| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.9 | Very low | 36.9 | Very low | 251 Ų | 251 | 137.3 Ų | 137.3 | 100% | 1.236 | 82% | 0.818 | S | S | * | * | 0 | 128.4 | 0 | -73 | -132.4 | -139.7 | 0 | 0 | 108 | |||||
| 2 | A | 35.5 | Very low | 36.5 | Very low | 85 Ų | 85 | 139.1 Ų | 139.1 | 70% | 0.702 | 82% | 0.819 | S | S | * | * | trans | -53.8 | 163.9 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 3 | V | 38.6 | Very low | 36.1 | Very low | 129 Ų | 129 | 141.7 Ų | 141.7 | 78% | 0.782 | 81% | 0.814 | S | S | * | * | cis | -164.7 | 139 | 46.1 | -145.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 4 | F | 34.7 | Very low | 35.9 | Very low | 199 Ų | 199 | 140.6 Ų | 140.6 | 87% | 0.873 | 80% | 0.804 | S | S | * | * | trans | 7 | 152.1 | 141.1 | -66.8 | -103.3 | 0 | 0 | 0 | 120 | ||||
| 5 | S | 37.3 | Very low | 35.7 | Very low | 120 Ų | 120 | 139.1 Ų | 139.1 | 84% | 0.839 | 79% | 0.792 | S | S | * | * | cis | 171.9 | 153.4 | 48.7 | 134.7 | 0 | 0 | 0 | 0 | 106 | ||||
| 6 | G | 35.9 | Very low | 35.5 | Very low | 57 Ų | 57 | 139.4 Ų | 139.4 | 59% | 0.588 | 79% | 0.785 | S | S | * | * | cis | -173.5 | 147.2 | 12.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 7 | V | 40.8 | Very low | 35.4 | Very low | 140 Ų | 140 | 138.6 Ų | 138.6 | 85% | 0.848 | 78% | 0.778 | S | S | * | * | 79 | 98 | 104.3 | -178.6 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 8 | L | 33.8 | Very low | 35.4 | Very low | 153 Ų | 153 | 139 Ų | 139 | 80% | 0.801 | 78% | 0.784 | S | S | * | * | 81.9 | 98.2 | 82.4 | -122.9 | 93.9 | 0 | 0 | 0 | 115.2 | |||||
| 9 | E | 39.3 | Very low | 35.5 | Very low | 177 Ų | 177 | 140.3 Ų | 140.3 | 83% | 0.827 | 79% | 0.788 | S | S | * | * | 19.6 | 128.7 | 118.3 | -150.8 | 163.5 | -151.8 | 0 | 0 | 120 | |||||
| 10 | S | 35.2 | Very low | 35.6 | Very low | 114 Ų | 114 | 143.1 Ų | 143.1 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -171.6 | 106.8 | 154.9 | -71.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 11 | A | 34.7 | Very low | 35.9 | Very low | 85 Ų | 85 | 141 Ų | 141 | 70% | 0.702 | 80% | 0.796 | S | S | * | * | 74.9 | 108.6 | 94.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 12 | L | 32.8 | Very low | 35.8 | Very low | 159 Ų | 159 | 140.9 Ų | 140.9 | 83% | 0.832 | 78% | 0.782 | S | S | * | * | 104.8 | 128.3 | 80.6 | -84.9 | 178.4 | 0 | 0 | 0 | 112.1 | |||||
| 13 | F | 31.2 | Very low | 35.8 | Very low | 173 Ų | 173 | 146 Ų | 146 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | 90.9 | 129.5 | 142.2 | -112.5 | -108.5 | 0 | 0 | 0 | 123.2 | ||||
| 14 | L | 32.8 | Very low | 35.7 | Very low | 127 Ų | 127 | 143.7 Ų | 143.7 | 67% | 0.665 | 79% | 0.794 | S | S | * | * | trans | -3.8 | 150.1 | 157.9 | -78.8 | 69.7 | 0 | 0 | 0 | 118.9 | ||||
| 15 | D | 33.1 | Very low | 35.7 | Very low | 118 Ų | 118 | 139.4 Ų | 139.4 | 63% | 0.631 | 79% | 0.789 | S | S | * | * | -172.2 | 159.2 | 54.7 | -150.7 | 5.4 | 0 | 0 | 0 | 115.6 | |||||
| 16 | Q | 33.3 | Very low | 36.1 | Very low | 144 Ų | 144 | 145.5 Ų | 145.5 | 67% | 0.673 | 79% | 0.793 | S | S | * | * | trans | 72.1 | 119 | 146.5 | -87.3 | 170.2 | 48 | 0 | 0 | 125.9 | ||||
| 17 | N | 32.2 | Very low | 36.9 | Very low | 126 Ų | 126 | 147.3 Ų | 147.3 | 67% | 0.674 | 80% | 0.797 | S | S | * | * | trans | 77.3 | 106.7 | 133.4 | -82.9 | -23 | 0 | 0 | 0 | 121.5 | ||||
| 18 | T | 36 | Very low | 37.3 | Very low | 145 Ų | 145 | 145.9 Ų | 145.9 | 89% | 0.89 | 79% | 0.79 | S | S | * | * | -165.4 | 120.9 | 109.6 | 8.1 | 0 | 0 | 0 | 0 | 112 | |||||
| 19 | L | 37.3 | Very low | 38.2 | Very low | 164 Ų | 164 | 147 Ų | 147 | 86% | 0.859 | 80% | 0.796 | S | S | * | * | trans | -68.7 | 129.1 | 168.2 | -74.8 | 158.4 | 0 | 0 | 0 | 110.1 | ||||
| 20 | Q | 37.6 | Very low | 39.2 | Very low | 195 Ų | 195 | 143.4 Ų | 143.4 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | trans | -150.3 | 109 | 144.9 | -108.5 | 179.4 | 18.4 | 0 | 0 | 111 | ||||
| 21 | A | 41.3 | Very low | 40.3 | Very low | 101 Ų | 101 | 145.8 Ų | 145.8 | 84% | 0.835 | 79% | 0.787 | S | S | * | * | trans | -59.8 | 133.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 22 | R | 37.6 | Very low | 41.5 | Very low | 248 Ų | 248 | 146.6 Ų | 146.6 | 94% | 0.936 | 78% | 0.779 | S | S | * | * | trans | -141.9 | 119.9 | 155.3 | -111.8 | 179.2 | 178.4 | -175.2 | -0.3 | 110.9 | G24 | R22-G24 PolarHBondContact O-N 3.08Š| ||
| 23 | Q | 35.8 | Very low | 42.9 | Very low | 192 Ų | 192 | 148.2 Ų | 148.2 | 90% | 0.897 | 78% | 0.78 | S | S | * | * | trans | -53.5 | 124.4 | -178.7 | -62.7 | 167.3 | 5.3 | 0 | 0 | 110.9 | S25 | Q23-S25 PolarHBondContact O-N 3.49Å; Q23-S25 VanDerWaalsContact O-N 3.14Å | ||
| 24 | G | 36.3 | Very low | 44.3 | Very low | 81 Ų | 81 | 148.7 Ų | 148.7 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | -72.4 | 98.8 | 164.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | R22 R26 | R22-G24 PolarHBondContact O-N 3.08Å; G24-R26 PolarHBondContact O-N 2.94Å | ||
| 25 | S | 36.6 | Very low | 45.8 | Very low | 109 Ų | 109 | 146.5 Ų | 146.5 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | trans | -69.7 | 114.7 | 167.4 | 58.7 | 0 | 0 | 0 | 0 | 108.7 | Q23 S27 | Q23-S25 PolarHBondContact O-N 3.49Å; Q23-S25 VanDerWaalsContact O-N 3.14Å; S25-S27 PolarHBondContact O-N 3.23Å; S25-S27 VanDerWaalsContact O-N 3.09Å | ||
| 26 | R | 43.7 | Very low | 47.4 | Very low | 248 Ų | 248 | 148.2 Ų | 148.2 | 94% | 0.936 | 78% | 0.781 | S | S | * | * | trans | -74.1 | 94.1 | 171 | -149.8 | 179.1 | -168.8 | -176.2 | 3.1 | 107 | G24 | G24-R26 PolarHBondContact O-N 2.94Š| ||
| 27 | S | 53.9 | Low | 48.9 | Very low | 95 Ų | 95 | 151 Ų | 151 | 66% | 0.664 | 79% | 0.786 | S | S | * | * | trans | -73.9 | 132.6 | 170.4 | 48.3 | 0 | 0 | 0 | 0 | 109.6 | S25 L29 | S25-S27 PolarHBondContact O-N 3.23Å; S25-S27 VanDerWaalsContact O-N 3.09Å; S27-L29 PolarHBondContact O-N 3.12Å | ||
| 28 | P | 49.5 | Very low | 50.4 | Low | 109 Ų | 109 | 150.8 Ų | 150.8 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | trans | -67.5 | 128.8 | 173.5 | -13.1 | 27.2 | 0 | 0 | 0 | 109.3 | T30 | P28-T30 PolarHBondContact O-N 2.92Š| ||
| 29 | L | 52.4 | Low | 51.7 | Low | 177 Ų | 177 | 149.3 Ų | 149.3 | 93% | 0.927 | 78% | 0.782 | S | S | * | * | trans | -62.9 | 100.1 | 168.8 | -67.2 | 170.7 | 0 | 0 | 0 | 108.2 | S27 | S27-L29 PolarHBondContact O-N 3.12Š| ||
| 30 | T | 60.3 | Low | 52.7 | Low | 102 Ų | 102 | 152.8 Ų | 152.8 | 63% | 0.626 | 78% | 0.784 | S | S | * | * | trans | -70.1 | 138.5 | 177 | 45.9 | 0 | 0 | 0 | 0 | 110.2 | P28 D32 | P28-T30 PolarHBondContact O-N 2.92Å; T30-D32 PolarHBondContact O-N 3.24Å | ||
| 31 | M | 58.4 | Low | 53.7 | Low | 164 Ų | 164 | 150.9 Ų | 150.9 | 81% | 0.808 | 78% | 0.778 | S | S | * | * | G | 310 helix | trans | -69 | 16.2 | -173.2 | -147.3 | 175.1 | 75.3 | 0 | 0 | 114.1 | ||
| 32 | D | 59 | Low | 54.4 | Low | 101 Ų | 101 | 154.3 Ų | 154.3 | 54% | 0.54 | 78% | 0.777 | S | S | . | * | G | 310 helix | trans | -85.5 | -11.3 | -173.1 | -74.4 | -53 | 0 | 0 | 0 | 113.5 | T30 F34 V35 | T30-D32 PolarHBondContact O-N 3.24Å; D32-F34 PolarHBondContact O-N 3.04Å; D32-V35 PolarHBondContact O-N 3.11Å |
| 33 | K | 61.8 | Low | 55 | Low | 193 Ų | 193 | 149.8 Ų | 149.8 | 84% | 0.839 | 77% | 0.771 | S | S | * | * | G | 310 helix | trans | -72.6 | -15.5 | -179.2 | -157.6 | 175.8 | -178.7 | -177.7 | 0 | 113.8 | ||
| 34 | F | 61.3 | Low | 56 | Low | 184 Ų | 184 | 145.1 Ų | 145.1 | 81% | 0.807 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -105.7 | 4.5 | -179 | -58.8 | -73.5 | 0 | 0 | 0 | 113.6 | D32 I36 | D32-F34 PolarHBondContact O-N 3.04Å; F34-I36 PolarHBondContact O-N 3.16Å |
| 35 | V | 63.6 | Low | 56.9 | Low | 80 Ų | 80 | 147.3 Ų | 147.3 | 49% | 0.485 | 76% | 0.759 | S | S | . | * | trans | -93.6 | 96.5 | -179.3 | -174.2 | 0 | 0 | 0 | 0 | 109.6 | D32 R37 | D32-V35 PolarHBondContact O-N 3.11Å; V35-R37 HydrophobicContact CG1-CG 3.81Å; V35-R37 PolarHBondContact O-N 3.4Å; V35-R37 VanDerWaalsContact O-N 3.15Å | ||
| 36 | I | 68.3 | Low | 57.8 | Low | 155 Ų | 155 | 150.7 Ų | 150.7 | 80% | 0.795 | 76% | 0.763 | S | S | * | * | trans | -74.7 | 101.4 | 166.8 | -57.6 | 173.9 | 0 | 0 | 0 | 107.4 | F34 T38 | F34-I36 PolarHBondContact O-N 3.16Å; I36-T38 PolarHBondContact O-N 3.47Å | ||
| 37 | R | 63.6 | Low | 58.4 | Low | 203 Ų | 203 | 147.9 Ų | 147.9 | 77% | 0.766 | 76% | 0.757 | S | S | * | * | trans | -82.4 | 94.5 | 171.9 | -63.8 | -173.8 | -179.9 | 176.4 | 1.9 | 108.7 | V35 | V35-R37 HydrophobicContact CG1-CG 3.81Å; V35-R37 PolarHBondContact O-N 3.4Å; V35-R37 VanDerWaalsContact O-N 3.15Å | ||
| 38 | T | 65.2 | Low | 58.4 | Low | 120 Ų | 120 | 152.8 Ų | 152.8 | 74% | 0.736 | 77% | 0.767 | S | S | * | * | trans | -64.5 | 133.1 | 167.6 | 26.5 | 0 | 0 | 0 | 0 | 109.5 | I36 R40 | I36-T38 PolarHBondContact O-N 3.47Å; T38-R40 PolarHBondContact O-N 3.29Å | ||
| 39 | P | 62.6 | Low | 58.8 | Low | 115 Ų | 115 | 154.7 Ų | 154.7 | 75% | 0.747 | 77% | 0.771 | S | S | * | * | trans | -62.3 | 131.1 | 177.9 | 23.4 | -30.6 | 0 | 0 | 0 | 109.7 | I41 | P39-I41 PolarHBondContact O-N 3.17Š| ||
| 40 | R | 58.3 | Low | 59.1 | Low | 237 Ų | 237 | 152 Ų | 152 | 89% | 0.894 | 77% | 0.767 | S | S | * | * | trans | -63.1 | 103.1 | 174.9 | -172.1 | 178.7 | -157 | 179.6 | 5.8 | 108.2 | T38 Q42 | T38-R40 PolarHBondContact O-N 3.29Å; R40-Q42 PolarHBondContact O-N 3.05Å; R40-Q42 VanDerWaalsContact O-N 3.08Å | ||
| 41 | I | 57.5 | Low | 59.3 | Low | 155 Ų | 155 | 150.3 Ų | 150.3 | 80% | 0.795 | 77% | 0.77 | S | S | * | * | trans | -56.4 | 117.1 | 171.2 | -61.1 | 171.9 | 0 | 0 | 0 | 107.1 | P39 N43 | P39-I41 PolarHBondContact O-N 3.17Å; I41-N43 PolarHBondContact O-N 3.39Å | ||
| 42 | Q | 57.4 | Low | 59.6 | Low | 173 Ų | 173 | 145.5 Ų | 145.5 | 81% | 0.808 | 76% | 0.763 | S | S | * | * | trans | -67.9 | 114.6 | 172.6 | -70.5 | -178.1 | -11.9 | 0 | 0 | 108.3 | R40 | R40-Q42 PolarHBondContact O-N 3.05Å; R40-Q42 VanDerWaalsContact O-N 3.08Å | ||
| 43 | N | 50.5 | Low | 60.3 | Low | 153 Ų | 153 | 148.4 Ų | 148.4 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | trans | 40.1 | 83.8 | 150.3 | -53.2 | -29.1 | 0 | 0 | 0 | 116.3 | I41 | I41-N43 PolarHBondContact O-N 3.39Š| ||
| 44 | S | 55.7 | Low | 61 | Low | 93 Ų | 93 | 145.1 Ų | 145.1 | 65% | 0.65 | 77% | 0.766 | S | S | * | * | trans | -63.5 | 133.9 | 144.3 | 54.9 | 0 | 0 | 0 | 0 | 107.9 | Q46 | S44-Q46 PolarHBondContact O-N 3.04Š| ||
| 45 | P | 55.1 | Low | 61.8 | Low | 128 Ų | 128 | 145.7 Ų | 145.7 | 83% | 0.831 | 76% | 0.764 | S | S | * | * | trans | -58.8 | 107.1 | 170.6 | 23.1 | -29.7 | 0 | 0 | 0 | 107.4 | K47 | P45-K47 PolarHBondContact O-N 3.14Š| ||
| 46 | Q | 55.5 | Low | 62.7 | Low | 179 Ų | 179 | 150.8 Ų | 150.8 | 84% | 0.836 | 78% | 0.78 | S | S | * | * | trans | -54.4 | 115.2 | 167.1 | -82.5 | -179.8 | -54.3 | 0 | 0 | 105.6 | S44 K48 | S44-Q46 PolarHBondContact O-N 3.04Å; Q46-K48 VanDerWaalsContact C-N 3.35Å; Q46-K48 PolarHBondContact O-N 3.12Å | ||
| 47 | K | 56.3 | Low | 63.6 | Low | 190 Ų | 190 | 152.8 Ų | 152.8 | 83% | 0.826 | 79% | 0.786 | S | S | * | * | trans | -48.3 | 111.5 | 156.6 | -96.7 | -179.8 | 171.7 | 178.3 | 0 | 105 | P45 D49 | P45-K47 PolarHBondContact O-N 3.14Å; K47-D49 VanDerWaalsContact C-N 3.27Å; K47-D49 PolarHBondContact O-N 3.22Å | ||
| 48 | K | 54.9 | Low | 64.5 | Low | 197 Ų | 197 | 146.1 Ų | 146.1 | 86% | 0.857 | 78% | 0.775 | S | S | * | * | trans | -57.9 | 104.3 | 161.5 | -84 | -178.4 | 176 | 176.8 | 0 | 104.1 | Q46 S50 | Q46-K48 VanDerWaalsContact C-N 3.35Å; Q46-K48 PolarHBondContact O-N 3.12Å; K48-S50 PolarHBondContact O-N 3.32Å | ||
| 49 | D | 56.8 | Low | 65.6 | Low | 149 Ų | 149 | 145 Ų | 145 | 80% | 0.797 | 77% | 0.768 | S | S | * | * | trans | -60.7 | 95.5 | 163.7 | -76.8 | -29 | 0 | 0 | 0 | 106 | K47 G51 | K47-D49 VanDerWaalsContact C-N 3.27Å; K47-D49 PolarHBondContact O-N 3.22Å; D49-G51 PolarHBondContact O-N 3.46Å | ||
| 50 | S | 59.8 | Low | 66.7 | Low | 121 Ų | 121 | 145 Ų | 145 | 85% | 0.846 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 100.9 | 174.7 | 48.3 | 0 | 0 | 0 | 0 | 107.5 | K48 | K48-S50 PolarHBondContact O-N 3.32Š|
| 51 | G | 63.2 | Low | 67.9 | Low | 67 Ų | 67 | 139.3 Ų | 139.3 | 69% | 0.691 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 124.1 | 33.6 | 166 | 0 | 0 | 0 | 0 | 0 | 116.5 | D49 K53 | D49-G51 PolarHBondContact O-N 3.46Å; G51-K53 PolarHBondContact O-N 2.85Å; G51-K53 VanDerWaalsContact O-N 3.09Å |
| 52 | G | 64.1 | Low | 69.2 | Low | 63 Ų | 63 | 135.4 Ų | 135.4 | 65% | 0.649 | 73% | 0.73 | S | S | * | * | trans | -53.4 | 118.4 | 161.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | V54 | G52-V54 PolarHBondContact O-N 3.03Š| ||
| 53 | K | 75.6 | Confident | 70.6 | Confident | 161 Ų | 161 | 131.3 Ų | 131.3 | 70% | 0.7 | 71% | 0.713 | S | S | * | * | trans | -57.4 | 111.6 | -179.9 | -71.2 | 178.8 | -179.8 | 176.9 | 0 | 108.6 | G51 Y55 | G51-K53 PolarHBondContact O-N 2.85Å; G51-K53 VanDerWaalsContact O-N 3.09Å; K53-Y55 HydrophobicContact CB-CD2 4.43Å; K53-Y55 HydrophobicContact CB-CE1 4.2Å; K53-Y55 HydrophobicContact CB-CE2 3.86Å; K53-Y55 HydrophobicContact CD-CE1 4.43Å; K53-Y55 WeakPolarHBondContact O-CD2 3.3Å; K53-Y55 WeakPolarHBondContact O-CE2 2.86Å; K53-Y55 PolarHBondContact O-N 3.21Å | ||
| 54 | V | 75.4 | Confident | 72.3 | Confident | 125 Ų | 125 | 128.6 Ų | 128.6 | 76% | 0.758 | 69% | 0.694 | S | S | * | * | trans | -72.9 | 97.2 | 171.6 | -179.2 | 0 | 0 | 0 | 0 | 107 | G52 K56 | G52-V54 PolarHBondContact O-N 3.03Å; V54-K56 HydrophobicContact CG1-CG 4.41Å; V54-K56 PolarHBondContact O-N 3.46Å | ||
| 55 | Y | 78.6 | Confident | 73.8 | Confident | 196 Ų | 196 | 131.1 Ų | 131.1 | 77% | 0.769 | 69% | 0.69 | S | S | * | * | trans | -73.8 | 108.9 | 172.2 | -59.8 | -79.6 | 0 | 0 | 0 | 108 | K53 | K53-Y55 HydrophobicContact CB-CD2 4.43Å; K53-Y55 HydrophobicContact CB-CE1 4.2Å; K53-Y55 HydrophobicContact CB-CE2 3.86Å; K53-Y55 HydrophobicContact CD-CE1 4.43Å; K53-Y55 WeakPolarHBondContact O-CD2 3.3Å; K53-Y55 WeakPolarHBondContact O-CE2 2.86Å; K53-Y55 PolarHBondContact O-N 3.21Å | ||
| 56 | K | 81.9 | Confident | 75.3 | Confident | 186 Ų | 186 | 127.3 Ų | 127.3 | 81% | 0.809 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -84 | 132.4 | 167.4 | -65 | -177.3 | -179.6 | -179.3 | 0 | 108.1 | V54 A58 | V54-K56 HydrophobicContact CG1-CG 4.41Å; V54-K56 PolarHBondContact O-N 3.46Å; K56-A58 PolarHBondContact O-N 3.47Å |
| 57 | Q | 87.1 | Confident | 76.8 | Confident | 197 Ų | 197 | 120.1 Ų | 120.1 | 92% | 0.921 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -65 | 129.1 | 171.9 | -176.1 | 174 | -11.3 | 0 | 0 | 109.1 | ||
| 58 | A | 83.8 | Confident | 78.4 | Confident | 64 Ų | 64 | 113.8 Ų | 113.8 | 53% | 0.529 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -99.9 | 139.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110 | K56 | K56-A58 PolarHBondContact O-N 3.47Š|
| 59 | T | 86.6 | Confident | 80.1 | Confident | 96 Ų | 96 | 107.2 Ų | 107.2 | 59% | 0.589 | 59% | 0.586 | S | S | * | * | P | Polyproline II helix | trans | -68 | 142.2 | 173.6 | -49.8 | 0 | 0 | 0 | 0 | 109.9 | E61 S62 | T59-E61 PolarHBondContact O-N 3.4Å; T59-E61 VanDerWaalsContact O-N 3.13Å; T59-S62 WeakPolarHBondContact O-CB 3.31Å; T59-S62 PolarHBondContact O-N 3.1Å; T59-S62 PolarHBondContact O-OG 2.99Å |
| 60 | I | 86.6 | Confident | 81.7 | Confident | 114 Ų | 114 | 105.6 Ų | 105.6 | 59% | 0.585 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -54 | -37.6 | -176.6 | -164.9 | 169.7 | 0 | 0 | 0 | 112.8 | S62 L63 V66 | I60-S62 VanDerWaalsContact C-N 3.3Å; I60-S62 PolarHBondContact O-N 3.27Å; I60-L63 WeakPolarHBondContact O-CB 3.44Å; I60-L63 WeakPolarHBondContact O-CG 3.4Å; I60-L63 PolarHBondContact O-N 2.85Å; I60-V66 HydrophobicContact CG1-CG1 4.22Å; I60-V66 HydrophobicContact CG1-CG2 4.1Å; I60-V66 VanDerWaalsContact O-CB 3.32Å; I60-V66 WeakPolarHBondContact O-CB 3.36Å; I60-V66 WeakPolarHBondContact O-CG2 3.27Å |
| 61 | E | 84.2 | Confident | 83.2 | Confident | 118 Ų | 118 | 103.2 Ų | 103.2 | 55% | 0.551 | 55% | 0.551 | S | S | * | * | G | 310 helix | trans | -68 | -25.5 | 179 | -64.2 | 171.7 | -177.5 | 0 | 0 | 113.4 | T59 L63 V68 K99 | T59-E61 PolarHBondContact O-N 3.4Å; T59-E61 VanDerWaalsContact O-N 3.13Å; E61-L63 PolarHBondContact O-N 3.34Å; E61-V68 HydrophobicContact CG-CG2 4.44Å; E61-K99 PolarHBondContact O-NZ 3.2Å |
| 62 | S | 84.8 | Confident | 84.6 | Confident | 74 Ų | 74 | 100.1 Ų | 100.1 | 52% | 0.517 | 52% | 0.519 | S | S | . | . | G | 310 helix | trans | -70.7 | -17.3 | 178.8 | 72 | 0 | 0 | 0 | 0 | 112.5 | T59 I60 | T59-S62 WeakPolarHBondContact O-CB 3.31Å; T59-S62 PolarHBondContact O-N 3.1Å; T59-S62 PolarHBondContact O-OG 2.99Å; I60-S62 VanDerWaalsContact C-N 3.3Å; I60-S62 PolarHBondContact O-N 3.27Å |
| 63 | L | 87 | Confident | 85.9 | Confident | 86 Ų | 86 | 101.7 Ų | 101.7 | 45% | 0.45 | 51% | 0.508 | S | S | . | . | S | Bend | trans | -70.8 | 131.5 | -178.7 | -59 | 177.6 | 0 | 0 | 0 | 110.9 | I60 E61 R65 V66 | I60-L63 WeakPolarHBondContact O-CB 3.44Å; I60-L63 WeakPolarHBondContact O-CG 3.4Å; I60-L63 PolarHBondContact O-N 2.85Å; E61-L63 PolarHBondContact O-N 3.34Å; L63-R65 PolarHBondContact O-N 2.85Å; L63-R65 VanDerWaalsContact O-N 3.07Å; L63-V66 HydrophobicContact CB-CB 4.19Å; L63-V66 HydrophobicContact CB-CG2 3.86Å; L63-V66 HydrophobicContact CD1-CG2 4.03Å; L63-V66 PolarHBondContact O-N 2.94Å |
| 64 | K | 86.1 | Confident | 86.7 | Confident | 97 Ų | 97 | 100.6 Ų | 100.6 | 42% | 0.422 | 50% | 0.499 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | -31.7 | -179.5 | -171.8 | 169.1 | -164.4 | -173.5 | 0 | 114.1 | I100 E136 | K64-I100 HydrophobicContact CD-CD1 3.81Å; K64-I100 HydrophobicContact CD-CG1 4.22Å; K64-I100 VanDerWaalsContact CE-CD1 3.41Å; K64-I100 HydrophobicContact CG-CD1 4.01Å; K64-I100 HydrophobicContact CG-CG1 3.97Å; K64-I100 PolarHBondContact O-N 3.1Å; K64-E136 WeakPolarHBondContact CE-OE1 3.39Å; K64-E136 IonicContact NZ-OE1 2.67Å; K64-E136 PolarHBondContact NZ-OE1 2.92Å |
| 65 | R | 85.9 | Confident | 87.5 | Confident | 146 Ų | 146 | 96.1 Ų | 96.1 | 55% | 0.551 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | -11.9 | -177.4 | -66.7 | -174.5 | 179.6 | -118.8 | -2.2 | 114 | L63 F140 H144 | L63-R65 PolarHBondContact O-N 2.85Å; L63-R65 VanDerWaalsContact O-N 3.07Å; R65-F140 VanDerWaalsContact CZ-CZ 3.47Å; R65-F140 VanDerWaalsContact NH1-CZ 3.25Å; R65-H144 PolarHBondContact NH2-NE2 3.21Å |
| 66 | V | 86.2 | Confident | 88.1 | Confident | 48 Ų | 48 | 89.1 Ų | 89.1 | 29% | 0.291 | 44% | 0.442 | S | S | . | . | trans | -93.7 | 122.5 | 178.5 | 178.1 | 0 | 0 | 0 | 0 | 107.3 | I60 L63 | I60-V66 HydrophobicContact CG1-CG1 4.22Å; I60-V66 HydrophobicContact CG1-CG2 4.1Å; I60-V66 VanDerWaalsContact O-CB 3.32Å; I60-V66 WeakPolarHBondContact O-CB 3.36Å; I60-V66 WeakPolarHBondContact O-CG2 3.27Å; L63-V66 HydrophobicContact CB-CB 4.19Å; L63-V66 HydrophobicContact CB-CG2 3.86Å; L63-V66 HydrophobicContact CD1-CG2 4.03Å; L63-V66 PolarHBondContact O-N 2.94Å | ||
| 67 | V | 87.1 | Confident | 88.5 | Confident | 27 Ų | 27 | 84 Ų | 84 | 16% | 0.164 | 43% | 0.426 | C | S | . | . | trans | -128.6 | 123.6 | -175.6 | -176.3 | 0 | 0 | 0 | 0 | 108.2 | V69 I72 K99 P101 | V67-V69 PolarHBondContact O-N 3.08Å; V67-I72 HydrophobicContact CG1-CD1 3.47Å; V67-I72 VanDerWaalsContact CG1-CD1 3.47Å; V67-I72 HydrophobicContact CG1-CG1 3.16Å; V67-K99 HydrophobicContact CG2-CB 4.02Å; V67-P101 HydrophobicContact CG2-CB 4.38Å; V67-P101 HydrophobicContact CG2-CG 4.43Å | ||
| 68 | V | 90.5 | Very high | 88.6 | Confident | 58 Ų | 58 | 76.1 Ų | 76.1 | 35% | 0.352 | 39% | 0.39 | S | S | . | . | trans | -75.8 | 120.9 | 171.5 | -178.4 | 0 | 0 | 0 | 0 | 107.3 | E61 E70 D71 I72 | E61-V68 HydrophobicContact CG-CG2 4.44Å; V68-E70 VanDerWaalsContact C-N 3.27Å; V68-E70 HydrophobicContact CG1-CB 4.36Å; V68-E70 PolarHBondContact O-N 3.01Å; V68-D71 HydrophobicContact CB-CB 4.25Å; V68-D71 WeakPolarHBondContact CB-OD2 3.43Å; V68-D71 PolarHBondContact O-N 3.43Å; V68-I72 PolarHBondContact O-N 2.96Å | ||
| 69 | V | 90.4 | Very high | 88.8 | Confident | 59 Ų | 59 | 73.3 Ų | 73.3 | 36% | 0.358 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.3 | -35.1 | -173.4 | 176.2 | 0 | 0 | 0 | 0 | 111.6 | V67 I72 K73 V105 T109 | V67-V69 PolarHBondContact O-N 3.08Å; V69-I72 PolarHBondContact O-N 3.36Å; V69-K73 WeakPolarHBondContact O-CG 3.42Å; V69-K73 PolarHBondContact O-N 3.28Å; V69-V105 HydrophobicContact CG2-CG2 4.29Å; V69-T109 HydrophobicContact CG1-CG2 4.48Å |
| 70 | E | 91.4 | Very high | 88.9 | Confident | 115 Ų | 115 | 73.3 Ų | 73.3 | 54% | 0.537 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.9 | -40.3 | 176.5 | -68.5 | -58 | 115.6 | 0 | 0 | 112.1 | V68 I72 K73 R74 | V68-E70 VanDerWaalsContact C-N 3.27Å; V68-E70 HydrophobicContact CG1-CB 4.36Å; V68-E70 PolarHBondContact O-N 3.01Å; E70-I72 VanDerWaalsContact C-N 3.31Å; E70-I72 PolarHBondContact O-N 3.32Å; E70-K73 WeakPolarHBondContact O-CB 3.27Å; E70-K73 PolarHBondContact O-N 3.32Å; E70-K73 VanDerWaalsContact O-N 3.13Å; E70-K73 IonicContact OE1-NZ 3.12Å; E70-K73 PolarHBondContact OE1-NZ 3.02Å; E70-R74 WeakPolarHBondContact O-CB 3.45Å; E70-R74 PolarHBondContact O-N 3.21Å |
| 71 | D | 90.5 | Very high | 88.8 | Confident | 70 Ų | 70 | 72.7 Ų | 72.7 | 37% | 0.374 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.7 | -40.6 | 175.4 | -67 | -17.3 | 0 | 0 | 0 | 111.5 | V68 K73 R74 W75 | V68-D71 HydrophobicContact CB-CB 4.25Å; V68-D71 WeakPolarHBondContact CB-OD2 3.43Å; V68-D71 PolarHBondContact O-N 3.43Å; D71-K73 VanDerWaalsContact C-N 3.33Å; D71-K73 PolarHBondContact O-N 3.01Å; D71-R74 WeakPolarHBondContact O-CB 3.3Å; D71-R74 PolarHBondContact O-N 2.9Å; D71-W75 PolarHBondContact O-N 3.07Å |
| 72 | I | 92 | Very high | 88.2 | Confident | 3 Ų | 3 | 72.1 Ų | 72.1 | 2% | 0.015 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.9 | -40.3 | 175.6 | -63.7 | -63.3 | 0 | 0 | 0 | 111.5 | V67 V68 V69 E70 W75 K76 L96 P101 V105 T109 I111 | V67-I72 HydrophobicContact CG1-CD1 3.47Å; V67-I72 VanDerWaalsContact CG1-CD1 3.47Å; V67-I72 HydrophobicContact CG1-CG1 3.16Å; V68-I72 PolarHBondContact O-N 2.96Å; V69-I72 PolarHBondContact O-N 3.36Å; E70-I72 VanDerWaalsContact C-N 3.31Å; E70-I72 PolarHBondContact O-N 3.32Å; I72-W75 PolarHBondContact O-N 2.92Å; I72-K76 VanDerWaalsContact O-CB 3.28Å; I72-K76 WeakPolarHBondContact O-CB 3.31Å; I72-K76 PolarHBondContact O-N 3.29Å; I72-L96 HydrophobicContact CD1-CD2 3.5Å; I72-P101 HydrophobicContact CD1-CG 4.1Å; I72-V105 HydrophobicContact CG1-CG1 4.44Å; I72-V105 HydrophobicContact CG2-CG1 4.49Å; I72-T109 HydrophobicContact CG2-CG2 3.86Å; I72-I111 HydrophobicContact CG2-CB 3.97Å; I72-I111 HydrophobicContact CG2-CG1 4.24Å; I72-I111 HydrophobicContact CG2-CG2 3.85Å |
| 73 | K | 92.1 | Very high | 87.8 | Confident | 96 Ų | 96 | 76.6 Ų | 76.6 | 42% | 0.417 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -65.6 | -42.1 | 175.5 | -70.2 | 175.7 | -174.8 | 166.6 | 0 | 111.1 | V69 E70 D71 W75 K76 T77 T109 | V69-K73 WeakPolarHBondContact O-CG 3.42Å; V69-K73 PolarHBondContact O-N 3.28Å; E70-K73 WeakPolarHBondContact O-CB 3.27Å; E70-K73 PolarHBondContact O-N 3.32Å; E70-K73 VanDerWaalsContact O-N 3.13Å; E70-K73 IonicContact OE1-NZ 3.12Å; E70-K73 PolarHBondContact OE1-NZ 3.02Å; D71-K73 VanDerWaalsContact C-N 3.33Å; D71-K73 PolarHBondContact O-N 3.01Å; K73-W75 PolarHBondContact O-N 3.39Å; K73-K76 WeakPolarHBondContact O-CB 3.33Å; K73-K76 PolarHBondContact O-N 3.21Å; K73-T77 PolarHBondContact O-N 2.92Å; K73-T77 PolarHBondContact O-OG1 2.92Å; K73-T109 HydrophobicContact CG-CG2 4.49Å |
| 74 | R | 92.9 | Very high | 87.3 | Confident | 138 Ų | 138 | 74.9 Ų | 74.9 | 52% | 0.521 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.8 | -45.1 | 176 | -173.3 | -174.8 | 166.5 | -143 | -12.3 | 111.3 | E70 D71 T77 M78 | E70-R74 WeakPolarHBondContact O-CB 3.45Å; E70-R74 PolarHBondContact O-N 3.21Å; D71-R74 WeakPolarHBondContact O-CB 3.3Å; D71-R74 PolarHBondContact O-N 2.9Å; R74-T77 PolarHBondContact O-N 3.49Å; R74-T77 PolarHBondContact O-OG1 3.4Å; R74-M78 WeakPolarHBondContact O-CB 3.28Å; R74-M78 PolarHBondContact O-N 3.02Å |
| 75 | W | 91.6 | Very high | 87.3 | Confident | 31 Ų | 31 | 74.1 Ų | 74.1 | 12% | 0.117 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -69.4 | -35.7 | 177.4 | -59.5 | 170.5 | 0 | 0 | 0 | 111.7 | D71 I72 K73 M78 L79 E95 L96 | D71-W75 PolarHBondContact O-N 3.07Å; I72-W75 PolarHBondContact O-N 2.92Å; K73-W75 PolarHBondContact O-N 3.39Å; W75-M78 HydrophobicContact CE3-CE 4.19Å; W75-M78 HydrophobicContact CE3-SD 4.18Å; W75-M78 HydrophobicContact CZ3-CE 3.78Å; W75-M78 HydrophobicContact CZ3-SD 4.22Å; W75-M78 WeakPolarHBondContact O-CB 3.32Å; W75-M78 PolarHBondContact O-N 3.31Å; W75-L79 VanDerWaalsContact O-CG 3.27Å; W75-L79 WeakPolarHBondContact O-CG 3.34Å; W75-L79 PolarHBondContact O-N 3.4Å; W75-E95 HydrophobicContact CZ2-CG 4.47Å; W75-L96 HydrophobicContact CB-CD1 4.27Å; W75-L96 HydrophobicContact CB-CD2 4.22Å; W75-L96 HydrophobicContact CB-CG 4.23Å; W75-L96 HydrophobicContact CG-CD2 4.47Å; W75-L96 HydrophobicContact CG-CG 4.47Å |
| 76 | K | 90.8 | Very high | 87.3 | Confident | 48 Ų | 48 | 73.3 Ų | 73.3 | 21% | 0.209 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -58 | -52.8 | 172.1 | -175.6 | -172.7 | 170 | -176.6 | 0 | 111.3 | I72 K73 M78 L79 E80 T109 I111 | I72-K76 VanDerWaalsContact O-CB 3.28Å; I72-K76 WeakPolarHBondContact O-CB 3.31Å; I72-K76 PolarHBondContact O-N 3.29Å; K73-K76 WeakPolarHBondContact O-CB 3.33Å; K73-K76 PolarHBondContact O-N 3.21Å; K76-M78 PolarHBondContact O-N 3.17Å; K76-L79 PolarHBondContact O-N 3.03Å; K76-L79 VanDerWaalsContact O-N 3.08Å; K76-E80 WeakPolarHBondContact CE-OE1 3.27Å; K76-E80 VanDerWaalsContact CE-OE2 3.31Å; K76-E80 WeakPolarHBondContact CE-OE2 3.26Å; K76-E80 HydrophobicContact CG-CG 4.34Å; K76-E80 IonicContact NZ-OE1 3.67Å; K76-E80 WeakPolarHBondContact O-CG 3.44Å; K76-E80 PolarHBondContact O-N 3.36Å; K76-T109 VanDerWaalsContact CD-O 3.31Å; K76-T109 WeakPolarHBondContact CD-O 3.47Å; K76-T109 WeakPolarHBondContact CE-O 3.38Å; K76-T109 PolarHBondContact NZ-O 2.91Å; K76-I111 VanDerWaalsContact CA-CD1 3.49Å; K76-I111 HydrophobicContact CB-CD1 3.61Å; K76-I111 HydrophobicContact CG-CD1 4.01Å |
| 77 | T | 91.3 | Very high | 87.4 | Confident | 78 Ų | 78 | 77.5 Ų | 77.5 | 48% | 0.479 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.4 | -38.6 | 179.9 | 50.8 | 0 | 0 | 0 | 0 | 110.8 | K73 R74 L79 E80 L81 | K73-T77 PolarHBondContact O-N 2.92Å; K73-T77 PolarHBondContact O-OG1 2.92Å; R74-T77 PolarHBondContact O-N 3.49Å; R74-T77 PolarHBondContact O-OG1 3.4Å; T77-L79 VanDerWaalsContact C-N 3.26Å; T77-L79 PolarHBondContact O-N 3.27Å; T77-E80 PolarHBondContact O-N 3.04Å; T77-L81 VanDerWaalsContact O-CG 3.3Å; T77-L81 WeakPolarHBondContact O-CG 3.46Å; T77-L81 PolarHBondContact O-N 3.41Å |
| 78 | M | 88.4 | Confident | 87.5 | Confident | 32 Ų | 32 | 79.1 Ų | 79.1 | 16% | 0.158 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -61.2 | -31.9 | 175.8 | -164.4 | 177 | -87.8 | 0 | 0 | 113.3 | R74 W75 K76 Q84 N88 A92 | R74-M78 WeakPolarHBondContact O-CB 3.28Å; R74-M78 PolarHBondContact O-N 3.02Å; W75-M78 HydrophobicContact CE3-CE 4.19Å; W75-M78 HydrophobicContact CE3-SD 4.18Å; W75-M78 HydrophobicContact CZ3-CE 3.78Å; W75-M78 HydrophobicContact CZ3-SD 4.22Å; W75-M78 WeakPolarHBondContact O-CB 3.32Å; W75-M78 PolarHBondContact O-N 3.31Å; K76-M78 PolarHBondContact O-N 3.17Å; M78-Q84 PolarHBondContact O-NE2 3.44Å; M78-N88 HydrophobicContact SD-CB 4.48Å; M78-A92 HydrophobicContact CG-CB 4.38Å; M78-A92 HydrophobicContact SD-CB 3.78Å |
| 79 | L | 88.3 | Confident | 87.4 | Confident | 5 Ų | 5 | 76.7 Ų | 76.7 | 3% | 0.026 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -91.6 | -17.3 | 179.1 | -66.4 | 174.7 | 0 | 0 | 0 | 113.9 | W75 K76 T77 L89 A92 L93 L96 I111 T114 V115 M118 | W75-L79 VanDerWaalsContact O-CG 3.27Å; W75-L79 WeakPolarHBondContact O-CG 3.34Å; W75-L79 PolarHBondContact O-N 3.4Å; K76-L79 PolarHBondContact O-N 3.03Å; K76-L79 VanDerWaalsContact O-N 3.08Å; T77-L79 VanDerWaalsContact C-N 3.26Å; T77-L79 PolarHBondContact O-N 3.27Å; L79-L89 HydrophobicContact CD2-CD2 3.7Å; L79-A92 HydrophobicContact CD2-CB 4.03Å; L79-A92 HydrophobicContact CG-CB 4.26Å; L79-L93 HydrophobicContact CD1-CD2 4.03Å; L79-L93 HydrophobicContact CD2-CD2 4.3Å; L79-L93 HydrophobicContact CD2-CG 4.08Å; L79-L96 HydrophobicContact CD1-CD1 3.7Å; L79-I111 HydrophobicContact CD1-CD1 4.27Å; L79-T114 HydrophobicContact CB-CG2 3.63Å; L79-V115 HydrophobicContact CD1-CG2 4.33Å; L79-M118 HydrophobicContact CD2-CG 4.36Å |
| 80 | E | 88.5 | Confident | 87.4 | Confident | 97 Ų | 97 | 74.7 Ų | 74.7 | 45% | 0.453 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -89.5 | -26.3 | -179.7 | -77.1 | -178.5 | 171.5 | 0 | 0 | 113.4 | K76 T77 T114 | K76-E80 WeakPolarHBondContact CE-OE1 3.27Å; K76-E80 VanDerWaalsContact CE-OE2 3.31Å; K76-E80 WeakPolarHBondContact CE-OE2 3.26Å; K76-E80 HydrophobicContact CG-CG 4.34Å; K76-E80 IonicContact NZ-OE1 3.67Å; K76-E80 WeakPolarHBondContact O-CG 3.44Å; K76-E80 PolarHBondContact O-N 3.36Å; T77-E80 PolarHBondContact O-N 3.04Å; E80-T114 HydrophobicContact CG-CG2 3.52Å; E80-T114 PolarHBondContact OE1-OG1 3.09Å |
| 81 | L | 85.7 | Confident | 87.5 | Confident | 101 Ų | 101 | 74.2 Ų | 74.2 | 53% | 0.529 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -65 | 125.1 | -179.5 | -73 | 171.2 | 0 | 0 | 0 | 111 | T77 | T77-L81 VanDerWaalsContact O-CG 3.3Å; T77-L81 WeakPolarHBondContact O-CG 3.46Å; T77-L81 PolarHBondContact O-N 3.41Å |
| 82 | P | 71.4 | Confident | 87.5 | Confident | 105 Ų | 105 | 71 Ų | 71 | 68% | 0.682 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.1 | 145.3 | 163.6 | 30.8 | -30.9 | 0 | 0 | 0 | 108.4 | ||
| 83 | D | 75.6 | Confident | 87.5 | Confident | 168 Ų | 168 | 70.8 Ų | 70.8 | 90% | 0.898 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.3 | 19.2 | -179.9 | -44.6 | -33.1 | 0 | 0 | 0 | 117 | ||
| 84 | Q | 77.1 | Confident | 87.6 | Confident | 51 Ų | 51 | 70.4 Ų | 70.4 | 24% | 0.238 | 35% | 0.351 | C | S | . | . | trans | -72.9 | 143.9 | 173.2 | -145.7 | 87.1 | -18.5 | 0 | 0 | 112.5 | M78 N88 L89 | M78-Q84 PolarHBondContact O-NE2 3.44Å; Q84-N88 HydrophobicContact CG-CB 4.01Å; Q84-L89 HydrophobicContact CB-CD2 3.92Å; Q84-L89 HydrophobicContact CB-CG 4.12Å; Q84-L89 HydrophobicContact CG-CD2 3.97Å; Q84-L89 HydrophobicContact CG-CG 4.25Å | ||
| 85 | T | 85.4 | Confident | 87.5 | Confident | 81 Ų | 81 | 66.6 Ų | 66.6 | 50% | 0.497 | 34% | 0.339 | S | S | . | . | trans | -68.2 | 145.9 | 170.2 | 59.4 | 0 | 0 | 0 | 0 | 111 | E87 N88 L89 | T85-E87 PolarHBondContact O-N 3.11Å; T85-N88 PolarHBondContact O-N 3.48Å; T85-N88 PolarHBondContact OG1-ND2 3.03Å; T85-N88 PolarHBondContact OG1-OD1 3.49Å; T85-L89 PolarHBondContact O-N 3.4Å | ||
| 86 | K | 86.1 | Confident | 87.5 | Confident | 129 Ų | 129 | 65.1 Ų | 65.1 | 56% | 0.561 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -52.9 | -38 | 178.1 | 68.1 | -178 | -177.6 | 174.4 | 0 | 112.9 | L89 V90 | K86-L89 PolarHBondContact O-N 2.92Å; K86-V90 WeakPolarHBondContact O-CG2 3.42Å; K86-V90 PolarHBondContact O-N 2.93Å |
| 87 | E | 88.3 | Confident | 87.5 | Confident | 136 Ų | 136 | 66.6 Ų | 66.6 | 64% | 0.636 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -65.7 | -43.7 | -176.3 | -68.1 | 170.9 | -167.3 | 0 | 0 | 111.1 | T85 L89 V90 E91 | T85-E87 PolarHBondContact O-N 3.11Å; E87-L89 VanDerWaalsContact C-N 3.31Å; E87-L89 PolarHBondContact O-N 2.74Å; E87-V90 PolarHBondContact O-N 3.03Å; E87-E91 WeakPolarHBondContact O-CB 3.24Å; E87-E91 PolarHBondContact O-N 3.47Å |
| 88 | N | 89.5 | Confident | 87.5 | Confident | 60 Ų | 60 | 68.4 Ų | 68.4 | 32% | 0.321 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.4 | -36.9 | 177.4 | -67.5 | -2.8 | 0 | 0 | 0 | 111.7 | M78 Q84 T85 A92 | M78-N88 HydrophobicContact SD-CB 4.48Å; Q84-N88 HydrophobicContact CG-CB 4.01Å; T85-N88 PolarHBondContact O-N 3.48Å; T85-N88 PolarHBondContact OG1-ND2 3.03Å; T85-N88 PolarHBondContact OG1-OD1 3.49Å; N88-A92 WeakPolarHBondContact O-CB 3.25Å; N88-A92 PolarHBondContact O-N 3.18Å |
| 89 | L | 87.9 | Confident | 87.6 | Confident | 8 Ų | 8 | 69.2 Ų | 69.2 | 4% | 0.042 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -66.1 | -43.8 | 176.3 | -63.7 | 176.6 | 0 | 0 | 0 | 111.3 | L79 Q84 T85 K86 E87 L93 V126 | L79-L89 HydrophobicContact CD2-CD2 3.7Å; Q84-L89 HydrophobicContact CB-CD2 3.92Å; Q84-L89 HydrophobicContact CB-CG 4.12Å; Q84-L89 HydrophobicContact CG-CD2 3.97Å; Q84-L89 HydrophobicContact CG-CG 4.25Å; T85-L89 PolarHBondContact O-N 3.4Å; K86-L89 PolarHBondContact O-N 2.92Å; E87-L89 VanDerWaalsContact C-N 3.31Å; E87-L89 PolarHBondContact O-N 2.74Å; L89-L93 WeakPolarHBondContact O-CB 3.48Å; L89-L93 VanDerWaalsContact O-CG 3.25Å; L89-L93 WeakPolarHBondContact O-CG 3.32Å; L89-L93 PolarHBondContact O-N 3.06Å; L89-V126 HydrophobicContact CB-CG1 4.29Å; L89-V126 HydrophobicContact CB-CG2 4.23Å; L89-V126 HydrophobicContact CD1-CG1 4.47Å |
| 90 | V | 90.9 | Very high | 87.7 | Confident | 16 Ų | 16 | 69.5 Ų | 69.5 | 10% | 0.097 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.9 | -45.4 | 177.3 | 173.1 | 0 | 0 | 0 | 0 | 110.6 | K86 E87 A92 L93 Q94 E125 V126 | K86-V90 WeakPolarHBondContact O-CG2 3.42Å; K86-V90 PolarHBondContact O-N 2.93Å; E87-V90 PolarHBondContact O-N 3.03Å; V90-A92 PolarHBondContact O-N 3.2Å; V90-L93 PolarHBondContact O-N 3.46Å; V90-Q94 HydrophobicContact CG1-CG 4.26Å; V90-Q94 WeakPolarHBondContact O-CB 3.3Å; V90-Q94 VanDerWaalsContact O-CG 3.28Å; V90-Q94 WeakPolarHBondContact O-CG 3.47Å; V90-Q94 PolarHBondContact O-N 2.86Å; V90-E125 HydrophobicContact CG2-CG 4.36Å; V90-V126 HydrophobicContact CG2-CG2 3.87Å |
| 91 | E | 92.6 | Very high | 87.7 | Confident | 106 Ų | 106 | 65 Ų | 65 | 50% | 0.495 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -58.6 | -49.5 | 177.1 | -173.3 | -177.8 | -174.3 | 0 | 0 | 111.3 | E87 L93 Q94 E95 | E87-E91 WeakPolarHBondContact O-CB 3.24Å; E87-E91 PolarHBondContact O-N 3.47Å; E91-L93 VanDerWaalsContact C-N 3.33Å; E91-L93 PolarHBondContact O-N 3.28Å; E91-Q94 PolarHBondContact O-N 2.81Å; E91-E95 PolarHBondContact O-N 3.02Å |
| 92 | A | 91.7 | Very high | 87.8 | Confident | 1 Ų | 1 | 62.9 Ų | 62.9 | 1% | 0.008 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -58.5 | -45 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | M78 L79 N88 V90 E95 L96 | M78-A92 HydrophobicContact CG-CB 4.38Å; M78-A92 HydrophobicContact SD-CB 3.78Å; L79-A92 HydrophobicContact CD2-CB 4.03Å; L79-A92 HydrophobicContact CG-CB 4.26Å; N88-A92 WeakPolarHBondContact O-CB 3.25Å; N88-A92 PolarHBondContact O-N 3.18Å; V90-A92 PolarHBondContact O-N 3.2Å; A92-E95 PolarHBondContact O-N 3.46Å; A92-L96 WeakPolarHBondContact O-CB 3.39Å; A92-L96 VanDerWaalsContact O-CG 3.25Å; A92-L96 WeakPolarHBondContact O-CG 2.91Å; A92-L96 PolarHBondContact O-N 2.9Å |
| 93 | L | 91.9 | Very high | 88.5 | Confident | 0 Ų | 0 | 65.4 Ų | 65.4 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -69.5 | -32.9 | 179.4 | -70.1 | 171.7 | 0 | 0 | 0 | 112.1 | L79 L89 V90 E91 L96 K97 V115 V126 L129 A130 | L79-L93 HydrophobicContact CD1-CD2 4.03Å; L79-L93 HydrophobicContact CD2-CD2 4.3Å; L79-L93 HydrophobicContact CD2-CG 4.08Å; L89-L93 WeakPolarHBondContact O-CB 3.48Å; L89-L93 VanDerWaalsContact O-CG 3.25Å; L89-L93 WeakPolarHBondContact O-CG 3.32Å; L89-L93 PolarHBondContact O-N 3.06Å; V90-L93 PolarHBondContact O-N 3.46Å; E91-L93 VanDerWaalsContact C-N 3.33Å; E91-L93 PolarHBondContact O-N 3.28Å; L93-L96 HydrophobicContact CD2-CD1 4.49Å; L93-L96 PolarHBondContact O-N 3.13Å; L93-K97 WeakPolarHBondContact O-CB 3.25Å; L93-K97 PolarHBondContact O-N 3.25Å; L93-V115 HydrophobicContact CD2-CG1 4.41Å; L93-V115 HydrophobicContact CD2-CG2 4.39Å; L93-V126 HydrophobicContact CD1-CG1 3.76Å; L93-L129 HydrophobicContact CB-CD2 3.25Å; L93-L129 HydrophobicContact CG-CD2 4.47Å; L93-L129 WeakPolarHBondContact O-CD2 3.26Å; L93-A130 HydrophobicContact CD1-CB 4.04Å; L93-A130 HydrophobicContact CD2-CB 4.2Å |
| 94 | Q | 92.9 | Very high | 89.1 | Confident | 87 Ų | 87 | 64.8 Ų | 64.8 | 41% | 0.407 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -66.9 | -42.7 | 173.3 | -76.4 | -179.4 | 7.1 | 0 | 0 | 111.9 | V90 E91 L96 K97 K98 L129 | V90-Q94 HydrophobicContact CG1-CG 4.26Å; V90-Q94 WeakPolarHBondContact O-CB 3.3Å; V90-Q94 VanDerWaalsContact O-CG 3.28Å; V90-Q94 WeakPolarHBondContact O-CG 3.47Å; V90-Q94 PolarHBondContact O-N 2.86Å; E91-Q94 PolarHBondContact O-N 2.81Å; Q94-L96 VanDerWaalsContact C-N 3.35Å; Q94-K97 WeakPolarHBondContact O-CB 3.4Å; Q94-K97 PolarHBondContact O-N 3.48Å; Q94-K98 WeakPolarHBondContact O-CG 3.41Å; Q94-K98 PolarHBondContact O-N 3.27Å; Q94-L129 HydrophobicContact CG-CD1 3.88Å; Q94-L129 HydrophobicContact CG-CD2 4.25Å |
| 95 | E | 91.4 | Very high | 89.6 | Confident | 58 Ų | 58 | 63.3 Ų | 63.3 | 27% | 0.271 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.7 | -40.3 | 174.1 | -71.4 | -54.3 | 140.3 | 0 | 0 | 111.7 | W75 E91 A92 K97 K98 | W75-E95 HydrophobicContact CZ2-CG 4.47Å; E91-E95 PolarHBondContact O-N 3.02Å; A92-E95 PolarHBondContact O-N 3.46Å; E95-K97 VanDerWaalsContact C-N 3.3Å; E95-K97 PolarHBondContact O-N 2.88Å; E95-K98 WeakPolarHBondContact O-CB 3.3Å; E95-K98 PolarHBondContact O-N 2.84Å; E95-K98 IonicContact OE1-NZ 3.16Å; E95-K98 PolarHBondContact OE1-NZ 3.48Å; E95-K98 IonicContact OE2-NZ 2.83Å |
| 96 | L | 91.7 | Very high | 89.9 | Confident | 1 Ų | 1 | 60.9 Ų | 60.9 | 1% | 0.005 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.7 | -34 | 173.6 | -74.1 | 173.8 | 0 | 0 | 0 | 112.6 | I72 W75 L79 A92 L93 Q94 K98 K99 I111 V115 V133 W137 | I72-L96 HydrophobicContact CD1-CD2 3.5Å; W75-L96 HydrophobicContact CB-CD1 4.27Å; W75-L96 HydrophobicContact CB-CD2 4.22Å; W75-L96 HydrophobicContact CB-CG 4.23Å; W75-L96 HydrophobicContact CG-CD2 4.47Å; W75-L96 HydrophobicContact CG-CG 4.47Å; L79-L96 HydrophobicContact CD1-CD1 3.7Å; A92-L96 WeakPolarHBondContact O-CB 3.39Å; A92-L96 VanDerWaalsContact O-CG 3.25Å; A92-L96 WeakPolarHBondContact O-CG 2.91Å; A92-L96 PolarHBondContact O-N 2.9Å; L93-L96 HydrophobicContact CD2-CD1 4.49Å; L93-L96 PolarHBondContact O-N 3.13Å; Q94-L96 VanDerWaalsContact C-N 3.35Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.2Å; L96-K99 PolarHBondContact O-N 3.43Å; L96-I111 HydrophobicContact CD1-CD1 4.28Å; L96-I111 HydrophobicContact CD1-CG1 4.39Å; L96-V115 HydrophobicContact CD1-CG2 4.14Å; L96-V133 HydrophobicContact CB-CG1 4.35Å; L96-W137 HydrophobicContact CB-CH2 4.34Å; L96-W137 HydrophobicContact CB-CZ2 3.99Å; L96-W137 HydrophobicContact CD1-CH2 4.33Å; L96-W137 HydrophobicContact CD2-CH2 4Å; L96-W137 HydrophobicContact CD2-CZ2 4.06Å; L96-W137 HydrophobicContact CG-CH2 4.46Å; L96-W137 HydrophobicContact CG-CZ2 4.5Å |
| 97 | K | 91.6 | Very high | 90 | Very high | 78 Ų | 78 | 60.5 Ų | 60.5 | 34% | 0.339 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -65.8 | -34.2 | 175.1 | -170.9 | 175.1 | 175.3 | 175.6 | 0 | 112.6 | L93 Q94 E95 K99 E132 V133 | L93-K97 WeakPolarHBondContact O-CB 3.25Å; L93-K97 PolarHBondContact O-N 3.25Å; Q94-K97 WeakPolarHBondContact O-CB 3.4Å; Q94-K97 PolarHBondContact O-N 3.48Å; E95-K97 VanDerWaalsContact C-N 3.3Å; E95-K97 PolarHBondContact O-N 2.88Å; K97-K99 PolarHBondContact O-N 3.23Å; K97-E132 IonicContact NZ-OE2 2.89Å; K97-E132 PolarHBondContact NZ-OE2 3.04Å; K97-V133 HydrophobicContact CB-CG2 3.72Å; K97-V133 HydrophobicContact CG-CG2 4.22Å |
| 98 | K | 90.9 | Very high | 90.1 | Very high | 116 Ų | 116 | 58.2 Ų | 58.2 | 50% | 0.504 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -67 | -18.6 | 176.9 | -66.7 | 171.2 | -170.3 | 171.6 | 0 | 112.3 | Q94 E95 L96 | Q94-K98 WeakPolarHBondContact O-CG 3.41Å; Q94-K98 PolarHBondContact O-N 3.27Å; E95-K98 WeakPolarHBondContact O-CB 3.3Å; E95-K98 PolarHBondContact O-N 2.84Å; E95-K98 IonicContact OE1-NZ 3.16Å; E95-K98 PolarHBondContact OE1-NZ 3.48Å; E95-K98 IonicContact OE2-NZ 2.83Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.2Å |
| 99 | K | 90.8 | Very high | 90.2 | Very high | 49 Ų | 49 | 55.7 Ų | 55.7 | 21% | 0.213 | 27% | 0.268 | C | S | . | . | trans | -115.8 | 146.4 | -175 | -57.4 | -57.9 | -177.8 | -174.8 | 0 | 111.7 | E61 V67 L96 K97 W137 | E61-K99 PolarHBondContact O-NZ 3.2Å; V67-K99 HydrophobicContact CG2-CB 4.02Å; L96-K99 PolarHBondContact O-N 3.43Å; K97-K99 PolarHBondContact O-N 3.23Å; K99-W137 PolarHBondContact O-NE1 3.14Å; K99-W137 VanDerWaalsContact O-NE1 3.17Å | ||
| 100 | I | 89.4 | Confident | 90.4 | Very high | 12 Ų | 12 | 63.2 Ų | 63.2 | 6% | 0.062 | 30% | 0.296 | C | S | . | . | trans | -119.4 | 97.4 | 170.8 | -61.3 | 175.6 | 0 | 0 | 0 | 107.8 | K64 F140 | K64-I100 HydrophobicContact CD-CD1 3.81Å; K64-I100 HydrophobicContact CD-CG1 4.22Å; K64-I100 VanDerWaalsContact CE-CD1 3.41Å; K64-I100 HydrophobicContact CG-CD1 4.01Å; K64-I100 HydrophobicContact CG-CG1 3.97Å; K64-I100 PolarHBondContact O-N 3.1Å; I100-F140 HydrophobicContact CD1-CD2 3.91Å; I100-F140 HydrophobicContact CD1-CE2 4.09Å; I100-F140 HydrophobicContact CD1-CG 4.41Å; I100-F140 HydrophobicContact CG2-CB 4.31Å; I100-F140 HydrophobicContact CG2-CD1 3.38Å; I100-F140 HydrophobicContact CG2-CD2 3.96Å; I100-F140 HydrophobicContact CG2-CE1 3.45Å; I100-F140 VanDerWaalsContact CG2-CE1 3.45Å; I100-F140 HydrophobicContact CG2-CE2 3.99Å; I100-F140 HydrophobicContact CG2-CG 3.63Å; I100-F140 HydrophobicContact CG2-CZ 3.72Å | ||
| 101 | P | 88.8 | Confident | 90.4 | Very high | 2 Ų | 2 | 62.5 Ų | 62.5 | 1% | 0.013 | 29% | 0.292 | C | S | . | . | trans | -64.2 | 149.9 | 177.7 | -17.8 | 30.4 | 0 | 0 | 0 | 111.9 | V67 I72 V105 L106 W137 | V67-P101 HydrophobicContact CG2-CB 4.38Å; V67-P101 HydrophobicContact CG2-CG 4.43Å; I72-P101 HydrophobicContact CD1-CG 4.1Å; P101-V105 HydrophobicContact CB-CB 4.21Å; P101-V105 HydrophobicContact CB-CG1 4Å; P101-L106 HydrophobicContact CB-CD2 3.87Å; P101-L106 HydrophobicContact CB-CG 4.05Å; P101-L106 HydrophobicContact CG-CD2 4.03Å; P101-W137 HydrophobicContact CG-CH2 4.35Å; P101-W137 HydrophobicContact CG-CZ2 3.88Å | ||
| 102 | S | 88.4 | Confident | 90.4 | Very high | 56 Ų | 56 | 58.3 Ų | 58.3 | 39% | 0.392 | 28% | 0.277 | S | S | . | . | trans | -69.8 | 160.2 | 173.5 | 75.3 | 0 | 0 | 0 | 0 | 111.2 | E104 V105 L106 | S102-E104 PolarHBondContact O-N 2.95Å; S102-V105 PolarHBondContact O-N 3.11Å; S102-V105 VanDerWaalsContact O-N 3.11Å; S102-V105 WeakPolarHBondContact OG-CG2 3.49Å; S102-V105 PolarHBondContact OG-N 3.32Å; S102-L106 WeakPolarHBondContact O-CG 3.48Å; S102-L106 PolarHBondContact O-N 2.93Å | ||
| 103 | R | 86.2 | Confident | 90.3 | Very high | 158 Ų | 158 | 64.8 Ų | 64.8 | 60% | 0.596 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -56.1 | -35.9 | 177 | -177.1 | 174.3 | -179.1 | -110.3 | 9.4 | 112.4 | K107 | R103-K107 HydrophobicContact CG-CD 4.38Å; R103-K107 VanDerWaalsContact NH2-NZ 3.16Å; R103-K107 WeakPolarHBondContact O-CB 3.43Å; R103-K107 VanDerWaalsContact O-CG 3.26Å; R103-K107 WeakPolarHBondContact O-CG 3.41Å; R103-K107 PolarHBondContact O-N 3.39Å; R103-K107 VanDerWaalsContact O-N 3.1Å |
| 104 | E | 86.8 | Confident | 90.3 | Very high | 156 Ų | 156 | 65.2 Ų | 65.2 | 73% | 0.729 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -67 | -45 | 177.7 | -66.9 | 175.9 | -178.9 | 0 | 0 | 111.5 | S102 K107 S108 | S102-E104 PolarHBondContact O-N 2.95Å; E104-K107 PolarHBondContact O-N 2.66Å; E104-S108 PolarHBondContact O-N 2.97Å; E104-S108 PolarHBondContact O-OG 3.25Å |
| 105 | V | 88.8 | Confident | 90.3 | Very high | 20 Ų | 20 | 61.1 Ų | 61.1 | 12% | 0.121 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.2 | -41.9 | 177 | 175.3 | 0 | 0 | 0 | 0 | 111.2 | V69 I72 P101 S102 K107 S108 T109 | V69-V105 HydrophobicContact CG2-CG2 4.29Å; I72-V105 HydrophobicContact CG1-CG1 4.44Å; I72-V105 HydrophobicContact CG2-CG1 4.49Å; P101-V105 HydrophobicContact CB-CB 4.21Å; P101-V105 HydrophobicContact CB-CG1 4Å; S102-V105 PolarHBondContact O-N 3.11Å; S102-V105 VanDerWaalsContact O-N 3.11Å; S102-V105 WeakPolarHBondContact OG-CG2 3.49Å; S102-V105 PolarHBondContact OG-N 3.32Å; V105-K107 VanDerWaalsContact C-N 3.29Å; V105-K107 PolarHBondContact O-N 3.5Å; V105-S108 PolarHBondContact O-N 2.86Å; V105-S108 PolarHBondContact O-OG 3.17Å; V105-T109 HydrophobicContact CG1-CG2 4.15Å; V105-T109 WeakPolarHBondContact O-CB 3.49Å; V105-T109 WeakPolarHBondContact O-CG2 3.48Å; V105-T109 PolarHBondContact O-N 2.85Å; V105-T109 PolarHBondContact O-OG1 3.43Å |
| 106 | L | 90.4 | Very high | 90.4 | Very high | 29 Ų | 29 | 61.3 Ų | 61.3 | 15% | 0.152 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.5 | -37.8 | 175.8 | -68.9 | 177.8 | 0 | 0 | 0 | 112.1 | P101 S102 R110 I111 W137 | P101-L106 HydrophobicContact CB-CD2 3.87Å; P101-L106 HydrophobicContact CB-CG 4.05Å; P101-L106 HydrophobicContact CG-CD2 4.03Å; S102-L106 WeakPolarHBondContact O-CG 3.48Å; S102-L106 PolarHBondContact O-N 2.93Å; L106-R110 VanDerWaalsContact O-CA 3.3Å; L106-R110 WeakPolarHBondContact O-CA 3.31Å; L106-R110 PolarHBondContact O-N 3.02Å; L106-R110 VanDerWaalsContact O-N 3.1Å; L106-I111 HydrophobicContact CD2-CG2 3.7Å; L106-W137 HydrophobicContact CD2-CD2 4.23Å; L106-W137 HydrophobicContact CD2-CE3 3.66Å; L106-W137 HydrophobicContact CD2-CH2 4.46Å; L106-W137 HydrophobicContact CD2-CZ3 3.8Å |
| 107 | K | 89.2 | Confident | 90.4 | Very high | 121 Ų | 121 | 68.4 Ų | 68.4 | 53% | 0.526 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -71.9 | -45.6 | 177.8 | -77.4 | 177.3 | 172 | -163.9 | 0 | 112.8 | R103 E104 V105 | R103-K107 HydrophobicContact CG-CD 4.38Å; R103-K107 VanDerWaalsContact NH2-NZ 3.16Å; R103-K107 WeakPolarHBondContact O-CB 3.43Å; R103-K107 VanDerWaalsContact O-CG 3.26Å; R103-K107 WeakPolarHBondContact O-CG 3.41Å; R103-K107 PolarHBondContact O-N 3.39Å; R103-K107 VanDerWaalsContact O-N 3.1Å; E104-K107 PolarHBondContact O-N 2.66Å; V105-K107 VanDerWaalsContact C-N 3.29Å; V105-K107 PolarHBondContact O-N 3.5Å |
| 108 | S | 90.3 | Very high | 90.3 | Very high | 88 Ų | 88 | 65.6 Ų | 65.6 | 62% | 0.615 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -69.7 | -45.6 | -176.1 | 62.2 | 0 | 0 | 0 | 0 | 111.8 | E104 V105 | E104-S108 PolarHBondContact O-N 2.97Å; E104-S108 PolarHBondContact O-OG 3.25Å; V105-S108 PolarHBondContact O-N 2.86Å; V105-S108 PolarHBondContact O-OG 3.17Å |
| 109 | T | 91.5 | Very high | 90.3 | Very high | 8 Ų | 8 | 64.3 Ų | 64.3 | 5% | 0.049 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -80.1 | -25.3 | -178.1 | 63 | 0 | 0 | 0 | 0 | 112.6 | V69 I72 K73 K76 V105 I111 | V69-T109 HydrophobicContact CG1-CG2 4.48Å; I72-T109 HydrophobicContact CG2-CG2 3.86Å; K73-T109 HydrophobicContact CG-CG2 4.49Å; K76-T109 VanDerWaalsContact CD-O 3.31Å; K76-T109 WeakPolarHBondContact CD-O 3.47Å; K76-T109 WeakPolarHBondContact CE-O 3.38Å; K76-T109 PolarHBondContact NZ-O 2.91Å; V105-T109 HydrophobicContact CG1-CG2 4.15Å; V105-T109 WeakPolarHBondContact O-CB 3.49Å; V105-T109 WeakPolarHBondContact O-CG2 3.48Å; V105-T109 PolarHBondContact O-N 2.85Å; V105-T109 PolarHBondContact O-OG1 3.43Å; T109-I111 PolarHBondContact O-N 3.45Å; T109-I111 VanDerWaalsContact OG1-CG2 3.31Å; T109-I111 WeakPolarHBondContact OG1-CG2 3.32Å; T109-I111 PolarHBondContact OG1-N 3.3Å |
| 110 | R | 91.5 | Very high | 90.2 | Very high | 166 Ų | 166 | 71 Ų | 71 | 63% | 0.626 | 33% | 0.333 | S | S | * | . | trans | 58 | 17 | -170.5 | -54.6 | -175.9 | -173.7 | 171 | 1.7 | 114.1 | L106 G112 H113 | L106-R110 VanDerWaalsContact O-CA 3.3Å; L106-R110 WeakPolarHBondContact O-CA 3.31Å; L106-R110 PolarHBondContact O-N 3.02Å; L106-R110 VanDerWaalsContact O-N 3.1Å; R110-G112 PolarHBondContact O-N 3.26Å; R110-H113 WeakPolarHBondContact O-CB 3.42Å; R110-H113 PolarHBondContact O-N 3.49Å | ||
| 111 | I | 92 | Very high | 90.2 | Very high | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -53.9 | -32.2 | 179.3 | -175.6 | 65.4 | 0 | 0 | 0 | 112.7 | I72 K76 L79 L96 L106 T109 H113 T114 V115 W137 | I72-I111 HydrophobicContact CG2-CB 3.97Å; I72-I111 HydrophobicContact CG2-CG1 4.24Å; I72-I111 HydrophobicContact CG2-CG2 3.85Å; K76-I111 VanDerWaalsContact CA-CD1 3.49Å; K76-I111 HydrophobicContact CB-CD1 3.61Å; K76-I111 HydrophobicContact CG-CD1 4.01Å; L79-I111 HydrophobicContact CD1-CD1 4.27Å; L96-I111 HydrophobicContact CD1-CD1 4.28Å; L96-I111 HydrophobicContact CD1-CG1 4.39Å; L106-I111 HydrophobicContact CD2-CG2 3.7Å; T109-I111 PolarHBondContact O-N 3.45Å; T109-I111 VanDerWaalsContact OG1-CG2 3.31Å; T109-I111 WeakPolarHBondContact OG1-CG2 3.32Å; T109-I111 PolarHBondContact OG1-N 3.3Å; I111-H113 PolarHBondContact O-N 2.91Å; I111-T114 WeakPolarHBondContact O-CB 3.25Å; I111-T114 PolarHBondContact O-N 3.14Å; I111-T114 VanDerWaalsContact O-N 3.12Å; I111-V115 HydrophobicContact CD1-CG2 4.41Å; I111-V115 HydrophobicContact CG1-CG2 4.19Å; I111-V115 WeakPolarHBondContact O-CG2 3.41Å; I111-V115 PolarHBondContact O-N 2.88Å; I111-W137 HydrophobicContact CG1-CH2 4.08Å; I111-W137 HydrophobicContact CG1-CZ3 4.3Å; I111-W137 HydrophobicContact CG2-CH2 4.17Å; I111-W137 HydrophobicContact CG2-CZ3 4.01Å |
| 112 | G | 91.3 | Very high | 90 | Very high | 18 Ų | 18 | 78.3 Ų | 78.3 | 19% | 0.186 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -59 | -29.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | R110 N116 | R110-G112 PolarHBondContact O-N 3.26Å; G112-N116 VanDerWaalsContact O-CB 3.27Å; G112-N116 WeakPolarHBondContact O-CB 3.49Å; G112-N116 PolarHBondContact O-N 3.49Å |
| 113 | H | 91.3 | Very high | 90.1 | Very high | 138 Ų | 138 | 78.8 Ų | 78.8 | 64% | 0.639 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -73.8 | -42.4 | 175.9 | -64.4 | 69.1 | 0 | 0 | 0 | 110.8 | R110 I111 N116 K117 | R110-H113 WeakPolarHBondContact O-CB 3.42Å; R110-H113 PolarHBondContact O-N 3.49Å; I111-H113 PolarHBondContact O-N 2.91Å; H113-N116 PolarHBondContact O-N 3.42Å; H113-K117 PolarHBondContact O-N 2.77Å |
| 114 | T | 91.9 | Very high | 90.3 | Very high | 9 Ų | 9 | 75.8 Ų | 75.8 | 6% | 0.055 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60.4 | -48.5 | 175.9 | -44.8 | 0 | 0 | 0 | 0 | 111.1 | L79 E80 I111 N116 K117 M118 | L79-T114 HydrophobicContact CB-CG2 3.63Å; E80-T114 HydrophobicContact CG-CG2 3.52Å; E80-T114 PolarHBondContact OE1-OG1 3.09Å; I111-T114 WeakPolarHBondContact O-CB 3.25Å; I111-T114 PolarHBondContact O-N 3.14Å; I111-T114 VanDerWaalsContact O-N 3.12Å; T114-N116 VanDerWaalsContact C-N 3.31Å; T114-N116 PolarHBondContact O-N 2.97Å; T114-K117 WeakPolarHBondContact O-CB 3.4Å; T114-K117 PolarHBondContact O-N 3.34Å; T114-K117 VanDerWaalsContact O-N 3.11Å; T114-M118 PolarHBondContact O-N 3.43Å |
| 115 | V | 92.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 74 Ų | 74 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.6 | -39.2 | 175.6 | 177.3 | 0 | 0 | 0 | 0 | 111 | L79 L93 L96 I111 K117 M118 R119 A130 V133 W137 | L79-V115 HydrophobicContact CD1-CG2 4.33Å; L93-V115 HydrophobicContact CD2-CG1 4.41Å; L93-V115 HydrophobicContact CD2-CG2 4.39Å; L96-V115 HydrophobicContact CD1-CG2 4.14Å; I111-V115 HydrophobicContact CD1-CG2 4.41Å; I111-V115 HydrophobicContact CG1-CG2 4.19Å; I111-V115 WeakPolarHBondContact O-CG2 3.41Å; I111-V115 PolarHBondContact O-N 2.88Å; V115-K117 VanDerWaalsContact C-N 3.29Å; V115-K117 PolarHBondContact O-N 2.97Å; V115-M118 PolarHBondContact O-N 2.94Å; V115-M118 VanDerWaalsContact O-N 3.17Å; V115-R119 PolarHBondContact O-N 2.9Å; V115-A130 HydrophobicContact CG1-CB 4.29Å; V115-V133 HydrophobicContact CG1-CB 4.27Å; V115-V133 HydrophobicContact CG1-CG1 4.14Å; V115-W137 HydrophobicContact CB-CZ3 4.4Å; V115-W137 HydrophobicContact CG2-CH2 4.02Å; V115-W137 HydrophobicContact CG2-CZ3 3.86Å |
| 116 | N | 92.6 | Very high | 90.5 | Very high | 62 Ų | 62 | 73.1 Ų | 73.1 | 33% | 0.332 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.2 | -33.4 | 175.7 | -173.7 | 60.7 | 0 | 0 | 0 | 112.8 | G112 H113 T114 R119 Y134 | G112-N116 VanDerWaalsContact O-CB 3.27Å; G112-N116 WeakPolarHBondContact O-CB 3.49Å; G112-N116 PolarHBondContact O-N 3.49Å; H113-N116 PolarHBondContact O-N 3.42Å; T114-N116 VanDerWaalsContact C-N 3.31Å; T114-N116 PolarHBondContact O-N 2.97Å; N116-R119 WeakPolarHBondContact O-CB 3.43Å; N116-R119 PolarHBondContact O-N 2.97Å; N116-R119 PolarHBondContact OD1-NH1 2.97Å; N116-Y134 HydrophobicContact CB-CD2 4.13Å; N116-Y134 HydrophobicContact CB-CE2 4.08Å |
| 117 | K | 91.3 | Very high | 90.6 | Very high | 151 Ų | 151 | 72 Ų | 72 | 66% | 0.657 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.9 | -42.7 | 172 | -171.2 | -177.4 | 177.8 | -172.2 | 0 | 111.1 | H113 T114 V115 R119 K120 | H113-K117 PolarHBondContact O-N 2.77Å; T114-K117 WeakPolarHBondContact O-CB 3.4Å; T114-K117 PolarHBondContact O-N 3.34Å; T114-K117 VanDerWaalsContact O-N 3.11Å; V115-K117 VanDerWaalsContact C-N 3.29Å; V115-K117 PolarHBondContact O-N 2.97Å; K117-R119 PolarHBondContact O-N 2.69Å; K117-R119 VanDerWaalsContact O-N 3.16Å; K117-K120 PolarHBondContact O-N 3.15Å |
| 118 | M | 89.4 | Confident | 90.8 | Very high | 19 Ų | 19 | 68.2 Ų | 68.2 | 9% | 0.094 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62.4 | -19.6 | 177.8 | -78.3 | -53.5 | 101.2 | 0 | 0 | 114.7 | L79 T114 V115 K120 H121 V126 A130 | L79-M118 HydrophobicContact CD2-CG 4.36Å; T114-M118 PolarHBondContact O-N 3.43Å; V115-M118 PolarHBondContact O-N 2.94Å; V115-M118 VanDerWaalsContact O-N 3.17Å; M118-K120 PolarHBondContact O-N 3.42Å; M118-K120 VanDerWaalsContact O-N 3.14Å; M118-H121 VanDerWaalsContact O-CB 3.27Å; M118-H121 WeakPolarHBondContact O-CB 3.28Å; M118-H121 PolarHBondContact O-N 3.23Å; M118-H121 VanDerWaalsContact O-N 3.08Å; M118-H121 HydrophobicContact SD-CB 4.33Å; M118-H121 VanDerWaalsContact SD-CD2 3.59Å; M118-V126 HydrophobicContact SD-CG1 4.27Å; M118-A130 HydrophobicContact CB-CB 3.76Å |
| 119 | R | 91.3 | Very high | 90.9 | Very high | 88 Ų | 88 | 65 Ų | 65 | 33% | 0.332 | 33% | 0.326 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -20.9 | 172.2 | -64 | 172.7 | 58.1 | -154.3 | -0.3 | 113.7 | V115 N116 K117 A130 R131 | V115-R119 PolarHBondContact O-N 2.9Å; N116-R119 WeakPolarHBondContact O-CB 3.43Å; N116-R119 PolarHBondContact O-N 2.97Å; N116-R119 PolarHBondContact OD1-NH1 2.97Å; K117-R119 PolarHBondContact O-N 2.69Å; K117-R119 VanDerWaalsContact O-N 3.16Å; R119-A130 HydrophobicContact CG-CB 4.1Å; R119-R131 HydrophobicContact CB-CG 4.18Å; R119-R131 HydrophobicContact CG-CG 3.89Å |
| 120 | K | 88.9 | Confident | 91 | Very high | 190 Ų | 190 | 64.6 Ų | 64.6 | 83% | 0.826 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.3 | 14.1 | 178.6 | -58.6 | -176.5 | 179.8 | -176.1 | 0 | 112.6 | K117 M118 | K117-K120 PolarHBondContact O-N 3.15Å; M118-K120 PolarHBondContact O-N 3.42Å; M118-K120 VanDerWaalsContact O-N 3.14Å |
| 121 | H | 89 | Confident | 91.1 | Very high | 57 Ų | 57 | 62 Ų | 62 | 26% | 0.264 | 31% | 0.314 | S | S | . | . | trans | -62.1 | 152.1 | 177.2 | -158 | -93.4 | 0 | 0 | 0 | 110.8 | M118 D123 V126 | M118-H121 VanDerWaalsContact O-CB 3.27Å; M118-H121 WeakPolarHBondContact O-CB 3.28Å; M118-H121 PolarHBondContact O-N 3.23Å; M118-H121 VanDerWaalsContact O-N 3.08Å; M118-H121 HydrophobicContact SD-CB 4.33Å; M118-H121 VanDerWaalsContact SD-CD2 3.59Å; H121-D123 VanDerWaalsContact C-N 3.29Å; H121-D123 IonicContact CE1-OD2 2.65Å; H121-D123 PolarHBondContact CE1-OD2 3.31Å; H121-D123 PolarHBondContact ND1-N 2.63Å; H121-D123 IonicContact ND1-OD2 3.13Å; H121-D123 PolarHBondContact ND1-OD2 3.47Å; H121-D123 PolarHBondContact O-N 2.77Å; H121-V126 HydrophobicContact CB-CB 4.4Å; H121-V126 HydrophobicContact CB-CG1 4.08Å | ||
| 122 | S | 86.2 | Confident | 91.2 | Very high | 110 Ų | 110 | 66.2 Ų | 66.2 | 77% | 0.769 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -62 | -38.3 | 178.5 | 44.5 | 0 | 0 | 0 | 0 | 112.1 | S124 | S122-S124 PolarHBondContact O-N 2.87Š|
| 123 | D | 89.1 | Confident | 91.4 | Very high | 67 Ų | 67 | 65.4 Ų | 65.4 | 36% | 0.358 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -74.9 | 122.4 | 177.7 | -62.7 | -63.3 | 0 | 0 | 0 | 112.4 | H121 E125 V126 A127 | H121-D123 VanDerWaalsContact C-N 3.29Å; H121-D123 IonicContact CE1-OD2 2.65Å; H121-D123 PolarHBondContact CE1-OD2 3.31Å; H121-D123 PolarHBondContact ND1-N 2.63Å; H121-D123 IonicContact ND1-OD2 3.13Å; H121-D123 PolarHBondContact ND1-OD2 3.47Å; H121-D123 PolarHBondContact O-N 2.77Å; D123-E125 VanDerWaalsContact C-N 3.3Å; D123-E125 PolarHBondContact O-N 3.36Å; D123-V126 HydrophobicContact CB-CB 4.21Å; D123-V126 HydrophobicContact CB-CG2 4.02Å; D123-V126 PolarHBondContact O-N 3.31Å; D123-A127 VanDerWaalsContact O-CB 3.3Å; D123-A127 WeakPolarHBondContact O-CB 3.3Å; D123-A127 PolarHBondContact O-N 2.65Å |
| 124 | S | 90.4 | Very high | 91.4 | Very high | 94 Ų | 94 | 62.1 Ų | 62.1 | 66% | 0.657 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -60.8 | -36.7 | -179.2 | -173.5 | 0 | 0 | 0 | 0 | 112.9 | S122 A127 S128 | S122-S124 PolarHBondContact O-N 2.87Å; S124-A127 PolarHBondContact O-N 2.92Å; S124-S128 WeakPolarHBondContact O-CB 3.42Å; S124-S128 PolarHBondContact O-N 3.23Å; S124-S128 PolarHBondContact O-OG 3.38Å |
| 125 | E | 89.8 | Confident | 91.5 | Very high | 120 Ų | 120 | 65.2 Ų | 65.2 | 56% | 0.561 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -67.9 | -47 | 179.9 | -175 | 177.7 | -168.5 | 0 | 0 | 112.2 | V90 D123 A127 S128 L129 | V90-E125 HydrophobicContact CG2-CG 4.36Å; D123-E125 VanDerWaalsContact C-N 3.3Å; D123-E125 PolarHBondContact O-N 3.36Å; E125-A127 VanDerWaalsContact C-N 3.31Å; E125-A127 PolarHBondContact O-N 3.18Å; E125-S128 PolarHBondContact O-N 3.23Å; E125-S128 PolarHBondContact O-OG 3.5Å; E125-L129 WeakPolarHBondContact O-CB 3.44Å; E125-L129 PolarHBondContact O-N 3.22Å |
| 126 | V | 90.6 | Very high | 91.5 | Very high | 1 Ų | 1 | 67.5 Ų | 67.5 | 1% | 0.006 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -62.6 | -43.5 | 175.3 | 178.2 | 0 | 0 | 0 | 0 | 109.9 | L89 V90 L93 M118 H121 D123 S128 L129 A130 | L89-V126 HydrophobicContact CB-CG1 4.29Å; L89-V126 HydrophobicContact CB-CG2 4.23Å; L89-V126 HydrophobicContact CD1-CG1 4.47Å; V90-V126 HydrophobicContact CG2-CG2 3.87Å; L93-V126 HydrophobicContact CD1-CG1 3.76Å; M118-V126 HydrophobicContact SD-CG1 4.27Å; H121-V126 HydrophobicContact CB-CB 4.4Å; H121-V126 HydrophobicContact CB-CG1 4.08Å; D123-V126 HydrophobicContact CB-CB 4.21Å; D123-V126 HydrophobicContact CB-CG2 4.02Å; D123-V126 PolarHBondContact O-N 3.31Å; V126-S128 PolarHBondContact O-N 3.25Å; V126-L129 PolarHBondContact O-N 3.2Å; V126-A130 VanDerWaalsContact O-CB 3.24Å; V126-A130 WeakPolarHBondContact O-CB 3.11Å; V126-A130 PolarHBondContact O-N 3.24Å |
| 127 | A | 92.3 | Very high | 91.5 | Very high | 5 Ų | 5 | 65 Ų | 65 | 4% | 0.041 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.5 | -34.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | D123 S124 E125 R131 | D123-A127 VanDerWaalsContact O-CB 3.3Å; D123-A127 WeakPolarHBondContact O-CB 3.3Å; D123-A127 PolarHBondContact O-N 2.65Å; S124-A127 PolarHBondContact O-N 2.92Å; E125-A127 VanDerWaalsContact C-N 3.31Å; E125-A127 PolarHBondContact O-N 3.18Å; A127-R131 WeakPolarHBondContact O-CB 3.49Å; A127-R131 WeakPolarHBondContact O-CG 3.22Å; A127-R131 PolarHBondContact O-N 3.37Å; A127-R131 PolarHBondContact O-NE 2.84Å |
| 128 | S | 92.8 | Very high | 91.4 | Very high | 41 Ų | 41 | 62.5 Ų | 62.5 | 29% | 0.287 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -72.1 | -45.2 | 176 | 68.7 | 0 | 0 | 0 | 0 | 110.8 | S124 E125 V126 A130 R131 E132 | S124-S128 WeakPolarHBondContact O-CB 3.42Å; S124-S128 PolarHBondContact O-N 3.23Å; S124-S128 PolarHBondContact O-OG 3.38Å; E125-S128 PolarHBondContact O-N 3.23Å; E125-S128 PolarHBondContact O-OG 3.5Å; V126-S128 PolarHBondContact O-N 3.25Å; S128-A130 PolarHBondContact O-N 3.42Å; S128-R131 VanDerWaalsContact O-CB 3.3Å; S128-R131 WeakPolarHBondContact O-CB 3.37Å; S128-R131 PolarHBondContact O-N 3.45Å; S128-R131 VanDerWaalsContact O-N 3.11Å; S128-E132 PolarHBondContact O-N 3.42Å |
| 129 | L | 93.7 | Very high | 91.4 | Very high | 20 Ų | 20 | 64.6 Ų | 64.6 | 11% | 0.105 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -67.7 | -39.5 | -179 | -150.3 | 140.9 | 0 | 0 | 0 | 111.5 | L93 Q94 E125 V126 R131 E132 V133 | L93-L129 HydrophobicContact CB-CD2 3.25Å; L93-L129 HydrophobicContact CG-CD2 4.47Å; L93-L129 WeakPolarHBondContact O-CD2 3.26Å; Q94-L129 HydrophobicContact CG-CD1 3.88Å; Q94-L129 HydrophobicContact CG-CD2 4.25Å; E125-L129 WeakPolarHBondContact O-CB 3.44Å; E125-L129 PolarHBondContact O-N 3.22Å; V126-L129 PolarHBondContact O-N 3.2Å; L129-R131 VanDerWaalsContact C-N 3.3Å; L129-R131 PolarHBondContact O-N 2.81Å; L129-E132 PolarHBondContact O-N 2.62Å; L129-V133 HydrophobicContact CD2-CG2 4.33Å; L129-V133 WeakPolarHBondContact O-CG2 3.48Å; L129-V133 PolarHBondContact O-N 3.41Å |
| 130 | A | 93.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.9 | -35.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L93 V115 M118 R119 V126 S128 Y134 | L93-A130 HydrophobicContact CD1-CB 4.04Å; L93-A130 HydrophobicContact CD2-CB 4.2Å; V115-A130 HydrophobicContact CG1-CB 4.29Å; M118-A130 HydrophobicContact CB-CB 3.76Å; R119-A130 HydrophobicContact CG-CB 4.1Å; V126-A130 VanDerWaalsContact O-CB 3.24Å; V126-A130 WeakPolarHBondContact O-CB 3.11Å; V126-A130 PolarHBondContact O-N 3.24Å; S128-A130 PolarHBondContact O-N 3.42Å; A130-Y134 VanDerWaalsContact O-CB 3.26Å; A130-Y134 WeakPolarHBondContact O-CB 3.24Å; A130-Y134 PolarHBondContact O-N 3.07Å |
| 131 | R | 94.1 | Very high | 91.2 | Very high | 113 Ų | 113 | 55.1 Ų | 55.1 | 43% | 0.426 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.7 | -45.9 | 174.4 | -92.5 | 177.9 | -87 | 157 | -9.9 | 111.1 | R119 A127 S128 L129 Y134 T135 | R119-R131 HydrophobicContact CB-CG 4.18Å; R119-R131 HydrophobicContact CG-CG 3.89Å; A127-R131 WeakPolarHBondContact O-CB 3.49Å; A127-R131 WeakPolarHBondContact O-CG 3.22Å; A127-R131 PolarHBondContact O-N 3.37Å; A127-R131 PolarHBondContact O-NE 2.84Å; S128-R131 VanDerWaalsContact O-CB 3.3Å; S128-R131 WeakPolarHBondContact O-CB 3.37Å; S128-R131 PolarHBondContact O-N 3.45Å; S128-R131 VanDerWaalsContact O-N 3.11Å; L129-R131 VanDerWaalsContact C-N 3.3Å; L129-R131 PolarHBondContact O-N 2.81Å; R131-Y134 PolarHBondContact O-N 3.24Å; R131-T135 VanDerWaalsContact O-CG2 3.32Å; R131-T135 WeakPolarHBondContact O-CG2 3.34Å; R131-T135 PolarHBondContact O-N 3.07Å; R131-T135 PolarHBondContact O-OG1 3.05Å; R131-T135 VanDerWaalsContact O-OG1 3.09Å |
| 132 | E | 94.1 | Very high | 91.1 | Very high | 88 Ų | 88 | 57.5 Ų | 57.5 | 41% | 0.411 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.2 | -46.8 | 178.1 | -69.7 | 179.7 | -170.2 | 0 | 0 | 112.5 | K97 S128 L129 Y134 T135 E136 | K97-E132 IonicContact NZ-OE2 2.89Å; K97-E132 PolarHBondContact NZ-OE2 3.04Å; S128-E132 PolarHBondContact O-N 3.42Å; L129-E132 PolarHBondContact O-N 2.62Å; E132-Y134 VanDerWaalsContact C-N 3.32Å; E132-Y134 PolarHBondContact O-N 2.77Å; E132-T135 PolarHBondContact O-N 3.13Å; E132-T135 PolarHBondContact O-OG1 2.62Å; E132-E136 WeakPolarHBondContact O-CB 3.35Å; E132-E136 PolarHBondContact O-N 3.29Å |
| 133 | V | 93.8 | Very high | 90.9 | Very high | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.7 | -45.3 | 177.5 | 174.8 | 0 | 0 | 0 | 0 | 110.5 | L96 K97 V115 L129 E136 W137 | L96-V133 HydrophobicContact CB-CG1 4.35Å; K97-V133 HydrophobicContact CB-CG2 3.72Å; K97-V133 HydrophobicContact CG-CG2 4.22Å; V115-V133 HydrophobicContact CG1-CB 4.27Å; V115-V133 HydrophobicContact CG1-CG1 4.14Å; L129-V133 HydrophobicContact CD2-CG2 4.33Å; L129-V133 WeakPolarHBondContact O-CG2 3.48Å; L129-V133 PolarHBondContact O-N 3.41Å; V133-E136 PolarHBondContact O-N 3.38Å; V133-W137 HydrophobicContact CG1-CD2 3.86Å; V133-W137 VanDerWaalsContact CG1-CE2 3.46Å; V133-W137 HydrophobicContact CG1-CE3 4.22Å; V133-W137 HydrophobicContact CG1-CG 4.48Å; V133-W137 HydrophobicContact CG1-CH2 3.91Å; V133-W137 HydrophobicContact CG1-CZ2 3.51Å; V133-W137 HydrophobicContact CG1-CZ3 4.24Å; V133-W137 WeakPolarHBondContact O-CB 3.49Å; V133-W137 VanDerWaalsContact O-CG 3.29Å; V133-W137 PolarHBondContact O-N 3.22Å |
| 134 | Y | 93.4 | Very high | 90.4 | Very high | 69 Ų | 69 | 59.9 Ų | 59.9 | 27% | 0.271 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.6 | -45.2 | 178.9 | 179.1 | -93.8 | 0 | 0 | 0 | 112.4 | N116 A130 R131 E132 W137 K138 | N116-Y134 HydrophobicContact CB-CD2 4.13Å; N116-Y134 HydrophobicContact CB-CE2 4.08Å; A130-Y134 VanDerWaalsContact O-CB 3.26Å; A130-Y134 WeakPolarHBondContact O-CB 3.24Å; A130-Y134 PolarHBondContact O-N 3.07Å; R131-Y134 PolarHBondContact O-N 3.24Å; E132-Y134 VanDerWaalsContact C-N 3.32Å; E132-Y134 PolarHBondContact O-N 2.77Å; Y134-W137 PolarHBondContact O-N 2.98Å; Y134-K138 HydrophobicContact CE1-CD 4.05Å; Y134-K138 VanDerWaalsContact O-CB 3.25Å; Y134-K138 WeakPolarHBondContact O-CB 3.47Å; Y134-K138 PolarHBondContact O-N 3.16Å |
| 135 | T | 92.9 | Very high | 89.5 | Confident | 74 Ų | 74 | 59 Ų | 59 | 45% | 0.454 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67.6 | -38.8 | 179.2 | 54.4 | 0 | 0 | 0 | 0 | 111.5 | R131 E132 K138 T139 | R131-T135 VanDerWaalsContact O-CG2 3.32Å; R131-T135 WeakPolarHBondContact O-CG2 3.34Å; R131-T135 PolarHBondContact O-N 3.07Å; R131-T135 PolarHBondContact O-OG1 3.05Å; R131-T135 VanDerWaalsContact O-OG1 3.09Å; E132-T135 PolarHBondContact O-N 3.13Å; E132-T135 PolarHBondContact O-OG1 2.62Å; T135-K138 PolarHBondContact O-N 3.35Å; T135-T139 WeakPolarHBondContact O-CB 3.32Å; T135-T139 WeakPolarHBondContact O-CG2 3.2Å; T135-T139 PolarHBondContact O-N 2.89Å; T135-T139 PolarHBondContact O-OG1 3.44Å |
| 136 | E | 91.8 | Very high | 88.5 | Confident | 49 Ų | 49 | 60.2 Ų | 60.2 | 23% | 0.229 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.4 | -47.6 | 175.6 | -173.6 | 168.2 | -165.5 | 0 | 0 | 111.3 | K64 E132 V133 K138 T139 F140 | K64-E136 WeakPolarHBondContact CE-OE1 3.39Å; K64-E136 IonicContact NZ-OE1 2.67Å; K64-E136 PolarHBondContact NZ-OE1 2.92Å; E132-E136 WeakPolarHBondContact O-CB 3.35Å; E132-E136 PolarHBondContact O-N 3.29Å; V133-E136 PolarHBondContact O-N 3.38Å; E136-K138 PolarHBondContact O-N 3.24Å; E136-T139 PolarHBondContact O-OG1 2.93Å; E136-F140 WeakPolarHBondContact O-CB 3.33Å; E136-F140 PolarHBondContact O-N 3.29Å |
| 137 | W | 92.9 | Very high | 87.6 | Confident | 9 Ų | 9 | 67.8 Ų | 67.8 | 3% | 0.034 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64.7 | -40.7 | 177.3 | -68 | -2.1 | 0 | 0 | 0 | 112.7 | L96 K99 P101 L106 I111 V115 V133 Y134 T141 | L96-W137 HydrophobicContact CB-CH2 4.34Å; L96-W137 HydrophobicContact CB-CZ2 3.99Å; L96-W137 HydrophobicContact CD1-CH2 4.33Å; L96-W137 HydrophobicContact CD2-CH2 4Å; L96-W137 HydrophobicContact CD2-CZ2 4.06Å; L96-W137 HydrophobicContact CG-CH2 4.46Å; L96-W137 HydrophobicContact CG-CZ2 4.5Å; K99-W137 PolarHBondContact O-NE1 3.14Å; K99-W137 VanDerWaalsContact O-NE1 3.17Å; P101-W137 HydrophobicContact CG-CH2 4.35Å; P101-W137 HydrophobicContact CG-CZ2 3.88Å; L106-W137 HydrophobicContact CD2-CD2 4.23Å; L106-W137 HydrophobicContact CD2-CE3 3.66Å; L106-W137 HydrophobicContact CD2-CH2 4.46Å; L106-W137 HydrophobicContact CD2-CZ3 3.8Å; I111-W137 HydrophobicContact CG1-CH2 4.08Å; I111-W137 HydrophobicContact CG1-CZ3 4.3Å; I111-W137 HydrophobicContact CG2-CH2 4.17Å; I111-W137 HydrophobicContact CG2-CZ3 4.01Å; V115-W137 HydrophobicContact CB-CZ3 4.4Å; V115-W137 HydrophobicContact CG2-CH2 4.02Å; V115-W137 HydrophobicContact CG2-CZ3 3.86Å; V133-W137 HydrophobicContact CG1-CD2 3.86Å; V133-W137 VanDerWaalsContact CG1-CE2 3.46Å; V133-W137 HydrophobicContact CG1-CE3 4.22Å; V133-W137 HydrophobicContact CG1-CG 4.48Å; V133-W137 HydrophobicContact CG1-CH2 3.91Å; V133-W137 HydrophobicContact CG1-CZ2 3.51Å; V133-W137 HydrophobicContact CG1-CZ3 4.24Å; V133-W137 WeakPolarHBondContact O-CB 3.49Å; V133-W137 VanDerWaalsContact O-CG 3.29Å; V133-W137 PolarHBondContact O-N 3.22Å; Y134-W137 PolarHBondContact O-N 2.98Å; W137-T141 WeakPolarHBondContact O-CB 3.49Å; W137-T141 PolarHBondContact O-N 2.8Å; W137-T141 PolarHBondContact O-OG1 3.35Å |
| 138 | K | 90.1 | Very high | 86.5 | Confident | 99 Ų | 99 | 72.4 Ų | 72.4 | 43% | 0.43 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -65.1 | -53.9 | 178.3 | -177.9 | 176 | 175.1 | -179.5 | 0 | 111.4 | Y134 T135 E136 F140 T141 E142 | Y134-K138 HydrophobicContact CE1-CD 4.05Å; Y134-K138 VanDerWaalsContact O-CB 3.25Å; Y134-K138 WeakPolarHBondContact O-CB 3.47Å; Y134-K138 PolarHBondContact O-N 3.16Å; T135-K138 PolarHBondContact O-N 3.35Å; E136-K138 PolarHBondContact O-N 3.24Å; K138-F140 VanDerWaalsContact C-N 3.27Å; K138-F140 PolarHBondContact O-N 2.65Å; K138-T141 PolarHBondContact O-N 3.4Å; K138-T141 VanDerWaalsContact O-N 3.14Å; K138-E142 WeakPolarHBondContact CE-OE1 3.32Å; K138-E142 WeakPolarHBondContact CG-OE1 3.47Å; K138-E142 IonicContact NZ-OE1 3.9Å; K138-E142 WeakPolarHBondContact O-CG 3.4Å; K138-E142 PolarHBondContact O-N 2.76Å |
| 139 | T | 90 | Very high | 85.2 | Confident | 62 Ų | 62 | 75 Ų | 75 | 38% | 0.38 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.5 | -36.3 | 180 | 56.3 | 0 | 0 | 0 | 0 | 111.8 | T135 E136 K143 | T135-T139 WeakPolarHBondContact O-CB 3.32Å; T135-T139 WeakPolarHBondContact O-CG2 3.2Å; T135-T139 PolarHBondContact O-N 2.89Å; T135-T139 PolarHBondContact O-OG1 3.44Å; E136-T139 PolarHBondContact O-OG1 2.93Å; T139-K143 WeakPolarHBondContact O-CB 3.42Å; T139-K143 VanDerWaalsContact O-CG 3.24Å; T139-K143 WeakPolarHBondContact O-CG 3.49Å; T139-K143 PolarHBondContact O-N 3.37Å |
| 140 | F | 88.1 | Confident | 84.1 | Confident | 36 Ų | 36 | 80.5 Ų | 80.5 | 16% | 0.158 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -64.1 | -46.9 | 174 | 179.1 | -91.1 | 0 | 0 | 0 | 111.8 | R65 I100 E136 K138 E142 K143 H144 | R65-F140 VanDerWaalsContact CZ-CZ 3.47Å; R65-F140 VanDerWaalsContact NH1-CZ 3.25Å; I100-F140 HydrophobicContact CD1-CD2 3.91Å; I100-F140 HydrophobicContact CD1-CE2 4.09Å; I100-F140 HydrophobicContact CD1-CG 4.41Å; I100-F140 HydrophobicContact CG2-CB 4.31Å; I100-F140 HydrophobicContact CG2-CD1 3.38Å; I100-F140 HydrophobicContact CG2-CD2 3.96Å; I100-F140 HydrophobicContact CG2-CE1 3.45Å; I100-F140 VanDerWaalsContact CG2-CE1 3.45Å; I100-F140 HydrophobicContact CG2-CE2 3.99Å; I100-F140 HydrophobicContact CG2-CG 3.63Å; I100-F140 HydrophobicContact CG2-CZ 3.72Å; E136-F140 WeakPolarHBondContact O-CB 3.33Å; E136-F140 PolarHBondContact O-N 3.29Å; K138-F140 VanDerWaalsContact C-N 3.27Å; K138-F140 PolarHBondContact O-N 2.65Å; F140-E142 VanDerWaalsContact C-N 3.34Å; F140-E142 PolarHBondContact O-N 3.17Å; F140-K143 PolarHBondContact O-N 2.67Å; F140-H144 AromaticContact CD2-CE1 3.42Å; F140-H144 VanDerWaalsContact CD2-CE1 3.42Å; F140-H144 WeakPolarHBondContact CD2-CE1 3.43Å; F140-H144 AromaticContact CD2-ND1 3.55Å; F140-H144 AromaticContact CE2-CE1 3.32Å; F140-H144 WeakPolarHBondContact CE2-CE1 3.28Å; F140-H144 AromaticContact CE2-ND1 3.64Å; F140-H144 AromaticContact CE2-NE2 3.87Å; F140-H144 AromaticContact CG-ND1 3.81Å; F140-H144 AromaticContact CZ-CE1 3.97Å; F140-H144 AromaticContact CZ-ND1 3.96Å; F140-H144 WeakPolarHBondContact O-CB 3.38Å; F140-H144 PolarHBondContact O-N 2.83Å; F140-H144 PolarHBondContact O-ND1 2.97Å |
| 141 | T | 86 | Confident | 83 | Confident | 43 Ų | 43 | 85.8 Ų | 85.8 | 26% | 0.264 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 179.3 | -58.1 | 0 | 0 | 0 | 0 | 110.9 | W137 K138 H144 S145 | W137-T141 WeakPolarHBondContact O-CB 3.49Å; W137-T141 PolarHBondContact O-N 2.8Å; W137-T141 PolarHBondContact O-OG1 3.35Å; K138-T141 PolarHBondContact O-N 3.4Å; K138-T141 VanDerWaalsContact O-N 3.14Å; T141-H144 PolarHBondContact O-N 3.03Å; T141-S145 WeakPolarHBondContact O-CA 3.35Å; T141-S145 VanDerWaalsContact O-CB 3.3Å; T141-S145 WeakPolarHBondContact O-CB 3.42Å; T141-S145 PolarHBondContact O-N 3.03Å |
| 142 | E | 87.1 | Confident | 82 | Confident | 107 Ų | 107 | 87.2 Ų | 87.2 | 50% | 0.5 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.4 | -50.1 | 176.5 | -74.1 | 169.7 | -179.9 | 0 | 0 | 111.5 | K138 F140 H144 S145 | K138-E142 WeakPolarHBondContact CE-OE1 3.32Å; K138-E142 WeakPolarHBondContact CG-OE1 3.47Å; K138-E142 IonicContact NZ-OE1 3.9Å; K138-E142 WeakPolarHBondContact O-CG 3.4Å; K138-E142 PolarHBondContact O-N 2.76Å; F140-E142 VanDerWaalsContact C-N 3.34Å; F140-E142 PolarHBondContact O-N 3.17Å; E142-H144 PolarHBondContact O-N 2.91Å; E142-S145 PolarHBondContact O-N 3.4Å; E142-S145 PolarHBondContact O-OG 2.84Å |
| 143 | K | 83.7 | Confident | 81 | Confident | 168 Ų | 168 | 91.2 Ų | 91.2 | 73% | 0.73 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -61.2 | -30.5 | 179.1 | -75.1 | 176.3 | -179.5 | 179.7 | 0 | 113.7 | T139 F140 | T139-K143 WeakPolarHBondContact O-CB 3.42Å; T139-K143 VanDerWaalsContact O-CG 3.24Å; T139-K143 WeakPolarHBondContact O-CG 3.49Å; T139-K143 PolarHBondContact O-N 3.37Å; F140-K143 PolarHBondContact O-N 2.67Å |
| 144 | H | 77.4 | Confident | 80.3 | Confident | 59 Ų | 59 | 93.5 Ų | 93.5 | 27% | 0.273 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -103.1 | -0.6 | -177.4 | -62.5 | 83.7 | 0 | 0 | 0 | 113.5 | R65 F140 T141 E142 N146 R147 | R65-H144 PolarHBondContact NH2-NE2 3.21Å; F140-H144 AromaticContact CD2-CE1 3.42Å; F140-H144 VanDerWaalsContact CD2-CE1 3.42Å; F140-H144 WeakPolarHBondContact CD2-CE1 3.43Å; F140-H144 AromaticContact CD2-ND1 3.55Å; F140-H144 AromaticContact CE2-CE1 3.32Å; F140-H144 WeakPolarHBondContact CE2-CE1 3.28Å; F140-H144 AromaticContact CE2-ND1 3.64Å; F140-H144 AromaticContact CE2-NE2 3.87Å; F140-H144 AromaticContact CG-ND1 3.81Å; F140-H144 AromaticContact CZ-CE1 3.97Å; F140-H144 AromaticContact CZ-ND1 3.96Å; F140-H144 WeakPolarHBondContact O-CB 3.38Å; F140-H144 PolarHBondContact O-N 2.83Å; F140-H144 PolarHBondContact O-ND1 2.97Å; T141-H144 PolarHBondContact O-N 3.03Å; E142-H144 PolarHBondContact O-N 2.91Å; H144-N146 VanDerWaalsContact C-N 3.31Å; H144-N146 PolarHBondContact O-N 3.44Å; H144-R147 PolarHBondContact O-N 3.13Å |
| 145 | S | 72.1 | Confident | 80 | Confident | 76 Ų | 76 | 94.1 Ų | 94.1 | 53% | 0.531 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.4 | -36.3 | 179.2 | 61 | 0 | 0 | 0 | 0 | 112.7 | T141 E142 | T141-S145 WeakPolarHBondContact O-CA 3.35Å; T141-S145 VanDerWaalsContact O-CB 3.3Å; T141-S145 WeakPolarHBondContact O-CB 3.42Å; T141-S145 PolarHBondContact O-N 3.03Å; E142-S145 PolarHBondContact O-N 3.4Å; E142-S145 PolarHBondContact O-OG 2.84Å |
| 146 | N | 69.3 | Low | 79.8 | Confident | 145 Ų | 145 | 95.8 Ų | 95.8 | 78% | 0.775 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.2 | 11.6 | -176.8 | -61.6 | -31.4 | 0 | 0 | 0 | 113 | H144 P148 | H144-N146 VanDerWaalsContact C-N 3.31Å; H144-N146 PolarHBondContact O-N 3.44Å; N146-P148 WeakPolarHBondContact O-CD 3.23Å |
| 147 | R | 71.8 | Confident | 79.7 | Confident | 160 Ų | 160 | 100.7 Ų | 100.7 | 60% | 0.604 | 52% | 0.518 | S | S | * | . | trans | -75.3 | 113.4 | 178.1 | -168.3 | 168.9 | -176.5 | 158.5 | -0.6 | 107.8 | H144 | H144-R147 PolarHBondContact O-N 3.13Š| ||
| 148 | P | 68.5 | Low | 79.6 | Confident | 103 Ų | 103 | 101.4 Ų | 101.4 | 67% | 0.669 | 52% | 0.524 | S | S | * | . | trans | -59.7 | 145.6 | 177.3 | 26.1 | -33.5 | 0 | 0 | 0 | 109 | N146 I150 | N146-P148 WeakPolarHBondContact O-CD 3.23Å; P148-I150 PolarHBondContact O-N 3.39Å | ||
| 149 | S | 64.4 | Low | 79.6 | Confident | 94 Ų | 94 | 99.9 Ų | 99.9 | 66% | 0.657 | 52% | 0.518 | S | S | * | . | trans | -51.7 | 129.2 | 167.7 | 43.9 | 0 | 0 | 0 | 0 | 108.2 | E151 | S149-E151 PolarHBondContact O-N 3.49Š| ||
| 150 | I | 71.6 | Confident | 79.8 | Confident | 137 Ų | 137 | 99.6 Ų | 99.6 | 70% | 0.703 | 52% | 0.519 | S | S | * | . | trans | -69.5 | 88.2 | 175.7 | -59.3 | 169.6 | 0 | 0 | 0 | 106.2 | P148 V152 | P148-I150 PolarHBondContact O-N 3.39Å; I150-V152 PolarHBondContact O-N 3.49Å | ||
| 151 | E | 70.4 | Confident | 80 | Confident | 111 Ų | 111 | 101 Ų | 101 | 52% | 0.519 | 53% | 0.528 | S | S | . | . | trans | -70.3 | 124.4 | 166.5 | -67.8 | -177.5 | -177.3 | 0 | 0 | 107.2 | S149 R153 | S149-E151 PolarHBondContact O-N 3.49Å; E151-R153 HydrophobicContact CB-CG 4.22Å; E151-R153 PolarHBondContact O-N 2.62Å; E151-R153 IonicContact OE2-CZ 4Å; E151-R153 IonicContact OE2-NE 2.63Å; E151-R153 PolarHBondContact OE2-NE 3.47Å; E151-R153 IonicContact OE2-NH2 2.74Å; E151-R153 PolarHBondContact OE2-NH2 2.77Å | ||
| 152 | V | 71.7 | Confident | 80.3 | Confident | 143 Ų | 143 | 101.3 Ų | 101.3 | 87% | 0.867 | 52% | 0.524 | S | S | * | . | trans | -72.8 | 80.6 | 172.6 | -175.2 | 0 | 0 | 0 | 0 | 107.3 | I150 | I150-V152 PolarHBondContact O-N 3.49Š| ||
| 153 | R | 74.3 | Confident | 80.6 | Confident | 172 Ų | 172 | 102.6 Ų | 102.6 | 65% | 0.649 | 53% | 0.528 | S | S | * | . | P | Polyproline II helix | trans | -74.2 | 145.6 | 171.5 | -67.3 | -71 | 174.6 | 154.4 | -5.1 | 109 | E151 | E151-R153 HydrophobicContact CB-CG 4.22Å; E151-R153 PolarHBondContact O-N 2.62Å; E151-R153 IonicContact OE2-CZ 4Å; E151-R153 IonicContact OE2-NE 2.63Å; E151-R153 PolarHBondContact OE2-NE 3.47Å; E151-R153 IonicContact OE2-NH2 2.74Å; E151-R153 PolarHBondContact OE2-NH2 2.77Å |
| 154 | S | 78.8 | Confident | 81.1 | Confident | 47 Ų | 47 | 99 Ų | 99 | 33% | 0.329 | 52% | 0.516 | S | S | . | . | P | Polyproline II helix | trans | -69.4 | 159.7 | 171 | -60.8 | 0 | 0 | 0 | 0 | 109.1 | ||
| 155 | D | 87.7 | Confident | 81.9 | Confident | 82 Ų | 82 | 96.4 Ų | 96.4 | 44% | 0.439 | 51% | 0.505 | S | S | . | . | P | Polyproline II helix | trans | -61 | 152 | 173.7 | 66 | -79.5 | 0 | 0 | 0 | 110.8 | K157 T158 E159 | D155-K157 PolarHBondContact O-N 3.04Å; D155-K157 WeakPolarHBondContact OD2-CA 3.37Å; D155-K157 VanDerWaalsContact OD2-CB 3.27Å; D155-K157 WeakPolarHBondContact OD2-CB 3.43Å; D155-K157 PolarHBondContact OD2-N 3.37Å; D155-T158 WeakPolarHBondContact O-CB 3.32Å; D155-T158 PolarHBondContact O-N 3.03Å; D155-T158 WeakPolarHBondContact OD1-CB 3.45Å; D155-T158 PolarHBondContact OD1-OG1 2.89Å; D155-T158 PolarHBondContact OD2-N 3.38Å; D155-T158 PolarHBondContact OD2-OG1 3.11Å; D155-E159 PolarHBondContact O-N 3.01Å |
| 156 | P | 88.4 | Confident | 83 | Confident | 110 Ų | 110 | 94.5 Ų | 94.5 | 71% | 0.714 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -56.5 | -29 | -176.2 | -27.6 | 35 | 0 | 0 | 0 | 114.5 | S160 | P156-S160 WeakPolarHBondContact O-CB 3.45Å; P156-S160 PolarHBondContact O-N 3.47Å; P156-S160 PolarHBondContact O-OG 2.72Å |
| 157 | K | 89.1 | Confident | 84.2 | Confident | 151 Ų | 151 | 92.6 Ų | 92.6 | 66% | 0.657 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -72.6 | -42.3 | 178 | -176.2 | -179 | -178.2 | 176.8 | 0 | 111 | D155 S160 L161 | D155-K157 PolarHBondContact O-N 3.04Å; D155-K157 WeakPolarHBondContact OD2-CA 3.37Å; D155-K157 VanDerWaalsContact OD2-CB 3.27Å; D155-K157 WeakPolarHBondContact OD2-CB 3.43Å; D155-K157 PolarHBondContact OD2-N 3.37Å; K157-S160 WeakPolarHBondContact CA-OG 3.28Å; K157-S160 PolarHBondContact O-OG 2.82Å; K157-L161 HydrophobicContact CG-CD1 4.31Å; K157-L161 WeakPolarHBondContact O-CG 2.78Å; K157-L161 PolarHBondContact O-N 3.2Å; K157-L161 VanDerWaalsContact O-N 3.09Å |
| 158 | T | 90.9 | Very high | 85.3 | Confident | 25 Ų | 25 | 88.4 Ų | 88.4 | 15% | 0.153 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -61.3 | -44.8 | 171.7 | -67.5 | 0 | 0 | 0 | 0 | 111.3 | D155 S160 L161 R162 I197 | D155-T158 WeakPolarHBondContact O-CB 3.32Å; D155-T158 PolarHBondContact O-N 3.03Å; D155-T158 WeakPolarHBondContact OD1-CB 3.45Å; D155-T158 PolarHBondContact OD1-OG1 2.89Å; D155-T158 PolarHBondContact OD2-N 3.38Å; D155-T158 PolarHBondContact OD2-OG1 3.11Å; T158-S160 PolarHBondContact O-N 2.88Å; T158-L161 PolarHBondContact O-N 3.38Å; T158-R162 HydrophobicContact CG2-CG 4.49Å; T158-R162 WeakPolarHBondContact O-CG 3.26Å; T158-R162 PolarHBondContact O-N 3.25Å; T158-I197 HydrophobicContact CG2-CD1 4.48Å; T158-I197 HydrophobicContact CG2-CG1 3.79Å |
| 159 | E | 91.1 | Very high | 86.5 | Confident | 67 Ų | 67 | 83.5 Ų | 83.5 | 31% | 0.313 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 179 | -67.8 | -167.2 | 161.1 | 0 | 0 | 112.5 | D155 L161 R162 K163 | D155-E159 PolarHBondContact O-N 3.01Å; E159-L161 PolarHBondContact O-N 3.16Å; E159-R162 PolarHBondContact O-N 2.9Å; E159-K163 WeakPolarHBondContact O-CG 3.28Å; E159-K163 PolarHBondContact O-N 3.36Å |
| 160 | S | 92.7 | Very high | 87.9 | Confident | 56 Ų | 56 | 79.3 Ų | 79.3 | 39% | 0.392 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.4 | -39.7 | 177.8 | 55.1 | 0 | 0 | 0 | 0 | 112.8 | P156 K157 T158 K163 N164 | P156-S160 WeakPolarHBondContact O-CB 3.45Å; P156-S160 PolarHBondContact O-N 3.47Å; P156-S160 PolarHBondContact O-OG 2.72Å; K157-S160 WeakPolarHBondContact CA-OG 3.28Å; K157-S160 PolarHBondContact O-OG 2.82Å; T158-S160 PolarHBondContact O-N 2.88Å; S160-K163 PolarHBondContact O-N 3.41Å; S160-N164 WeakPolarHBondContact O-CB 3.36Å; S160-N164 VanDerWaalsContact O-CG 3.27Å; S160-N164 PolarHBondContact O-N 3.48Å; S160-N164 PolarHBondContact O-ND2 3.3Å |
| 161 | L | 92.3 | Very high | 89 | Confident | 65 Ų | 65 | 77.4 Ų | 77.4 | 34% | 0.34 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.3 | -40.1 | 175.6 | -74.7 | 168.6 | 0 | 0 | 0 | 112.4 | K157 T158 E159 N164 A165 I197 | K157-L161 HydrophobicContact CG-CD1 4.31Å; K157-L161 WeakPolarHBondContact O-CG 2.78Å; K157-L161 PolarHBondContact O-N 3.2Å; K157-L161 VanDerWaalsContact O-N 3.09Å; T158-L161 PolarHBondContact O-N 3.38Å; E159-L161 PolarHBondContact O-N 3.16Å; L161-N164 PolarHBondContact O-N 3.39Å; L161-A165 PolarHBondContact O-N 2.95Å; L161-I197 HydrophobicContact CB-CG2 4.17Å; L161-I197 HydrophobicContact CD1-CG2 3.77Å |
| 162 | R | 92.9 | Very high | 90 | Very high | 49 Ų | 49 | 72.1 Ų | 72.1 | 19% | 0.185 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -67.7 | -42 | 176.5 | -68 | -175.5 | 71.9 | -170.7 | -4.1 | 111.7 | T158 E159 N164 A165 Q166 E186 I197 | T158-R162 HydrophobicContact CG2-CG 4.49Å; T158-R162 WeakPolarHBondContact O-CG 3.26Å; T158-R162 PolarHBondContact O-N 3.25Å; E159-R162 PolarHBondContact O-N 2.9Å; R162-N164 VanDerWaalsContact C-N 3.31Å; R162-N164 PolarHBondContact O-N 3.28Å; R162-A165 WeakPolarHBondContact O-CB 3.37Å; R162-A165 PolarHBondContact O-N 3.29Å; R162-A165 VanDerWaalsContact O-N 3.15Å; R162-Q166 WeakPolarHBondContact O-CG 3.44Å; R162-Q166 PolarHBondContact O-N 3.19Å; R162-E186 WeakPolarHBondContact CG-OE1 3.33Å; R162-E186 IonicContact CZ-OE1 3.55Å; R162-E186 IonicContact CZ-OE2 3.46Å; R162-E186 IonicContact NE-OE1 2.78Å; R162-E186 PolarHBondContact NE-OE1 2.97Å; R162-E186 IonicContact NE-OE2 3.35Å; R162-E186 PolarHBondContact NE-OE2 3.31Å; R162-E186 IonicContact NH2-OE1 3.46Å; R162-E186 PolarHBondContact NH2-OE1 3.42Å; R162-E186 IonicContact NH2-OE2 2.74Å; R162-E186 PolarHBondContact NH2-OE2 3.37Å; R162-I197 HydrophobicContact CG-CD1 3.59Å; R162-I197 HydrophobicContact CG-CG1 4.46Å |
| 163 | K | 93.7 | Very high | 90.9 | Very high | 134 Ų | 134 | 65.3 Ų | 65.3 | 58% | 0.583 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -60.1 | -40.4 | 172.5 | -74 | -177.8 | 179.3 | -178.5 | 0 | 112.2 | E159 S160 Q166 K167 | E159-K163 WeakPolarHBondContact O-CG 3.28Å; E159-K163 PolarHBondContact O-N 3.36Å; S160-K163 PolarHBondContact O-N 3.41Å; K163-Q166 PolarHBondContact O-N 2.94Å; K163-K167 PolarHBondContact O-N 2.94Å |
| 164 | N | 94.3 | Very high | 91.7 | Very high | 92 Ų | 92 | 63.4 Ų | 63.4 | 49% | 0.492 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.8 | -39 | 174.5 | -73.4 | -30.1 | 0 | 0 | 0 | 112.2 | S160 L161 R162 K167 L168 | S160-N164 WeakPolarHBondContact O-CB 3.36Å; S160-N164 VanDerWaalsContact O-CG 3.27Å; S160-N164 PolarHBondContact O-N 3.48Å; S160-N164 PolarHBondContact O-ND2 3.3Å; L161-N164 PolarHBondContact O-N 3.39Å; R162-N164 VanDerWaalsContact C-N 3.31Å; R162-N164 PolarHBondContact O-N 3.28Å; N164-K167 WeakPolarHBondContact O-CB 3.29Å; N164-K167 PolarHBondContact O-N 3.46Å; N164-L168 WeakPolarHBondContact O-CG 3.44Å; N164-L168 PolarHBondContact O-N 3.01Å |
| 165 | A | 93.8 | Very high | 92.2 | Very high | 5 Ų | 5 | 63.6 Ų | 63.6 | 4% | 0.041 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.8 | -45 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L161 R162 K167 L168 L169 E186 Y201 V205 | L161-A165 PolarHBondContact O-N 2.95Å; R162-A165 WeakPolarHBondContact O-CB 3.37Å; R162-A165 PolarHBondContact O-N 3.29Å; R162-A165 VanDerWaalsContact O-N 3.15Å; A165-K167 VanDerWaalsContact C-N 3.27Å; A165-K167 PolarHBondContact O-N 3.44Å; A165-L168 PolarHBondContact O-N 3.31Å; A165-L169 WeakPolarHBondContact O-CB 3.25Å; A165-L169 WeakPolarHBondContact O-CG 3.42Å; A165-L169 PolarHBondContact O-N 3.35Å; A165-E186 HydrophobicContact CB-CG 4.28Å; A165-Y201 HydrophobicContact CB-CE1 4.49Å; A165-Y201 WeakPolarHBondContact CB-OH 3.48Å; A165-V205 HydrophobicContact CB-CG1 3.93Å; A165-V205 HydrophobicContact CB-CG2 4.27Å |
| 166 | Q | 94.8 | Very high | 92.2 | Very high | 36 Ų | 36 | 68 Ų | 68 | 17% | 0.168 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -58.7 | -40.2 | 173.2 | -68.6 | 174.6 | -2.9 | 0 | 0 | 111.3 | R162 K163 L169 S170 M177 V182 E186 | R162-Q166 WeakPolarHBondContact O-CG 3.44Å; R162-Q166 PolarHBondContact O-N 3.19Å; K163-Q166 PolarHBondContact O-N 2.94Å; Q166-L169 PolarHBondContact O-N 3.41Å; Q166-S170 WeakPolarHBondContact O-CB 3.42Å; Q166-S170 PolarHBondContact O-N 3.29Å; Q166-S170 PolarHBondContact O-OG 2.94Å; Q166-M177 HydrophobicContact CB-CE 4.27Å; Q166-V182 HydrophobicContact CB-CG1 4.09Å; Q166-V182 VanDerWaalsContact O-CG1 3.29Å; Q166-V182 WeakPolarHBondContact O-CG1 3.39Å; Q166-E186 HydrophobicContact CG-CB 3.85Å; Q166-E186 HydrophobicContact CG-CG 3.84Å |
| 167 | K | 95.3 | Very high | 91.9 | Very high | 106 Ų | 106 | 66.2 Ų | 66.2 | 46% | 0.461 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -58.4 | -52.2 | 175.4 | -174.5 | 180 | 177.7 | -175.6 | 0 | 112.3 | K163 N164 A165 L169 S170 E171 M177 | K163-K167 PolarHBondContact O-N 2.94Å; N164-K167 WeakPolarHBondContact O-CB 3.29Å; N164-K167 PolarHBondContact O-N 3.46Å; A165-K167 VanDerWaalsContact C-N 3.27Å; A165-K167 PolarHBondContact O-N 3.44Å; K167-L169 VanDerWaalsContact C-N 3.27Å; K167-L169 PolarHBondContact O-N 2.93Å; K167-S170 PolarHBondContact O-N 3.04Å; K167-S170 PolarHBondContact O-OG 3.31Å; K167-E171 VanDerWaalsContact CE-OE1 3.25Å; K167-E171 WeakPolarHBondContact CE-OE1 3.4Å; K167-E171 WeakPolarHBondContact O-CG 3.44Å; K167-E171 PolarHBondContact O-N 3.15Å; K167-M177 WeakPolarHBondContact CA-SD 3.48Å; K167-M177 HydrophobicContact CB-CE 3.78Å; K167-M177 HydrophobicContact CB-SD 3.72Å; K167-M177 HydrophobicContact CG-CE 4.42Å; K167-M177 HydrophobicContact CG-SD 3.75Å |
| 168 | L | 94.6 | Very high | 91.6 | Very high | 72 Ų | 72 | 66 Ų | 66 | 38% | 0.377 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.4 | -36.5 | 178.8 | -65.2 | 171.6 | 0 | 0 | 0 | 112.7 | N164 A165 A172 V209 | N164-L168 WeakPolarHBondContact O-CG 3.44Å; N164-L168 PolarHBondContact O-N 3.01Å; A165-L168 PolarHBondContact O-N 3.31Å; L168-A172 WeakPolarHBondContact O-CB 3.46Å; L168-A172 PolarHBondContact O-N 2.71Å; L168-A172 VanDerWaalsContact O-N 3.09Å; L168-V209 HydrophobicContact CB-CG2 3.84Å |
| 169 | L | 93.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 68.7 Ų | 68.7 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -70.3 | -40.4 | 176.5 | -72.6 | 169.1 | 0 | 0 | 0 | 112 | A165 Q166 K167 A172 L173 V182 I185 E186 L208 V209 L212 | A165-L169 WeakPolarHBondContact O-CB 3.25Å; A165-L169 WeakPolarHBondContact O-CG 3.42Å; A165-L169 PolarHBondContact O-N 3.35Å; Q166-L169 PolarHBondContact O-N 3.41Å; K167-L169 VanDerWaalsContact C-N 3.27Å; K167-L169 PolarHBondContact O-N 2.93Å; L169-A172 PolarHBondContact O-N 3.47Å; L169-L173 WeakPolarHBondContact O-CB 3.42Å; L169-L173 WeakPolarHBondContact O-CG 3.37Å; L169-L173 PolarHBondContact O-N 3Å; L169-V182 HydrophobicContact CB-CG1 3.88Å; L169-I185 HydrophobicContact CD1-CB 4.46Å; L169-I185 HydrophobicContact CD1-CG2 3.96Å; L169-I185 HydrophobicContact CD2-CG2 4.07Å; L169-E186 HydrophobicContact CD1-CB 4.06Å; L169-L208 HydrophobicContact CD2-CB 4.25Å; L169-V209 HydrophobicContact CD2-CG2 3.82Å; L169-V209 HydrophobicContact CG-CG2 4.18Å; L169-L212 HydrophobicContact CD2-CD1 4.13Å |
| 170 | S | 94.8 | Very high | 91.7 | Very high | 6 Ų | 6 | 71.9 Ų | 71.9 | 4% | 0.042 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.4 | -41.6 | 176.4 | 74.3 | 0 | 0 | 0 | 0 | 111.8 | Q166 K167 L173 E174 L175 M177 | Q166-S170 WeakPolarHBondContact O-CB 3.42Å; Q166-S170 PolarHBondContact O-N 3.29Å; Q166-S170 PolarHBondContact O-OG 2.94Å; K167-S170 PolarHBondContact O-N 3.04Å; K167-S170 PolarHBondContact O-OG 3.31Å; S170-L173 CarbonylContact O-C 3.56Å; S170-L173 PolarHBondContact O-N 3.47Å; S170-E174 WeakPolarHBondContact O-CA 3.3Å; S170-E174 PolarHBondContact O-N 3.33Å; S170-L175 PolarHBondContact O-N 2.87Å; S170-M177 PolarHBondContact OG-SD 3.33Å |
| 171 | E | 93.9 | Very high | 91.6 | Very high | 96 Ų | 96 | 70.6 Ų | 70.6 | 45% | 0.449 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.8 | -40.6 | 174.4 | -71.4 | 172.6 | -169.2 | 0 | 0 | 111.5 | K167 L173 E174 | K167-E171 VanDerWaalsContact CE-OE1 3.25Å; K167-E171 WeakPolarHBondContact CE-OE1 3.4Å; K167-E171 WeakPolarHBondContact O-CG 3.44Å; K167-E171 PolarHBondContact O-N 3.15Å; E171-L173 VanDerWaalsContact C-N 3.33Å; E171-E174 PolarHBondContact O-N 3.22Å |
| 172 | A | 92.1 | Very high | 91.6 | Very high | 1 Ų | 1 | 67.5 Ų | 67.5 | 1% | 0.008 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -69.9 | -30.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L168 L169 V209 L212 K213 R219 | L168-A172 WeakPolarHBondContact O-CB 3.46Å; L168-A172 PolarHBondContact O-N 2.71Å; L168-A172 VanDerWaalsContact O-N 3.09Å; L169-A172 PolarHBondContact O-N 3.47Å; A172-V209 HydrophobicContact CB-CG1 4.22Å; A172-L212 HydrophobicContact CB-CB 3.85Å; A172-L212 HydrophobicContact CB-CD1 4.48Å; A172-K213 HydrophobicContact CB-CG 3.78Å; A172-R219 PolarHBondContact O-NE 3.16Å |
| 173 | L | 90.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 68.4 Ų | 68.4 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -90.5 | -8.4 | 176.5 | -71.7 | 166.8 | 0 | 0 | 0 | 112.8 | L169 S170 E171 L175 V182 I185 L212 R219 V222 K223 | L169-L173 WeakPolarHBondContact O-CB 3.42Å; L169-L173 WeakPolarHBondContact O-CG 3.37Å; L169-L173 PolarHBondContact O-N 3Å; S170-L173 CarbonylContact O-C 3.56Å; S170-L173 PolarHBondContact O-N 3.47Å; E171-L173 VanDerWaalsContact C-N 3.33Å; L173-L175 HydrophobicContact CB-CB 4.33Å; L173-L175 HydrophobicContact CB-CD1 3.87Å; L173-L175 HydrophobicContact CB-CG 3.9Å; L173-L175 HydrophobicContact CD1-CD1 4.32Å; L173-L175 PolarHBondContact O-N 3.28Å; L173-V182 HydrophobicContact CD1-CG2 3.96Å; L173-I185 HydrophobicContact CD1-CD1 3.71Å; L173-L212 HydrophobicContact CD1-CD1 4.5Å; L173-L212 HydrophobicContact CD2-CD1 4.15Å; L173-L212 HydrophobicContact CD2-CD2 3.89Å; L173-L212 HydrophobicContact CG-CD1 4.1Å; L173-R219 HydrophobicContact CD2-CG 4.09Å; L173-V222 HydrophobicContact CD2-CG1 4.42Å; L173-K223 HydrophobicContact CD2-CG 4.49Å; L173-K223 WeakPolarHBondContact O-CE 3.28Å; L173-K223 PolarHBondContact O-NZ 3.45Å |
| 174 | E | 90.6 | Very high | 91.6 | Very high | 131 Ų | 131 | 65.4 Ų | 65.4 | 61% | 0.612 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.8 | 41.7 | -172.3 | -57.4 | 150 | 166.1 | 0 | 0 | 111.6 | S170 E171 R219 K223 | S170-E174 WeakPolarHBondContact O-CA 3.3Å; S170-E174 PolarHBondContact O-N 3.33Å; E171-E174 PolarHBondContact O-N 3.22Å; E174-R219 IonicContact OE1-NH1 2.62Å; E174-R219 PolarHBondContact OE1-NH1 3.07Å; E174-R219 IonicContact OE2-NH1 2.75Å; E174-R219 PolarHBondContact OE2-NH1 2.88Å; E174-K223 IonicContact OE2-NZ 2.65Å; E174-K223 PolarHBondContact OE2-NZ 3.23Å |
| 175 | L | 89.4 | Confident | 91.6 | Very high | 51 Ų | 51 | 61 Ų | 61 | 27% | 0.267 | 30% | 0.298 | S | S | . | . | trans | -116.1 | 164.9 | 179.2 | -65.6 | 177.3 | 0 | 0 | 0 | 110.5 | S170 L173 H179 L181 V182 | S170-L175 PolarHBondContact O-N 2.87Å; L173-L175 HydrophobicContact CB-CB 4.33Å; L173-L175 HydrophobicContact CB-CD1 3.87Å; L173-L175 HydrophobicContact CB-CG 3.9Å; L173-L175 HydrophobicContact CD1-CD1 4.32Å; L173-L175 PolarHBondContact O-N 3.28Å; L175-H179 HydrophobicContact CB-CB 4.22Å; L175-L181 HydrophobicContact CD1-CD2 4.1Å; L175-V182 HydrophobicContact CB-CG2 4.37Å; L175-V182 HydrophobicContact CD1-CG2 4.45Å | ||
| 176 | K | 89.1 | Confident | 91.6 | Very high | 175 Ų | 175 | 60.8 Ų | 60.8 | 76% | 0.761 | 30% | 0.296 | S | S | * | . | trans | -63.6 | 147.8 | 170.7 | -66.1 | -175.7 | -179.1 | 178.1 | 0 | 110.4 | D178 H179 | K176-D178 VanDerWaalsContact C-N 3.25Å; K176-D178 PolarHBondContact O-N 3.27Å; K176-H179 VanDerWaalsContact O-CB 3.23Å; K176-H179 WeakPolarHBondContact O-CB 3.3Å; K176-H179 PolarHBondContact O-N 3.21Å; K176-H179 VanDerWaalsContact O-N 3.14Å | ||
| 177 | M | 80.4 | Confident | 91.6 | Very high | 73 Ų | 73 | 65.8 Ų | 65.8 | 36% | 0.36 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -49.4 | -43.7 | 178.1 | -78.6 | -65 | -42.1 | 0 | 0 | 113.5 | Q166 K167 S170 H179 | Q166-M177 HydrophobicContact CB-CE 4.27Å; K167-M177 WeakPolarHBondContact CA-SD 3.48Å; K167-M177 HydrophobicContact CB-CE 3.78Å; K167-M177 HydrophobicContact CB-SD 3.72Å; K167-M177 HydrophobicContact CG-CE 4.42Å; K167-M177 HydrophobicContact CG-SD 3.75Å; S170-M177 PolarHBondContact OG-SD 3.33Å; M177-H179 VanDerWaalsContact C-N 3.27Å; M177-H179 PolarHBondContact O-N 2.85Å |
| 178 | D | 83.4 | Confident | 91.5 | Very high | 147 Ų | 147 | 63.8 Ų | 63.8 | 79% | 0.786 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | 21.3 | -173.6 | -52.3 | -43.6 | 0 | 0 | 0 | 112.8 | K176 | K176-D178 VanDerWaalsContact C-N 3.25Å; K176-D178 PolarHBondContact O-N 3.27Å |
| 179 | H | 92.4 | Very high | 91.4 | Very high | 80 Ų | 80 | 60.4 Ų | 60.4 | 37% | 0.37 | 29% | 0.288 | S | S | . | . | trans | -74.5 | 129.8 | 178.9 | -167.1 | -78 | 0 | 0 | 0 | 110.7 | L175 K176 M177 L181 V182 E183 | L175-H179 HydrophobicContact CB-CB 4.22Å; K176-H179 VanDerWaalsContact O-CB 3.23Å; K176-H179 WeakPolarHBondContact O-CB 3.3Å; K176-H179 PolarHBondContact O-N 3.21Å; K176-H179 VanDerWaalsContact O-N 3.14Å; M177-H179 VanDerWaalsContact C-N 3.27Å; M177-H179 PolarHBondContact O-N 2.85Å; H179-L181 VanDerWaalsContact ND1-CB 3.28Å; H179-L181 WeakPolarHBondContact ND1-CB 3.43Å; H179-L181 PolarHBondContact ND1-N 3.33Å; H179-L181 VanDerWaalsContact ND1-N 3.16Å; H179-L181 PolarHBondContact O-N 2.95Å; H179-L181 VanDerWaalsContact O-N 3.07Å; H179-V182 HydrophobicContact CB-CG2 4.25Å; H179-V182 WeakPolarHBondContact O-CB 3.42Å; H179-V182 PolarHBondContact O-N 2.84Å; H179-E183 PolarHBondContact O-N 2.75Å | ||
| 180 | L | 91.8 | Very high | 91.4 | Very high | 134 Ų | 134 | 61.8 Ų | 61.8 | 70% | 0.702 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -53.3 | -35.9 | -176.8 | -86.4 | 67.7 | 0 | 0 | 0 | 113.2 | V182 E183 N184 | L180-V182 PolarHBondContact O-N 2.82Å; L180-E183 PolarHBondContact O-N 3.35Å; L180-N184 VanDerWaalsContact O-CB 3.26Å; L180-N184 WeakPolarHBondContact O-CB 3.48Å; L180-N184 PolarHBondContact O-N 2.85Å |
| 181 | L | 90.4 | Very high | 91.3 | Very high | 29 Ų | 29 | 65.7 Ų | 65.7 | 15% | 0.152 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60.6 | -42.4 | 176.2 | -175.1 | 60.4 | 0 | 0 | 0 | 112.9 | L175 H179 N184 I185 V222 V229 | L175-L181 HydrophobicContact CD1-CD2 4.1Å; H179-L181 VanDerWaalsContact ND1-CB 3.28Å; H179-L181 WeakPolarHBondContact ND1-CB 3.43Å; H179-L181 PolarHBondContact ND1-N 3.33Å; H179-L181 VanDerWaalsContact ND1-N 3.16Å; H179-L181 PolarHBondContact O-N 2.95Å; H179-L181 VanDerWaalsContact O-N 3.07Å; L181-N184 PolarHBondContact O-N 3.27Å; L181-I185 HydrophobicContact CD1-CD1 4.29Å; L181-I185 HydrophobicContact CG-CD1 4.09Å; L181-I185 WeakPolarHBondContact O-CD1 3.38Å; L181-I185 VanDerWaalsContact O-CG1 3.28Å; L181-I185 WeakPolarHBondContact O-CG1 3.45Å; L181-I185 PolarHBondContact O-N 2.74Å; L181-V222 HydrophobicContact CD1-CG1 4.38Å; L181-V222 HydrophobicContact CD2-CG1 4.3Å; L181-V229 HydrophobicContact CD1-CG2 3.79Å |
| 182 | V | 92.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -66.7 | -44.1 | 179 | 175.8 | 0 | 0 | 0 | 0 | 109.7 | Q166 L169 L173 L175 H179 L180 N184 I185 E186 | Q166-V182 HydrophobicContact CB-CG1 4.09Å; Q166-V182 VanDerWaalsContact O-CG1 3.29Å; Q166-V182 WeakPolarHBondContact O-CG1 3.39Å; L169-V182 HydrophobicContact CB-CG1 3.88Å; L173-V182 HydrophobicContact CD1-CG2 3.96Å; L175-V182 HydrophobicContact CB-CG2 4.37Å; L175-V182 HydrophobicContact CD1-CG2 4.45Å; H179-V182 HydrophobicContact CB-CG2 4.25Å; H179-V182 WeakPolarHBondContact O-CB 3.42Å; H179-V182 PolarHBondContact O-N 2.84Å; L180-V182 PolarHBondContact O-N 2.82Å; V182-N184 VanDerWaalsContact C-N 3.33Å; V182-N184 PolarHBondContact O-N 3.42Å; V182-I185 PolarHBondContact O-N 3.29Å; V182-E186 PolarHBondContact O-N 3.35Å; V182-E186 VanDerWaalsContact O-N 3.11Å |
| 183 | E | 93.3 | Very high | 91 | Very high | 68 Ų | 68 | 63.5 Ų | 63.5 | 32% | 0.318 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 176.2 | -172.8 | 177.6 | -173.4 | 0 | 0 | 111.6 | H179 L180 E186 R187 | H179-E183 PolarHBondContact O-N 2.75Å; L180-E183 PolarHBondContact O-N 3.35Å; E183-E186 PolarHBondContact O-N 3.46Å; E183-R187 HydrophobicContact CG-CG 4.31Å; E183-R187 WeakPolarHBondContact O-CB 3.5Å; E183-R187 VanDerWaalsContact O-CG 3.28Å; E183-R187 WeakPolarHBondContact O-CG 3.42Å; E183-R187 PolarHBondContact O-N 2.78Å; E183-R187 IonicContact OE1-CZ 3.47Å; E183-R187 IonicContact OE1-NE 3.04Å; E183-R187 PolarHBondContact OE1-NE 2.7Å; E183-R187 IonicContact OE1-NH2 3.22Å; E183-R187 PolarHBondContact OE1-NH2 3.49Å |
| 184 | N | 93.5 | Very high | 90.9 | Very high | 71 Ų | 71 | 66.9 Ų | 66.9 | 38% | 0.38 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.8 | -48.5 | 178.9 | -167.9 | 1.3 | 0 | 0 | 0 | 111.6 | L180 L181 V182 E186 R187 E188 | L180-N184 VanDerWaalsContact O-CB 3.26Å; L180-N184 WeakPolarHBondContact O-CB 3.48Å; L180-N184 PolarHBondContact O-N 2.85Å; L181-N184 PolarHBondContact O-N 3.27Å; V182-N184 VanDerWaalsContact C-N 3.33Å; V182-N184 PolarHBondContact O-N 3.42Å; N184-E186 VanDerWaalsContact C-N 3.3Å; N184-E186 PolarHBondContact O-N 3.09Å; N184-R187 PolarHBondContact O-N 3.32Å; N184-E188 WeakPolarHBondContact O-CB 3.43Å; N184-E188 WeakPolarHBondContact O-CG 3.04Å; N184-E188 PolarHBondContact O-N 2.99Å |
| 185 | I | 93.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.6 | -43 | 177.6 | -66.5 | 161.2 | 0 | 0 | 0 | 111.1 | L169 L173 L181 V182 T189 L208 V222 V229 V233 | L169-I185 HydrophobicContact CD1-CB 4.46Å; L169-I185 HydrophobicContact CD1-CG2 3.96Å; L169-I185 HydrophobicContact CD2-CG2 4.07Å; L173-I185 HydrophobicContact CD1-CD1 3.71Å; L181-I185 HydrophobicContact CD1-CD1 4.29Å; L181-I185 HydrophobicContact CG-CD1 4.09Å; L181-I185 WeakPolarHBondContact O-CD1 3.38Å; L181-I185 VanDerWaalsContact O-CG1 3.28Å; L181-I185 WeakPolarHBondContact O-CG1 3.45Å; L181-I185 PolarHBondContact O-N 2.74Å; V182-I185 PolarHBondContact O-N 3.29Å; I185-T189 WeakPolarHBondContact O-CB 3.4Å; I185-T189 PolarHBondContact O-N 3.03Å; I185-T189 PolarHBondContact O-OG1 2.94Å; I185-L208 HydrophobicContact CG2-CD1 4.23Å; I185-V222 HydrophobicContact CD1-CG1 4.02Å; I185-V229 HydrophobicContact CB-CG1 4.19Å; I185-V229 HydrophobicContact CG1-CB 4.5Å; I185-V229 HydrophobicContact CG1-CG1 3.6Å; I185-V229 HydrophobicContact CG1-CG2 4.11Å; I185-V233 HydrophobicContact CG2-CG2 4.2Å |
| 186 | E | 94.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 70.1 Ų | 70.1 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -67 | -44.3 | 178.1 | -169.2 | -80.9 | 151.3 | 0 | 0 | 112 | R162 A165 Q166 L169 V182 E183 N184 T189 F190 Y201 | R162-E186 WeakPolarHBondContact CG-OE1 3.33Å; R162-E186 IonicContact CZ-OE1 3.55Å; R162-E186 IonicContact CZ-OE2 3.46Å; R162-E186 IonicContact NE-OE1 2.78Å; R162-E186 PolarHBondContact NE-OE1 2.97Å; R162-E186 IonicContact NE-OE2 3.35Å; R162-E186 PolarHBondContact NE-OE2 3.31Å; R162-E186 IonicContact NH2-OE1 3.46Å; R162-E186 PolarHBondContact NH2-OE1 3.42Å; R162-E186 IonicContact NH2-OE2 2.74Å; R162-E186 PolarHBondContact NH2-OE2 3.37Å; A165-E186 HydrophobicContact CB-CG 4.28Å; Q166-E186 HydrophobicContact CG-CB 3.85Å; Q166-E186 HydrophobicContact CG-CG 3.84Å; L169-E186 HydrophobicContact CD1-CB 4.06Å; V182-E186 PolarHBondContact O-N 3.35Å; V182-E186 VanDerWaalsContact O-N 3.11Å; E183-E186 PolarHBondContact O-N 3.46Å; N184-E186 VanDerWaalsContact C-N 3.3Å; N184-E186 PolarHBondContact O-N 3.09Å; E186-T189 PolarHBondContact O-N 3.21Å; E186-F190 WeakPolarHBondContact O-CB 3.42Å; E186-F190 PolarHBondContact O-N 3.15Å; E186-Y201 PolarHBondContact OE1-OH 3.04Å |
| 187 | R | 93.6 | Very high | 90.6 | Very high | 142 Ų | 142 | 63.2 Ų | 63.2 | 54% | 0.536 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 178.6 | -76.6 | 179.7 | 177.7 | -131.6 | 5.9 | 111.9 | E183 N184 F190 H191 | E183-R187 HydrophobicContact CG-CG 4.31Å; E183-R187 WeakPolarHBondContact O-CB 3.5Å; E183-R187 VanDerWaalsContact O-CG 3.28Å; E183-R187 WeakPolarHBondContact O-CG 3.42Å; E183-R187 PolarHBondContact O-N 2.78Å; E183-R187 IonicContact OE1-CZ 3.47Å; E183-R187 IonicContact OE1-NE 3.04Å; E183-R187 PolarHBondContact OE1-NE 2.7Å; E183-R187 IonicContact OE1-NH2 3.22Å; E183-R187 PolarHBondContact OE1-NH2 3.49Å; N184-R187 PolarHBondContact O-N 3.32Å; R187-F190 PolarHBondContact O-N 3.36Å; R187-H191 WeakPolarHBondContact O-CB 3.49Å; R187-H191 PolarHBondContact O-N 2.92Å |
| 188 | E | 93.3 | Very high | 91 | Very high | 64 Ų | 64 | 61.7 Ų | 61.7 | 30% | 0.299 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64.8 | -41.2 | 175.5 | -73.8 | -56.5 | 135 | 0 | 0 | 111.6 | N184 F190 H191 L192 V229 V233 | N184-E188 WeakPolarHBondContact O-CB 3.43Å; N184-E188 WeakPolarHBondContact O-CG 3.04Å; N184-E188 PolarHBondContact O-N 2.99Å; E188-F190 VanDerWaalsContact C-N 3.35Å; E188-F190 PolarHBondContact O-N 3.22Å; E188-H191 PolarHBondContact O-N 2.99Å; E188-L192 WeakPolarHBondContact O-CB 3.16Å; E188-L192 WeakPolarHBondContact O-CG 3.38Å; E188-L192 PolarHBondContact O-N 3.38Å; E188-V229 HydrophobicContact CB-CG1 4.2Å; E188-V229 HydrophobicContact CG-CG1 3.98Å; E188-V233 HydrophobicContact CB-CG2 4.21Å |
| 189 | T | 93.3 | Very high | 91.3 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 174.5 | -55.4 | 0 | 0 | 0 | 0 | 111.4 | I185 E186 L192 C193 Y201 T204 V205 L208 V233 | I185-T189 WeakPolarHBondContact O-CB 3.4Å; I185-T189 PolarHBondContact O-N 3.03Å; I185-T189 PolarHBondContact O-OG1 2.94Å; E186-T189 PolarHBondContact O-N 3.21Å; T189-L192 PolarHBondContact O-N 2.6Å; T189-C193 VanDerWaalsContact O-CB 3.29Å; T189-C193 WeakPolarHBondContact O-CB 3.4Å; T189-C193 PolarHBondContact O-N 2.89Å; T189-C193 PolarHBondContact O-SG 2.94Å; T189-C193 VanDerWaalsContact O-SG 3.41Å; T189-Y201 HydrophobicContact CG2-CD2 4Å; T189-Y201 HydrophobicContact CG2-CE2 4.15Å; T189-T204 HydrophobicContact CG2-CG2 3.79Å; T189-V205 HydrophobicContact CG2-CG2 3.87Å; T189-L208 HydrophobicContact CG2-CD1 4.31Å; T189-L208 VanDerWaalsContact OG1-CD1 3.3Å; T189-L208 WeakPolarHBondContact OG1-CD1 3.32Å; T189-V233 HydrophobicContact CG2-CG1 4.44Å; T189-V233 WeakPolarHBondContact OG1-CG1 3.39Å |
| 190 | F | 93.7 | Very high | 91.3 | Very high | 30 Ų | 30 | 54 Ų | 54 | 13% | 0.132 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.3 | -41.9 | 176.6 | -176.4 | -109.3 | 0 | 0 | 0 | 111.8 | E186 R187 E188 C193 R195 I197 Y201 | E186-F190 WeakPolarHBondContact O-CB 3.42Å; E186-F190 PolarHBondContact O-N 3.15Å; R187-F190 PolarHBondContact O-N 3.36Å; E188-F190 VanDerWaalsContact C-N 3.35Å; E188-F190 PolarHBondContact O-N 3.22Å; F190-C193 PolarHBondContact O-N 3.02Å; F190-R195 HydrophobicContact CD1-CB 4.24Å; F190-R195 HydrophobicContact CD1-CG 4.28Å; F190-R195 HydrophobicContact CE1-CB 3.65Å; F190-R195 HydrophobicContact CE1-CG 4.04Å; F190-R195 WeakPolarHBondContact CE2-O 3.41Å; F190-R195 VanDerWaalsContact CZ-CA 3.49Å; F190-R195 HydrophobicContact CZ-CB 3.86Å; F190-R195 WeakPolarHBondContact CZ-O 3.32Å; F190-R195 VanDerWaalsContact O-CA 3.24Å; F190-R195 WeakPolarHBondContact O-CA 3.44Å; F190-R195 PolarHBondContact O-N 3.09Å; F190-I197 HydrophobicContact CD2-CD1 3.81Å; F190-I197 HydrophobicContact CE2-CD1 3.81Å; F190-I197 HydrophobicContact CE2-CG1 4.34Å; F190-Y201 HydrophobicContact CB-CD2 4.48Å; F190-Y201 HydrophobicContact CB-CE2 4.01Å; F190-Y201 HydrophobicContact CD2-CD2 4.39Å; F190-Y201 HydrophobicContact CD2-CE2 4.19Å |
| 191 | H | 93.1 | Very high | 91.4 | Very high | 88 Ų | 88 | 48 Ų | 48 | 41% | 0.407 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.2 | -50.9 | 176.6 | -175 | 98.4 | 0 | 0 | 0 | 111.8 | R187 E188 C193 S194 R195 | R187-H191 WeakPolarHBondContact O-CB 3.49Å; R187-H191 PolarHBondContact O-N 2.92Å; E188-H191 PolarHBondContact O-N 2.99Å; H191-C193 VanDerWaalsContact C-N 3.3Å; H191-C193 PolarHBondContact O-N 3.2Å; H191-S194 PolarHBondContact O-N 2.77Å; H191-R195 PolarHBondContact CE1-NH2 3.01Å; H191-R195 PolarHBondContact ND1-NH2 3.01Å |
| 192 | L | 90.9 | Very high | 91.5 | Very high | 46 Ų | 46 | 52.5 Ų | 52.5 | 24% | 0.241 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -68.3 | -27.3 | -178.1 | -72.9 | 175 | 0 | 0 | 0 | 113.4 | E188 T189 S194 V233 Q234 K237 | E188-L192 WeakPolarHBondContact O-CB 3.16Å; E188-L192 WeakPolarHBondContact O-CG 3.38Å; E188-L192 PolarHBondContact O-N 3.38Å; T189-L192 PolarHBondContact O-N 2.6Å; L192-S194 VanDerWaalsContact C-N 3.27Å; L192-S194 PolarHBondContact O-N 3.41Å; L192-V233 HydrophobicContact CD1-CB 3.98Å; L192-V233 HydrophobicContact CD1-CG1 3.55Å; L192-Q234 HydrophobicContact CD1-CB 4.4Å; L192-K237 PolarHBondContact O-NZ 3.09Å |
| 193 | C | 89.1 | Confident | 91.6 | Very high | 5 Ų | 5 | 57 Ų | 57 | 3% | 0.034 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.6 | 38.5 | 175.2 | -64.6 | 0 | 0 | 0 | 0 | 112.8 | T189 F190 H191 R195 L196 N198 Y201 | T189-C193 VanDerWaalsContact O-CB 3.29Å; T189-C193 WeakPolarHBondContact O-CB 3.4Å; T189-C193 PolarHBondContact O-N 2.89Å; T189-C193 PolarHBondContact O-SG 2.94Å; T189-C193 VanDerWaalsContact O-SG 3.41Å; F190-C193 PolarHBondContact O-N 3.02Å; H191-C193 VanDerWaalsContact C-N 3.3Å; H191-C193 PolarHBondContact O-N 3.2Å; C193-R195 VanDerWaalsContact C-N 3.27Å; C193-R195 PolarHBondContact O-N 3.23Å; C193-L196 PolarHBondContact O-N 3.46Å; C193-N198 PolarHBondContact O-ND2 3.06Å; C193-Y201 HydrophobicContact CB-CD2 4.31Å |
| 194 | S | 86.1 | Confident | 91.6 | Very high | 71 Ų | 71 | 53.9 Ų | 53.9 | 50% | 0.497 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61 | 24.6 | 172.8 | 76.8 | 0 | 0 | 0 | 0 | 115.6 | H191 L192 L196 N198 | H191-S194 PolarHBondContact O-N 2.77Å; L192-S194 VanDerWaalsContact C-N 3.27Å; L192-S194 PolarHBondContact O-N 3.41Å; S194-L196 PolarHBondContact O-N 3.45Å; S194-N198 PolarHBondContact OG-ND2 3.29Å |
| 195 | R | 88.9 | Confident | 91.7 | Very high | 144 Ų | 144 | 50.8 Ų | 50.8 | 54% | 0.543 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.1 | 34 | -178.9 | -58.4 | 170.8 | 175.7 | 77.2 | -10.2 | 113.3 | F190 H191 C193 | F190-R195 HydrophobicContact CD1-CB 4.24Å; F190-R195 HydrophobicContact CD1-CG 4.28Å; F190-R195 HydrophobicContact CE1-CB 3.65Å; F190-R195 HydrophobicContact CE1-CG 4.04Å; F190-R195 WeakPolarHBondContact CE2-O 3.41Å; F190-R195 VanDerWaalsContact CZ-CA 3.49Å; F190-R195 HydrophobicContact CZ-CB 3.86Å; F190-R195 WeakPolarHBondContact CZ-O 3.32Å; F190-R195 VanDerWaalsContact O-CA 3.24Å; F190-R195 WeakPolarHBondContact O-CA 3.44Å; F190-R195 PolarHBondContact O-N 3.09Å; H191-R195 PolarHBondContact CE1-NH2 3.01Å; H191-R195 PolarHBondContact ND1-NH2 3.01Å; C193-R195 VanDerWaalsContact C-N 3.27Å; C193-R195 PolarHBondContact O-N 3.23Å |
| 196 | L | 87.3 | Confident | 91.7 | Very high | 106 Ų | 106 | 58.3 Ų | 58.3 | 56% | 0.555 | 27% | 0.268 | S | S | * | . | S | Bend | trans | -134.3 | 142 | 178.8 | -66.9 | 173.6 | 0 | 0 | 0 | 110.6 | C193 S194 N198 | C193-L196 PolarHBondContact O-N 3.46Å; S194-L196 PolarHBondContact O-N 3.45Å; L196-N198 HydrophobicContact CB-CB 4.44Å; L196-N198 PolarHBondContact O-N 3.47Å |
| 197 | I | 87.9 | Confident | 91.7 | Very high | 30 Ų | 30 | 58.9 Ų | 58.9 | 15% | 0.154 | 27% | 0.273 | C | S | . | . | trans | -80.5 | 62.2 | 173.9 | -50.3 | -61.9 | 0 | 0 | 0 | 110.1 | T158 L161 R162 F190 Y201 R202 | T158-I197 HydrophobicContact CG2-CD1 4.48Å; T158-I197 HydrophobicContact CG2-CG1 3.79Å; L161-I197 HydrophobicContact CB-CG2 4.17Å; L161-I197 HydrophobicContact CD1-CG2 3.77Å; R162-I197 HydrophobicContact CG-CD1 3.59Å; R162-I197 HydrophobicContact CG-CG1 4.46Å; F190-I197 HydrophobicContact CD2-CD1 3.81Å; F190-I197 HydrophobicContact CE2-CD1 3.81Å; F190-I197 HydrophobicContact CE2-CG1 4.34Å; I197-Y201 HydrophobicContact CB-CD1 4.49Å; I197-Y201 HydrophobicContact CD1-CD1 3.79Å; I197-Y201 HydrophobicContact CD1-CD2 4.35Å; I197-Y201 HydrophobicContact CD1-CE1 3.51Å; I197-Y201 HydrophobicContact CD1-CE2 4.09Å; I197-Y201 HydrophobicContact CD1-CG 4.19Å; I197-Y201 HydrophobicContact CG2-CD1 3.9Å; I197-Y201 HydrophobicContact CG2-CE1 4.14Å; I197-R202 PolarHBondContact O-NH1 2.98Å | ||
| 198 | N | 87.8 | Confident | 91.8 | Very high | 41 Ų | 41 | 52.1 Ų | 52.1 | 22% | 0.219 | 25% | 0.248 | C | C | . | . | trans | -90.6 | 179.3 | -178.6 | 59.9 | 24 | 0 | 0 | 0 | 111.9 | C193 S194 L196 P200 Y201 R202 | C193-N198 PolarHBondContact O-ND2 3.06Å; S194-N198 PolarHBondContact OG-ND2 3.29Å; L196-N198 HydrophobicContact CB-CB 4.44Å; L196-N198 PolarHBondContact O-N 3.47Å; N198-P200 WeakPolarHBondContact OD1-CB 3.46Å; N198-P200 VanDerWaalsContact OD1-CD 3.23Å; N198-P200 WeakPolarHBondContact OD1-CD 3.48Å; N198-Y201 PolarHBondContact O-N 3.45Å; N198-Y201 PolarHBondContact OD1-N 3.41Å; N198-R202 PolarHBondContact O-N 3.48Å; N198-R202 PolarHBondContact O-NH1 3.02Å | ||
| 199 | G | 91.2 | Very high | 91.8 | Very high | 25 Ų | 25 | 49.7 Ų | 49.7 | 26% | 0.258 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -53.6 | -47.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y201 R202 R203 | G199-Y201 PolarHBondContact O-N 2.89Å; G199-R202 PolarHBondContact O-N 2.85Å; G199-R203 WeakPolarHBondContact O-CB 3.34Å; G199-R203 WeakPolarHBondContact O-CG 3.46Å; G199-R203 PolarHBondContact O-N 2.94Å |
| 200 | P | 91.8 | Very high | 91.9 | Very high | 41 Ų | 41 | 56 Ų | 56 | 27% | 0.266 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -53 | -47 | 173.6 | -27.9 | 31.3 | 0 | 0 | 0 | 114.5 | N198 R202 R203 T204 | N198-P200 WeakPolarHBondContact OD1-CB 3.46Å; N198-P200 VanDerWaalsContact OD1-CD 3.23Å; N198-P200 WeakPolarHBondContact OD1-CD 3.48Å; P200-R202 PolarHBondContact O-N 3.49Å; P200-R203 PolarHBondContact O-N 2.98Å; P200-T204 WeakPolarHBondContact O-CB 3.5Å; P200-T204 PolarHBondContact O-N 3.49Å; P200-T204 PolarHBondContact O-OG1 3.41Å |
| 201 | Y | 94.2 | Very high | 91.9 | Very high | 6 Ų | 6 | 55.3 Ų | 55.3 | 2% | 0.024 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -56.6 | -51.9 | 176.3 | 173.7 | -93.2 | 0 | 0 | 0 | 111.1 | A165 E186 T189 F190 C193 I197 N198 G199 R203 T204 V205 | A165-Y201 HydrophobicContact CB-CE1 4.49Å; A165-Y201 WeakPolarHBondContact CB-OH 3.48Å; E186-Y201 PolarHBondContact OE1-OH 3.04Å; T189-Y201 HydrophobicContact CG2-CD2 4Å; T189-Y201 HydrophobicContact CG2-CE2 4.15Å; F190-Y201 HydrophobicContact CB-CD2 4.48Å; F190-Y201 HydrophobicContact CB-CE2 4.01Å; F190-Y201 HydrophobicContact CD2-CD2 4.39Å; F190-Y201 HydrophobicContact CD2-CE2 4.19Å; C193-Y201 HydrophobicContact CB-CD2 4.31Å; I197-Y201 HydrophobicContact CB-CD1 4.49Å; I197-Y201 HydrophobicContact CD1-CD1 3.79Å; I197-Y201 HydrophobicContact CD1-CD2 4.35Å; I197-Y201 HydrophobicContact CD1-CE1 3.51Å; I197-Y201 HydrophobicContact CD1-CE2 4.09Å; I197-Y201 HydrophobicContact CD1-CG 4.19Å; I197-Y201 HydrophobicContact CG2-CD1 3.9Å; I197-Y201 HydrophobicContact CG2-CE1 4.14Å; N198-Y201 PolarHBondContact O-N 3.45Å; N198-Y201 PolarHBondContact OD1-N 3.41Å; G199-Y201 PolarHBondContact O-N 2.89Å; Y201-R203 VanDerWaalsContact C-N 3.3Å; Y201-R203 PolarHBondContact O-N 3.43Å; Y201-T204 PolarHBondContact O-N 3.48Å; Y201-V205 HydrophobicContact CD1-CG2 4.29Å; Y201-V205 HydrophobicContact CD2-CG2 4.4Å; Y201-V205 HydrophobicContact CE1-CG2 3.94Å; Y201-V205 HydrophobicContact CE2-CG2 4.08Å; Y201-V205 WeakPolarHBondContact O-CG2 3.4Å; Y201-V205 PolarHBondContact O-N 3.46Å |
| 202 | R | 92.7 | Very high | 91.8 | Very high | 124 Ų | 124 | 51.1 Ų | 51.1 | 47% | 0.468 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -65.4 | -31 | -179.6 | -63 | -167.3 | -58.6 | -85.6 | 5.5 | 113.2 | I197 N198 G199 P200 R206 | I197-R202 PolarHBondContact O-NH1 2.98Å; N198-R202 PolarHBondContact O-N 3.48Å; N198-R202 PolarHBondContact O-NH1 3.02Å; G199-R202 PolarHBondContact O-N 2.85Å; P200-R202 PolarHBondContact O-N 3.49Å; R202-R206 WeakPolarHBondContact O-CG 3.32Å; R202-R206 PolarHBondContact O-N 3.39Å; R202-R206 PolarHBondContact O-NE 2.86Å |
| 203 | R | 94.5 | Very high | 91.9 | Very high | 96 Ų | 96 | 53.2 Ų | 53.2 | 36% | 0.362 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -72.2 | -41.9 | 175.8 | -76.9 | -174.6 | -73.4 | 109.7 | -6 | 111 | G199 P200 Y201 R206 A207 K238 | G199-R203 WeakPolarHBondContact O-CB 3.34Å; G199-R203 WeakPolarHBondContact O-CG 3.46Å; G199-R203 PolarHBondContact O-N 2.94Å; P200-R203 PolarHBondContact O-N 2.98Å; Y201-R203 VanDerWaalsContact C-N 3.3Å; Y201-R203 PolarHBondContact O-N 3.43Å; R203-R206 PolarHBondContact O-N 3Å; R203-A207 WeakPolarHBondContact O-CB 3.44Å; R203-A207 PolarHBondContact O-N 3.03Å; R203-K238 HydrophobicContact CB-CB 4.4Å; R203-K238 PolarHBondContact NH1-O 3.39Å; R203-K238 VanDerWaalsContact NH1-O 3.14Å; R203-K238 PolarHBondContact NH1-OXT 3.45Å |
| 204 | T | 94 | Very high | 92.1 | Very high | 1 Ų | 1 | 59 Ų | 59 | 1% | 0.006 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -66.9 | -48.6 | 178.9 | -55 | 0 | 0 | 0 | 0 | 111 | T189 P200 Y201 R206 A207 L208 V233 K238 | T189-T204 HydrophobicContact CG2-CG2 3.79Å; P200-T204 WeakPolarHBondContact O-CB 3.5Å; P200-T204 PolarHBondContact O-N 3.49Å; P200-T204 PolarHBondContact O-OG1 3.41Å; Y201-T204 PolarHBondContact O-N 3.48Å; T204-R206 VanDerWaalsContact C-N 3.32Å; T204-R206 PolarHBondContact O-N 2.9Å; T204-A207 WeakPolarHBondContact O-CB 3.49Å; T204-A207 PolarHBondContact O-N 2.92Å; T204-A207 VanDerWaalsContact O-N 3.07Å; T204-L208 HydrophobicContact CG2-CD1 4.07Å; T204-L208 HydrophobicContact CG2-CG 4.39Å; T204-L208 VanDerWaalsContact O-CG 3.32Å; T204-L208 WeakPolarHBondContact O-CG 3.37Å; T204-L208 PolarHBondContact O-N 3.33Å; T204-V233 HydrophobicContact CG2-CG1 4.46Å; T204-K238 PolarHBondContact OG1-N 3.14Å |
| 205 | V | 94.5 | Very high | 92.4 | Very high | 7 Ų | 7 | 62.6 Ų | 62.6 | 4% | 0.042 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -55.6 | -46.2 | 175.7 | 172.2 | 0 | 0 | 0 | 0 | 111.5 | A165 T189 Y201 A207 L208 V209 | A165-V205 HydrophobicContact CB-CG1 3.93Å; A165-V205 HydrophobicContact CB-CG2 4.27Å; T189-V205 HydrophobicContact CG2-CG2 3.87Å; Y201-V205 HydrophobicContact CD1-CG2 4.29Å; Y201-V205 HydrophobicContact CD2-CG2 4.4Å; Y201-V205 HydrophobicContact CE1-CG2 3.94Å; Y201-V205 HydrophobicContact CE2-CG2 4.08Å; Y201-V205 WeakPolarHBondContact O-CG2 3.4Å; Y201-V205 PolarHBondContact O-N 3.46Å; V205-A207 PolarHBondContact O-N 3.34Å; V205-L208 PolarHBondContact O-N 2.94Å; V205-V209 HydrophobicContact CG1-CG2 4.32Å; V205-V209 WeakPolarHBondContact O-CB 3.27Å; V205-V209 VanDerWaalsContact O-CG2 3.26Å; V205-V209 WeakPolarHBondContact O-CG2 3.32Å; V205-V209 PolarHBondContact O-N 3.46Å |
| 206 | R | 94.1 | Very high | 92.4 | Very high | 157 Ų | 157 | 59.2 Ų | 59.2 | 59% | 0.592 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -63.6 | -39.4 | 177.4 | -75.6 | -178.4 | -68.8 | 146.9 | -7.7 | 112.6 | R202 R203 T204 F210 | R202-R206 WeakPolarHBondContact O-CG 3.32Å; R202-R206 PolarHBondContact O-N 3.39Å; R202-R206 PolarHBondContact O-NE 2.86Å; R203-R206 PolarHBondContact O-N 3Å; T204-R206 VanDerWaalsContact C-N 3.32Å; T204-R206 PolarHBondContact O-N 2.9Å; R206-F210 VanDerWaalsContact O-CB 3.29Å; R206-F210 WeakPolarHBondContact O-CB 3.41Å; R206-F210 PolarHBondContact O-N 2.93Å |
| 207 | A | 94.6 | Very high | 92.6 | Very high | 12 Ų | 12 | 61.5 Ų | 61.5 | 10% | 0.099 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65.1 | -41.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | R203 T204 V205 F210 T211 | R203-A207 WeakPolarHBondContact O-CB 3.44Å; R203-A207 PolarHBondContact O-N 3.03Å; T204-A207 WeakPolarHBondContact O-CB 3.49Å; T204-A207 PolarHBondContact O-N 2.92Å; T204-A207 VanDerWaalsContact O-N 3.07Å; V205-A207 PolarHBondContact O-N 3.34Å; A207-F210 PolarHBondContact O-N 3.33Å; A207-T211 WeakPolarHBondContact O-CB 3.29Å; A207-T211 VanDerWaalsContact O-CG2 3.23Å; A207-T211 WeakPolarHBondContact O-CG2 3.24Å; A207-T211 PolarHBondContact O-N 3.33Å; A207-T211 PolarHBondContact O-OG1 2.91Å |
| 208 | L | 93.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.5 | -48.6 | 174.7 | -67.2 | 170.3 | 0 | 0 | 0 | 111.4 | L169 I185 T189 T204 V205 F210 T211 L212 F232 V233 H236 | L169-L208 HydrophobicContact CD2-CB 4.25Å; I185-L208 HydrophobicContact CG2-CD1 4.23Å; T189-L208 HydrophobicContact CG2-CD1 4.31Å; T189-L208 VanDerWaalsContact OG1-CD1 3.3Å; T189-L208 WeakPolarHBondContact OG1-CD1 3.32Å; T204-L208 HydrophobicContact CG2-CD1 4.07Å; T204-L208 HydrophobicContact CG2-CG 4.39Å; T204-L208 VanDerWaalsContact O-CG 3.32Å; T204-L208 WeakPolarHBondContact O-CG 3.37Å; T204-L208 PolarHBondContact O-N 3.33Å; V205-L208 PolarHBondContact O-N 2.94Å; L208-F210 VanDerWaalsContact C-N 3.34Å; L208-F210 PolarHBondContact O-N 2.9Å; L208-T211 WeakPolarHBondContact CA-OG1 3.23Å; L208-T211 PolarHBondContact O-N 3.4Å; L208-T211 PolarHBondContact O-OG1 2.87Å; L208-L212 WeakPolarHBondContact O-CB 3.38Å; L208-L212 VanDerWaalsContact O-CG 3.23Å; L208-L212 WeakPolarHBondContact O-CG 3.3Å; L208-L212 PolarHBondContact O-N 3.25Å; L208-F232 HydrophobicContact CD2-CD1 3.95Å; L208-F232 HydrophobicContact CD2-CE1 3.46Å; L208-F232 VanDerWaalsContact CD2-CE1 3.46Å; L208-F232 HydrophobicContact CD2-CE2 4.24Å; L208-F232 HydrophobicContact CD2-CZ 3.61Å; L208-V233 HydrophobicContact CD1-CG1 4.35Å; L208-V233 HydrophobicContact CD1-CG2 4.18Å; L208-H236 HydrophobicContact CD2-CB 3.62Å; L208-H236 HydrophobicContact CG-CB 4.22Å |
| 209 | V | 95.1 | Very high | 92.8 | Very high | 14 Ų | 14 | 61.2 Ų | 61.2 | 9% | 0.085 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60 | -44.7 | 177.7 | 169.6 | 0 | 0 | 0 | 0 | 111.1 | L168 L169 A172 V205 K213 | L168-V209 HydrophobicContact CB-CG2 3.84Å; L169-V209 HydrophobicContact CD2-CG2 3.82Å; L169-V209 HydrophobicContact CG-CG2 4.18Å; A172-V209 HydrophobicContact CB-CG1 4.22Å; V205-V209 HydrophobicContact CG1-CG2 4.32Å; V205-V209 WeakPolarHBondContact O-CB 3.27Å; V205-V209 VanDerWaalsContact O-CG2 3.26Å; V205-V209 WeakPolarHBondContact O-CG2 3.32Å; V205-V209 PolarHBondContact O-N 3.46Å; V209-K213 HydrophobicContact CG1-CD 4.05Å; V209-K213 HydrophobicContact CG1-CG 4.43Å; V209-K213 WeakPolarHBondContact O-CB 3.4Å; V209-K213 VanDerWaalsContact O-CG 3.3Å; V209-K213 WeakPolarHBondContact O-CG 3.3Å; V209-K213 PolarHBondContact O-N 3.42Å |
| 210 | F | 94.8 | Very high | 92.8 | Very high | 132 Ų | 132 | 62.7 Ų | 62.7 | 58% | 0.579 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -62.5 | -46 | 178.9 | -176.3 | -93.7 | 0 | 0 | 0 | 112 | R206 A207 L208 K213 H214 | R206-F210 VanDerWaalsContact O-CB 3.29Å; R206-F210 WeakPolarHBondContact O-CB 3.41Å; R206-F210 PolarHBondContact O-N 2.93Å; A207-F210 PolarHBondContact O-N 3.33Å; L208-F210 VanDerWaalsContact C-N 3.34Å; L208-F210 PolarHBondContact O-N 2.9Å; F210-K213 PolarHBondContact O-N 3.24Å; F210-H214 AromaticContact CD2-CD2 3.4Å; F210-H214 VanDerWaalsContact CD2-CD2 3.4Å; F210-H214 WeakPolarHBondContact CD2-CD2 3.33Å; F210-H214 AromaticContact CD2-NE2 3.61Å; F210-H214 AromaticContact CE1-CD2 3.97Å; F210-H214 AromaticContact CE2-CD2 3.28Å; F210-H214 WeakPolarHBondContact CE2-CD2 3.26Å; F210-H214 AromaticContact CE2-NE2 3.39Å; F210-H214 WeakPolarHBondContact CE2-NE2 3.47Å; F210-H214 AromaticContact CG-CD2 3.81Å; F210-H214 AromaticContact CZ-CD2 3.58Å; F210-H214 PolarHBondContact O-CD2 3.02Å; F210-H214 PolarHBondContact O-N 3.4Å |
| 211 | T | 93 | Very high | 92.7 | Very high | 15 Ų | 15 | 64.6 Ų | 64.6 | 9% | 0.092 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -65.2 | -43.6 | 179.8 | 51.3 | 0 | 0 | 0 | 0 | 111.7 | A207 L208 K213 H214 R215 | A207-T211 WeakPolarHBondContact O-CB 3.29Å; A207-T211 VanDerWaalsContact O-CG2 3.23Å; A207-T211 WeakPolarHBondContact O-CG2 3.24Å; A207-T211 PolarHBondContact O-N 3.33Å; A207-T211 PolarHBondContact O-OG1 2.91Å; L208-T211 WeakPolarHBondContact CA-OG1 3.23Å; L208-T211 PolarHBondContact O-N 3.4Å; L208-T211 PolarHBondContact O-OG1 2.87Å; T211-K213 PolarHBondContact O-N 2.88Å; T211-H214 PolarHBondContact O-N 3.45Å; T211-R215 WeakPolarHBondContact O-CB 3.38Å; T211-R215 PolarHBondContact O-N 2.97Å |
| 212 | L | 92.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 175.5 | -68.4 | 170.4 | 0 | 0 | 0 | 112 | L169 A172 L173 L208 R219 V222 F232 | L169-L212 HydrophobicContact CD2-CD1 4.13Å; A172-L212 HydrophobicContact CB-CB 3.85Å; A172-L212 HydrophobicContact CB-CD1 4.48Å; L173-L212 HydrophobicContact CD1-CD1 4.5Å; L173-L212 HydrophobicContact CD2-CD1 4.15Å; L173-L212 HydrophobicContact CD2-CD2 3.89Å; L173-L212 HydrophobicContact CG-CD1 4.1Å; L208-L212 WeakPolarHBondContact O-CB 3.38Å; L208-L212 VanDerWaalsContact O-CG 3.23Å; L208-L212 WeakPolarHBondContact O-CG 3.3Å; L208-L212 PolarHBondContact O-N 3.25Å; L212-R219 VanDerWaalsContact O-CZ 3.24Å; L212-R219 PolarHBondContact O-NE 2.98Å; L212-R219 PolarHBondContact O-NH2 3.01Å; L212-V222 HydrophobicContact CD2-CG2 4.49Å; L212-F232 HydrophobicContact CD1-CE1 4.19Å; L212-F232 HydrophobicContact CD1-CZ 4.28Å; L212-F232 HydrophobicContact CD2-CE1 4.09Å; L212-F232 HydrophobicContact CD2-CZ 3.75Å; L212-F232 HydrophobicContact CG-CE1 4.24Å; L212-F232 HydrophobicContact CG-CZ 3.85Å |
| 213 | K | 93.1 | Very high | 92.2 | Very high | 90 Ų | 90 | 62.7 Ų | 62.7 | 39% | 0.391 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -67.5 | -38 | 178.3 | -78.9 | -172.7 | 174.6 | -171.2 | 0 | 113.3 | A172 V209 F210 T211 R219 | A172-K213 HydrophobicContact CB-CG 3.78Å; V209-K213 HydrophobicContact CG1-CD 4.05Å; V209-K213 HydrophobicContact CG1-CG 4.43Å; V209-K213 WeakPolarHBondContact O-CB 3.4Å; V209-K213 VanDerWaalsContact O-CG 3.3Å; V209-K213 WeakPolarHBondContact O-CG 3.3Å; V209-K213 PolarHBondContact O-N 3.42Å; F210-K213 PolarHBondContact O-N 3.24Å; T211-K213 PolarHBondContact O-N 2.88Å; K213-R219 PolarHBondContact O-NH2 3.31Å |
| 214 | H | 92.3 | Very high | 91.9 | Very high | 127 Ų | 127 | 62.2 Ų | 62.2 | 59% | 0.588 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -104.7 | -15 | -171.5 | -62.6 | -66.2 | 0 | 0 | 0 | 115.2 | F210 T211 | F210-H214 AromaticContact CD2-CD2 3.4Å; F210-H214 VanDerWaalsContact CD2-CD2 3.4Å; F210-H214 WeakPolarHBondContact CD2-CD2 3.33Å; F210-H214 AromaticContact CD2-NE2 3.61Å; F210-H214 AromaticContact CE1-CD2 3.97Å; F210-H214 AromaticContact CE2-CD2 3.28Å; F210-H214 WeakPolarHBondContact CE2-CD2 3.26Å; F210-H214 AromaticContact CE2-NE2 3.39Å; F210-H214 WeakPolarHBondContact CE2-NE2 3.47Å; F210-H214 AromaticContact CG-CD2 3.81Å; F210-H214 AromaticContact CZ-CD2 3.58Å; F210-H214 PolarHBondContact O-CD2 3.02Å; F210-H214 PolarHBondContact O-N 3.4Å; T211-H214 PolarHBondContact O-N 3.45Å |
| 215 | R | 92.1 | Very high | 91.5 | Very high | 147 Ų | 147 | 64.8 Ų | 64.8 | 56% | 0.555 | 34% | 0.335 | S | S | * | . | trans | -115.6 | 96.1 | 178.9 | -61.4 | -177.4 | 176.4 | -170.3 | -1.3 | 110.7 | T211 E217 I218 R219 | T211-R215 WeakPolarHBondContact O-CB 3.38Å; T211-R215 PolarHBondContact O-N 2.97Å; R215-E217 VanDerWaalsContact C-N 3.32Å; R215-E217 PolarHBondContact O-N 3.09Å; R215-I218 HydrophobicContact CB-CB 4.24Å; R215-I218 HydrophobicContact CB-CD1 4.07Å; R215-I218 HydrophobicContact CB-CG1 4.11Å; R215-I218 VanDerWaalsContact CD-CD1 3.47Å; R215-I218 HydrophobicContact CG-CD1 4.43Å; R215-I218 PolarHBondContact O-N 3.24Å; R215-R219 PolarHBondContact O-N 3.39Å; R215-R219 VanDerWaalsContact O-N 3.15Å | ||
| 216 | A | 89.3 | Confident | 91.1 | Very high | 72 Ų | 72 | 68.9 Ų | 68.9 | 60% | 0.595 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -63 | -35.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113 | R219 A220 | A216-R219 WeakPolarHBondContact O-CB 3.4Å; A216-R219 PolarHBondContact O-N 2.88Å; A216-A220 PolarHBondContact O-N 2.84Å |
| 217 | E | 91.6 | Very high | 90.7 | Very high | 155 Ų | 155 | 63.6 Ų | 63.6 | 72% | 0.724 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -60.2 | -50.4 | 177.2 | -65 | 174.4 | -173.7 | 0 | 0 | 112 | R215 R219 A220 Q221 | R215-E217 VanDerWaalsContact C-N 3.32Å; R215-E217 PolarHBondContact O-N 3.09Å; E217-R219 VanDerWaalsContact C-N 3.29Å; E217-R219 PolarHBondContact O-N 3.31Å; E217-A220 PolarHBondContact O-N 3.27Å; E217-Q221 WeakPolarHBondContact O-CG 3.16Å; E217-Q221 PolarHBondContact O-N 3.5Å |
| 218 | I | 89.8 | Confident | 90.5 | Very high | 28 Ų | 28 | 66.8 Ų | 66.8 | 14% | 0.144 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 178.7 | -59.6 | -176.6 | 0 | 0 | 0 | 110.1 | R215 A220 Q221 V222 L227 F232 | R215-I218 HydrophobicContact CB-CB 4.24Å; R215-I218 HydrophobicContact CB-CD1 4.07Å; R215-I218 HydrophobicContact CB-CG1 4.11Å; R215-I218 VanDerWaalsContact CD-CD1 3.47Å; R215-I218 HydrophobicContact CG-CD1 4.43Å; R215-I218 PolarHBondContact O-N 3.24Å; I218-A220 VanDerWaalsContact C-N 3.34Å; I218-A220 PolarHBondContact O-N 3.09Å; I218-Q221 PolarHBondContact O-N 3.32Å; I218-V222 HydrophobicContact CG2-CG2 4.31Å; I218-V222 VanDerWaalsContact O-CG2 3.3Å; I218-V222 WeakPolarHBondContact O-CG2 3.47Å; I218-V222 PolarHBondContact O-N 2.9Å; I218-L227 HydrophobicContact CG2-CD2 4.46Å; I218-F232 HydrophobicContact CG2-CD2 4.17Å; I218-F232 HydrophobicContact CG2-CE2 3.66Å; I218-F232 HydrophobicContact CG2-CZ 4.4Å |
| 219 | R | 91 | Very high | 90.4 | Very high | 36 Ų | 36 | 67.7 Ų | 67.7 | 14% | 0.136 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -59 | -45 | 175.5 | -166.6 | -167.3 | -54.6 | -178.7 | 2.3 | 111.6 | A172 L173 E174 L212 K213 R215 A216 E217 V222 K223 | A172-R219 PolarHBondContact O-NE 3.16Å; L173-R219 HydrophobicContact CD2-CG 4.09Å; E174-R219 IonicContact OE1-NH1 2.62Å; E174-R219 PolarHBondContact OE1-NH1 3.07Å; E174-R219 IonicContact OE2-NH1 2.75Å; E174-R219 PolarHBondContact OE2-NH1 2.88Å; L212-R219 VanDerWaalsContact O-CZ 3.24Å; L212-R219 PolarHBondContact O-NE 2.98Å; L212-R219 PolarHBondContact O-NH2 3.01Å; K213-R219 PolarHBondContact O-NH2 3.31Å; R215-R219 PolarHBondContact O-N 3.39Å; R215-R219 VanDerWaalsContact O-N 3.15Å; A216-R219 WeakPolarHBondContact O-CB 3.4Å; A216-R219 PolarHBondContact O-N 2.88Å; E217-R219 VanDerWaalsContact C-N 3.29Å; E217-R219 PolarHBondContact O-N 3.31Å; R219-V222 PolarHBondContact O-N 3.47Å; R219-K223 WeakPolarHBondContact O-CB 3.23Å; R219-K223 WeakPolarHBondContact O-CG 3.48Å; R219-K223 PolarHBondContact O-N 3.34Å |
| 220 | A | 89.6 | Confident | 90.1 | Very high | 56 Ų | 56 | 68.3 Ų | 68.3 | 46% | 0.463 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -66.4 | -39.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | A216 E217 I218 K223 S224 | A216-A220 PolarHBondContact O-N 2.84Å; E217-A220 PolarHBondContact O-N 3.27Å; I218-A220 VanDerWaalsContact C-N 3.34Å; I218-A220 PolarHBondContact O-N 3.09Å; A220-K223 PolarHBondContact O-N 3.23Å; A220-S224 WeakPolarHBondContact O-CB 3.4Å; A220-S224 PolarHBondContact O-N 2.87Å; A220-S224 PolarHBondContact O-OG 3.4Å |
| 221 | Q | 90.3 | Very high | 89.8 | Confident | 82 Ų | 82 | 65.1 Ų | 65.1 | 38% | 0.383 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.2 | -39.7 | 175.8 | -71.6 | 173.8 | 5 | 0 | 0 | 112.6 | E217 I218 S224 G225 S226 L227 | E217-Q221 WeakPolarHBondContact O-CG 3.16Å; E217-Q221 PolarHBondContact O-N 3.5Å; I218-Q221 PolarHBondContact O-N 3.32Å; Q221-S224 WeakPolarHBondContact CA-OG 3.29Å; Q221-S224 PolarHBondContact O-OG 3.35Å; Q221-G225 PolarHBondContact O-N 2.96Å; Q221-G225 VanDerWaalsContact O-N 3.13Å; Q221-S226 PolarHBondContact O-N 3.22Å; Q221-L227 HydrophobicContact CB-CB 4.12Å; Q221-L227 PolarHBondContact O-N 3.27Å |
| 222 | V | 88.3 | Confident | 89.7 | Confident | 2 Ų | 2 | 64.5 Ų | 64.5 | 1% | 0.012 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -71.2 | -38.1 | 176.4 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | L173 L181 I185 L212 I218 R219 G225 L227 F232 | L173-V222 HydrophobicContact CD2-CG1 4.42Å; L181-V222 HydrophobicContact CD1-CG1 4.38Å; L181-V222 HydrophobicContact CD2-CG1 4.3Å; I185-V222 HydrophobicContact CD1-CG1 4.02Å; L212-V222 HydrophobicContact CD2-CG2 4.49Å; I218-V222 HydrophobicContact CG2-CG2 4.31Å; I218-V222 VanDerWaalsContact O-CG2 3.3Å; I218-V222 WeakPolarHBondContact O-CG2 3.47Å; I218-V222 PolarHBondContact O-N 2.9Å; R219-V222 PolarHBondContact O-N 3.47Å; V222-G225 PolarHBondContact O-N 2.94Å; V222-L227 HydrophobicContact CG2-CB 4.44Å; V222-L227 HydrophobicContact CG2-CD2 4.08Å; V222-F232 HydrophobicContact CG2-CD1 4.1Å; V222-F232 HydrophobicContact CG2-CD2 4.27Å; V222-F232 HydrophobicContact CG2-CE1 4.31Å; V222-F232 HydrophobicContact CG2-CE2 4.49Å; V222-F232 HydrophobicContact CG2-CG 4.09Å |
| 223 | K | 88.8 | Confident | 89.7 | Confident | 87 Ų | 87 | 64.5 Ų | 64.5 | 38% | 0.378 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.3 | -40.9 | 174.9 | -77.4 | -180 | 178.3 | -173.6 | 0 | 112.8 | L173 E174 R219 A220 G225 | L173-K223 HydrophobicContact CD2-CG 4.49Å; L173-K223 WeakPolarHBondContact O-CE 3.28Å; L173-K223 PolarHBondContact O-NZ 3.45Å; E174-K223 IonicContact OE2-NZ 2.65Å; E174-K223 PolarHBondContact OE2-NZ 3.23Å; R219-K223 WeakPolarHBondContact O-CB 3.23Å; R219-K223 WeakPolarHBondContact O-CG 3.48Å; R219-K223 PolarHBondContact O-N 3.34Å; A220-K223 PolarHBondContact O-N 3.23Å; K223-G225 VanDerWaalsContact C-N 3.29Å |
| 224 | S | 88.1 | Confident | 89.6 | Confident | 86 Ų | 86 | 66.4 Ų | 66.4 | 60% | 0.601 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -80 | -9.2 | 179.9 | 55.2 | 0 | 0 | 0 | 0 | 113.7 | A220 Q221 S226 | A220-S224 WeakPolarHBondContact O-CB 3.4Å; A220-S224 PolarHBondContact O-N 2.87Å; A220-S224 PolarHBondContact O-OG 3.4Å; Q221-S224 WeakPolarHBondContact CA-OG 3.29Å; Q221-S224 PolarHBondContact O-OG 3.35Å; S224-S226 PolarHBondContact O-N 3.46Å |
| 225 | G | 84.6 | Confident | 89.5 | Confident | 55 Ų | 55 | 65.6 Ų | 65.6 | 57% | 0.567 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.2 | 5.6 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q221 V222 K223 L227 | Q221-G225 PolarHBondContact O-N 2.96Å; Q221-G225 VanDerWaalsContact O-N 3.13Å; V222-G225 PolarHBondContact O-N 2.94Å; K223-G225 VanDerWaalsContact C-N 3.29Å; G225-L227 PolarHBondContact O-N 3.3Å |
| 226 | S | 86.3 | Confident | 89.2 | Confident | 93 Ų | 93 | 60.1 Ų | 60.1 | 65% | 0.65 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -63.7 | -28.9 | 175.9 | -178.6 | 0 | 0 | 0 | 0 | 112.5 | Q221 S224 | Q221-S226 PolarHBondContact O-N 3.22Å; S224-S226 PolarHBondContact O-N 3.46Å |
| 227 | L | 85.9 | Confident | 89.1 | Confident | 47 Ų | 47 | 61.9 Ų | 61.9 | 25% | 0.246 | 36% | 0.358 | C | S | . | . | S | Bend | trans | -108.1 | 115.8 | 172.8 | -175.5 | 66.3 | 0 | 0 | 0 | 109.3 | I218 Q221 V222 G225 F232 | I218-L227 HydrophobicContact CG2-CD2 4.46Å; Q221-L227 HydrophobicContact CB-CB 4.12Å; Q221-L227 PolarHBondContact O-N 3.27Å; V222-L227 HydrophobicContact CG2-CB 4.44Å; V222-L227 HydrophobicContact CG2-CD2 4.08Å; G225-L227 PolarHBondContact O-N 3.3Å; L227-F232 HydrophobicContact CD2-CB 3.8Å; L227-F232 HydrophobicContact CD2-CD2 3.74Å; L227-F232 HydrophobicContact CD2-CG 4.07Å; L227-F232 HydrophobicContact CG-CB 4.11Å |
| 228 | P | 91.3 | Very high | 88.3 | Confident | 79 Ų | 79 | 62.3 Ų | 62.3 | 51% | 0.513 | 36% | 0.358 | S | S | . | . | trans | -60.3 | 139.5 | 177 | -22.3 | 31.7 | 0 | 0 | 0 | 111.9 | G230 T231 F232 | P228-G230 VanDerWaalsContact C-N 3.32Å; P228-G230 PolarHBondContact O-N 3.01Å; P228-T231 WeakPolarHBondContact CB-OG1 3.48Å; P228-T231 WeakPolarHBondContact CD-OG1 3.38Å; P228-T231 PolarHBondContact O-N 2.71Å; P228-T231 PolarHBondContact O-OG1 2.97Å; P228-F232 WeakPolarHBondContact O-CB 3.45Å; P228-F232 PolarHBondContact O-N 3.39Å | ||
| 229 | V | 90.1 | Very high | 88.2 | Confident | 18 Ų | 18 | 64.1 Ų | 64.1 | 11% | 0.109 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59.4 | -42.4 | -177.9 | 173.5 | 0 | 0 | 0 | 0 | 111.5 | L181 I185 E188 T231 F232 V233 | L181-V229 HydrophobicContact CD1-CG2 3.79Å; I185-V229 HydrophobicContact CB-CG1 4.19Å; I185-V229 HydrophobicContact CG1-CB 4.5Å; I185-V229 HydrophobicContact CG1-CG1 3.6Å; I185-V229 HydrophobicContact CG1-CG2 4.11Å; E188-V229 HydrophobicContact CB-CG1 4.2Å; E188-V229 HydrophobicContact CG-CG1 3.98Å; V229-T231 PolarHBondContact O-N 3.14Å; V229-F232 PolarHBondContact O-N 2.79Å; V229-V233 HydrophobicContact CG1-CG2 4.2Å; V229-V233 VanDerWaalsContact O-CG2 3.3Å; V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 2.9Å |
| 230 | G | 89.4 | Confident | 88.1 | Confident | 28 Ų | 28 | 65.5 Ų | 65.5 | 29% | 0.289 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -60.4 | -46.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | P228 V233 Q234 | P228-G230 VanDerWaalsContact C-N 3.32Å; P228-G230 PolarHBondContact O-N 3.01Å; G230-V233 PolarHBondContact O-N 3.15Å; G230-Q234 WeakPolarHBondContact O-CB 3.23Å; G230-Q234 PolarHBondContact O-N 3.25Å |
| 231 | T | 89.6 | Confident | 88 | Confident | 64 Ų | 64 | 66.1 Ų | 66.1 | 39% | 0.393 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.6 | -42.1 | 176.8 | 45.3 | 0 | 0 | 0 | 0 | 111.6 | P228 V229 V233 Q234 T235 | P228-T231 WeakPolarHBondContact CB-OG1 3.48Å; P228-T231 WeakPolarHBondContact CD-OG1 3.38Å; P228-T231 PolarHBondContact O-N 2.71Å; P228-T231 PolarHBondContact O-OG1 2.97Å; V229-T231 PolarHBondContact O-N 3.14Å; T231-V233 PolarHBondContact O-N 2.89Å; T231-Q234 PolarHBondContact O-N 2.97Å; T231-T235 PolarHBondContact O-N 2.84Å; T231-T235 PolarHBondContact O-OG1 3.23Å |
| 232 | F | 90.8 | Very high | 87.8 | Confident | 2 Ų | 2 | 65.1 Ų | 65.1 | 1% | 0.009 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -59.8 | -48.1 | 177.7 | 174.3 | -120.7 | 0 | 0 | 0 | 112 | L208 L212 I218 V222 L227 P228 V229 Q234 T235 H236 | L208-F232 HydrophobicContact CD2-CD1 3.95Å; L208-F232 HydrophobicContact CD2-CE1 3.46Å; L208-F232 VanDerWaalsContact CD2-CE1 3.46Å; L208-F232 HydrophobicContact CD2-CE2 4.24Å; L208-F232 HydrophobicContact CD2-CZ 3.61Å; L212-F232 HydrophobicContact CD1-CE1 4.19Å; L212-F232 HydrophobicContact CD1-CZ 4.28Å; L212-F232 HydrophobicContact CD2-CE1 4.09Å; L212-F232 HydrophobicContact CD2-CZ 3.75Å; L212-F232 HydrophobicContact CG-CE1 4.24Å; L212-F232 HydrophobicContact CG-CZ 3.85Å; I218-F232 HydrophobicContact CG2-CD2 4.17Å; I218-F232 HydrophobicContact CG2-CE2 3.66Å; I218-F232 HydrophobicContact CG2-CZ 4.4Å; V222-F232 HydrophobicContact CG2-CD1 4.1Å; V222-F232 HydrophobicContact CG2-CD2 4.27Å; V222-F232 HydrophobicContact CG2-CE1 4.31Å; V222-F232 HydrophobicContact CG2-CE2 4.49Å; V222-F232 HydrophobicContact CG2-CG 4.09Å; L227-F232 HydrophobicContact CD2-CB 3.8Å; L227-F232 HydrophobicContact CD2-CD2 3.74Å; L227-F232 HydrophobicContact CD2-CG 4.07Å; L227-F232 HydrophobicContact CG-CB 4.11Å; P228-F232 WeakPolarHBondContact O-CB 3.45Å; P228-F232 PolarHBondContact O-N 3.39Å; V229-F232 PolarHBondContact O-N 2.79Å; F232-Q234 VanDerWaalsContact C-N 3.34Å; F232-Q234 PolarHBondContact O-N 3.34Å; F232-T235 PolarHBondContact O-N 3.08Å; F232-H236 AromaticContact CD2-CD2 3.67Å; F232-H236 AromaticContact CD2-NE2 3.92Å; F232-H236 AromaticContact CE2-CD2 3.37Å; F232-H236 WeakPolarHBondContact CE2-CD2 3.39Å; F232-H236 AromaticContact CE2-NE2 3.49Å; F232-H236 WeakPolarHBondContact CE2-NE2 3.33Å; F232-H236 PolarHBondContact O-CD2 3.47Å; F232-H236 VanDerWaalsContact O-CD2 3.23Å; F232-H236 PolarHBondContact O-N 3.42Å |
| 233 | V | 91 | Very high | 87.8 | Confident | 1 Ų | 1 | 69.1 Ų | 69.1 | 1% | 0.006 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -65.5 | -39.1 | 178.7 | 178.4 | 0 | 0 | 0 | 0 | 111.2 | I185 E188 T189 L192 T204 L208 V229 G230 T231 H236 K237 | I185-V233 HydrophobicContact CG2-CG2 4.2Å; E188-V233 HydrophobicContact CB-CG2 4.21Å; T189-V233 HydrophobicContact CG2-CG1 4.44Å; T189-V233 WeakPolarHBondContact OG1-CG1 3.39Å; L192-V233 HydrophobicContact CD1-CB 3.98Å; L192-V233 HydrophobicContact CD1-CG1 3.55Å; T204-V233 HydrophobicContact CG2-CG1 4.46Å; L208-V233 HydrophobicContact CD1-CG1 4.35Å; L208-V233 HydrophobicContact CD1-CG2 4.18Å; V229-V233 HydrophobicContact CG1-CG2 4.2Å; V229-V233 VanDerWaalsContact O-CG2 3.3Å; V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 2.9Å; G230-V233 PolarHBondContact O-N 3.15Å; T231-V233 PolarHBondContact O-N 2.89Å; V233-H236 PolarHBondContact O-N 3.42Å; V233-K237 PolarHBondContact O-N 3.28Å; V233-K237 VanDerWaalsContact O-N 3.09Å |
| 234 | Q | 91.3 | Very high | 87.8 | Confident | 129 Ų | 129 | 67.9 Ų | 67.9 | 60% | 0.603 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -63.6 | -41.6 | 179.1 | -170.5 | 171.9 | 13.8 | 0 | 0 | 112.6 | L192 G230 T231 F232 H236 K237 | L192-Q234 HydrophobicContact CD1-CB 4.4Å; G230-Q234 WeakPolarHBondContact O-CB 3.23Å; G230-Q234 PolarHBondContact O-N 3.25Å; T231-Q234 PolarHBondContact O-N 2.97Å; F232-Q234 VanDerWaalsContact C-N 3.34Å; F232-Q234 PolarHBondContact O-N 3.34Å; Q234-H236 PolarHBondContact O-N 2.87Å; Q234-K237 WeakPolarHBondContact O-CB 3.49Å; Q234-K237 PolarHBondContact O-N 3.31Å |
| 235 | T | 90.8 | Very high | 87.7 | Confident | 110 Ų | 110 | 66.6 Ų | 66.6 | 68% | 0.675 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -61.4 | -30 | 176.9 | -54.7 | 0 | 0 | 0 | 0 | 112.7 | T231 F232 | T231-T235 PolarHBondContact O-N 2.84Å; T231-T235 PolarHBondContact O-OG1 3.23Å; F232-T235 PolarHBondContact O-N 3.08Å |
| 236 | H | 86.6 | Confident | 88 | Confident | 33 Ų | 33 | 67.5 Ų | 67.5 | 15% | 0.153 | 37% | 0.372 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.6 | 4.7 | -176.7 | -67.7 | -60.9 | 0 | 0 | 0 | 114.3 | L208 F232 V233 Q234 K238 | L208-H236 HydrophobicContact CD2-CB 3.62Å; L208-H236 HydrophobicContact CG-CB 4.22Å; F232-H236 AromaticContact CD2-CD2 3.67Å; F232-H236 AromaticContact CD2-NE2 3.92Å; F232-H236 AromaticContact CE2-CD2 3.37Å; F232-H236 WeakPolarHBondContact CE2-CD2 3.39Å; F232-H236 AromaticContact CE2-NE2 3.49Å; F232-H236 WeakPolarHBondContact CE2-NE2 3.33Å; F232-H236 PolarHBondContact O-CD2 3.47Å; F232-H236 VanDerWaalsContact O-CD2 3.23Å; F232-H236 PolarHBondContact O-N 3.42Å; V233-H236 PolarHBondContact O-N 3.42Å; Q234-H236 PolarHBondContact O-N 2.87Å; H236-K238 PolarHBondContact O-N 2.93Å |
| 237 | K | 85.9 | Confident | 88.1 | Confident | 108 Ų | 108 | 65.3 Ų | 65.3 | 47% | 0.47 | 35% | 0.348 | S | S | . | . | trans | -64.4 | 126.7 | 174.3 | -177.9 | 175.1 | 172.6 | 172.8 | 0 | 110 | L192 V233 Q234 | L192-K237 PolarHBondContact O-NZ 3.09Å; V233-K237 PolarHBondContact O-N 3.28Å; V233-K237 VanDerWaalsContact O-N 3.09Å; Q234-K237 WeakPolarHBondContact O-CB 3.49Å; Q234-K237 PolarHBondContact O-N 3.31Å | ||
| 238 | K | 74.7 | Confident | 88.3 | Confident | 165 Ų | 165 | 67 Ų | 67 | 72% | 0.717 | 36% | 0.358 | S | S | * | . | trans | -120.8 | 0 | 175.9 | -64.9 | -172.4 | 179 | -173.9 | 0 | 111.6 | R203 T204 H236 | R203-K238 HydrophobicContact CB-CB 4.4Å; R203-K238 PolarHBondContact NH1-O 3.39Å; R203-K238 VanDerWaalsContact NH1-O 3.14Å; R203-K238 PolarHBondContact NH1-OXT 3.45Å; T204-K238 PolarHBondContact OG1-N 3.14Å; H236-K238 PolarHBondContact O-N 2.93Å |
Retrieved 238 of 238 residues in 43.3 ms
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