Å; I237-L241 VanDerWaalsContact O-CG 3.31Å; I237-L241 WeakPolarHBondContact O-CG 3.18Å; I237-L241 PolarHBondContact O-N 2.95Å; V238-L241 PolarHBondContact O-N 3.44Å; K239-L241 VanDerWaalsContact C-N 3.27Å; K239-L241 PolarHBondContact O-N 3.35Å; L241-C244 WeakPolarHBondContact O-CB 3.42Å; L241-C244 PolarHBondContact O-N 3.33Å; L241-C244 VanDerWaalsContact O-N 3.13Å; L241-V246 HydrophobicContact CB-CG2 4.38Å; L241-V246 WeakPolarHBondContact O-CG2 3.33Å |
| 242 | I | 95.9 | Very high | 94.7 | Very high | 29 Ų | 29 | 49.3 Ų | 49.3 | 15% | 0.149 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66 | -39.8 | 174.7 | -68.6 | 165.6 | 0 | 0 | 0 | 111.4 | L226 V238 K239 C244 G245 I273 L274 | L226-I242 HydrophobicContact CD1-CD1 4.36Å; L226-I242 HydrophobicContact CD1-CG1 4.14Å; V238-I242 HydrophobicContact CG1-CD1 3.78Å; V238-I242 WeakPolarHBondContact O-CD1 3.21Å; V238-I242 VanDerWaalsContact O-CG1 3.28Å; V238-I242 WeakPolarHBondContact O-CG1 3.36Å; V238-I242 PolarHBondContact O-N 3.46Å; V238-I242 VanDerWaalsContact O-N 3.1Å; K239-I242 PolarHBondContact O-N 3.27Å; I242-C244 PolarHBondContact O-N 3.02Å; I242-C244 VanDerWaalsContact O-N 3.15Å; I242-G245 PolarHBondContact O-N 2.88Å; I242-I273 HydrophobicContact CD1-CG2 3.76Å; I242-L274 HydrophobicContact CD1-CD2 4.09Å |
| 243 | D | 95.3 | Very high | 94.5 | Very high | 106 Ų | 106 | 52.7 Ų | 52.7 | 57% | 0.567 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -61.6 | -19.4 | 173.7 | -69.3 | -31.8 | 0 | 0 | 0 | 111.9 | K239 | K239-D243 VanDerWaalsContact NZ-CG 3.35Å; K239-D243 IonicContact NZ-OD1 2.89Å; K239-D243 PolarHBondContact NZ-OD1 3.22Å; K239-D243 IonicContact NZ-OD2 2.69Å; K239-D243 PolarHBondContact NZ-OD2 3.28Å; K239-D243 WeakPolarHBondContact O-CB 3.3Å; K239-D243 VanDerWaalsContact O-CG 3.28Å; K239-D243 PolarHBondContact O-N 2.93Å |
| 244 | C | 93.9 | Very high | 94 | Very high | 65 Ų | 65 | 57.5 Ų | 57.5 | 44% | 0.439 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.3 | -2.4 | 171.1 | -67 | 0 | 0 | 0 | 0 | 114.8 | P215 M240 L241 I242 | P215-C244 HydrophobicContact CG-CB 4.06Å; M240-C244 PolarHBondContact O-N 2.72Å; M240-C244 PolarHBondContact O-SG 3.36Å; M240-C244 VanDerWaalsContact O-SG 3.35Å; L241-C244 WeakPolarHBondContact O-CB 3.42Å; L241-C244 PolarHBondContact O-N 3.33Å; L241-C244 VanDerWaalsContact O-N 3.13Å; I242-C244 PolarHBondContact O-N 3.02Å; I242-C244 VanDerWaalsContact O-N 3.15Å |
| 245 | G | 91.3 | Very high | 93.4 | Very high | 59 Ų | 59 | 53.8 Ų | 53.8 | 61% | 0.608 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.9 | 29.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 116 | I242 | I242-G245 PolarHBondContact O-N 2.88Š|
| 246 | V | 94.1 | Very high | 92.9 | Very high | 15 Ų | 15 | 52.2 Ų | 52.2 | 9% | 0.091 | 27% | 0.274 | C | S | . | . | trans | -64.5 | 156.8 | 171.1 | -61.9 | 0 | 0 | 0 | 0 | 112.4 | P215 L226 L241 V248 | P215-V246 HydrophobicContact CB-CG1 3.55Å; P215-V246 HydrophobicContact CG-CG1 3.71Å; L226-V246 HydrophobicContact CB-CG2 4.38Å; L226-V246 HydrophobicContact CD2-CG2 3.82Å; L241-V246 HydrophobicContact CB-CG2 4.38Å; L241-V246 WeakPolarHBondContact O-CG2 3.33Å; V246-V248 PolarHBondContact O-N 3.43Å | ||
| 247 | D | 93.2 | Very high | 92.7 | Very high | 93 Ų | 93 | 48 Ų | 48 | 50% | 0.497 | 25% | 0.252 | S | S | . | . | trans | -69.4 | 121.5 | 168.3 | -163.7 | -19.8 | 0 | 0 | 0 | 110.7 | N249 E250 | D247-N249 VanDerWaalsContact C-N 3.29Å; D247-N249 PolarHBondContact OD1-N 3.06Å; D247-E250 HydrophobicContact CB-CB 4.36Å | ||
| 248 | V | 94.5 | Very high | 92.5 | Very high | 16 Ų | 16 | 48 Ų | 48 | 10% | 0.097 | 25% | 0.252 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | -17.7 | -179.5 | -159.7 | 0 | 0 | 0 | 0 | 111.6 | L226 V246 P258 L274 A279 | L226-V248 HydrophobicContact CD2-CG1 4.34Å; V246-V248 PolarHBondContact O-N 3.43Å; V248-P258 WeakPolarHBondContact O-CG 3.28Å; V248-L274 HydrophobicContact CG1-CB 4.35Å; V248-L274 HydrophobicContact CG1-CD2 3.46Å; V248-L274 VanDerWaalsContact CG1-CD2 3.46Å; V248-A279 HydrophobicContact CG1-CB 3.82Å |
| 249 | N | 91.8 | Very high | 92.5 | Very high | 49 Ų | 49 | 48.1 Ų | 48.1 | 26% | 0.262 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.1 | 15.2 | -176.8 | -60.5 | -65.5 | 0 | 0 | 0 | 112.9 | D247 Y251 G278 A279 D280 | D247-N249 VanDerWaalsContact C-N 3.29Å; D247-N249 PolarHBondContact OD1-N 3.06Å; N249-Y251 PolarHBondContact O-N 2.83Å; N249-G278 PolarHBondContact ND2-O 2.9Å; N249-A279 WeakPolarHBondContact OD1-CA 3.35Å; N249-D280 PolarHBondContact OD1-N 3.2Å |
| 250 | E | 90.9 | Very high | 92.4 | Very high | 30 Ų | 30 | 43.4 Ų | 43.4 | 14% | 0.14 | 23% | 0.232 | C | C | . | . | trans | -58.8 | 121.7 | 178.4 | 176.8 | 58.7 | -170.3 | 0 | 0 | 111.5 | L218 R222 D247 P258 | L218-E250 WeakPolarHBondContact CD1-OE1 3Å; L218-E250 HydrophobicContact CD2-CG 3.88Å; R222-E250 IonicContact CZ-OE1 2.88Å; R222-E250 IonicContact CZ-OE2 2.65Å; R222-E250 IonicContact NE-OE1 3.08Å; R222-E250 PolarHBondContact NE-OE1 3.4Å; R222-E250 IonicContact NH2-OE1 3.65Å; R222-E250 PolarHBondContact NH2-OE1 3.04Å; R222-E250 IonicContact NH2-OE2 3.19Å; R222-E250 PolarHBondContact NH2-OE2 3.34Å; D247-E250 HydrophobicContact CB-CB 4.36Å; E250-P258 VanDerWaalsContact O-CD 3.3Å; E250-P258 WeakPolarHBondContact O-CD 3.25Å | ||
| 251 | Y | 90.3 | Very high | 92.3 | Very high | 79 Ų | 79 | 44.5 Ų | 44.5 | 31% | 0.31 | 24% | 0.235 | S | C | . | . | trans | -96.9 | 124.3 | -176.9 | -99.1 | -84.8 | 0 | 0 | 0 | 111.8 | R222 N249 G256 V283 E284 | R222-Y251 PolarHBondContact NE-O 3.49Å; R222-Y251 PolarHBondContact NH1-O 2.86Å; N249-Y251 PolarHBondContact O-N 2.83Å; Y251-G256 WeakPolarHBondContact CA-O 3.46Å; Y251-V283 HydrophobicContact CE1-CG1 4.26Å; Y251-V283 HydrophobicContact CE2-CG1 4.1Å; Y251-V283 HydrophobicContact CE2-CG2 3.92Å; Y251-V283 WeakPolarHBondContact OH-CG1 3.48Å; Y251-E284 WeakPolarHBondContact CE1-O 3.37Å; Y251-E284 PolarHBondContact OH-N 3.2Å; Y251-E284 PolarHBondContact OH-O 3.3Å | ||
| 252 | D | 91.7 | Very high | 92.2 | Very high | 10 Ų | 10 | 44.5 Ų | 44.5 | 5% | 0.053 | 23% | 0.234 | C | C | . | . | trans | -86.9 | 176.7 | 174.6 | 66.7 | 40.6 | 0 | 0 | 0 | 113.6 | G221 R222 N254 G255 G256 Y261 | G221-D252 WeakPolarHBondContact O-CB 3.34Å; R222-D252 HydrophobicContact CB-CB 4.2Å; D252-N254 PolarHBondContact O-N 3.39Å; D252-N254 WeakPolarHBondContact OD1-CA 3.47Å; D252-N254 WeakPolarHBondContact OD1-CB 3.32Å; D252-N254 PolarHBondContact OD1-N 3.49Å; D252-G255 PolarHBondContact OD1-N 3.12Å; D252-G256 PolarHBondContact N-O 2.89Å; D252-G256 WeakPolarHBondContact OD1-CA 3.45Å; D252-G256 PolarHBondContact OD1-N 3.03Å; D252-Y261 WeakPolarHBondContact OD2-CE2 3.48Å; D252-Y261 PolarHBondContact OD2-OH 2.95Å; D252-Y261 VanDerWaalsContact OD2-OH 3.04Å | ||
| 253 | W | 90.4 | Very high | 92.2 | Very high | 185 Ų | 185 | 43.1 Ų | 43.1 | 70% | 0.701 | 23% | 0.227 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | 6.6 | 178.6 | -68.2 | -9.9 | 0 | 0 | 0 | 114.4 | K220 G221 | K220-W253 VanDerWaalsContact O-CE3 3.23Å; K220-W253 WeakPolarHBondContact O-CZ3 3.38Å; G221-W253 WeakPolarHBondContact O-CB 3.37Å; G221-W253 PolarHBondContact O-N 3.2Å |
| 254 | N | 85.2 | Confident | 92.2 | Very high | 119 Ų | 119 | 43.3 Ų | 43.3 | 64% | 0.636 | 23% | 0.225 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -103.3 | 8.6 | 174.7 | -69.6 | 48.1 | 0 | 0 | 0 | 111.7 | D252 G256 | D252-N254 PolarHBondContact O-N 3.39Å; D252-N254 WeakPolarHBondContact OD1-CA 3.47Å; D252-N254 WeakPolarHBondContact OD1-CB 3.32Å; D252-N254 PolarHBondContact OD1-N 3.49Å; N254-G256 PolarHBondContact O-N 2.81Å |
| 255 | G | 83.8 | Confident | 92.1 | Very high | 2 Ų | 2 | 41.7 Ų | 41.7 | 2% | 0.021 | 22% | 0.219 | C | C | . | . | S | Bend | trans | 69.9 | 22.3 | -171.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | D252 S285 D286 | D252-G255 PolarHBondContact OD1-N 3.12Å; G255-S285 VanDerWaalsContact O-CA 3.29Å; G255-S285 WeakPolarHBondContact O-CA 3.45Å; G255-S285 WeakPolarHBondContact O-CB 3.31Å; G255-D286 VanDerWaalsContact CA-CG 3.43Å; G255-D286 WeakPolarHBondContact CA-OD1 3.48Å |
| 256 | G | 86.7 | Confident | 92.3 | Very high | 5 Ų | 5 | 42.2 Ų | 42.2 | 5% | 0.052 | 21% | 0.208 | C | C | . | . | trans | -97.7 | 151.6 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y251 D252 N254 | Y251-G256 WeakPolarHBondContact CA-O 3.46Å; D252-G256 PolarHBondContact N-O 2.89Å; D252-G256 WeakPolarHBondContact OD1-CA 3.45Å; D252-G256 PolarHBondContact OD1-N 3.03Å; N254-G256 PolarHBondContact O-N 2.81Å | ||
| 257 | A | 92.5 | Very high | 92.5 | Very high | 1 Ų | 1 | 43.8 Ų | 43.8 | 1% | 0.008 | 21% | 0.214 | C | C | . | . | trans | -141.2 | 154.9 | 170 | 0 | 0 | 0 | 0 | 0 | 108.4 | L259 L260 Y261 V283 | A257-L259 PolarHBondContact O-N 3.2Å; A257-L259 VanDerWaalsContact O-N 3.09Å; A257-L260 HydrophobicContact CB-CD1 4.14Å; A257-L260 HydrophobicContact CB-CG 4.38Å; A257-L260 WeakPolarHBondContact O-CB 3.42Å; A257-L260 PolarHBondContact O-N 3.49Å; A257-Y261 VanDerWaalsContact O-CD2 3.26Å; A257-Y261 WeakPolarHBondContact O-CD2 3.45Å; A257-Y261 PolarHBondContact O-N 3.25Å; A257-Y261 VanDerWaalsContact O-N 3.09Å; A257-V283 HydrophobicContact CB-CG1 3.78Å | ||
| 258 | P | 95.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -48.8 | -40.8 | -177.3 | -32.2 | 36.8 | 0 | 0 | 0 | 114.7 | L226 C230 V248 E250 Y261 A262 L274 | L226-P258 HydrophobicContact CD2-CB 3.97Å; L226-P258 HydrophobicContact CD2-CG 3.79Å; L226-P258 HydrophobicContact CG-CB 4.02Å; L226-P258 HydrophobicContact CG-CG 4.01Å; C230-P258 HydrophobicContact CB-CB 4.42Å; C230-P258 WeakPolarHBondContact CB-O 3.38Å; V248-P258 WeakPolarHBondContact O-CG 3.28Å; E250-P258 VanDerWaalsContact O-CD 3.3Å; E250-P258 WeakPolarHBondContact O-CD 3.25Å; P258-Y261 PolarHBondContact O-N 3.43Å; P258-A262 PolarHBondContact O-N 2.9Å; P258-L274 HydrophobicContact CB-CD1 4.43Å; P258-L274 HydrophobicContact CB-CD2 4.05Å |
| 259 | L | 95.5 | Very high | 92.7 | Very high | 3 Ų | 3 | 46.4 Ų | 46.4 | 2% | 0.016 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.8 | -44.2 | 177 | -174.3 | 63.2 | 0 | 0 | 0 | 112.7 | A257 Y261 A262 V263 V271 L274 L275 A279 D280 P281 A291 | A257-L259 PolarHBondContact O-N 3.2Å; A257-L259 VanDerWaalsContact O-N 3.09Å; L259-Y261 VanDerWaalsContact C-N 3.31Å; L259-Y261 PolarHBondContact O-N 3.19Å; L259-A262 PolarHBondContact O-N 3.38Å; L259-V263 VanDerWaalsContact O-CG2 3.25Å; L259-V263 WeakPolarHBondContact O-CG2 3.32Å; L259-V263 PolarHBondContact O-N 3.02Å; L259-V271 HydrophobicContact CD1-CB 4.47Å; L259-V271 HydrophobicContact CD1-CG1 4Å; L259-V271 HydrophobicContact CD1-CG2 4.44Å; L259-L274 HydrophobicContact CB-CD1 4.49Å; L259-L274 HydrophobicContact CD1-CB 4.19Å; L259-L274 HydrophobicContact CD1-CD1 4.31Å; L259-L275 HydrophobicContact CD1-CD2 4.16Å; L259-L275 HydrophobicContact CD1-CG 4.08Å; L259-L275 HydrophobicContact CD2-CD2 3.88Å; L259-A279 HydrophobicContact CB-CB 4.29Å; L259-A279 HydrophobicContact CD2-CB 4.16Å; L259-D280 WeakPolarHBondContact CD2-O 3.47Å; L259-P281 HydrophobicContact CD2-CB 4.31Å; L259-A291 HydrophobicContact CD2-CB 4.05Å; L259-A291 HydrophobicContact CG-CB 4.14Å |
| 260 | L | 94.5 | Very high | 92.9 | Very high | 6 Ų | 6 | 44.1 Ų | 44.1 | 3% | 0.031 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60.6 | -40.9 | 176.6 | -65.2 | 171.1 | 0 | 0 | 0 | 111.1 | A257 V263 H264 V283 A291 M294 | A257-L260 HydrophobicContact CB-CD1 4.14Å; A257-L260 HydrophobicContact CB-CG 4.38Å; A257-L260 WeakPolarHBondContact O-CB 3.42Å; A257-L260 PolarHBondContact O-N 3.49Å; L260-V263 PolarHBondContact O-N 2.98Å; L260-H264 VanDerWaalsContact O-CB 3.32Å; L260-H264 WeakPolarHBondContact O-CB 3.48Å; L260-H264 PolarHBondContact O-N 3.04Å; L260-V283 HydrophobicContact CD1-CG1 3.88Å; L260-V283 HydrophobicContact CG-CG1 4.17Å; L260-A291 HydrophobicContact CD2-CB 4Å; L260-M294 HydrophobicContact CD2-CE 4.23Å |
| 261 | Y | 94.8 | Very high | 93.1 | Very high | 62 Ų | 62 | 42.7 Ų | 42.7 | 24% | 0.243 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -67 | -40.4 | 175.5 | -74.1 | -64.7 | 0 | 0 | 0 | 113.6 | D252 A257 P258 L259 H264 G265 | D252-Y261 WeakPolarHBondContact OD2-CE2 3.48Å; D252-Y261 PolarHBondContact OD2-OH 2.95Å; D252-Y261 VanDerWaalsContact OD2-OH 3.04Å; A257-Y261 VanDerWaalsContact O-CD2 3.26Å; A257-Y261 WeakPolarHBondContact O-CD2 3.45Å; A257-Y261 PolarHBondContact O-N 3.25Å; A257-Y261 VanDerWaalsContact O-N 3.09Å; P258-Y261 PolarHBondContact O-N 3.43Å; L259-Y261 VanDerWaalsContact C-N 3.31Å; L259-Y261 PolarHBondContact O-N 3.19Å; Y261-H264 PolarHBondContact O-N 2.97Å; Y261-G265 PolarHBondContact O-N 2.93Å |
| 262 | A | 95.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.6 | -41.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | C230 P258 L259 N266 H267 C270 V271 L274 | C230-A262 HydrophobicContact CB-CB 4.35Å; P258-A262 PolarHBondContact O-N 2.9Å; L259-A262 PolarHBondContact O-N 3.38Å; A262-N266 PolarHBondContact O-N 3.31Å; A262-H267 HydrophobicContact CB-CB 4.5Å; A262-H267 WeakPolarHBondContact O-CB 3.22Å; A262-H267 PolarHBondContact O-N 2.98Å; A262-C270 HydrophobicContact CB-CB 3.89Å; A262-V271 HydrophobicContact CB-CG2 3.69Å; A262-L274 HydrophobicContact CB-CD1 3.67Å |
| 263 | V | 95.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -63.3 | -48.4 | 174.1 | 168.9 | 0 | 0 | 0 | 0 | 111.4 | L259 L260 G265 N266 V271 A291 M294 A295 H300 V303 M307 | L259-V263 VanDerWaalsContact O-CG2 3.25Å; L259-V263 WeakPolarHBondContact O-CG2 3.32Å; L259-V263 PolarHBondContact O-N 3.02Å; L260-V263 PolarHBondContact O-N 2.98Å; V263-G265 VanDerWaalsContact C-N 3.29Å; V263-G265 PolarHBondContact O-N 2.97Å; V263-N266 PolarHBondContact O-N 2.89Å; V263-V271 HydrophobicContact CG2-CG2 3.98Å; V263-A291 WeakPolarHBondContact CG1-O 3.38Å; V263-A291 HydrophobicContact CG2-CB 4.08Å; V263-M294 HydrophobicContact CG1-CB 4.04Å; V263-M294 HydrophobicContact CG1-CG 4.14Å; V263-M294 HydrophobicContact CG1-SD 4.41Å; V263-A295 HydrophobicContact CG1-CB 3.85Å; V263-H300 PolarHBondContact O-CE1 3.37Å; V263-H300 PolarHBondContact O-ND1 3.45Å; V263-V303 HydrophobicContact CB-CG1 4.4Å; V263-V303 HydrophobicContact CG1-CG1 4.27Å; V263-V303 HydrophobicContact CG2-CG1 3.84Å; V263-M307 HydrophobicContact CG2-SD 4.21Å |
| 264 | H | 93.8 | Very high | 93.8 | Very high | 110 Ų | 110 | 33.4 Ų | 33.4 | 51% | 0.509 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -59.7 | -39.1 | -178.7 | -173 | 82.6 | 0 | 0 | 0 | 112.1 | L260 Y261 N266 M294 M298 H300 | L260-H264 VanDerWaalsContact O-CB 3.32Å; L260-H264 WeakPolarHBondContact O-CB 3.48Å; L260-H264 PolarHBondContact O-N 3.04Å; Y261-H264 PolarHBondContact O-N 2.97Å; H264-N266 VanDerWaalsContact C-N 3.27Å; H264-N266 PolarHBondContact O-N 3.38Å; H264-M294 HydrophobicContact CB-SD 3.86Å; H264-M298 WeakPolarHBondContact O-CE 3.23Å; H264-H300 PolarHBondContact O-CE1 3.36Å |
| 265 | G | 93.4 | Very high | 94.3 | Very high | 31 Ų | 31 | 28 Ų | 28 | 32% | 0.32 | 14% | 0.138 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.9 | -0.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y261 V263 H267 | Y261-G265 PolarHBondContact O-N 2.93Å; V263-G265 VanDerWaalsContact C-N 3.29Å; V263-G265 PolarHBondContact O-N 2.97Å; G265-H267 PolarHBondContact O-CE1 2.99Å; G265-H267 PolarHBondContact O-N 3.41Å |
| 266 | N | 95.8 | Very high | 94.7 | Very high | 71 Ų | 71 | 33 Ų | 33 | 38% | 0.38 | 17% | 0.165 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 58.7 | 29.6 | -171.4 | -164.8 | 28.7 | 0 | 0 | 0 | 113.4 | A262 V263 H264 V268 H300 | A262-N266 PolarHBondContact O-N 3.31Å; V263-N266 PolarHBondContact O-N 2.89Å; H264-N266 VanDerWaalsContact C-N 3.27Å; H264-N266 PolarHBondContact O-N 3.38Å; N266-V268 VanDerWaalsContact C-N 3.27Å; N266-V268 PolarHBondContact O-N 3.4Å; N266-H300 WeakPolarHBondContact OD1-CB 3.46Å |
| 267 | H | 96.7 | Very high | 95 | Very high | 47 Ų | 47 | 35.1 Ų | 35.1 | 22% | 0.218 | 18% | 0.179 | C | C | . | . | trans | -83.2 | 66.9 | -173.6 | -60.2 | -53.8 | 0 | 0 | 0 | 111.3 | C230 S231 K232 G233 A262 G265 R269 C270 V271 | C230-H267 PolarHBondContact O-CD2 3.44Å; S231-H267 PolarHBondContact O-NE2 3.09Å; K232-H267 VanDerWaalsContact C-CE1 3.47Å; K232-H267 VanDerWaalsContact C-NE2 3.31Å; K232-H267 PolarHBondContact O-CE1 2.87Å; G233-H267 WeakPolarHBondContact CA-ND1 3.31Å; G233-H267 PolarHBondContact N-CD2 3.17Å; G233-H267 PolarHBondContact N-NE2 3.4Å; A262-H267 HydrophobicContact CB-CB 4.5Å; A262-H267 WeakPolarHBondContact O-CB 3.22Å; A262-H267 PolarHBondContact O-N 2.98Å; G265-H267 PolarHBondContact O-CE1 2.99Å; G265-H267 PolarHBondContact O-N 3.41Å; H267-R269 PolarHBondContact O-N 3.41Å; H267-C270 HydrophobicContact CB-CB 3.98Å; H267-C270 WeakPolarHBondContact O-CA 3.31Å; H267-C270 WeakPolarHBondContact O-CB 3.38Å; H267-C270 PolarHBondContact O-N 2.82Å; H267-V271 PolarHBondContact O-N 2.86Å | ||
| 268 | V | 95.9 | Very high | 94.9 | Very high | 32 Ų | 32 | 37.6 Ų | 37.6 | 19% | 0.194 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -43.9 | -46.8 | -174.3 | -173 | 0 | 0 | 0 | 0 | 112.7 | N266 C270 V271 E272 N302 V303 V306 | N266-V268 VanDerWaalsContact C-N 3.27Å; N266-V268 PolarHBondContact O-N 3.4Å; V268-C270 PolarHBondContact O-N 3.02Å; V268-V271 WeakPolarHBondContact O-CB 3.49Å; V268-V271 PolarHBondContact O-N 3.48Å; V268-E272 WeakPolarHBondContact O-CG 3.34Å; V268-E272 PolarHBondContact O-N 3.2Å; V268-N302 HydrophobicContact CG1-CB 4.37Å; V268-N302 HydrophobicContact CG2-CB 3.64Å; V268-V303 HydrophobicContact CG2-CG2 3.94Å; V268-V306 HydrophobicContact CG1-CG2 3.78Å |
| 269 | R | 96.4 | Very high | 94.8 | Very high | 133 Ų | 133 | 37.7 Ų | 37.7 | 50% | 0.502 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -71.9 | -28.2 | -178 | -173.9 | 56.4 | -173.2 | 155.1 | 11.5 | 113.7 | T235 H267 E272 I273 | T235-R269 HydrophobicContact CG2-CB 3.79Å; T235-R269 HydrophobicContact CG2-CG 3.66Å; H267-R269 PolarHBondContact O-N 3.41Å; R269-E272 WeakPolarHBondContact CD-OE2 3.46Å; R269-E272 IonicContact CZ-OE2 3.6Å; R269-E272 IonicContact NE-OE2 3.72Å; R269-E272 IonicContact NH1-OE2 2.71Å; R269-E272 PolarHBondContact NH1-OE2 3.19Å; R269-I273 HydrophobicContact CG-CD1 4.24Å; R269-I273 WeakPolarHBondContact O-CD1 3.45Å; R269-I273 VanDerWaalsContact O-CG1 3.24Å; R269-I273 WeakPolarHBondContact O-CG1 3.48Å; R269-I273 PolarHBondContact O-N 3.45Å |
| 270 | C | 96.2 | Very high | 94.6 | Very high | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.007 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -70.4 | -41.5 | 168.9 | -66.3 | 0 | 0 | 0 | 0 | 110.7 | A262 H267 V268 E272 I273 L274 | A262-C270 HydrophobicContact CB-CB 3.89Å; H267-C270 HydrophobicContact CB-CB 3.98Å; H267-C270 WeakPolarHBondContact O-CA 3.31Å; H267-C270 WeakPolarHBondContact O-CB 3.38Å; H267-C270 PolarHBondContact O-N 2.82Å; V268-C270 PolarHBondContact O-N 3.02Å; C270-E272 VanDerWaalsContact C-N 3.35Å; C270-E272 PolarHBondContact O-N 3.31Å; C270-I273 PolarHBondContact O-N 3.44Å; C270-L274 WeakPolarHBondContact O-CB 3.39Å; C270-L274 WeakPolarHBondContact O-CD1 3.39Å; C270-L274 WeakPolarHBondContact O-CG 3.49Å; C270-L274 PolarHBondContact O-N 3.44Å |
| 271 | V | 96.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.5 | -45.6 | 175.2 | 174.8 | 0 | 0 | 0 | 0 | 111.1 | L259 A262 V263 H267 V268 L274 L275 V303 V306 M307 | L259-V271 HydrophobicContact CD1-CB 4.47Å; L259-V271 HydrophobicContact CD1-CG1 4Å; L259-V271 HydrophobicContact CD1-CG2 4.44Å; A262-V271 HydrophobicContact CB-CG2 3.69Å; V263-V271 HydrophobicContact CG2-CG2 3.98Å; H267-V271 PolarHBondContact O-N 2.86Å; V268-V271 WeakPolarHBondContact O-CB 3.49Å; V268-V271 PolarHBondContact O-N 3.48Å; V271-L274 PolarHBondContact O-N 3.29Å; V271-L275 HydrophobicContact CG1-CD1 3.64Å; V271-L275 HydrophobicContact CG1-CG 4.28Å; V271-L275 WeakPolarHBondContact O-CB 3.42Å; V271-L275 VanDerWaalsContact O-CG 3.25Å; V271-L275 WeakPolarHBondContact O-CG 3.49Å; V271-L275 PolarHBondContact O-N 3.28Å; V271-V303 HydrophobicContact CG1-CG1 4.27Å; V271-V303 HydrophobicContact CG2-CG1 4.18Å; V271-V306 HydrophobicContact CG1-CG1 4.06Å; V271-M307 HydrophobicContact CG1-CG 4.2Å |
| 272 | E | 95.3 | Very high | 93.9 | Very high | 58 Ų | 58 | 42.4 Ų | 42.4 | 27% | 0.271 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -55.6 | -51.8 | 173.3 | -71.4 | 174.2 | 175.1 | 0 | 0 | 112 | V268 R269 C270 L274 L275 D276 V306 | V268-E272 WeakPolarHBondContact O-CG 3.34Å; V268-E272 PolarHBondContact O-N 3.2Å; R269-E272 WeakPolarHBondContact CD-OE2 3.46Å; R269-E272 IonicContact CZ-OE2 3.6Å; R269-E272 IonicContact NE-OE2 3.72Å; R269-E272 IonicContact NH1-OE2 2.71Å; R269-E272 PolarHBondContact NH1-OE2 3.19Å; C270-E272 VanDerWaalsContact C-N 3.35Å; C270-E272 PolarHBondContact O-N 3.31Å; E272-L274 PolarHBondContact O-N 3.48Å; E272-L275 PolarHBondContact O-N 3.1Å; E272-D276 WeakPolarHBondContact O-CB 3.37Å; E272-D276 PolarHBondContact O-N 2.96Å; E272-V306 HydrophobicContact CB-CG1 4.45Å; E272-V306 HydrophobicContact CG-CB 4.38Å; E272-V306 HydrophobicContact CG-CG1 3.6Å; E272-V306 HydrophobicContact CG-CG2 3.8Å |
| 273 | I | 95.9 | Very high | 93.5 | Very high | 21 Ų | 21 | 43.1 Ų | 43.1 | 11% | 0.108 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.8 | -43.5 | -178 | -69 | 165.6 | 0 | 0 | 0 | 111.5 | V238 I242 R269 C270 S277 | V238-I273 HydrophobicContact CG1-CG2 4.15Å; I242-I273 HydrophobicContact CD1-CG2 3.76Å; R269-I273 HydrophobicContact CG-CD1 4.24Å; R269-I273 WeakPolarHBondContact O-CD1 3.45Å; R269-I273 VanDerWaalsContact O-CG1 3.24Å; R269-I273 WeakPolarHBondContact O-CG1 3.48Å; R269-I273 PolarHBondContact O-N 3.45Å; C270-I273 PolarHBondContact O-N 3.44Å; I273-S277 VanDerWaalsContact O-CB 3.3Å; I273-S277 WeakPolarHBondContact O-CB 3.29Å; I273-S277 PolarHBondContact O-N 2.82Å; I273-S277 VanDerWaalsContact O-N 3.09Å; I273-S277 PolarHBondContact O-OG 3.48Å |
| 274 | L | 95.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.3 | -47.1 | -180 | -69.6 | 166.2 | 0 | 0 | 0 | 111.4 | L226 V238 I242 V248 P258 L259 A262 C270 V271 E272 S277 G278 A279 | L226-L274 HydrophobicContact CD1-CD2 4.42Å; L226-L274 HydrophobicContact CD2-CD2 4.33Å; V238-L274 HydrophobicContact CG1-CD2 4.31Å; I242-L274 HydrophobicContact CD1-CD2 4.09Å; V248-L274 HydrophobicContact CG1-CB 4.35Å; V248-L274 HydrophobicContact CG1-CD2 3.46Å; V248-L274 VanDerWaalsContact CG1-CD2 3.46Å; P258-L274 HydrophobicContact CB-CD1 4.43Å; P258-L274 HydrophobicContact CB-CD2 4.05Å; L259-L274 HydrophobicContact CB-CD1 4.49Å; L259-L274 HydrophobicContact CD1-CB 4.19Å; L259-L274 HydrophobicContact CD1-CD1 4.31Å; A262-L274 HydrophobicContact CB-CD1 3.67Å; C270-L274 WeakPolarHBondContact O-CB 3.39Å; C270-L274 WeakPolarHBondContact O-CD1 3.39Å; C270-L274 WeakPolarHBondContact O-CG 3.49Å; C270-L274 PolarHBondContact O-N 3.44Å; V271-L274 PolarHBondContact O-N 3.29Å; E272-L274 PolarHBondContact O-N 3.48Å; L274-S277 CarbonylContact O-C 3.43Å; L274-S277 WeakPolarHBondContact O-CA 3.47Å; L274-S277 PolarHBondContact O-N 2.84Å; L274-S277 VanDerWaalsContact O-N 3.1Å; L274-G278 PolarHBondContact O-N 2.88Å; L274-A279 HydrophobicContact CB-CB 3.88Å; L274-A279 WeakPolarHBondContact O-CB 3.45Å; L274-A279 PolarHBondContact O-N 3.35Å |
| 275 | L | 94.2 | Very high | 92.8 | Very high | 4 Ų | 4 | 43.7 Ų | 43.7 | 2% | 0.021 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.3 | -44.8 | 178.6 | -69.5 | 171.5 | 0 | 0 | 0 | 111.9 | L259 V271 E272 S277 G278 P281 V306 M307 H310 | L259-L275 HydrophobicContact CD1-CD2 4.16Å; L259-L275 HydrophobicContact CD1-CG 4.08Å; L259-L275 HydrophobicContact CD2-CD2 3.88Å; V271-L275 HydrophobicContact CG1-CD1 3.64Å; V271-L275 HydrophobicContact CG1-CG 4.28Å; V271-L275 WeakPolarHBondContact O-CB 3.42Å; V271-L275 VanDerWaalsContact O-CG 3.25Å; V271-L275 WeakPolarHBondContact O-CG 3.49Å; V271-L275 PolarHBondContact O-N 3.28Å; E272-L275 PolarHBondContact O-N 3.1Å; L275-S277 PolarHBondContact O-N 3.41Å; L275-S277 VanDerWaalsContact O-N 3.13Å; L275-G278 PolarHBondContact O-N 3.23Å; L275-P281 HydrophobicContact CD2-CB 4.14Å; L275-P281 HydrophobicContact CD2-CG 4.44Å; L275-V306 HydrophobicContact CD1-CG1 4.06Å; L275-M307 HydrophobicContact CD1-CG 4.17Å; L275-H310 HydrophobicContact CD1-CB 4.05Å; L275-H310 PolarHBondContact O-CE1 3.42Å |
| 276 | D | 93.1 | Very high | 92.5 | Very high | 108 Ų | 108 | 48.6 Ų | 48.6 | 58% | 0.578 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -63.9 | -15.4 | 174.2 | -73.2 | -16.6 | 0 | 0 | 0 | 112.4 | E272 | E272-D276 WeakPolarHBondContact O-CB 3.37Å; E272-D276 PolarHBondContact O-N 2.96Å |
| 277 | S | 93.6 | Very high | 92 | Very high | 50 Ų | 50 | 49.1 Ų | 49.1 | 35% | 0.35 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100 | 7.2 | 175.4 | -51.4 | 0 | 0 | 0 | 0 | 114.2 | I273 L274 L275 | I273-S277 VanDerWaalsContact O-CB 3.3Å; I273-S277 WeakPolarHBondContact O-CB 3.29Å; I273-S277 PolarHBondContact O-N 2.82Å; I273-S277 VanDerWaalsContact O-N 3.09Å; I273-S277 PolarHBondContact O-OG 3.48Å; L274-S277 CarbonylContact O-C 3.43Å; L274-S277 WeakPolarHBondContact O-CA 3.47Å; L274-S277 PolarHBondContact O-N 2.84Å; L274-S277 VanDerWaalsContact O-N 3.1Å; L275-S277 PolarHBondContact O-N 3.41Å; L275-S277 VanDerWaalsContact O-N 3.13Å |
| 278 | G | 90.8 | Very high | 91.5 | Very high | 52 Ų | 52 | 48.9 Ų | 48.9 | 54% | 0.536 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.7 | 24 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | N249 L274 L275 | N249-G278 PolarHBondContact ND2-O 2.9Å; L274-G278 PolarHBondContact O-N 2.88Å; L275-G278 PolarHBondContact O-N 3.23Å |
| 279 | A | 93 | Very high | 91.2 | Very high | 3 Ų | 3 | 52.4 Ų | 52.4 | 3% | 0.025 | 30% | 0.298 | C | S | . | . | trans | -65.2 | 132.9 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | V248 N249 L259 L274 P281 | V248-A279 HydrophobicContact CG1-CB 3.82Å; N249-A279 WeakPolarHBondContact OD1-CA 3.35Å; L259-A279 HydrophobicContact CB-CB 4.29Å; L259-A279 HydrophobicContact CD2-CB 4.16Å; L274-A279 HydrophobicContact CB-CB 3.88Å; L274-A279 WeakPolarHBondContact O-CB 3.45Å; L274-A279 PolarHBondContact O-N 3.35Å; A279-P281 WeakPolarHBondContact O-CD 3.44Å | ||
| 280 | D | 89.9 | Confident | 90.9 | Very high | 67 Ų | 67 | 47.5 Ų | 47.5 | 36% | 0.358 | 28% | 0.282 | S | S | . | . | trans | -81.8 | 117.3 | -179.9 | -173.5 | -16.6 | 0 | 0 | 0 | 110.6 | N249 L259 T282 V283 | N249-D280 PolarHBondContact OD1-N 3.2Å; L259-D280 WeakPolarHBondContact CD2-O 3.47Å; D280-T282 VanDerWaalsContact C-N 3.26Å; D280-T282 VanDerWaalsContact CG-OG1 3.29Å; D280-T282 PolarHBondContact O-N 3.5Å; D280-T282 WeakPolarHBondContact OD1-CA 3.33Å; D280-T282 WeakPolarHBondContact OD1-CB 3.35Å; D280-T282 PolarHBondContact OD1-N 2.86Å; D280-T282 PolarHBondContact OD1-OG1 3.35Å; D280-T282 PolarHBondContact OD2-OG1 2.95Å; D280-V283 HydrophobicContact CB-CG2 3.97Å; D280-V283 WeakPolarHBondContact O-CB 3.27Å | ||
| 281 | P | 88.3 | Confident | 90.7 | Very high | 11 Ų | 11 | 47.5 Ų | 47.5 | 7% | 0.071 | 28% | 0.282 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | -10.9 | 177.8 | 31.9 | -36.4 | 0 | 0 | 0 | 114.3 | L259 L275 A279 M307 L311 | L259-P281 HydrophobicContact CD2-CB 4.31Å; L275-P281 HydrophobicContact CD2-CB 4.14Å; L275-P281 HydrophobicContact CD2-CG 4.44Å; A279-P281 WeakPolarHBondContact O-CD 3.44Å; P281-M307 HydrophobicContact CB-CE 3.6Å; P281-L311 HydrophobicContact CB-CD2 4.28Å; P281-L311 HydrophobicContact CG-CD2 3.57Å; P281-L311 HydrophobicContact CG-CG 4.35Å |
| 282 | T | 87 | Confident | 90.6 | Very high | 92 Ų | 92 | 49.2 Ų | 49.2 | 56% | 0.564 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -10.2 | 179 | 73.4 | 0 | 0 | 0 | 0 | 113.3 | D280 E284 | D280-T282 VanDerWaalsContact C-N 3.26Å; D280-T282 VanDerWaalsContact CG-OG1 3.29Å; D280-T282 PolarHBondContact O-N 3.5Å; D280-T282 WeakPolarHBondContact OD1-CA 3.33Å; D280-T282 WeakPolarHBondContact OD1-CB 3.35Å; D280-T282 PolarHBondContact OD1-N 2.86Å; D280-T282 PolarHBondContact OD1-OG1 3.35Å; D280-T282 PolarHBondContact OD2-OG1 2.95Å; T282-E284 PolarHBondContact O-N 3.03Å; T282-E284 VanDerWaalsContact O-N 3.12Å |
| 283 | V | 86.3 | Confident | 90.5 | Very high | 15 Ų | 15 | 49.9 Ų | 49.9 | 9% | 0.091 | 30% | 0.296 | C | S | . | . | trans | -47.8 | 112.3 | 169.7 | 151.3 | 0 | 0 | 0 | 0 | 111.3 | Y251 A257 L260 D280 N290 | Y251-V283 HydrophobicContact CE1-CG1 4.26Å; Y251-V283 HydrophobicContact CE2-CG1 4.1Å; Y251-V283 HydrophobicContact CE2-CG2 3.92Å; Y251-V283 WeakPolarHBondContact OH-CG1 3.48Å; A257-V283 HydrophobicContact CB-CG1 3.78Å; L260-V283 HydrophobicContact CD1-CG1 3.88Å; L260-V283 HydrophobicContact CG-CG1 4.17Å; D280-V283 HydrophobicContact CB-CG2 3.97Å; D280-V283 WeakPolarHBondContact O-CB 3.27Å; V283-N290 VanDerWaalsContact O-CA 3.31Å; V283-N290 WeakPolarHBondContact O-CA 3.21Å | ||
| 284 | E | 88.3 | Confident | 90.3 | Very high | 107 Ų | 107 | 50.5 Ų | 50.5 | 50% | 0.5 | 30% | 0.299 | S | S | . | . | B | Isolated β-bridge | trans | -89.9 | 143.9 | 172.8 | -71.3 | -179.7 | -169.4 | 0 | 0 | 111.2 | Y251 T282 N290 | Y251-E284 WeakPolarHBondContact CE1-O 3.37Å; Y251-E284 PolarHBondContact OH-N 3.2Å; Y251-E284 PolarHBondContact OH-O 3.3Å; T282-E284 PolarHBondContact O-N 3.03Å; T282-E284 VanDerWaalsContact O-N 3.12Å; E284-N290 HydrophobicContact CG-CB 4.08Å |
| 285 | S | 87.8 | Confident | 90.2 | Very high | 15 Ų | 15 | 50.5 Ų | 50.5 | 11% | 0.105 | 30% | 0.299 | C | S | . | . | trans | -74.7 | 165.2 | 166 | 54.4 | 0 | 0 | 0 | 0 | 112.4 | G255 S287 G288 F289 | G255-S285 VanDerWaalsContact O-CA 3.29Å; G255-S285 WeakPolarHBondContact O-CA 3.45Å; G255-S285 WeakPolarHBondContact O-CB 3.31Å; S285-S287 PolarHBondContact O-N 3.44Å; S285-S287 PolarHBondContact OG-OG 2.83Å; S285-G288 PolarHBondContact O-N 2.99Å; S285-F289 PolarHBondContact N-O 2.87Å; S285-F289 PolarHBondContact OG-N 2.88Å; S285-F289 PolarHBondContact OG-O 3.2Å | ||
| 286 | D | 86.6 | Confident | 90.2 | Very high | 134 Ų | 134 | 54.1 Ų | 54.1 | 72% | 0.717 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50 | -23.9 | 170.1 | -78.6 | 13.5 | 0 | 0 | 0 | 113.8 | G255 | G255-D286 VanDerWaalsContact CA-CG 3.43Å; G255-D286 WeakPolarHBondContact CA-OD1 3.48Å |
| 287 | S | 84.9 | Confident | 90.2 | Very high | 82 Ų | 82 | 52.9 Ų | 52.9 | 57% | 0.573 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | 2.9 | 177.1 | 49.7 | 0 | 0 | 0 | 0 | 115.3 | S285 F289 | S285-S287 PolarHBondContact O-N 3.44Å; S285-S287 PolarHBondContact OG-OG 2.83Å; S287-F289 VanDerWaalsContact C-N 3.34Å |
| 288 | G | 87.3 | Confident | 90.2 | Very high | 41 Ų | 41 | 54.3 Ų | 54.3 | 42% | 0.423 | 33% | 0.328 | S | S | . | . | S | Bend | trans | 74.2 | 20.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | S285 | S285-G288 PolarHBondContact O-N 2.99Š|
| 289 | F | 88.1 | Confident | 90.3 | Very high | 106 Ų | 106 | 54 Ų | 54 | 47% | 0.465 | 32% | 0.324 | S | S | . | . | trans | -107.1 | 125.9 | 173.4 | -64.8 | -73.8 | 0 | 0 | 0 | 110 | S285 S287 D293 | S285-F289 PolarHBondContact N-O 2.87Å; S285-F289 PolarHBondContact OG-N 2.88Å; S285-F289 PolarHBondContact OG-O 3.2Å; S287-F289 VanDerWaalsContact C-N 3.34Å; F289-D293 HydrophobicContact CB-CB 4.48Å; F289-D293 HydrophobicContact CD1-CB 4.05Å | ||
| 290 | N | 91.3 | Very high | 90.5 | Very high | 31 Ų | 31 | 55.2 Ų | 55.2 | 17% | 0.166 | 33% | 0.329 | C | S | . | . | B | Isolated β-bridge | trans | -81.1 | 175.3 | 167.8 | 63.6 | 61.6 | 0 | 0 | 0 | 111.8 | V283 E284 M292 D293 M294 | V283-N290 VanDerWaalsContact O-CA 3.31Å; V283-N290 WeakPolarHBondContact O-CA 3.21Å; E284-N290 HydrophobicContact CG-CB 4.08Å; N290-M292 VanDerWaalsContact C-N 3.3Å; N290-M292 PolarHBondContact O-N 2.95Å; N290-M292 WeakPolarHBondContact OD1-CA 3.27Å; N290-M292 WeakPolarHBondContact OD1-CB 3.25Å; N290-M292 PolarHBondContact OD1-N 3.46Å; N290-D293 VanDerWaalsContact CG-OD2 3.32Å; N290-D293 PolarHBondContact ND2-OD2 2.9Å; N290-D293 PolarHBondContact O-N 3.06Å; N290-D293 PolarHBondContact OD1-N 2.87Å; N290-D293 PolarHBondContact OD1-OD2 3.1Å; N290-M294 PolarHBondContact O-N 2.93Å |
| 291 | A | 91.7 | Very high | 90.7 | Very high | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.4 | -35.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | L259 L260 V263 A295 M307 | L259-A291 HydrophobicContact CD2-CB 4.05Å; L259-A291 HydrophobicContact CG-CB 4.14Å; L260-A291 HydrophobicContact CD2-CB 4Å; V263-A291 WeakPolarHBondContact CG1-O 3.38Å; V263-A291 HydrophobicContact CG2-CB 4.08Å; A291-A295 WeakPolarHBondContact O-CB 3.26Å; A291-A295 PolarHBondContact O-N 2.83Å; A291-A295 VanDerWaalsContact O-N 3.09Å; A291-M307 HydrophobicContact CB-CE 3.48Å; A291-M307 VanDerWaalsContact CB-CE 3.48Å; A291-M307 HydrophobicContact CB-SD 4.11Å |
| 292 | M | 93.1 | Very high | 91.1 | Very high | 37 Ų | 37 | 64.9 Ų | 64.9 | 18% | 0.182 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -75 | -42.6 | 179.4 | -173.2 | 61.3 | 178.6 | 0 | 0 | 111.2 | N290 M294 A295 V296 Q304 M307 E308 | N290-M292 VanDerWaalsContact C-N 3.3Å; N290-M292 PolarHBondContact O-N 2.95Å; N290-M292 WeakPolarHBondContact OD1-CA 3.27Å; N290-M292 WeakPolarHBondContact OD1-CB 3.25Å; N290-M292 PolarHBondContact OD1-N 3.46Å; M292-M294 VanDerWaalsContact C-N 3.31Å; M292-M294 PolarHBondContact O-N 2.93Å; M292-A295 WeakPolarHBondContact O-CB 3.37Å; M292-A295 PolarHBondContact O-N 3.39Å; M292-A295 VanDerWaalsContact O-N 3.17Å; M292-V296 HydrophobicContact CE-CG2 4.26Å; M292-V296 WeakPolarHBondContact O-CG2 3.38Å; M292-V296 PolarHBondContact O-N 3.14Å; M292-Q304 HydrophobicContact CE-CB 3.95Å; M292-Q304 HydrophobicContact CE-CG 4.16Å; M292-Q304 HydrophobicContact SD-CB 4.39Å; M292-Q304 HydrophobicContact SD-CG 4.4Å; M292-M307 HydrophobicContact CB-CE 3.97Å; M292-M307 HydrophobicContact CB-SD 4.39Å; M292-M307 HydrophobicContact SD-CB 3.91Å; M292-M307 HydrophobicContact SD-SD 4.27Å; M292-E308 HydrophobicContact CE-CG 3.73Å; M292-E308 WeakPolarHBondContact CE-OE1 3.45Å |
| 293 | D | 93.1 | Very high | 91.5 | Very high | 72 Ų | 72 | 60.5 Ų | 60.5 | 39% | 0.385 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.1 | -39.1 | 176.5 | -68.6 | -38.4 | 0 | 0 | 0 | 111.9 | F289 N290 V296 A297 | F289-D293 HydrophobicContact CB-CB 4.48Å; F289-D293 HydrophobicContact CD1-CB 4.05Å; N290-D293 VanDerWaalsContact CG-OD2 3.32Å; N290-D293 PolarHBondContact ND2-OD2 2.9Å; N290-D293 PolarHBondContact O-N 3.06Å; N290-D293 PolarHBondContact OD1-N 2.87Å; N290-D293 PolarHBondContact OD1-OD2 3.1Å; D293-V296 PolarHBondContact O-N 2.97Å; D293-A297 VanDerWaalsContact O-CB 3.29Å; D293-A297 WeakPolarHBondContact O-CB 3.36Å; D293-A297 PolarHBondContact O-N 3.46Å |
| 294 | M | 92.4 | Very high | 91.9 | Very high | 34 Ų | 34 | 61.2 Ų | 61.2 | 17% | 0.167 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.7 | -43.2 | 173.8 | -168.2 | 178.4 | -62.2 | 0 | 0 | 111.6 | L260 V263 H264 N290 M292 V296 A297 M298 | L260-M294 HydrophobicContact CD2-CE 4.23Å; V263-M294 HydrophobicContact CG1-CB 4.04Å; V263-M294 HydrophobicContact CG1-CG 4.14Å; V263-M294 HydrophobicContact CG1-SD 4.41Å; H264-M294 HydrophobicContact CB-SD 3.86Å; N290-M294 PolarHBondContact O-N 2.93Å; M292-M294 VanDerWaalsContact C-N 3.31Å; M292-M294 PolarHBondContact O-N 2.93Å; M294-V296 VanDerWaalsContact C-N 3.29Å; M294-V296 PolarHBondContact O-N 3.22Å; M294-A297 PolarHBondContact O-N 3.44Å; M294-M298 HydrophobicContact CG-SD 3.98Å; M294-M298 WeakPolarHBondContact O-CB 3.39Å; M294-M298 WeakPolarHBondContact O-CG 3.42Å; M294-M298 PolarHBondContact O-N 3.45Å |
| 295 | A | 94.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.2 | -36.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | V263 A291 M292 G299 H300 V303 Q304 | V263-A295 HydrophobicContact CG1-CB 3.85Å; A291-A295 WeakPolarHBondContact O-CB 3.26Å; A291-A295 PolarHBondContact O-N 2.83Å; A291-A295 VanDerWaalsContact O-N 3.09Å; M292-A295 WeakPolarHBondContact O-CB 3.37Å; M292-A295 PolarHBondContact O-N 3.39Å; M292-A295 VanDerWaalsContact O-N 3.17Å; A295-G299 PolarHBondContact O-N 2.94Å; A295-H300 PolarHBondContact O-N 3.22Å; A295-V303 HydrophobicContact CB-CB 4.29Å; A295-V303 HydrophobicContact CB-CG1 3.81Å; A295-Q304 HydrophobicContact CB-CG 3.94Å; A295-Q304 PolarHBondContact O-NE2 3.06Å |
| 296 | V | 94.3 | Very high | 92.5 | Very high | 80 Ų | 80 | 62.5 Ų | 62.5 | 49% | 0.485 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -69.5 | -50.2 | 174.9 | 170.3 | 0 | 0 | 0 | 0 | 111.3 | M292 D293 M294 M298 G299 Q304 | M292-V296 HydrophobicContact CE-CG2 4.26Å; M292-V296 WeakPolarHBondContact O-CG2 3.38Å; M292-V296 PolarHBondContact O-N 3.14Å; D293-V296 PolarHBondContact O-N 2.97Å; M294-V296 VanDerWaalsContact C-N 3.29Å; M294-V296 PolarHBondContact O-N 3.22Å; V296-M298 VanDerWaalsContact C-N 3.31Å; V296-M298 PolarHBondContact O-N 2.85Å; V296-G299 PolarHBondContact O-N 3.39Å; V296-Q304 HydrophobicContact CG2-CG 4.29Å |
| 297 | A | 92.9 | Very high | 92.7 | Very high | 82 Ų | 82 | 56.2 Ų | 56.2 | 68% | 0.678 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -61.5 | -36.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113 | D293 M294 | D293-A297 VanDerWaalsContact O-CB 3.29Å; D293-A297 WeakPolarHBondContact O-CB 3.36Å; D293-A297 PolarHBondContact O-N 3.46Å; M294-A297 PolarHBondContact O-N 3.44Å |
| 298 | M | 92.4 | Very high | 93.1 | Very high | 80 Ų | 80 | 56.8 Ų | 56.8 | 39% | 0.394 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | -6.4 | 176 | -58.8 | -177.3 | 75.5 | 0 | 0 | 113.4 | H264 M294 V296 H300 | H264-M298 WeakPolarHBondContact O-CE 3.23Å; M294-M298 HydrophobicContact CG-SD 3.98Å; M294-M298 WeakPolarHBondContact O-CB 3.39Å; M294-M298 WeakPolarHBondContact O-CG 3.42Å; M294-M298 PolarHBondContact O-N 3.45Å; V296-M298 VanDerWaalsContact C-N 3.31Å; V296-M298 PolarHBondContact O-N 2.85Å; M298-H300 VanDerWaalsContact C-N 3.33Å; M298-H300 PolarHBondContact O-CD2 2.83Å; M298-H300 PolarHBondContact O-N 3.3Å |
| 299 | G | 94.4 | Very high | 93.2 | Very high | 45 Ų | 45 | 57.1 Ų | 57.1 | 46% | 0.464 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.2 | 21.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | A295 V296 R301 | A295-G299 PolarHBondContact O-N 2.94Å; V296-G299 PolarHBondContact O-N 3.39Å; G299-R301 PolarHBondContact O-N 3.23Å |
| 300 | H | 95.8 | Very high | 93.3 | Very high | 28 Ų | 28 | 53.3 Ų | 53.3 | 13% | 0.13 | 29% | 0.291 | C | S | . | . | trans | -73.9 | 67.6 | -177.2 | -64.7 | 172.2 | 0 | 0 | 0 | 112.2 | V263 H264 N266 A295 M298 N302 V303 Q304 | V263-H300 PolarHBondContact O-CE1 3.37Å; V263-H300 PolarHBondContact O-ND1 3.45Å; H264-H300 PolarHBondContact O-CE1 3.36Å; N266-H300 WeakPolarHBondContact OD1-CB 3.46Å; A295-H300 PolarHBondContact O-N 3.22Å; M298-H300 VanDerWaalsContact C-N 3.33Å; M298-H300 PolarHBondContact O-CD2 2.83Å; M298-H300 PolarHBondContact O-N 3.3Å; H300-N302 VanDerWaalsContact C-N 3.25Å; H300-N302 PolarHBondContact O-N 3.32Å; H300-N302 VanDerWaalsContact O-N 3.1Å; H300-V303 HydrophobicContact CB-CB 3.99Å; H300-V303 HydrophobicContact CB-CG2 4.04Å; H300-V303 WeakPolarHBondContact O-CA 3.44Å; H300-V303 WeakPolarHBondContact O-CB 3.19Å; H300-V303 PolarHBondContact O-N 2.96Å; H300-Q304 WeakPolarHBondContact O-CG 3.14Å; H300-Q304 PolarHBondContact O-N 3.13Å | ||
| 301 | R | 95 | Very high | 93.1 | Very high | 183 Ų | 183 | 54.4 Ų | 54.4 | 69% | 0.691 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -51.5 | -35.8 | -174.5 | -70 | 178.8 | -179.3 | -100.8 | -0.4 | 115.1 | G299 Q304 Q305 | G299-R301 PolarHBondContact O-N 3.23Å; R301-Q304 PolarHBondContact O-N 3.38Å; R301-Q305 WeakPolarHBondContact O-CG 3.37Å; R301-Q305 PolarHBondContact O-N 2.95Å |
| 302 | N | 95.5 | Very high | 92.9 | Very high | 98 Ų | 98 | 59.5 Ų | 59.5 | 52% | 0.524 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -71.7 | -37.8 | 179.6 | -62.7 | 8.1 | 0 | 0 | 0 | 111.2 | V268 H300 Q305 V306 | V268-N302 HydrophobicContact CG1-CB 4.37Å; V268-N302 HydrophobicContact CG2-CB 3.64Å; H300-N302 VanDerWaalsContact C-N 3.25Å; H300-N302 PolarHBondContact O-N 3.32Å; H300-N302 VanDerWaalsContact O-N 3.1Å; N302-Q305 PolarHBondContact O-N 3.12Å; N302-V306 WeakPolarHBondContact O-CG2 3.31Å; N302-V306 PolarHBondContact O-N 3.46Å |
| 303 | V | 95.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -65.5 | -45.3 | 172.8 | 176 | 0 | 0 | 0 | 0 | 110.2 | V263 V268 V271 A295 H300 Q305 V306 M307 | V263-V303 HydrophobicContact CB-CG1 4.4Å; V263-V303 HydrophobicContact CG1-CG1 4.27Å; V263-V303 HydrophobicContact CG2-CG1 3.84Å; V268-V303 HydrophobicContact CG2-CG2 3.94Å; V271-V303 HydrophobicContact CG1-CG1 4.27Å; V271-V303 HydrophobicContact CG2-CG1 4.18Å; A295-V303 HydrophobicContact CB-CB 4.29Å; A295-V303 HydrophobicContact CB-CG1 3.81Å; H300-V303 HydrophobicContact CB-CB 3.99Å; H300-V303 HydrophobicContact CB-CG2 4.04Å; H300-V303 WeakPolarHBondContact O-CA 3.44Å; H300-V303 WeakPolarHBondContact O-CB 3.19Å; H300-V303 PolarHBondContact O-N 2.96Å; V303-Q305 VanDerWaalsContact C-N 3.33Å; V303-Q305 PolarHBondContact O-N 3.33Å; V303-V306 PolarHBondContact O-N 2.85Å; V303-M307 HydrophobicContact CG1-CG 4.3Å; V303-M307 HydrophobicContact CG1-SD 4.12Å; V303-M307 WeakPolarHBondContact O-CG 3.33Å; V303-M307 PolarHBondContact O-N 3.45Å |
| 304 | Q | 94.9 | Very high | 92.2 | Very high | 31 Ų | 31 | 64.1 Ų | 64.1 | 15% | 0.145 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -53.7 | -48.4 | 175 | -65 | 161.8 | 17.2 | 0 | 0 | 111.4 | M292 A295 V296 H300 R301 V306 M307 E308 | M292-Q304 HydrophobicContact CE-CB 3.95Å; M292-Q304 HydrophobicContact CE-CG 4.16Å; M292-Q304 HydrophobicContact SD-CB 4.39Å; M292-Q304 HydrophobicContact SD-CG 4.4Å; A295-Q304 HydrophobicContact CB-CG 3.94Å; A295-Q304 PolarHBondContact O-NE2 3.06Å; V296-Q304 HydrophobicContact CG2-CG 4.29Å; H300-Q304 WeakPolarHBondContact O-CG 3.14Å; H300-Q304 PolarHBondContact O-N 3.13Å; R301-Q304 PolarHBondContact O-N 3.38Å; Q304-V306 PolarHBondContact O-N 3.35Å; Q304-M307 PolarHBondContact O-N 3.42Å; Q304-E308 WeakPolarHBondContact O-CB 3.26Å; Q304-E308 VanDerWaalsContact O-CG 3.31Å; Q304-E308 WeakPolarHBondContact O-CG 3.41Å; Q304-E308 PolarHBondContact O-N 3.05Å |
| 305 | Q | 94.4 | Very high | 91.8 | Very high | 123 Ų | 123 | 67.7 Ų | 67.7 | 58% | 0.575 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -62.5 | -39.4 | 179 | -74.5 | 173.5 | -2.2 | 0 | 0 | 113.5 | R301 N302 V303 A309 | R301-Q305 WeakPolarHBondContact O-CG 3.37Å; R301-Q305 PolarHBondContact O-N 2.95Å; N302-Q305 PolarHBondContact O-N 3.12Å; V303-Q305 VanDerWaalsContact C-N 3.33Å; V303-Q305 PolarHBondContact O-N 3.33Å; Q305-A309 VanDerWaalsContact O-CB 3.23Å; Q305-A309 WeakPolarHBondContact O-CB 3.45Å; Q305-A309 PolarHBondContact O-N 3.18Å |
| 306 | V | 94.6 | Very high | 91.2 | Very high | 26 Ų | 26 | 74.3 Ų | 74.3 | 16% | 0.158 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -65.4 | -45.3 | 174.6 | 167.1 | 0 | 0 | 0 | 0 | 110.9 | V268 V271 E272 L275 N302 V303 Q304 A309 H310 | V268-V306 HydrophobicContact CG1-CG2 3.78Å; V271-V306 HydrophobicContact CG1-CG1 4.06Å; E272-V306 HydrophobicContact CB-CG1 4.45Å; E272-V306 HydrophobicContact CG-CB 4.38Å; E272-V306 HydrophobicContact CG-CG1 3.6Å; E272-V306 HydrophobicContact CG-CG2 3.8Å; L275-V306 HydrophobicContact CD1-CG1 4.06Å; N302-V306 WeakPolarHBondContact O-CG2 3.31Å; N302-V306 PolarHBondContact O-N 3.46Å; V303-V306 PolarHBondContact O-N 2.85Å; Q304-V306 PolarHBondContact O-N 3.35Å; V306-A309 PolarHBondContact O-N 3.24Å; V306-H310 PolarHBondContact O-N 2.85Å |
| 307 | M | 92 | Very high | 90.1 | Very high | 1 Ų | 1 | 73.1 Ų | 73.1 | 1% | 0.005 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.6 | -46.2 | 179.3 | -71.9 | -168 | 73.6 | 0 | 0 | 112.3 | V263 V271 L275 P281 A291 M292 V303 Q304 A309 H310 L311 | V263-M307 HydrophobicContact CG2-SD 4.21Å; V271-M307 HydrophobicContact CG1-CG 4.2Å; L275-M307 HydrophobicContact CD1-CG 4.17Å; P281-M307 HydrophobicContact CB-CE 3.6Å; A291-M307 HydrophobicContact CB-CE 3.48Å; A291-M307 VanDerWaalsContact CB-CE 3.48Å; A291-M307 HydrophobicContact CB-SD 4.11Å; M292-M307 HydrophobicContact CB-CE 3.97Å; M292-M307 HydrophobicContact CB-SD 4.39Å; M292-M307 HydrophobicContact SD-CB 3.91Å; M292-M307 HydrophobicContact SD-SD 4.27Å; V303-M307 HydrophobicContact CG1-CG 4.3Å; V303-M307 HydrophobicContact CG1-SD 4.12Å; V303-M307 WeakPolarHBondContact O-CG 3.33Å; V303-M307 PolarHBondContact O-N 3.45Å; Q304-M307 PolarHBondContact O-N 3.42Å; M307-A309 VanDerWaalsContact C-N 3.34Å; M307-A309 PolarHBondContact O-N 2.91Å; M307-H310 PolarHBondContact O-N 2.9Å; M307-L311 WeakPolarHBondContact O-CB 3.46Å; M307-L311 VanDerWaalsContact O-CG 3.31Å; M307-L311 WeakPolarHBondContact O-CG 3.04Å; M307-L311 PolarHBondContact O-N 2.92Å |
| 308 | E | 91.4 | Very high | 88.6 | Confident | 95 Ų | 95 | 75.7 Ų | 75.7 | 44% | 0.444 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -56.7 | -46.9 | 173.2 | -75.2 | 171.4 | -165.6 | 0 | 0 | 111.1 | M292 Q304 H310 L311 L312 | M292-E308 HydrophobicContact CE-CG 3.73Å; M292-E308 WeakPolarHBondContact CE-OE1 3.45Å; Q304-E308 WeakPolarHBondContact O-CB 3.26Å; Q304-E308 VanDerWaalsContact O-CG 3.31Å; Q304-E308 WeakPolarHBondContact O-CG 3.41Å; Q304-E308 PolarHBondContact O-N 3.05Å; E308-H310 VanDerWaalsContact C-N 3.31Å; E308-H310 PolarHBondContact O-N 3.47Å; E308-L311 PolarHBondContact O-N 3.43Å; E308-L312 WeakPolarHBondContact O-CB 3.5Å; E308-L312 VanDerWaalsContact O-CG 3.22Å; E308-L312 WeakPolarHBondContact O-CG 3.45Å; E308-L312 PolarHBondContact O-N 3.44Å |
| 309 | A | 90.9 | Very high | 86.7 | Confident | 48 Ų | 48 | 82.3 Ų | 82.3 | 40% | 0.397 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -64.5 | -32.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q305 V306 M307 K313 | Q305-A309 VanDerWaalsContact O-CB 3.23Å; Q305-A309 WeakPolarHBondContact O-CB 3.45Å; Q305-A309 PolarHBondContact O-N 3.18Å; V306-A309 PolarHBondContact O-N 3.24Å; M307-A309 VanDerWaalsContact C-N 3.34Å; M307-A309 PolarHBondContact O-N 2.91Å; A309-K313 VanDerWaalsContact O-CG 3.28Å; A309-K313 WeakPolarHBondContact O-CG 3.37Å; A309-K313 PolarHBondContact O-N 3.26Å |
| 310 | H | 89.7 | Confident | 84.1 | Confident | 26 Ų | 26 | 92 Ų | 92 | 12% | 0.12 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -76.6 | -46.7 | 175.2 | -171 | 97 | 0 | 0 | 0 | 112 | L275 V306 M307 E308 L312 K313 L314 | L275-H310 HydrophobicContact CD1-CB 4.05Å; L275-H310 PolarHBondContact O-CE1 3.42Å; V306-H310 PolarHBondContact O-N 2.85Å; M307-H310 PolarHBondContact O-N 2.9Å; E308-H310 VanDerWaalsContact C-N 3.31Å; E308-H310 PolarHBondContact O-N 3.47Å; H310-L312 VanDerWaalsContact C-N 3.29Å; H310-L312 PolarHBondContact O-N 2.91Å; H310-K313 WeakPolarHBondContact O-CB 3.46Å; H310-K313 PolarHBondContact O-N 3.5Å; H310-L314 PolarHBondContact O-N 2.94Å |
| 311 | L | 87.1 | Confident | 83.5 | Confident | 54 Ų | 54 | 95.2 Ų | 95.2 | 28% | 0.283 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -58.2 | -39.7 | 176 | -73.5 | 168 | 0 | 0 | 0 | 112 | P281 M307 E308 L314 L315 | P281-L311 HydrophobicContact CB-CD2 4.28Å; P281-L311 HydrophobicContact CG-CD2 3.57Å; P281-L311 HydrophobicContact CG-CG 4.35Å; M307-L311 WeakPolarHBondContact O-CB 3.46Å; M307-L311 VanDerWaalsContact O-CG 3.31Å; M307-L311 WeakPolarHBondContact O-CG 3.04Å; M307-L311 PolarHBondContact O-N 2.92Å; E308-L311 PolarHBondContact O-N 3.43Å; L311-L314 PolarHBondContact O-N 3.21Å; L311-L315 WeakPolarHBondContact O-CB 3.43Å; L311-L315 WeakPolarHBondContact O-CG 3.47Å; L311-L315 PolarHBondContact O-N 3.06Å |
| 312 | L | 87.9 | Confident | 82.9 | Confident | 106 Ų | 106 | 90.5 Ų | 90.5 | 56% | 0.555 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -65.1 | -38.2 | 174.2 | -73.3 | 170 | 0 | 0 | 0 | 112.6 | E308 H310 M316 | E308-L312 WeakPolarHBondContact O-CB 3.5Å; E308-L312 VanDerWaalsContact O-CG 3.22Å; E308-L312 WeakPolarHBondContact O-CG 3.45Å; E308-L312 PolarHBondContact O-N 3.44Å; H310-L312 VanDerWaalsContact C-N 3.29Å; H310-L312 PolarHBondContact O-N 2.91Å; L312-M316 WeakPolarHBondContact O-CB 3.44Å; L312-M316 VanDerWaalsContact O-CG 3.3Å; L312-M316 WeakPolarHBondContact O-CG 3.38Å; L312-M316 PolarHBondContact O-N 3.01Å |
| 313 | K | 86.9 | Confident | 82.2 | Confident | 130 Ų | 130 | 90.1 Ų | 90.1 | 57% | 0.565 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -61.6 | -46.4 | 172.9 | -69.6 | 165.8 | -169.3 | 174.6 | 0 | 111.1 | A309 H310 M316 G317 | A309-K313 VanDerWaalsContact O-CG 3.28Å; A309-K313 WeakPolarHBondContact O-CG 3.37Å; A309-K313 PolarHBondContact O-N 3.26Å; H310-K313 WeakPolarHBondContact O-CB 3.46Å; H310-K313 PolarHBondContact O-N 3.5Å; K313-M316 PolarHBondContact O-N 3.29Å; K313-G317 PolarHBondContact O-N 3.34Å |
| 314 | L | 84.2 | Confident | 81.4 | Confident | 76 Ų | 76 | 95.4 Ų | 95.4 | 40% | 0.398 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.3 | -50.1 | 177.6 | -67.1 | 175.3 | 0 | 0 | 0 | 111.1 | H310 L311 M316 G317 I318 | H310-L314 PolarHBondContact O-N 2.94Å; L311-L314 PolarHBondContact O-N 3.21Å; L314-M316 PolarHBondContact O-N 3.42Å; L314-G317 PolarHBondContact O-N 2.83Å; L314-G317 VanDerWaalsContact O-N 3.16Å; L314-I318 WeakPolarHBondContact O-CD1 3.46Å; L314-I318 VanDerWaalsContact O-CG1 3.27Å; L314-I318 WeakPolarHBondContact O-CG1 3.42Å; L314-I318 PolarHBondContact O-N 3.26Å |
| 315 | L | 83.4 | Confident | 80.5 | Confident | 110 Ų | 110 | 99.4 Ų | 99.4 | 58% | 0.576 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.6 | -24.1 | 178.8 | -70.4 | 172.3 | 0 | 0 | 0 | 113.9 | L311 | L311-L315 WeakPolarHBondContact O-CB 3.43Å; L311-L315 WeakPolarHBondContact O-CG 3.47Å; L311-L315 PolarHBondContact O-N 3.06Å |
| 316 | M | 83.1 | Confident | 79.6 | Confident | 139 Ų | 139 | 97.9 Ų | 97.9 | 69% | 0.685 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -82.1 | -38.9 | 171.6 | -73.2 | -177.1 | 66.2 | 0 | 0 | 112.4 | L312 K313 L314 I318 R319 | L312-M316 WeakPolarHBondContact O-CB 3.44Å; L312-M316 VanDerWaalsContact O-CG 3.3Å; L312-M316 WeakPolarHBondContact O-CG 3.38Å; L312-M316 PolarHBondContact O-N 3.01Å; K313-M316 PolarHBondContact O-N 3.29Å; L314-M316 PolarHBondContact O-N 3.42Å; M316-I318 PolarHBondContact O-N 2.71Å; M316-R319 WeakPolarHBondContact O-CB 3.32Å; M316-R319 PolarHBondContact O-N 3.25Å; M316-R319 VanDerWaalsContact O-N 3.12Å |
| 317 | G | 69.8 | Low | 78.5 | Confident | 55 Ų | 55 | 103 Ų | 103 | 57% | 0.567 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.8 | -21 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | K313 L314 R319 | K313-G317 PolarHBondContact O-N 3.34Å; L314-G317 PolarHBondContact O-N 2.83Å; L314-G317 VanDerWaalsContact O-N 3.16Å; G317-R319 PolarHBondContact O-N 3.23Å |
| 318 | I | 60.8 | Low | 77.5 | Confident | 135 Ų | 135 | 110.8 Ų | 110.8 | 69% | 0.692 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -0 | 174.1 | -66.8 | 161.9 | 0 | 0 | 0 | 112.3 | L314 M316 | L314-I318 WeakPolarHBondContact O-CD1 3.46Å; L314-I318 VanDerWaalsContact O-CG1 3.27Å; L314-I318 WeakPolarHBondContact O-CG1 3.42Å; L314-I318 PolarHBondContact O-N 3.26Å; M316-I318 PolarHBondContact O-N 2.71Å |
| 319 | R | 53.8 | Low | 76.3 | Confident | 220 Ų | 220 | 112.2 Ų | 112.2 | 83% | 0.83 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.1 | 6.8 | -177.2 | -72.6 | -177.3 | 166.4 | -152.4 | -2.9 | 115.6 | M316 G317 | M316-R319 WeakPolarHBondContact O-CB 3.32Å; M316-R319 PolarHBondContact O-N 3.25Å; M316-R319 VanDerWaalsContact O-N 3.12Å; G317-R319 PolarHBondContact O-N 3.23Å |
| 320 | E | 38.5 | Very low | 75 | Confident | 247 Ų | 247 | 118 Ų | 118 | 100% | 1.154 | 58% | 0.584 | S | S | * | * | trans | -110.4 | 0 | 174.3 | -61.6 | -168.4 | 158 | 0 | 0 | 111.5 |
Retrieved 320 of 320 residues in 265.1 ms
(Link to these results)