| 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 | 34.1 | Very low | 37 | Very low | 242 Ų | 242 | 145.1 Ų | 145.1 | 100% | 1.192 | 80% | 0.801 | S | S | * | * | 0 | 111.8 | 0 | -79.5 | -72.1 | -140.7 | 0 | 0 | 107.8 | |||||
| 2 | A | 35.1 | Very low | 36.6 | Very low | 91 Ų | 91 | 144.8 Ų | 144.8 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | trans | 45.9 | 110.9 | 165.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 3 | V | 38.4 | Very low | 36.7 | Very low | 120 Ų | 120 | 143.2 Ų | 143.2 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | 73.4 | 118.3 | 62.8 | -171.4 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 4 | F | 37.9 | Very low | 36.8 | Very low | 187 Ų | 187 | 149.4 Ų | 149.4 | 82% | 0.82 | 81% | 0.807 | S | S | * | * | -160.8 | 127.5 | 76.7 | -93.1 | -85.3 | 0 | 0 | 0 | 110.6 | |||||
| 5 | S | 38.9 | Very low | 36.5 | Very low | 93 Ų | 93 | 147.6 Ų | 147.6 | 65% | 0.65 | 81% | 0.81 | S | S | * | * | 88.1 | 103 | 91 | -179.1 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 6 | H | 36.3 | Very low | 36.6 | Very low | 182 Ų | 182 | 153.1 Ų | 153.1 | 84% | 0.843 | 82% | 0.815 | S | S | * | * | 81.9 | 140.4 | 78.4 | -101.1 | -78.5 | 0 | 0 | 0 | 115.9 | |||||
| 7 | Q | 40.7 | Very low | 36.2 | Very low | 177 Ų | 177 | 147.8 Ų | 147.8 | 83% | 0.827 | 81% | 0.805 | S | S | * | * | trans | 102.4 | 122.6 | 170.4 | -69 | -154.5 | 11.8 | 0 | 0 | 114.6 | ||||
| 8 | V | 38 | Very low | 36.3 | Very low | 113 Ų | 113 | 145.8 Ų | 145.8 | 69% | 0.685 | 80% | 0.804 | S | S | * | * | cis | -154.3 | 138.6 | 24.7 | 166.6 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 9 | L | 37.8 | Very low | 36.5 | Very low | 139 Ų | 139 | 150 Ų | 150 | 73% | 0.728 | 81% | 0.808 | S | S | * | * | trans | 15.5 | 132.9 | 150 | -77.3 | 82.3 | 0 | 0 | 0 | 122.3 | ||||
| 10 | L | 37.1 | Very low | 36.6 | Very low | 163 Ų | 163 | 150.5 Ų | 150.5 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | 61.4 | 136.9 | 74 | -65.1 | 173.4 | 0 | 0 | 0 | 113 | |||||
| 11 | A | 33.1 | Very low | 36.5 | Very low | 89 Ų | 89 | 151 Ų | 151 | 74% | 0.736 | 81% | 0.811 | S | S | * | * | cis | -157 | 167.2 | 25.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 12 | V | 31.8 | Very low | 36.5 | Very low | 142 Ų | 142 | 144.9 Ų | 144.9 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | -161.6 | 129.3 | 84.1 | 163.7 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 13 | T | 37.8 | Very low | 36.5 | Very low | 124 Ų | 124 | 148.9 Ų | 148.9 | 76% | 0.761 | 79% | 0.793 | S | S | * | * | trans | -108 | 150.1 | 168.9 | 51.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 14 | R | 37.8 | Very low | 36.2 | Very low | 230 Ų | 230 | 154.9 Ų | 154.9 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | trans | 60.1 | 123.5 | 148 | -78.5 | 178.8 | 158.8 | 174.3 | -3.9 | 120.1 | ||||
| 15 | S | 32 | Very low | 36 | Very low | 122 Ų | 122 | 153.5 Ų | 153.5 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | trans | -146.4 | 124.2 | 137.2 | 173.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 16 | R | 38.9 | Very low | 35.6 | Very low | 235 Ų | 235 | 154.9 Ų | 154.9 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | trans | -87 | 148.6 | 167.8 | -79.5 | 176.2 | 153.7 | 179.4 | -6.7 | 108.1 | ||||
| 17 | G | 30.2 | Very low | 35.4 | Very low | 63 Ų | 63 | 152.3 Ų | 152.3 | 65% | 0.649 | 81% | 0.809 | S | S | * | * | trans | 176.5 | 105.9 | 161.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 18 | S | 38.1 | Very low | 35 | Very low | 112 Ų | 112 | 149.7 Ų | 149.7 | 78% | 0.783 | 81% | 0.81 | S | S | * | * | trans | -82.6 | 138.5 | 169.9 | -55.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 19 | Y | 39.7 | Very low | 35 | Very low | 226 Ų | 226 | 149.7 Ų | 149.7 | 89% | 0.886 | 82% | 0.816 | S | S | * | * | trans | -145.6 | 140.2 | 153.9 | -53.4 | -78.3 | 0 | 0 | 0 | 111.4 | ||||
| 20 | L | 37.4 | Very low | 34.9 | Very low | 159 Ų | 159 | 151.9 Ų | 151.9 | 83% | 0.832 | 83% | 0.827 | S | S | * | * | trans | -83.7 | 166.1 | -175.3 | -85.5 | 158.6 | 0 | 0 | 0 | 113.2 | ||||
| 21 | L | 35.1 | Very low | 34.7 | Very low | 161 Ų | 161 | 149 Ų | 149 | 84% | 0.843 | 82% | 0.82 | S | S | * | * | trans | 74.5 | 115.5 | 152.4 | -70 | 151.4 | 0 | 0 | 0 | 118.8 | ||||
| 22 | S | 34.3 | Very low | 34.7 | Very low | 115 Ų | 115 | 149.9 Ų | 149.9 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | 173.9 | 140.3 | 88.5 | -170.2 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 23 | K | 34.8 | Very low | 34.8 | Very low | 174 Ų | 174 | 153.1 Ų | 153.1 | 76% | 0.757 | 82% | 0.818 | S | S | * | * | trans | -91.5 | 129 | 178.5 | -175.4 | -176.9 | -172.3 | -179.9 | 0 | 108.1 | ||||
| 24 | R | 31.6 | Very low | 34.5 | Very low | 246 Ų | 246 | 152 Ų | 152 | 93% | 0.928 | 82% | 0.821 | S | S | * | * | trans | -153.1 | 126.1 | 152.6 | -112.5 | -178.5 | -171.1 | -168.3 | 2.2 | 112.3 | ||||
| 25 | H | 33.7 | Very low | 34.4 | Very low | 158 Ų | 158 | 150.1 Ų | 150.1 | 73% | 0.731 | 82% | 0.816 | S | S | * | * | trans | -71.5 | 143.2 | 163.2 | -67.3 | -98.7 | 0 | 0 | 0 | 109.5 | ||||
| 26 | S | 30.4 | Very low | 34.4 | Very low | 122 Ų | 122 | 152.8 Ų | 152.8 | 85% | 0.853 | 82% | 0.819 | S | S | * | * | trans | -163.8 | 128.2 | 145.1 | -79.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 27 | C | 32.2 | Very low | 33.8 | Very low | 128 Ų | 128 | 152.1 Ų | 152.1 | 87% | 0.865 | 82% | 0.817 | S | S | * | * | trans | -73.5 | 141.5 | 174.2 | -55 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 28 | S | 33.4 | Very low | 34.1 | Very low | 122 Ų | 122 | 153.9 Ų | 153.9 | 85% | 0.853 | 83% | 0.825 | S | S | * | * | trans | -157.2 | 125.5 | 143.7 | -30.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 29 | S | 38.6 | Very low | 33.8 | Very low | 114 Ų | 114 | 155.5 Ų | 155.5 | 80% | 0.797 | 83% | 0.825 | S | S | * | * | trans | -70.3 | 136.8 | 168.6 | 50.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 30 | L | 35.5 | Very low | 33.8 | Very low | 185 Ų | 185 | 148.8 Ų | 148.8 | 97% | 0.969 | 82% | 0.817 | S | S | * | * | trans | -155.5 | 145.3 | 151.7 | -100.4 | 167.3 | 0 | 0 | 0 | 110.7 | ||||
| 31 | S | 32.4 | Very low | 34.3 | Very low | 102 Ų | 102 | 147.6 Ų | 147.6 | 71% | 0.713 | 82% | 0.818 | S | S | * | * | trans | -106.9 | 152.8 | -165.4 | 172.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 32 | S | 32.1 | Very low | 34.2 | Very low | 107 Ų | 107 | 150.8 Ų | 150.8 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | trans | 78.9 | 118.4 | 145.5 | -74.4 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 33 | R | 35.8 | Very low | 34.4 | Very low | 210 Ų | 210 | 153.9 Ų | 153.9 | 79% | 0.792 | 82% | 0.821 | S | S | * | * | trans | 83 | 100.5 | 130.3 | -150.9 | 173.6 | -170.3 | 167.1 | 1.7 | 116.7 | ||||
| 34 | A | 31.2 | Very low | 34.4 | Very low | 101 Ų | 101 | 150.6 Ų | 150.6 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | trans | -133.9 | 118.1 | 161.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 35 | Y | 34.8 | Very low | 34.6 | Very low | 191 Ų | 191 | 144.4 Ų | 144.4 | 75% | 0.749 | 82% | 0.82 | S | S | * | * | trans | -70.7 | 133.4 | 169.2 | -79.4 | -96 | 0 | 0 | 0 | 109.5 | ||||
| 36 | L | 32.2 | Very low | 34.6 | Very low | 178 Ų | 178 | 142.3 Ų | 142.3 | 93% | 0.932 | 82% | 0.823 | S | S | * | * | trans | -92.7 | 104 | 163.9 | -76.7 | 170.6 | 0 | 0 | 0 | 109 | ||||
| 37 | R | 27.5 | Very low | 34.8 | Very low | 220 Ų | 220 | 140.9 Ų | 140.9 | 83% | 0.83 | 81% | 0.813 | S | S | * | * | trans | -84.1 | 112.7 | 166.4 | -172.8 | 179.6 | -165.3 | 151.9 | 3.3 | 106.8 | ||||
| 38 | A | 36.2 | Very low | 35 | Very low | 100 Ų | 100 | 144.3 Ų | 144.3 | 83% | 0.826 | 81% | 0.814 | S | S | * | * | trans | -83.2 | 113.3 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 39 | D | 31.9 | Very low | 35.8 | Very low | 146 Ų | 146 | 144 Ų | 144 | 78% | 0.781 | 81% | 0.809 | S | S | * | * | trans | -76 | 129.6 | 168.7 | -86.1 | -41.2 | 0 | 0 | 0 | 109.9 | ||||
| 40 | A | 39.6 | Very low | 36.8 | Very low | 86 Ų | 86 | 144.1 Ų | 144.1 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -112.1 | 131.4 | 166.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 41 | P | 46.6 | Very low | 36.6 | Very low | 134 Ų | 134 | 146.6 Ų | 146.6 | 87% | 0.87 | 80% | 0.804 | S | S | * | * | trans | -76.2 | 134.6 | -177.7 | 28.3 | -30.6 | 0 | 0 | 0 | 111.7 | ||||
| 42 | R | 34.2 | Very low | 36.8 | Very low | 228 Ų | 228 | 149.7 Ų | 149.7 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | -83.8 | 133.6 | 174.9 | -76.5 | -176 | 177.1 | -174.3 | -0.8 | 112.1 | ||||
| 43 | H | 37.4 | Very low | 36.8 | Very low | 180 Ų | 180 | 148.6 Ų | 148.6 | 83% | 0.833 | 80% | 0.799 | S | S | * | * | trans | 43 | 129.8 | 136.4 | -65.8 | -68.3 | 0 | 0 | 0 | 122.6 | ||||
| 44 | A | 34.3 | Very low | 36.9 | Very low | 105 Ų | 105 | 148.4 Ų | 148.4 | 87% | 0.868 | 80% | 0.798 | S | S | * | * | trans | -117.4 | 145.3 | 142.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 45 | S | 37.5 | Very low | 37.1 | Very low | 116 Ų | 116 | 154 Ų | 154 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | trans | -104.3 | 156.9 | -160.1 | 48.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 46 | S | 31.9 | Very low | 37 | Very low | 113 Ų | 113 | 148.6 Ų | 148.6 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | 175.8 | 157.8 | 136.2 | 58.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 47 | S | 35.3 | Very low | 37.1 | Very low | 92 Ų | 92 | 148 Ų | 148 | 64% | 0.643 | 79% | 0.794 | S | S | * | * | cis | -173.8 | 120.6 | -43.8 | 46.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 48 | F | 36.8 | Very low | 37.5 | Very low | 200 Ų | 200 | 144.5 Ų | 144.5 | 88% | 0.877 | 79% | 0.786 | S | S | * | * | trans | 63.3 | 162.5 | 156.3 | -60.2 | -68.3 | 0 | 0 | 0 | 121.9 | ||||
| 49 | P | 50 | Low | 37.4 | Very low | 117 Ų | 117 | 148 Ų | 148 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | cis | -131.7 | -179 | -23.3 | 25 | -0.9 | 0 | 0 | 0 | 114.7 | ||||
| 50 | P | 58.9 | Low | 37.4 | Very low | 116 Ų | 116 | 147.2 Ų | 147.2 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -111.5 | 164.7 | -165.4 | 39.7 | -29.1 | 0 | 0 | 0 | 114.6 | ||||
| 51 | R | 31.6 | Very low | 37.1 | Very low | 237 Ų | 237 | 148 Ų | 148 | 89% | 0.894 | 80% | 0.796 | S | S | * | * | trans | -150.8 | 116.5 | 151.5 | -93.8 | -164.6 | 174.6 | 175.5 | -1.7 | 113.3 | ||||
| 52 | H | 36.2 | Very low | 36.5 | Very low | 167 Ų | 167 | 153.8 Ų | 153.8 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | trans | 56.2 | 117.5 | 134.1 | -77.6 | -56.9 | 0 | 0 | 0 | 120.4 | ||||
| 53 | S | 33.9 | Very low | 36.2 | Very low | 84 Ų | 84 | 146.5 Ų | 146.5 | 59% | 0.587 | 80% | 0.797 | S | S | * | * | 96.8 | 130.4 | 90 | -179 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 54 | R | 36.7 | Very low | 36.1 | Very low | 205 Ų | 205 | 146.3 Ų | 146.3 | 77% | 0.774 | 80% | 0.802 | S | S | * | * | cis | -179.8 | 157.2 | 23.1 | -120.6 | -177.1 | -137.1 | -163 | 4.9 | 107.8 | ||||
| 55 | Y | 36.3 | Very low | 35.9 | Very low | 218 Ų | 218 | 144.4 Ų | 144.4 | 86% | 0.855 | 79% | 0.793 | S | S | * | * | trans | 74.3 | 134.2 | 148.8 | -82.7 | -109.8 | 0 | 0 | 0 | 122 | ||||
| 56 | G | 33 | Very low | 35.8 | Very low | 78 Ų | 78 | 144 Ų | 144 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | 154.2 | 73.5 | 160.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 57 | H | 33.9 | Very low | 36 | Very low | 167 Ų | 167 | 145 Ų | 145 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | trans | -87.2 | 135.6 | 170.5 | -144.3 | 65.1 | 0 | 0 | 0 | 109 | ||||
| 58 | H | 34.5 | Very low | 36 | Very low | 145 Ų | 145 | 148 Ų | 148 | 67% | 0.671 | 80% | 0.799 | S | S | * | * | 157 | 139.7 | 122 | -87.9 | -76.8 | 0 | 0 | 0 | 114.9 | |||||
| 59 | H | 34.4 | Very low | 35.8 | Very low | 175 Ų | 175 | 146.3 Ų | 146.3 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | trans | 93.2 | 115.7 | 151.6 | -72.9 | -59.9 | 0 | 0 | 0 | 122.3 | ||||
| 60 | C | 33.5 | Very low | 35 | Very low | 128 Ų | 128 | 145.2 Ų | 145.2 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -57.2 | 145.5 | 160.2 | -60.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 61 | A | 32.5 | Very low | 34 | Very low | 102 Ų | 102 | 151 Ų | 151 | 84% | 0.843 | 81% | 0.806 | S | S | * | * | trans | -156.8 | 141 | 134.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 62 | R | 33.6 | Very low | 33.9 | Very low | 256 Ų | 256 | 144.2 Ų | 144.2 | 97% | 0.966 | 80% | 0.8 | S | S | * | * | trans | -79.3 | 140.6 | 177.6 | -172.7 | -176.6 | -162 | 172.3 | 3.4 | 109 | ||||
| 63 | G | 28.6 | Very low | 33.9 | Very low | 76 Ų | 76 | 144.3 Ų | 144.3 | 78% | 0.784 | 81% | 0.805 | S | S | * | * | trans | -174.7 | 108.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 64 | D | 34.5 | Very low | 33.8 | Very low | 176 Ų | 176 | 149.6 Ų | 149.6 | 94% | 0.941 | 82% | 0.821 | S | S | * | * | trans | -61.5 | 154.8 | 174.9 | -153.3 | -7.1 | 0 | 0 | 0 | 112.6 | ||||
| 65 | G | 30.2 | Very low | 33.5 | Very low | 65 Ų | 65 | 145.4 Ų | 145.4 | 67% | 0.67 | 82% | 0.822 | S | S | * | * | trans | 157.3 | 77.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 66 | S | 35.7 | Very low | 33.4 | Very low | 108 Ų | 108 | 140.9 Ų | 140.9 | 76% | 0.755 | 82% | 0.823 | S | S | * | * | trans | -59.5 | 129.3 | 165.5 | -174.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 67 | V | 35.7 | Very low | 33.3 | Very low | 132 Ų | 132 | 141.7 Ų | 141.7 | 80% | 0.8 | 82% | 0.822 | S | S | * | * | trans | -129.5 | 103.5 | 167.6 | -178.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 68 | L | 35.5 | Very low | 33.2 | Very low | 156 Ų | 156 | 139.8 Ų | 139.8 | 82% | 0.817 | 82% | 0.822 | S | S | * | * | trans | -80 | 118.6 | 168.8 | -72.7 | 167 | 0 | 0 | 0 | 109.6 | A70 | L68-A70 PolarHBondContact O-N 3.26Š| ||
| 69 | L | 33 | Very low | 33 | Very low | 164 Ų | 164 | 144.1 Ų | 144.1 | 86% | 0.859 | 83% | 0.832 | S | S | * | * | trans | -80.7 | 93 | 167 | -97.9 | 162.9 | 0 | 0 | 0 | 109.5 | ||||
| 70 | A | 33.1 | Very low | 32.8 | Very low | 95 Ų | 95 | 142.4 Ų | 142.4 | 79% | 0.785 | 83% | 0.828 | S | S | * | * | trans | -93.8 | 112.4 | 166.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | L68 | L68-A70 PolarHBondContact O-N 3.26Š| ||
| 71 | R | 38.1 | Very low | 32.6 | Very low | 238 Ų | 238 | 144.5 Ų | 144.5 | 90% | 0.898 | 83% | 0.825 | S | S | * | * | trans | -86.7 | 117.6 | 166.2 | -97.1 | -174.3 | 170.2 | 104.6 | -1.9 | 109 | ||||
| 72 | A | 29.4 | Very low | 32.4 | Very low | 93 Ų | 93 | 145.9 Ų | 145.9 | 77% | 0.769 | 82% | 0.819 | S | S | * | * | trans | -73.7 | 129.1 | 172 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 73 | L | 36.3 | Very low | 32.2 | Very low | 169 Ų | 169 | 140.8 Ų | 140.8 | 89% | 0.885 | 82% | 0.815 | S | S | * | * | trans | -105.1 | 125.1 | 162.1 | -75.5 | 174.5 | 0 | 0 | 0 | 108.6 | S75 | L73-S75 PolarHBondContact O-N 3.42Š| ||
| 74 | H | 31.6 | Very low | 32.1 | Very low | 196 Ų | 196 | 145.9 Ų | 145.9 | 91% | 0.907 | 82% | 0.816 | S | S | * | * | trans | -54.6 | 123.8 | 172.2 | -82.2 | 54.7 | 0 | 0 | 0 | 110.7 | ||||
| 75 | S | 30.5 | Very low | 31.8 | Very low | 116 Ų | 116 | 145 Ų | 145 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -111.8 | 120.1 | 156.5 | 52.6 | 0 | 0 | 0 | 0 | 108.5 | L73 A77 | L73-S75 PolarHBondContact O-N 3.42Å; S75-A77 PolarHBondContact O-N 2.71Å | ||
| 76 | S | 32.9 | Very low | 31.6 | Very low | 124 Ų | 124 | 149.9 Ų | 149.9 | 87% | 0.867 | 82% | 0.817 | S | S | * | * | trans | -67.9 | 121.9 | 173.9 | 50.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 77 | A | 32.7 | Very low | 31.3 | Very low | 94 Ų | 94 | 151.1 Ų | 151.1 | 78% | 0.777 | 82% | 0.815 | S | S | * | * | trans | -87.6 | 123.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | S75 | S75-A77 PolarHBondContact O-N 2.71Š| ||
| 78 | V | 31.6 | Very low | 30.8 | Very low | 128 Ų | 128 | 151.9 Ų | 151.9 | 78% | 0.776 | 82% | 0.82 | S | S | * | * | trans | -156.6 | 106.7 | 148.1 | -177.3 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 79 | W | 29.1 | Very low | 30.4 | Very low | 236 Ų | 236 | 153.9 Ų | 153.9 | 89% | 0.894 | 82% | 0.823 | S | S | * | * | 179.1 | 118.3 | 124.5 | -101.3 | 93.5 | 0 | 0 | 0 | 108.4 | |||||
| 80 | L | 29.9 | Very low | 30 | Very low | 139 Ų | 139 | 150.9 Ų | 150.9 | 73% | 0.728 | 82% | 0.821 | S | S | * | * | trans | -112.4 | 136.6 | -179 | -169.5 | 112.7 | 0 | 0 | 0 | 107.6 | ||||
| 81 | Q | 29.4 | Very low | 29.6 | Very low | 171 Ų | 171 | 151.6 Ų | 151.6 | 80% | 0.799 | 82% | 0.821 | S | S | * | * | trans | 167.6 | 95.1 | 143.7 | -94.4 | 159.1 | 14.2 | 0 | 0 | 106.2 | ||||
| 82 | D | 28.4 | Very low | 29.7 | Very low | 132 Ų | 132 | 145.8 Ų | 145.8 | 71% | 0.706 | 81% | 0.813 | S | S | * | * | 63.3 | 94.4 | 72.1 | -151.7 | 11.9 | 0 | 0 | 0 | 112.2 | |||||
| 83 | V | 29.3 | Very low | 29.5 | Very low | 148 Ų | 148 | 146.3 Ų | 146.3 | 90% | 0.897 | 82% | 0.818 | S | S | * | * | trans | -139.6 | 119 | 146.5 | 178.6 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 84 | K | 28 | Very low | 29.1 | Very low | 184 Ų | 184 | 142.7 Ų | 142.7 | 80% | 0.8 | 81% | 0.813 | S | S | * | * | trans | -76.9 | 147 | -175.8 | -164.6 | 174.6 | 177.8 | -178.9 | 0 | 111.5 | ||||
| 85 | Q | 26.5 | Very low | 29.3 | Very low | 157 Ų | 157 | 138.7 Ų | 138.7 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | trans | -57.3 | 145.2 | 164.5 | -81.6 | 165.6 | -69.1 | 0 | 0 | 111.9 | ||||
| 86 | D | 26.6 | Very low | 29.2 | Very low | 167 Ų | 167 | 142.2 Ų | 142.2 | 89% | 0.893 | 81% | 0.807 | S | S | * | * | trans | -131.2 | 124.6 | 143.8 | -85.6 | -38.5 | 0 | 0 | 0 | 108.9 | ||||
| 87 | D | 29.6 | Very low | 28.9 | Very low | 135 Ų | 135 | 144.1 Ų | 144.1 | 72% | 0.722 | 81% | 0.808 | S | S | * | * | trans | -79.1 | 141.7 | 170.7 | -72.1 | -54.6 | 0 | 0 | 0 | 110.1 | ||||
| 88 | T | 26.4 | Very low | 28.6 | Very low | 147 Ų | 147 | 143.4 Ų | 143.4 | 90% | 0.902 | 81% | 0.81 | S | S | * | * | trans | -151.7 | 132.7 | 145.4 | -67.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 89 | K | 27.1 | Very low | 28.4 | Very low | 199 Ų | 199 | 146.1 Ų | 146.1 | 87% | 0.865 | 81% | 0.814 | S | S | * | * | trans | -94.9 | 135.9 | -175.5 | 171.2 | -174 | -176 | -178.8 | 0 | 110.4 | ||||
| 90 | A | 24.7 | Very low | 28.3 | Very low | 100 Ų | 100 | 143.5 Ų | 143.5 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | trans | 150.6 | 134.1 | 132.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 91 | S | 23.6 | Very low | 28.1 | Very low | 111 Ų | 111 | 142.8 Ų | 142.8 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | trans | -84.2 | -169.9 | 166.7 | -152.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 92 | P | 40.5 | Very low | 27.9 | Very low | 115 Ų | 115 | 140.8 Ų | 140.8 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | cis | -131.1 | 174.7 | -20.9 | 24 | -0.8 | 0 | 0 | 0 | 113.6 | ||||
| 93 | A | 25.5 | Very low | 28 | Very low | 104 Ų | 104 | 139.8 Ų | 139.8 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | 178.8 | 127.5 | 138.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 94 | A | 26.5 | Very low | 27.8 | Very low | 94 Ų | 94 | 137.2 Ų | 137.2 | 78% | 0.777 | 80% | 0.798 | S | S | * | * | trans | -104 | -176.8 | 147.8 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 95 | P | 37.5 | Very low | 27.7 | Very low | 112 Ų | 112 | 133.3 Ų | 133.3 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | cis | -140.8 | -178.4 | 12.9 | 40.5 | -19.9 | 0 | 0 | 0 | 115.2 | ||||
| 96 | Q | 28.5 | Very low | 27.7 | Very low | 189 Ų | 189 | 130.1 Ų | 130.1 | 88% | 0.883 | 80% | 0.801 | S | S | * | * | -174.4 | 144.8 | 129.5 | -101.7 | 178.5 | 17.5 | 0 | 0 | 114.1 | |||||
| 97 | D | 24.8 | Very low | 27.7 | Very low | 164 Ų | 164 | 126.6 Ų | 126.6 | 88% | 0.877 | 80% | 0.795 | S | S | * | * | trans | -80.5 | 170.5 | -174 | -61.5 | -66.9 | 0 | 0 | 0 | 115.5 | ||||
| 98 | G | 27.9 | Very low | 27.5 | Very low | 79 Ų | 79 | 126 Ų | 126 | 81% | 0.814 | 80% | 0.796 | S | S | * | * | trans | 176.5 | 98.1 | 162.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 99 | E | 26.4 | Very low | 27.6 | Very low | 186 Ų | 186 | 124.6 Ų | 124.6 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | trans | -68 | 152 | 173.5 | -67.3 | 167 | 105.9 | 0 | 0 | 114.8 | ||||
| 100 | K | 27.3 | Very low | 27.5 | Very low | 181 Ų | 181 | 120.9 Ų | 120.9 | 79% | 0.787 | 78% | 0.781 | S | S | * | * | 164 | 129.6 | 109.3 | -113.5 | 179 | 173.2 | 171.2 | 0 | 114.1 | |||||
| 101 | N | 25.9 | Very low | 27.5 | Very low | 123 Ų | 123 | 122.9 Ų | 122.9 | 66% | 0.658 | 78% | 0.778 | S | S | * | * | 43.8 | 147.8 | 126.9 | -70.2 | 30 | 0 | 0 | 0 | 120.8 | |||||
| 102 | D | 25.9 | Very low | 27.6 | Very low | 129 Ų | 129 | 121.3 Ų | 121.3 | 69% | 0.69 | 77% | 0.767 | S | S | * | * | cis | -171.9 | 164.1 | 8.4 | -104.9 | -31.1 | 0 | 0 | 0 | 108.8 | ||||
| 103 | S | 29.5 | Very low | 27 | Very low | 111 Ų | 111 | 124.5 Ų | 124.5 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | 71.5 | 111.7 | 154.4 | -57 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 104 | A | 26.1 | Very low | 26.9 | Very low | 94 Ų | 94 | 130.2 Ų | 130.2 | 78% | 0.777 | 77% | 0.771 | S | S | * | * | 84.7 | 109.8 | 60.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 105 | A | 25.3 | Very low | 27.4 | Very low | 102 Ų | 102 | 131.1 Ų | 131.1 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | 62.4 | 154.4 | 138.2 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 106 | A | 25.2 | Very low | 27 | Very low | 90 Ų | 90 | 131.7 Ų | 131.7 | 74% | 0.744 | 78% | 0.776 | S | S | * | * | cis | -173.8 | 155.8 | -20 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 107 | A | 26.7 | Very low | 27 | Very low | 94 Ų | 94 | 127.1 Ų | 127.1 | 78% | 0.777 | 77% | 0.77 | S | S | * | * | trans | 70.9 | 153.9 | 150.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 108 | V | 26.4 | Very low | 27.8 | Very low | 122 Ų | 122 | 125 Ų | 125 | 74% | 0.739 | 77% | 0.765 | S | S | * | * | cis | -179 | 138.1 | -6.8 | 131.9 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 109 | V | 27.8 | Very low | 27.8 | Very low | 118 Ų | 118 | 127.7 Ų | 127.7 | 72% | 0.715 | 77% | 0.766 | S | S | * | * | trans | 49.7 | 131.8 | 137.4 | -164.3 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 110 | T | 24.8 | Very low | 27.8 | Very low | 120 Ų | 120 | 123.1 Ų | 123.1 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | 167.4 | 121.4 | 74.1 | -26.8 | 0 | 0 | 0 | 0 | 104.4 | |||||
| 111 | D | 25 | Very low | 27.9 | Very low | 142 Ų | 142 | 119.2 Ų | 119.2 | 76% | 0.759 | 76% | 0.762 | S | S | * | * | 93 | 146.8 | 91.4 | -167.2 | 40.1 | 0 | 0 | 0 | 115.9 | |||||
| 112 | S | 26.3 | Very low | 28.1 | Very low | 78 Ų | 78 | 118 Ų | 118 | 55% | 0.545 | 77% | 0.768 | S | S | . | * | trans | 86.4 | 102.1 | 152.8 | -80.9 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 113 | Q | 27.1 | Very low | 28.2 | Very low | 183 Ų | 183 | 116.7 Ų | 116.7 | 86% | 0.855 | 78% | 0.776 | S | S | * | * | 107.2 | 111.5 | 105.9 | -150.9 | 153.6 | -32.7 | 0 | 0 | 120.3 | |||||
| 114 | R | 24.7 | Very low | 28.3 | Very low | 223 Ų | 223 | 116.1 Ų | 116.1 | 84% | 0.842 | 78% | 0.778 | S | S | * | * | trans | -54.1 | 152 | 158.1 | 171.2 | -174.2 | -99.6 | -174 | -2.6 | 111.4 | ||||
| 115 | P | 36.8 | Very low | 28.8 | Very low | 114 Ų | 114 | 117.1 Ų | 117.1 | 74% | 0.74 | 79% | 0.786 | S | S | * | * | -156.9 | 155.1 | 65.1 | 38.9 | -15.6 | 0 | 0 | 0 | 120.5 | |||||
| 116 | S | 28.2 | Very low | 29.3 | Very low | 123 Ų | 123 | 116.8 Ų | 116.8 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | 178.1 | 130.9 | 126.7 | 39.4 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 117 | A | 28.5 | Very low | 29.6 | Very low | 93 Ų | 93 | 117.3 Ų | 117.3 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -109.8 | 165.2 | 155.4 | 0 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 118 | P | 42 | Very low | 30.2 | Very low | 119 Ų | 119 | 119.1 Ų | 119.1 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | cis | -136.4 | 170.2 | 34.6 | 32.6 | -9.4 | 0 | 0 | 0 | 114 | ||||
| 119 | T | 27.9 | Very low | 31 | Very low | 136 Ų | 136 | 118.7 Ų | 118.7 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | -178.5 | 149.1 | 102 | -67.2 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 120 | A | 27.3 | Very low | 31.6 | Very low | 91 Ų | 91 | 118.7 Ų | 118.7 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | trans | -51.9 | 150.7 | -176.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 121 | A | 29 | Very low | 32.2 | Very low | 99 Ų | 99 | 117.7 Ų | 117.7 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | 169.5 | 135.4 | 112.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 122 | A | 28.6 | Very low | 32.9 | Very low | 96 Ų | 96 | 120.1 Ų | 120.1 | 79% | 0.793 | 80% | 0.802 | S | S | * | * | trans | 62.3 | 110.2 | 142.4 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 123 | A | 29.8 | Very low | 33.6 | Very low | 102 Ų | 102 | 125.2 Ų | 125.2 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | 54.1 | 106.1 | 122.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 124 | A | 31.7 | Very low | 34.3 | Very low | 99 Ų | 99 | 126 Ų | 126 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | -172 | 115.2 | 125.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | A126 | A124-A126 PolarHBondContact O-N 3.02Š| |||
| 125 | A | 36 | Very low | 35.1 | Very low | 115 Ų | 115 | 119.8 Ų | 119.8 | 95% | 0.95 | 81% | 0.814 | S | S | * | * | trans | -69.9 | 115 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 126 | A | 35.2 | Very low | 35.4 | Very low | 96 Ų | 96 | 122.6 Ų | 122.6 | 79% | 0.793 | 82% | 0.819 | S | S | * | * | trans | -113.3 | 118.5 | 168.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | A124 | A124-A126 PolarHBondContact O-N 3.02Š| ||
| 127 | A | 32.4 | Very low | 36.3 | Very low | 100 Ų | 100 | 123.2 Ų | 123.2 | 83% | 0.826 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 135.1 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 128 | V | 39.1 | Very low | 37.7 | Very low | 132 Ų | 132 | 127 Ų | 127 | 80% | 0.8 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -80.4 | 126.3 | 165.5 | 179.7 | 0 | 0 | 0 | 0 | 108.1 | ||
| 129 | P | 43.8 | Very low | 38.5 | Very low | 113 Ų | 113 | 126.8 Ų | 126.8 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -75 | 132.2 | 172.4 | 29.6 | -31 | 0 | 0 | 0 | 109.8 | ||
| 130 | P | 39.6 | Very low | 40.9 | Very low | 119 Ų | 119 | 123 Ų | 123 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -75 | 138.1 | 177.9 | 29.4 | -31.7 | 0 | 0 | 0 | 111.1 | Q132 | P130-Q132 PolarHBondContact O-N 3.22Š|
| 131 | A | 37.9 | Very low | 43.1 | Very low | 99 Ų | 99 | 125.2 Ų | 125.2 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 123.3 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | E133 | A131-E133 PolarHBondContact O-N 3.16Š|
| 132 | Q | 38.5 | Very low | 45.4 | Very low | 192 Ų | 192 | 128.8 Ų | 128.8 | 90% | 0.897 | 78% | 0.775 | S | S | * | * | trans | -71.6 | 89.2 | 170.8 | -70.1 | -179.2 | -9.7 | 0 | 0 | 109.6 | P130 K134 | P130-Q132 PolarHBondContact O-N 3.22Å; Q132-K134 PolarHBondContact O-N 3.15Å | ||
| 133 | E | 42.4 | Very low | 47.9 | Very low | 186 Ų | 186 | 129.1 Ų | 129.1 | 87% | 0.869 | 76% | 0.76 | S | S | * | * | trans | -61.1 | 119.8 | 151.7 | -87.8 | -172.3 | 147.7 | 0 | 0 | 107.7 | A131 A135 | A131-E133 PolarHBondContact O-N 3.16Å; E133-A135 VanDerWaalsContact C-N 3.26Å; E133-A135 PolarHBondContact O-N 3.45Å | ||
| 134 | K | 40.7 | Very low | 50.1 | Low | 200 Ų | 200 | 129 Ų | 129 | 87% | 0.87 | 74% | 0.737 | S | S | * | * | trans | -62.1 | 93.1 | 169.7 | -68.6 | 178.9 | -179.8 | 178.1 | 0 | 108 | Q132 M136 | Q132-K134 PolarHBondContact O-N 3.15Å; K134-M136 PolarHBondContact O-N 3.12Å | ||
| 135 | A | 42.3 | Very low | 52.2 | Low | 91 Ų | 91 | 128.7 Ų | 128.7 | 75% | 0.752 | 72% | 0.721 | S | S | * | * | trans | -57.2 | 99.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108 | E133 V137 | E133-A135 VanDerWaalsContact C-N 3.26Å; E133-A135 PolarHBondContact O-N 3.45Å; A135-V137 PolarHBondContact O-N 3.15Å | ||
| 136 | M | 43.6 | Very low | 54.3 | Low | 173 Ų | 173 | 124.9 Ų | 124.9 | 85% | 0.852 | 69% | 0.686 | S | S | * | * | trans | -57.5 | 109.1 | 164.5 | -65.3 | -178.3 | -173.8 | 0 | 0 | 106 | K134 K138 | K134-M136 PolarHBondContact O-N 3.12Å; M136-K138 PolarHBondContact O-N 3.16Å | ||
| 137 | V | 46.4 | Very low | 56.2 | Low | 137 Ų | 137 | 123.5 Ų | 123.5 | 83% | 0.83 | 67% | 0.665 | S | S | * | * | trans | -50.9 | 106.8 | 171.5 | 176.3 | 0 | 0 | 0 | 0 | 106.3 | A135 K139 | A135-V137 PolarHBondContact O-N 3.15Å; V137-K139 PolarHBondContact O-N 2.92Å | ||
| 138 | K | 57.1 | Low | 58.4 | Low | 173 Ų | 173 | 123.9 Ų | 123.9 | 75% | 0.752 | 65% | 0.65 | S | S | * | * | trans | -62.3 | 104.2 | 178.3 | -71.4 | 178.2 | -177.5 | 174.5 | 0 | 105.3 | M136 S140 R144 | M136-K138 PolarHBondContact O-N 3.16Å; K138-S140 PolarHBondContact O-N 3.48Å; K138-R144 VanDerWaalsContact CB-NH2 3.27Å | ||
| 139 | K | 59.2 | Low | 60 | Low | 113 Ų | 113 | 122.8 Ų | 122.8 | 49% | 0.491 | 64% | 0.639 | S | S | . | * | trans | -41.1 | 135 | 167.6 | -69.7 | -179.2 | 172.5 | -172.4 | 0 | 108.4 | V137 Q143 R144 D147 | V137-K139 PolarHBondContact O-N 2.92Å; K139-Q143 HydrophobicContact CB-CB 4.27Å; K139-R144 HydrophobicContact CB-CG 4.01Å; K139-R144 PolarHBondContact O-NE 2.81Å; K139-D147 IonicContact NZ-OD2 2.8Å; K139-D147 PolarHBondContact NZ-OD2 3.08Å | ||
| 140 | S | 78.1 | Confident | 61.6 | Low | 58 Ų | 58 | 123.4 Ų | 123.4 | 41% | 0.406 | 63% | 0.63 | S | S | . | * | trans | -55.1 | 149 | -175.9 | 80.3 | 0 | 0 | 0 | 0 | 109.9 | K138 Y142 Q143 R144 | K138-S140 PolarHBondContact O-N 3.48Å; S140-Y142 PolarHBondContact O-N 3.04Å; S140-Y142 VanDerWaalsContact O-N 3.08Å; S140-Q143 WeakPolarHBondContact O-CA 3.25Å; S140-Q143 WeakPolarHBondContact O-CB 3.2Å; S140-Q143 PolarHBondContact O-N 3.46Å; S140-Q143 WeakPolarHBondContact OG-CG 3.45Å; S140-Q143 PolarHBondContact OG-N 3.43Å; S140-R144 PolarHBondContact O-N 3.39Å | ||
| 141 | L | 73.8 | Confident | 63.3 | Low | 136 Ų | 136 | 122 Ų | 122 | 71% | 0.712 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -51.9 | -36.8 | -178.5 | -68.1 | 170.6 | 0 | 0 | 0 | 111.6 | R144 I145 | L141-R144 PolarHBondContact O-N 2.95Å; L141-I145 WeakPolarHBondContact O-CD1 3.5Å; L141-I145 VanDerWaalsContact O-CG1 3.22Å; L141-I145 WeakPolarHBondContact O-CG1 3.3Å; L141-I145 PolarHBondContact O-N 3.14Å |
| 142 | Y | 78.4 | Confident | 64.9 | Low | 175 Ų | 175 | 122.8 Ų | 122.8 | 69% | 0.686 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63.4 | -46.2 | 173.8 | -175.3 | -97.9 | 0 | 0 | 0 | 113.1 | S140 R144 I145 V146 | S140-Y142 PolarHBondContact O-N 3.04Å; S140-Y142 VanDerWaalsContact O-N 3.08Å; Y142-R144 VanDerWaalsContact C-N 3.29Å; Y142-R144 PolarHBondContact O-N 3.13Å; Y142-I145 PolarHBondContact O-N 3.29Å; Y142-V146 HydrophobicContact CD1-CG2 4.12Å; Y142-V146 HydrophobicContact CE1-CG2 3.72Å; Y142-V146 HydrophobicContact CE2-CG2 4.24Å; Y142-V146 WeakPolarHBondContact O-CG2 3.32Å; Y142-V146 PolarHBondContact O-N 3.26Å |
| 143 | Q | 79.5 | Confident | 66.7 | Low | 102 Ų | 102 | 121.1 Ų | 121.1 | 48% | 0.477 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -63.2 | -36.2 | 176.5 | -73.2 | 172.3 | -9.9 | 0 | 0 | 112 | K139 S140 D147 | K139-Q143 HydrophobicContact CB-CB 4.27Å; S140-Q143 WeakPolarHBondContact O-CA 3.25Å; S140-Q143 WeakPolarHBondContact O-CB 3.2Å; S140-Q143 PolarHBondContact O-N 3.46Å; S140-Q143 WeakPolarHBondContact OG-CG 3.45Å; S140-Q143 PolarHBondContact OG-N 3.43Å; Q143-D147 WeakPolarHBondContact O-CB 3.43Å; Q143-D147 PolarHBondContact O-N 3.42Å |
| 144 | R | 76.9 | Confident | 68.4 | Low | 100 Ų | 100 | 116.8 Ų | 116.8 | 38% | 0.377 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.9 | -46.1 | 174 | -65.3 | 177.7 | -175.1 | -159 | -11.6 | 111.7 | K138 K139 S140 L141 Y142 D147 E148 | K138-R144 VanDerWaalsContact CB-NH2 3.27Å; K139-R144 HydrophobicContact CB-CG 4.01Å; K139-R144 PolarHBondContact O-NE 2.81Å; S140-R144 PolarHBondContact O-N 3.39Å; L141-R144 PolarHBondContact O-N 2.95Å; Y142-R144 VanDerWaalsContact C-N 3.29Å; Y142-R144 PolarHBondContact O-N 3.13Å; R144-D147 PolarHBondContact O-N 2.78Å; R144-E148 VanDerWaalsContact O-CB 3.28Å; R144-E148 WeakPolarHBondContact O-CB 3.49Å; R144-E148 VanDerWaalsContact O-CG 3.23Å; R144-E148 WeakPolarHBondContact O-CG 3.21Å; R144-E148 PolarHBondContact O-N 3.07Å |
| 145 | I | 75.6 | Confident | 70.1 | Confident | 93 Ų | 93 | 107.7 Ų | 107.7 | 48% | 0.477 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.4 | -43.1 | 178.3 | -67.8 | 162.8 | 0 | 0 | 0 | 110.9 | L141 Y142 E148 L149 | L141-I145 WeakPolarHBondContact O-CD1 3.5Å; L141-I145 VanDerWaalsContact O-CG1 3.22Å; L141-I145 WeakPolarHBondContact O-CG1 3.3Å; L141-I145 PolarHBondContact O-N 3.14Å; Y142-I145 PolarHBondContact O-N 3.29Å; I145-E148 PolarHBondContact O-N 3.36Å; I145-L149 HydrophobicContact CG2-CD1 3.84Å; I145-L149 HydrophobicContact CG2-CG 4.36Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 VanDerWaalsContact O-CG 3.28Å; I145-L149 WeakPolarHBondContact O-CG 3.37Å; I145-L149 PolarHBondContact O-N 3.32Å |
| 146 | V | 80.3 | Confident | 71.9 | Confident | 35 Ų | 35 | 109 Ų | 109 | 21% | 0.212 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -67.7 | -41.4 | 177.9 | 172.9 | 0 | 0 | 0 | 0 | 111.5 | Y142 E148 L149 K150 | Y142-V146 HydrophobicContact CD1-CG2 4.12Å; Y142-V146 HydrophobicContact CE1-CG2 3.72Å; Y142-V146 HydrophobicContact CE2-CG2 4.24Å; Y142-V146 WeakPolarHBondContact O-CG2 3.32Å; Y142-V146 PolarHBondContact O-N 3.26Å; V146-E148 VanDerWaalsContact C-N 3.35Å; V146-L149 PolarHBondContact O-N 2.65Å; V146-K150 HydrophobicContact CG1-CD 4.07Å; V146-K150 HydrophobicContact CG1-CG 4.45Å; V146-K150 WeakPolarHBondContact O-CB 3.49Å; V146-K150 VanDerWaalsContact O-CG 3.28Å; V146-K150 WeakPolarHBondContact O-CG 3.44Å; V146-K150 PolarHBondContact O-N 3.07Å |
| 147 | D | 75.6 | Confident | 73.7 | Confident | 67 Ų | 67 | 108.6 Ų | 108.6 | 36% | 0.358 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.5 | -41.7 | 175.7 | -76.2 | -9 | 0 | 0 | 0 | 110.9 | K139 Q143 R144 H151 | K139-D147 IonicContact NZ-OD2 2.8Å; K139-D147 PolarHBondContact NZ-OD2 3.08Å; Q143-D147 WeakPolarHBondContact O-CB 3.43Å; Q143-D147 PolarHBondContact O-N 3.42Å; R144-D147 PolarHBondContact O-N 2.78Å; D147-H151 VanDerWaalsContact O-CB 3.31Å; D147-H151 WeakPolarHBondContact O-CB 3.46Å; D147-H151 PolarHBondContact O-N 2.92Å |
| 148 | E | 76.8 | Confident | 75.5 | Confident | 108 Ų | 108 | 106.2 Ų | 106.2 | 51% | 0.505 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.9 | -47.4 | 174.9 | -76.5 | 173.7 | -162.4 | 0 | 0 | 111.6 | R144 I145 V146 K150 H151 Y152 | R144-E148 VanDerWaalsContact O-CB 3.28Å; R144-E148 WeakPolarHBondContact O-CB 3.49Å; R144-E148 VanDerWaalsContact O-CG 3.23Å; R144-E148 WeakPolarHBondContact O-CG 3.21Å; R144-E148 PolarHBondContact O-N 3.07Å; I145-E148 PolarHBondContact O-N 3.36Å; V146-E148 VanDerWaalsContact C-N 3.35Å; E148-K150 PolarHBondContact O-N 3.41Å; E148-H151 CarbonylContact O-C 3.56Å; E148-H151 WeakPolarHBondContact O-CA 3.31Å; E148-H151 VanDerWaalsContact O-CB 3.31Å; E148-H151 WeakPolarHBondContact O-CB 3.32Å; E148-H151 PolarHBondContact O-N 3.29Å; E148-H151 VanDerWaalsContact O-N 3.11Å; E148-Y152 HydrophobicContact CB-CD2 4.4Å; E148-Y152 HydrophobicContact CB-CE2 4.16Å; E148-Y152 WeakPolarHBondContact O-CD2 3.28Å; E148-Y152 PolarHBondContact O-N 2.88Å |
| 149 | L | 74.3 | Confident | 76.6 | Confident | 108 Ų | 108 | 98.4 Ų | 98.4 | 57% | 0.565 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -62.6 | -41.6 | 177.3 | -76.4 | 170.1 | 0 | 0 | 0 | 112.3 | I145 V146 H151 Y152 Y153 | I145-L149 HydrophobicContact CG2-CD1 3.84Å; I145-L149 HydrophobicContact CG2-CG 4.36Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 VanDerWaalsContact O-CG 3.28Å; I145-L149 WeakPolarHBondContact O-CG 3.37Å; I145-L149 PolarHBondContact O-N 3.32Å; V146-L149 PolarHBondContact O-N 2.65Å; L149-H151 VanDerWaalsContact C-N 3.29Å; L149-H151 PolarHBondContact O-N 3.34Å; L149-Y152 PolarHBondContact O-N 3.5Å; L149-Y153 WeakPolarHBondContact O-CB 3.47Å; L149-Y153 PolarHBondContact O-N 2.86Å |
| 150 | K | 77.4 | Confident | 77.7 | Confident | 126 Ų | 126 | 94.9 Ų | 94.9 | 55% | 0.548 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62 | -39.7 | 173.1 | -76.6 | 174.7 | -178.6 | 174.7 | 0 | 111.1 | V146 E148 N154 | V146-K150 HydrophobicContact CG1-CD 4.07Å; V146-K150 HydrophobicContact CG1-CG 4.45Å; V146-K150 WeakPolarHBondContact O-CB 3.49Å; V146-K150 VanDerWaalsContact O-CG 3.28Å; V146-K150 WeakPolarHBondContact O-CG 3.44Å; V146-K150 PolarHBondContact O-N 3.07Å; E148-K150 PolarHBondContact O-N 3.41Å; K150-N154 WeakPolarHBondContact O-CB 3.25Å; K150-N154 VanDerWaalsContact O-CG 3.23Å; K150-N154 PolarHBondContact O-N 3.39Å; K150-N154 PolarHBondContact O-ND2 2.99Å |
| 151 | H | 74.9 | Confident | 78 | Confident | 91 Ų | 91 | 96.3 Ų | 96.3 | 42% | 0.421 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 174.5 | -177.5 | 72.1 | 0 | 0 | 0 | 111.7 | D147 E148 L149 N154 G155 | D147-H151 VanDerWaalsContact O-CB 3.31Å; D147-H151 WeakPolarHBondContact O-CB 3.46Å; D147-H151 PolarHBondContact O-N 2.92Å; E148-H151 CarbonylContact O-C 3.56Å; E148-H151 WeakPolarHBondContact O-CA 3.31Å; E148-H151 VanDerWaalsContact O-CB 3.31Å; E148-H151 WeakPolarHBondContact O-CB 3.32Å; E148-H151 PolarHBondContact O-N 3.29Å; E148-H151 VanDerWaalsContact O-N 3.11Å; L149-H151 VanDerWaalsContact C-N 3.29Å; L149-H151 PolarHBondContact O-N 3.34Å; H151-N154 PolarHBondContact O-N 3.18Å; H151-G155 PolarHBondContact O-N 3.39Å |
| 152 | Y | 71.8 | Confident | 78.6 | Confident | 114 Ų | 114 | 91.2 Ų | 91.2 | 45% | 0.447 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 175.5 | -72.8 | -64 | 0 | 0 | 0 | 113 | E148 L149 G155 F156 F228 | E148-Y152 HydrophobicContact CB-CD2 4.4Å; E148-Y152 HydrophobicContact CB-CE2 4.16Å; E148-Y152 WeakPolarHBondContact O-CD2 3.28Å; E148-Y152 PolarHBondContact O-N 2.88Å; L149-Y152 PolarHBondContact O-N 3.5Å; Y152-G155 PolarHBondContact O-N 3.37Å; Y152-F156 WeakPolarHBondContact O-CB 3.36Å; Y152-F156 PolarHBondContact O-N 3.06Å; Y152-F228 AromaticContact CD1-CD1 3.72Å; Y152-F228 HydrophobicContact CD1-CD1 3.72Å; Y152-F228 AromaticContact CD1-CE1 3.35Å; Y152-F228 HydrophobicContact CD1-CE1 3.35Å; Y152-F228 AromaticContact CD1-CZ 3.81Å; Y152-F228 HydrophobicContact CD1-CZ 3.81Å; Y152-F228 AromaticContact CE1-CD1 3.8Å; Y152-F228 HydrophobicContact CE1-CD1 3.8Å; Y152-F228 AromaticContact CE1-CE1 3.92Å; Y152-F228 HydrophobicContact CE1-CE1 3.92Å; Y152-F228 HydrophobicContact CE1-CG 4.32Å; Y152-F228 HydrophobicContact CE1-CZ 4.44Å; Y152-F228 HydrophobicContact CG-CE1 4.29Å |
| 153 | Y | 75.6 | Confident | 78.9 | Confident | 157 Ų | 157 | 85.6 Ų | 85.6 | 62% | 0.616 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -61.3 | -46.2 | 177.5 | -179.6 | -99 | 0 | 0 | 0 | 112 | L149 G155 F156 R157 | L149-Y153 WeakPolarHBondContact O-CB 3.47Å; L149-Y153 PolarHBondContact O-N 2.86Å; Y153-G155 PolarHBondContact O-N 2.8Å; Y153-F156 PolarHBondContact O-N 2.92Å; Y153-R157 WeakPolarHBondContact O-CB 3.43Å; Y153-R157 PolarHBondContact O-N 3.42Å |
| 154 | N | 77.9 | Confident | 79.3 | Confident | 96 Ų | 96 | 89 Ų | 89 | 51% | 0.513 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.4 | -40 | 177.1 | -71.2 | -22.5 | 0 | 0 | 0 | 111.9 | K150 H151 R157 L158 | K150-N154 WeakPolarHBondContact O-CB 3.25Å; K150-N154 VanDerWaalsContact O-CG 3.23Å; K150-N154 PolarHBondContact O-N 3.39Å; K150-N154 PolarHBondContact O-ND2 2.99Å; H151-N154 PolarHBondContact O-N 3.18Å; N154-R157 PolarHBondContact O-N 3.48Å; N154-L158 PolarHBondContact O-N 2.98Å |
| 155 | G | 77.4 | Confident | 79.7 | Confident | 9 Ų | 9 | 87.2 Ų | 87.2 | 9% | 0.093 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.2 | -42 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | H151 Y152 Y153 L158 L159 | H151-G155 PolarHBondContact O-N 3.39Å; Y152-G155 PolarHBondContact O-N 3.37Å; Y153-G155 PolarHBondContact O-N 2.8Å; G155-L158 PolarHBondContact O-N 3.08Å; G155-L159 WeakPolarHBondContact O-CB 3.43Å; G155-L159 PolarHBondContact O-N 2.83Å |
| 156 | F | 79.2 | Confident | 80.1 | Confident | 119 Ų | 119 | 83.3 Ų | 83.3 | 52% | 0.522 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -68.6 | -39.4 | 176.9 | -169.8 | -97.5 | 0 | 0 | 0 | 112.2 | Y152 Y153 L158 L159 G160 M201 | Y152-F156 WeakPolarHBondContact O-CB 3.36Å; Y152-F156 PolarHBondContact O-N 3.06Å; Y153-F156 PolarHBondContact O-N 2.92Å; F156-L158 VanDerWaalsContact C-N 3.34Å; F156-L158 PolarHBondContact O-N 3.11Å; F156-L159 PolarHBondContact O-N 2.56Å; F156-G160 PolarHBondContact O-N 3.48Å; F156-M201 HydrophobicContact CE2-CE 4.3Å |
| 157 | R | 82.3 | Confident | 80.4 | Confident | 164 Ų | 164 | 83.7 Ų | 83.7 | 62% | 0.619 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -60.1 | -44 | 173.8 | -176 | -179.7 | 175.9 | -169.4 | -0.1 | 111.6 | Y153 N154 G160 I161 | Y153-R157 WeakPolarHBondContact O-CB 3.43Å; Y153-R157 PolarHBondContact O-N 3.42Å; N154-R157 PolarHBondContact O-N 3.48Å; R157-G160 PolarHBondContact O-N 3.14Å; R157-I161 WeakPolarHBondContact O-CG1 2.95Å; R157-I161 PolarHBondContact O-N 3.48Å |
| 158 | L | 83.9 | Confident | 81 | Confident | 87 Ų | 87 | 90.2 Ų | 90.2 | 46% | 0.455 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.1 | -44.5 | 177 | -173.1 | 63.3 | 0 | 0 | 0 | 111.4 | N154 G155 F156 G160 I161 D162 T227 | N154-L158 PolarHBondContact O-N 2.98Å; G155-L158 PolarHBondContact O-N 3.08Å; F156-L158 VanDerWaalsContact C-N 3.34Å; F156-L158 PolarHBondContact O-N 3.11Å; L158-G160 VanDerWaalsContact C-N 3.32Å; L158-G160 PolarHBondContact O-N 3.18Å; L158-I161 WeakPolarHBondContact O-CB 3.49Å; L158-I161 PolarHBondContact O-N 3.21Å; L158-D162 PolarHBondContact O-N 3.06Å; L158-T227 HydrophobicContact CD2-CG2 4.1Å |
| 159 | L | 79.8 | Confident | 81.5 | Confident | 8 Ų | 8 | 85.8 Ų | 85.8 | 4% | 0.042 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61.7 | -38.3 | 176.8 | -175.4 | 65.6 | 0 | 0 | 0 | 112.5 | G155 F156 I161 D162 T163 D193 L197 | G155-L159 WeakPolarHBondContact O-CB 3.43Å; G155-L159 PolarHBondContact O-N 2.83Å; F156-L159 PolarHBondContact O-N 2.56Å; L159-I161 VanDerWaalsContact C-N 3.35Å; L159-I161 PolarHBondContact O-N 3.43Å; L159-D162 PolarHBondContact O-N 3.2Å; L159-T163 WeakPolarHBondContact O-CB 3.42Å; L159-T163 PolarHBondContact O-N 2.79Å; L159-T163 PolarHBondContact O-OG1 3.44Å; L159-D193 HydrophobicContact CD1-CB 4.05Å; L159-L197 HydrophobicContact CD2-CD2 3.93Å |
| 160 | G | 81.9 | Confident | 82.2 | Confident | 40 Ų | 40 | 83.3 Ų | 83.3 | 41% | 0.412 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.1 | -41 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | F156 R157 L158 T163 K164 | F156-G160 PolarHBondContact O-N 3.48Å; R157-G160 PolarHBondContact O-N 3.14Å; L158-G160 VanDerWaalsContact C-N 3.32Å; L158-G160 PolarHBondContact O-N 3.18Å; G160-T163 PolarHBondContact O-N 3.34Å; G160-K164 PolarHBondContact O-N 3.41Å; G160-K164 VanDerWaalsContact O-N 3.13Å |
| 161 | I | 85.3 | Confident | 82.7 | Confident | 87 Ų | 87 | 85.2 Ų | 85.2 | 45% | 0.446 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.9 | -48.1 | 174.2 | -65.1 | 167.1 | 0 | 0 | 0 | 110.2 | R157 L158 L159 T163 K164 I165 | R157-I161 WeakPolarHBondContact O-CG1 2.95Å; R157-I161 PolarHBondContact O-N 3.48Å; L158-I161 WeakPolarHBondContact O-CB 3.49Å; L158-I161 PolarHBondContact O-N 3.21Å; L159-I161 VanDerWaalsContact C-N 3.35Å; L159-I161 PolarHBondContact O-N 3.43Å; I161-T163 VanDerWaalsContact C-N 3.32Å; I161-T163 PolarHBondContact O-N 2.74Å; I161-K164 PolarHBondContact O-N 2.92Å; I161-I165 HydrophobicContact CG2-CD1 3.93Å; I161-I165 WeakPolarHBondContact O-CG1 3.32Å; I161-I165 PolarHBondContact O-N 3.41Å; I161-I165 VanDerWaalsContact O-N 3.14Å |
| 162 | D | 85.5 | Confident | 83.2 | Confident | 30 Ų | 30 | 82 Ų | 82 | 16% | 0.16 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -63.6 | -37.1 | 179 | -78.8 | -31.6 | 0 | 0 | 0 | 112.4 | L158 L159 I165 A166 R186 T190 | L158-D162 PolarHBondContact O-N 3.06Å; L159-D162 PolarHBondContact O-N 3.2Å; D162-I165 PolarHBondContact O-N 2.82Å; D162-A166 VanDerWaalsContact O-CB 3.29Å; D162-A166 WeakPolarHBondContact O-CB 3.39Å; D162-A166 PolarHBondContact O-N 2.85Å; D162-R186 IonicContact OD1-CZ 3.61Å; D162-R186 IonicContact OD1-NH1 3.62Å; D162-R186 PolarHBondContact OD1-NH1 2.92Å; D162-T190 HydrophobicContact CB-CG2 4.11Å |
| 163 | T | 85.3 | Confident | 84 | Confident | 56 Ų | 56 | 80.6 Ų | 80.6 | 34% | 0.344 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -64.1 | -41.3 | 177.2 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | L159 G160 I161 A166 G167 | L159-T163 WeakPolarHBondContact O-CB 3.42Å; L159-T163 PolarHBondContact O-N 2.79Å; L159-T163 PolarHBondContact O-OG1 3.44Å; G160-T163 PolarHBondContact O-N 3.34Å; I161-T163 VanDerWaalsContact C-N 3.32Å; I161-T163 PolarHBondContact O-N 2.74Å; T163-A166 PolarHBondContact O-N 3.42Å; T163-G167 PolarHBondContact O-N 3.02Å |
| 164 | K | 87.6 | Confident | 84.7 | Confident | 175 Ų | 175 | 79.2 Ų | 79.2 | 76% | 0.761 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -63.9 | -42.4 | 176 | -175.7 | 176.9 | -179.8 | 176.2 | 0 | 111.9 | G160 I161 R168 | G160-K164 PolarHBondContact O-N 3.41Å; G160-K164 VanDerWaalsContact O-N 3.13Å; I161-K164 PolarHBondContact O-N 2.92Å; K164-R168 PolarHBondContact O-N 2.72Å |
| 165 | I | 85 | Confident | 85.2 | Confident | 62 Ų | 62 | 80.3 Ų | 80.3 | 32% | 0.318 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.8 | -46.9 | 177.2 | -64.6 | 166.2 | 0 | 0 | 0 | 109.9 | I161 D162 G167 R168 T169 | I161-I165 HydrophobicContact CG2-CD1 3.93Å; I161-I165 WeakPolarHBondContact O-CG1 3.32Å; I161-I165 PolarHBondContact O-N 3.41Å; I161-I165 VanDerWaalsContact O-N 3.14Å; D162-I165 PolarHBondContact O-N 2.82Å; I165-G167 VanDerWaalsContact C-N 3.33Å; I165-G167 PolarHBondContact O-N 3.49Å; I165-R168 WeakPolarHBondContact O-CB 3.34Å; I165-R168 PolarHBondContact O-N 3.13Å; I165-R168 VanDerWaalsContact O-N 3.1Å; I165-T169 PolarHBondContact O-N 3.42Å; I165-T169 PolarHBondContact O-OG1 3.14Å; I165-T169 VanDerWaalsContact O-OG1 3.07Å |
| 166 | A | 84.9 | Confident | 85.7 | Confident | 10 Ų | 10 | 82.9 Ų | 82.9 | 8% | 0.083 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -57.3 | -44.4 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | D162 T163 R168 T169 V170 L187 T190 | D162-A166 VanDerWaalsContact O-CB 3.29Å; D162-A166 WeakPolarHBondContact O-CB 3.39Å; D162-A166 PolarHBondContact O-N 2.85Å; T163-A166 PolarHBondContact O-N 3.42Å; A166-R168 VanDerWaalsContact C-N 3.33Å; A166-R168 PolarHBondContact O-N 3.3Å; A166-T169 PolarHBondContact O-N 2.93Å; A166-T169 VanDerWaalsContact O-N 3.17Å; A166-V170 WeakPolarHBondContact O-CG2 3.47Å; A166-V170 PolarHBondContact O-N 2.95Å; A166-L187 HydrophobicContact CB-CD1 4.05Å; A166-T190 HydrophobicContact CB-CG2 3.74Å |
| 167 | G | 86.9 | Confident | 86 | Confident | 43 Ų | 43 | 82.8 Ų | 82.8 | 44% | 0.443 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -58 | -42.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | T163 I165 V170 W171 | T163-G167 PolarHBondContact O-N 3.02Å; I165-G167 VanDerWaalsContact C-N 3.33Å; I165-G167 PolarHBondContact O-N 3.49Å; G167-V170 PolarHBondContact O-N 3.11Å; G167-W171 WeakPolarHBondContact O-CB 3.46Å; G167-W171 PolarHBondContact O-N 2.98Å |
| 168 | R | 87.9 | Confident | 86 | Confident | 204 Ų | 204 | 81.7 Ų | 81.7 | 77% | 0.77 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -65.1 | -41.1 | 174.8 | -175.2 | -178.2 | 175.4 | 106 | -1.3 | 112.1 | K164 I165 A166 W171 S172 | K164-R168 PolarHBondContact O-N 2.72Å; I165-R168 WeakPolarHBondContact O-CB 3.34Å; I165-R168 PolarHBondContact O-N 3.13Å; I165-R168 VanDerWaalsContact O-N 3.1Å; A166-R168 VanDerWaalsContact C-N 3.33Å; A166-R168 PolarHBondContact O-N 3.3Å; R168-W171 WeakPolarHBondContact O-CB 3.01Å; R168-W171 PolarHBondContact O-N 3.18Å; R168-S172 WeakPolarHBondContact O-CB 3.25Å; R168-S172 PolarHBondContact O-N 3.14Å |
| 169 | T | 86.9 | Confident | 85.9 | Confident | 15 Ų | 15 | 78.8 Ų | 78.8 | 9% | 0.092 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -66.8 | -39.8 | 177.5 | -56.5 | 0 | 0 | 0 | 0 | 111.9 | I165 A166 S172 L173 L179 E183 | I165-T169 PolarHBondContact O-N 3.42Å; I165-T169 PolarHBondContact O-OG1 3.14Å; I165-T169 VanDerWaalsContact O-OG1 3.07Å; A166-T169 PolarHBondContact O-N 2.93Å; A166-T169 VanDerWaalsContact O-N 3.17Å; T169-S172 WeakPolarHBondContact O-CB 3.4Å; T169-S172 PolarHBondContact O-N 3.14Å; T169-L173 PolarHBondContact O-N 2.92Å; T169-L179 HydrophobicContact CG2-CD1 3.98Å; T169-L179 HydrophobicContact CG2-CD2 3.38Å; T169-L179 HydrophobicContact CG2-CG 4.33Å; T169-E183 HydrophobicContact CG2-CB 4.1Å |
| 170 | V | 87.9 | Confident | 86.2 | Confident | 57 Ų | 57 | 81.2 Ų | 81.2 | 35% | 0.345 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.6 | -46.8 | 172.4 | 171.8 | 0 | 0 | 0 | 0 | 110.2 | A166 G167 S172 L173 L174 L187 | A166-V170 WeakPolarHBondContact O-CG2 3.47Å; A166-V170 PolarHBondContact O-N 2.95Å; G167-V170 PolarHBondContact O-N 3.11Å; V170-S172 VanDerWaalsContact C-N 3.32Å; V170-S172 PolarHBondContact O-N 3.11Å; V170-L173 WeakPolarHBondContact O-CB 3.17Å; V170-L173 PolarHBondContact O-N 3.42Å; V170-L173 VanDerWaalsContact O-N 3.14Å; V170-L174 HydrophobicContact CG1-CD1 3.64Å; V170-L174 WeakPolarHBondContact O-CD1 3.31Å; V170-L174 PolarHBondContact O-N 2.81Å; V170-L187 HydrophobicContact CG2-CD1 3.43Å; V170-L187 VanDerWaalsContact CG2-CD1 3.43Å |
| 171 | W | 88.6 | Confident | 86.3 | Confident | 166 Ų | 166 | 79.6 Ų | 79.6 | 63% | 0.629 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -56.3 | -47.3 | 176.1 | -174 | -95.6 | 0 | 0 | 0 | 111.5 | G167 R168 L173 L174 H175 | G167-W171 WeakPolarHBondContact O-CB 3.46Å; G167-W171 PolarHBondContact O-N 2.98Å; R168-W171 WeakPolarHBondContact O-CB 3.01Å; R168-W171 PolarHBondContact O-N 3.18Å; W171-L173 VanDerWaalsContact C-N 3.34Å; W171-L173 PolarHBondContact O-N 3.37Å; W171-L174 WeakPolarHBondContact O-CB 3.13Å; W171-L174 PolarHBondContact O-N 3.27Å; W171-H175 AromaticContact CD1-CE1 3.7Å; W171-H175 AromaticContact CD1-ND1 3.75Å; W171-H175 AromaticContact CD2-CE1 3.62Å; W171-H175 AromaticContact CE2-CE1 3.06Å; W171-H175 AromaticContact CE2-ND1 3.87Å; W171-H175 AromaticContact CE2-NE2 3.7Å; W171-H175 AromaticContact CZ2-CE1 3.31Å; W171-H175 WeakPolarHBondContact CZ2-CE1 3.27Å; W171-H175 AromaticContact CZ2-NE2 3.69Å; W171-H175 AromaticContact NE1-CE1 3.11Å; W171-H175 PolarHBondContact NE1-CE1 3.02Å; W171-H175 AromaticContact NE1-ND1 3.61Å; W171-H175 AromaticContact NE1-NE2 3.56Å; W171-H175 PolarHBondContact O-N 2.91Å; W171-H175 VanDerWaalsContact O-N 3.13Å; W171-H175 PolarHBondContact O-ND1 3.36Å |
| 172 | S | 85.8 | Confident | 86.3 | Confident | 22 Ų | 22 | 81.2 Ų | 81.2 | 15% | 0.154 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -58 | -41.6 | 175.2 | 172.2 | 0 | 0 | 0 | 0 | 113 | R168 T169 V170 H175 G176 Q177 | R168-S172 WeakPolarHBondContact O-CB 3.25Å; R168-S172 PolarHBondContact O-N 3.14Å; T169-S172 WeakPolarHBondContact O-CB 3.4Å; T169-S172 PolarHBondContact O-N 3.14Å; V170-S172 VanDerWaalsContact C-N 3.32Å; V170-S172 PolarHBondContact O-N 3.11Å; S172-H175 PolarHBondContact O-N 2.92Å; S172-G176 PolarHBondContact O-N 3.46Å; S172-Q177 WeakPolarHBondContact O-CB 3.43Å; S172-Q177 PolarHBondContact O-N 2.88Å; S172-Q177 VanDerWaalsContact O-N 3.15Å; S172-Q177 WeakPolarHBondContact OG-CB 3.1Å; S172-Q177 VanDerWaalsContact OG-CD 3.31Å; S172-Q177 PolarHBondContact OG-OE1 2.71Å |
| 173 | L | 89 | Confident | 86.3 | Confident | 86 Ų | 86 | 83.4 Ų | 83.4 | 45% | 0.45 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.5 | -40 | 175.1 | -177.2 | 67.1 | 0 | 0 | 0 | 112.2 | T169 V170 W171 H175 G176 L179 | T169-L173 PolarHBondContact O-N 2.92Å; V170-L173 WeakPolarHBondContact O-CB 3.17Å; V170-L173 PolarHBondContact O-N 3.42Å; V170-L173 VanDerWaalsContact O-N 3.14Å; W171-L173 VanDerWaalsContact C-N 3.34Å; W171-L173 PolarHBondContact O-N 3.37Å; L173-H175 PolarHBondContact O-N 2.64Å; L173-G176 PolarHBondContact O-N 3.32Å; L173-L179 HydrophobicContact CB-CD1 4.36Å; L173-L179 HydrophobicContact CD1-CD1 4.17Å; L173-L179 HydrophobicContact CD1-CG 4.13Å; L173-L179 HydrophobicContact CD2-CD1 4.2Å; L173-L179 HydrophobicContact CG-CD1 4.49Å |
| 174 | L | 89.4 | Confident | 86.3 | Confident | 127 Ų | 127 | 85.4 Ų | 85.4 | 67% | 0.665 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -62.8 | -26.7 | 174.5 | -91.7 | 75.9 | 0 | 0 | 0 | 112.3 | V170 W171 G176 | V170-L174 HydrophobicContact CG1-CD1 3.64Å; V170-L174 WeakPolarHBondContact O-CD1 3.31Å; V170-L174 PolarHBondContact O-N 2.81Å; W171-L174 WeakPolarHBondContact O-CB 3.13Å; W171-L174 PolarHBondContact O-N 3.27Å; L174-G176 VanDerWaalsContact C-N 3.25Å; L174-G176 PolarHBondContact O-N 3.46Å |
| 175 | H | 89.2 | Confident | 86.1 | Confident | 119 Ų | 119 | 81.1 Ų | 81.1 | 55% | 0.551 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.1 | 9.1 | 176 | -68.8 | 64.3 | 0 | 0 | 0 | 112.9 | W171 S172 L173 | W171-H175 AromaticContact CD1-CE1 3.7Å; W171-H175 AromaticContact CD1-ND1 3.75Å; W171-H175 AromaticContact CD2-CE1 3.62Å; W171-H175 AromaticContact CE2-CE1 3.06Å; W171-H175 AromaticContact CE2-ND1 3.87Å; W171-H175 AromaticContact CE2-NE2 3.7Å; W171-H175 AromaticContact CZ2-CE1 3.31Å; W171-H175 WeakPolarHBondContact CZ2-CE1 3.27Å; W171-H175 AromaticContact CZ2-NE2 3.69Å; W171-H175 AromaticContact NE1-CE1 3.11Å; W171-H175 PolarHBondContact NE1-CE1 3.02Å; W171-H175 AromaticContact NE1-ND1 3.61Å; W171-H175 AromaticContact NE1-NE2 3.56Å; W171-H175 PolarHBondContact O-N 2.91Å; W171-H175 VanDerWaalsContact O-N 3.13Å; W171-H175 PolarHBondContact O-ND1 3.36Å; S172-H175 PolarHBondContact O-N 2.92Å; L173-H175 PolarHBondContact O-N 2.64Å |
| 176 | G | 86.7 | Confident | 86 | Confident | 63 Ų | 63 | 84 Ų | 84 | 65% | 0.649 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.3 | 13.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115 | S172 L173 L174 | S172-G176 PolarHBondContact O-N 3.46Å; L173-G176 PolarHBondContact O-N 3.32Å; L174-G176 VanDerWaalsContact C-N 3.25Å; L174-G176 PolarHBondContact O-N 3.46Å |
| 177 | Q | 85.9 | Confident | 86.1 | Confident | 117 Ų | 117 | 84 Ų | 84 | 55% | 0.547 | 41% | 0.414 | S | S | . | . | P | Polyproline II helix | trans | -75.7 | 134.6 | 173.9 | -58.9 | -166.7 | -79 | 0 | 0 | 110.7 | S172 L179 | S172-Q177 WeakPolarHBondContact O-CB 3.43Å; S172-Q177 PolarHBondContact O-N 2.88Å; S172-Q177 VanDerWaalsContact O-N 3.15Å; S172-Q177 WeakPolarHBondContact OG-CB 3.1Å; S172-Q177 VanDerWaalsContact OG-CD 3.31Å; S172-Q177 PolarHBondContact OG-OE1 2.71Å; Q177-L179 PolarHBondContact O-N 3.22Å |
| 178 | V | 83 | Confident | 85.9 | Confident | 142 Ų | 142 | 87.3 Ų | 87.3 | 86% | 0.861 | 42% | 0.419 | S | S | * | . | P | Polyproline II helix | trans | -77.5 | 122 | 174.5 | -176.1 | 0 | 0 | 0 | 0 | 108.6 | ||
| 179 | L | 82.4 | Confident | 85.7 | Confident | 26 Ų | 26 | 84.6 Ų | 84.6 | 14% | 0.136 | 41% | 0.409 | C | S | . | . | P | Polyproline II helix | trans | -74.6 | 137.2 | -179.9 | -64.5 | 178.9 | 0 | 0 | 0 | 111.1 | T169 L173 Q177 E183 R184 L187 | T169-L179 HydrophobicContact CG2-CD1 3.98Å; T169-L179 HydrophobicContact CG2-CD2 3.38Å; T169-L179 HydrophobicContact CG2-CG 4.33Å; L173-L179 HydrophobicContact CB-CD1 4.36Å; L173-L179 HydrophobicContact CD1-CD1 4.17Å; L173-L179 HydrophobicContact CD1-CG 4.13Å; L173-L179 HydrophobicContact CD2-CD1 4.2Å; L173-L179 HydrophobicContact CG-CD1 4.49Å; Q177-L179 PolarHBondContact O-N 3.22Å; L179-E183 HydrophobicContact CB-CB 4.38Å; L179-E183 HydrophobicContact CD2-CB 4.26Å; L179-R184 HydrophobicContact CB-CB 4.5Å; L179-L187 HydrophobicContact CD1-CD2 4.26Å |
| 180 | T | 85.5 | Confident | 85.5 | Confident | 59 Ų | 59 | 84.2 Ų | 84.2 | 36% | 0.362 | 41% | 0.407 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 157.3 | 165.9 | 61.8 | 0 | 0 | 0 | 0 | 110.2 | R182 E183 R184 | T180-R182 PolarHBondContact O-N 3.44Å; T180-E183 PolarHBondContact N-OE2 3.01Å; T180-E183 PolarHBondContact O-N 2.79Å; T180-E183 VanDerWaalsContact O-N 3.17Å; T180-E183 WeakPolarHBondContact OG1-CB 3.32Å; T180-E183 WeakPolarHBondContact OG1-CG 3.04Å; T180-E183 PolarHBondContact OG1-N 3.44Å; T180-E183 PolarHBondContact OG1-OE2 3.45Å; T180-R184 PolarHBondContact O-N 3.44Å |
| 181 | R | 83.9 | Confident | 85.3 | Confident | 6 Ų | 6 | 83.6 Ų | 83.6 | 2% | 0.023 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -55.7 | -36.5 | 176.7 | -175.8 | 175.5 | 174.1 | -132.5 | 12.3 | 112.1 | R185 D348 M351 E355 M360 | R181-R185 WeakPolarHBondContact O-CG 3.44Å; R181-R185 PolarHBondContact O-N 2.99Å; R181-R185 VanDerWaalsContact O-N 3.12Å; R181-D348 IonicContact CZ-OD1 3.63Å; R181-D348 IonicContact CZ-OD2 3.76Å; R181-D348 IonicContact NE-OD1 2.79Å; R181-D348 PolarHBondContact NE-OD1 3.45Å; R181-D348 IonicContact NE-OD2 3.62Å; R181-D348 IonicContact NH2-OD1 2.95Å; R181-D348 IonicContact NH2-OD2 3.46Å; R181-D348 PolarHBondContact NH2-OD2 3.39Å; R181-M351 HydrophobicContact CB-CB 4.32Å; R181-M351 HydrophobicContact CB-SD 4.41Å; R181-M351 HydrophobicContact CG-CB 4.49Å; R181-M351 HydrophobicContact CG-CE 4.14Å; R181-E355 VanDerWaalsContact CB-OE1 3.24Å; R181-E355 WeakPolarHBondContact CB-OE1 3.39Å; R181-E355 WeakPolarHBondContact CB-OE2 3.26Å; R181-E355 PolarHBondContact N-OE1 3.25Å; R181-M360 PolarHBondContact NH1-SD 3.46Å |
| 182 | R | 84.8 | Confident | 85 | Confident | 120 Ų | 120 | 77.7 Ų | 77.7 | 45% | 0.453 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -66.6 | -47.5 | 177.8 | -70.1 | -179.4 | 173.8 | 151 | 8.1 | 111.8 | T180 R185 R186 V359 E364 | T180-R182 PolarHBondContact O-N 3.44Å; R182-R185 PolarHBondContact O-N 3.45Å; R182-R186 WeakPolarHBondContact O-CB 3.23Å; R182-R186 PolarHBondContact O-N 3.1Å; R182-V359 PolarHBondContact NH2-O 3.1Å; R182-E364 WeakPolarHBondContact CG-OE1 3.47Å; R182-E364 IonicContact CZ-OE1 3.49Å; R182-E364 IonicContact CZ-OE2 2.62Å; R182-E364 IonicContact NE-OE1 3.19Å; R182-E364 PolarHBondContact NE-OE1 3.37Å; R182-E364 IonicContact NE-OE2 3.11Å; R182-E364 PolarHBondContact NE-OE2 3.4Å; R182-E364 IonicContact NH2-OE1 2.8Å; R182-E364 IonicContact NH2-OE2 2.78Å; R182-E364 PolarHBondContact NH2-OE2 3.2Å |
| 183 | E | 85.9 | Confident | 84.8 | Confident | 77 Ų | 77 | 77 Ų | 77 | 36% | 0.36 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.6 | -44.7 | 178.3 | -71.9 | 164.1 | 154.7 | 0 | 0 | 111.4 | T169 L179 T180 R185 R186 L187 | T169-E183 HydrophobicContact CG2-CB 4.1Å; L179-E183 HydrophobicContact CB-CB 4.38Å; L179-E183 HydrophobicContact CD2-CB 4.26Å; T180-E183 PolarHBondContact N-OE2 3.01Å; T180-E183 PolarHBondContact O-N 2.79Å; T180-E183 VanDerWaalsContact O-N 3.17Å; T180-E183 WeakPolarHBondContact OG1-CB 3.32Å; T180-E183 WeakPolarHBondContact OG1-CG 3.04Å; T180-E183 PolarHBondContact OG1-N 3.44Å; T180-E183 PolarHBondContact OG1-OE2 3.45Å; E183-R185 VanDerWaalsContact C-N 3.33Å; E183-R185 PolarHBondContact O-N 3.33Å; E183-R186 PolarHBondContact O-N 3.28Å; E183-L187 VanDerWaalsContact O-CB 3.28Å; E183-L187 WeakPolarHBondContact O-CB 3.38Å; E183-L187 PolarHBondContact O-N 3.32Å |
| 184 | R | 84.4 | Confident | 84.4 | Confident | 97 Ų | 97 | 76.7 Ų | 76.7 | 37% | 0.366 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -58.6 | -44.1 | 176.8 | -173.5 | -178.1 | -176.5 | -154.9 | -0.4 | 111.9 | L179 T180 M188 S347 | L179-R184 HydrophobicContact CB-CB 4.5Å; T180-R184 PolarHBondContact O-N 3.44Å; R184-M188 WeakPolarHBondContact O-CB 3.32Å; R184-M188 VanDerWaalsContact O-CG 3.23Å; R184-M188 WeakPolarHBondContact O-CG 3.27Å; R184-M188 PolarHBondContact O-N 3.11Å; R184-S347 PolarHBondContact NH1-OG 3.41Å; R184-S347 VanDerWaalsContact NH1-OG 3.16Å |
| 185 | R | 83.2 | Confident | 84.1 | Confident | 86 Ų | 86 | 78.1 Ų | 78.1 | 33% | 0.325 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.9 | -43.9 | 177.6 | -77.4 | 177.3 | -169.3 | -153.1 | -9.3 | 112.5 | R181 R182 E183 L187 M188 R189 D348 | R181-R185 WeakPolarHBondContact O-CG 3.44Å; R181-R185 PolarHBondContact O-N 2.99Å; R181-R185 VanDerWaalsContact O-N 3.12Å; R182-R185 PolarHBondContact O-N 3.45Å; E183-R185 VanDerWaalsContact C-N 3.33Å; E183-R185 PolarHBondContact O-N 3.33Å; R185-L187 VanDerWaalsContact C-N 3.33Å; R185-M188 PolarHBondContact O-N 2.86Å; R185-R189 WeakPolarHBondContact O-CB 3.38Å; R185-R189 PolarHBondContact O-N 2.9Å; R185-D348 IonicContact CZ-OD1 2.77Å; R185-D348 IonicContact NE-OD1 3.02Å; R185-D348 IonicContact NH2-OD1 3.48Å; R185-D348 PolarHBondContact NH2-OD1 3.26Å; R185-D348 IonicContact NH2-OD2 2.9Å; R185-D348 PolarHBondContact NH2-OD2 3.11Å; R185-D348 VanDerWaalsContact NH2-OD2 3.11Å |
| 186 | R | 84.1 | Confident | 83.5 | Confident | 122 Ų | 122 | 76.3 Ų | 76.3 | 46% | 0.46 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59.7 | -48.2 | 176.7 | -175.6 | -178 | -85.3 | -121.8 | 11.3 | 109.7 | D162 R182 E183 M188 R189 T190 | D162-R186 IonicContact OD1-CZ 3.61Å; D162-R186 IonicContact OD1-NH1 3.62Å; D162-R186 PolarHBondContact OD1-NH1 2.92Å; R182-R186 WeakPolarHBondContact O-CB 3.23Å; R182-R186 PolarHBondContact O-N 3.1Å; E183-R186 PolarHBondContact O-N 3.28Å; R186-M188 PolarHBondContact O-N 3.44Å; R186-R189 PolarHBondContact O-N 3.47Å; R186-T190 PolarHBondContact O-N 3.44Å; R186-T190 PolarHBondContact O-OG1 2.84Å |
| 187 | L | 85.9 | Confident | 83.1 | Confident | 11 Ų | 11 | 74.6 Ų | 74.6 | 6% | 0.058 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -54.8 | -53.8 | 175.7 | -178.4 | 77.1 | 0 | 0 | 0 | 111.8 | A166 V170 L179 E183 R185 R189 T190 C191 | A166-L187 HydrophobicContact CB-CD1 4.05Å; V170-L187 HydrophobicContact CG2-CD1 3.43Å; V170-L187 VanDerWaalsContact CG2-CD1 3.43Å; L179-L187 HydrophobicContact CD1-CD2 4.26Å; E183-L187 VanDerWaalsContact O-CB 3.28Å; E183-L187 WeakPolarHBondContact O-CB 3.38Å; E183-L187 PolarHBondContact O-N 3.32Å; R185-L187 VanDerWaalsContact C-N 3.33Å; L187-R189 VanDerWaalsContact C-N 3.28Å; L187-R189 PolarHBondContact O-N 2.76Å; L187-T190 PolarHBondContact O-N 3.19Å; L187-C191 WeakPolarHBondContact O-CB 3.37Å; L187-C191 PolarHBondContact O-N 2.79Å; L187-C191 PolarHBondContact O-SG 3.27Å |
| 188 | M | 84.1 | Confident | 82.9 | Confident | 112 Ų | 112 | 72.7 Ų | 72.7 | 55% | 0.552 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -62.3 | -36.2 | -178.4 | -70.4 | -68.3 | 145.8 | 0 | 0 | 112.3 | R184 R185 R186 A192 | R184-M188 WeakPolarHBondContact O-CB 3.32Å; R184-M188 VanDerWaalsContact O-CG 3.23Å; R184-M188 WeakPolarHBondContact O-CG 3.27Å; R184-M188 PolarHBondContact O-N 3.11Å; R185-M188 PolarHBondContact O-N 2.86Å; R186-M188 PolarHBondContact O-N 3.44Å; M188-A192 WeakPolarHBondContact O-CB 3.45Å; M188-A192 PolarHBondContact O-N 2.86Å |
| 189 | R | 83.6 | Confident | 82.6 | Confident | 146 Ų | 146 | 67.7 Ų | 67.7 | 55% | 0.551 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -64.9 | -49.8 | 174.3 | -170.5 | -177.8 | -159.1 | 104.7 | 4.9 | 111.3 | R185 R186 L187 C191 A192 D193 S226 | R185-R189 WeakPolarHBondContact O-CB 3.38Å; R185-R189 PolarHBondContact O-N 2.9Å; R186-R189 PolarHBondContact O-N 3.47Å; L187-R189 VanDerWaalsContact C-N 3.28Å; L187-R189 PolarHBondContact O-N 2.76Å; R189-C191 PolarHBondContact O-N 3.39Å; R189-A192 PolarHBondContact O-N 3.38Å; R189-D193 WeakPolarHBondContact O-CB 3.33Å; R189-D193 PolarHBondContact O-N 3.16Å; R189-S226 PolarHBondContact NE-OG 2.91Å; R189-S226 PolarHBondContact NH2-OG 3.43Å |
| 190 | T | 83.3 | Confident | 82.3 | Confident | 8 Ų | 8 | 68 Ų | 68 | 5% | 0.049 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 179.4 | -53.1 | 0 | 0 | 0 | 0 | 111.6 | D162 A166 R186 L187 D193 L194 | D162-T190 HydrophobicContact CB-CG2 4.11Å; A166-T190 HydrophobicContact CB-CG2 3.74Å; R186-T190 PolarHBondContact O-N 3.44Å; R186-T190 PolarHBondContact O-OG1 2.84Å; L187-T190 PolarHBondContact O-N 3.19Å; T190-D193 PolarHBondContact O-N 2.91Å; T190-L194 WeakPolarHBondContact O-CB 3.2Å; T190-L194 PolarHBondContact O-N 3.4Å |
| 191 | C | 83.1 | Confident | 82.1 | Confident | 44 Ų | 44 | 68.7 Ų | 68.7 | 30% | 0.297 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.3 | -46.1 | 173.8 | -71.1 | 0 | 0 | 0 | 0 | 111.2 | L187 R189 D193 L194 F195 | L187-C191 WeakPolarHBondContact O-CB 3.37Å; L187-C191 PolarHBondContact O-N 2.79Å; L187-C191 PolarHBondContact O-SG 3.27Å; R189-C191 PolarHBondContact O-N 3.39Å; C191-D193 PolarHBondContact O-N 3.38Å; C191-L194 PolarHBondContact O-N 2.9Å; C191-F195 WeakPolarHBondContact O-CD2 3.48Å; C191-F195 PolarHBondContact O-N 3.17Å |
| 192 | A | 81.4 | Confident | 82.1 | Confident | 41 Ų | 41 | 71.9 Ų | 71.9 | 34% | 0.339 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | M188 R189 L194 F195 R196 | M188-A192 WeakPolarHBondContact O-CB 3.45Å; M188-A192 PolarHBondContact O-N 2.86Å; R189-A192 PolarHBondContact O-N 3.38Å; A192-L194 VanDerWaalsContact C-N 3.33Å; A192-F195 PolarHBondContact O-N 3.37Å; A192-R196 WeakPolarHBondContact O-CB 3.12Å; A192-R196 VanDerWaalsContact O-CG 3.27Å; A192-R196 WeakPolarHBondContact O-CG 3.24Å; A192-R196 PolarHBondContact O-N 2.78Å |
| 193 | D | 81.9 | Confident | 81.8 | Confident | 7 Ų | 7 | 67.2 Ų | 67.2 | 4% | 0.037 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -65.9 | -34.7 | 176.4 | -73.3 | -23.7 | 0 | 0 | 0 | 111.7 | L159 R189 T190 C191 R196 L197 P225 S226 | L159-D193 HydrophobicContact CD1-CB 4.05Å; R189-D193 WeakPolarHBondContact O-CB 3.33Å; R189-D193 PolarHBondContact O-N 3.16Å; T190-D193 PolarHBondContact O-N 2.91Å; C191-D193 PolarHBondContact O-N 3.38Å; D193-R196 WeakPolarHBondContact O-CB 3.4Å; D193-L197 PolarHBondContact O-N 3.06Å; D193-L197 VanDerWaalsContact O-N 3.1Å; D193-P225 HydrophobicContact CB-CB 4.44Å; D193-S226 WeakPolarHBondContact OD1-CB 3.47Å; D193-S226 PolarHBondContact OD1-N 2.96Å; D193-S226 PolarHBondContact OD1-OG 3.41Å; D193-S226 PolarHBondContact OD2-OG 3.12Å |
| 194 | L | 81 | Confident | 81.5 | Confident | 81 Ų | 81 | 68.7 Ų | 68.7 | 42% | 0.424 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -69.8 | -46.3 | 174 | -177.2 | 63.9 | 0 | 0 | 0 | 112 | T190 C191 A192 R196 L197 V198 | T190-L194 WeakPolarHBondContact O-CB 3.2Å; T190-L194 PolarHBondContact O-N 3.4Å; C191-L194 PolarHBondContact O-N 2.9Å; A192-L194 VanDerWaalsContact C-N 3.33Å; L194-R196 PolarHBondContact O-N 2.82Å; L194-L197 WeakPolarHBondContact O-CA 3.33Å; L194-L197 WeakPolarHBondContact O-CB 2.91Å; L194-L197 PolarHBondContact O-N 2.62Å; L194-V198 WeakPolarHBondContact O-CG2 3.36Å; L194-V198 PolarHBondContact O-N 2.8Å |
| 195 | F | 82.2 | Confident | 81.4 | Confident | 157 Ų | 157 | 70.5 Ų | 70.5 | 69% | 0.689 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -59.5 | -37.4 | 174.9 | -87.5 | -69 | 0 | 0 | 0 | 111.8 | C191 A192 L197 V198 P199 | C191-F195 WeakPolarHBondContact O-CD2 3.48Å; C191-F195 PolarHBondContact O-N 3.17Å; A192-F195 PolarHBondContact O-N 3.37Å; F195-L197 VanDerWaalsContact C-N 3.29Å; F195-L197 PolarHBondContact O-N 2.96Å; F195-V198 PolarHBondContact O-N 3.45Å; F195-P199 WeakPolarHBondContact O-CD 3.38Å |
| 196 | R | 77.3 | Confident | 81.4 | Confident | 80 Ų | 80 | 69.2 Ų | 69.2 | 30% | 0.302 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.1 | -32.6 | 172.1 | -79.4 | 177.1 | -168.4 | -169.1 | 4 | 112.7 | A192 D193 L194 P199 F200 E222 M223 L224 | A192-R196 WeakPolarHBondContact O-CB 3.12Å; A192-R196 VanDerWaalsContact O-CG 3.27Å; A192-R196 WeakPolarHBondContact O-CG 3.24Å; A192-R196 PolarHBondContact O-N 2.78Å; D193-R196 WeakPolarHBondContact O-CB 3.4Å; L194-R196 PolarHBondContact O-N 2.82Å; R196-P199 WeakPolarHBondContact O-CD 3.41Å; R196-F200 WeakPolarHBondContact O-CD2 3.38Å; R196-F200 WeakPolarHBondContact O-CE2 3.5Å; R196-E222 PolarHBondContact NH1-O 3.19Å; R196-M223 VanDerWaalsContact CB-O 3.3Å; R196-M223 WeakPolarHBondContact CB-O 3.37Å; R196-L224 PolarHBondContact NH1-O 3.11Å |
| 197 | L | 78.1 | Confident | 81.2 | Confident | 28 Ų | 28 | 68.2 Ų | 68.2 | 15% | 0.147 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -76.5 | -29.4 | 178.1 | -167.4 | 69.5 | 0 | 0 | 0 | 113.4 | L159 D193 L194 F195 F200 M201 | L159-L197 HydrophobicContact CD2-CD2 3.93Å; D193-L197 PolarHBondContact O-N 3.06Å; D193-L197 VanDerWaalsContact O-N 3.1Å; L194-L197 WeakPolarHBondContact O-CA 3.33Å; L194-L197 WeakPolarHBondContact O-CB 2.91Å; L194-L197 PolarHBondContact O-N 2.62Å; F195-L197 VanDerWaalsContact C-N 3.29Å; F195-L197 PolarHBondContact O-N 2.96Å; L197-F200 HydrophobicContact CD1-CB 4.42Å; L197-F200 WeakPolarHBondContact O-CA 3.47Å; L197-F200 WeakPolarHBondContact O-CB 3.34Å; L197-F200 PolarHBondContact O-N 2.98Å; L197-M201 HydrophobicContact CD1-CE 4.27Å; L197-M201 HydrophobicContact CD2-CE 3.66Å; L197-M201 HydrophobicContact CG-CE 3.96Å; L197-M201 HydrophobicContact CG-CG 4.22Å; L197-M201 PolarHBondContact O-N 3.21Å |
| 198 | V | 83 | Confident | 80.8 | Confident | 76 Ų | 76 | 76.8 Ų | 76.8 | 46% | 0.461 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -52.8 | -48.5 | -176.4 | 169.1 | 0 | 0 | 0 | 0 | 112.7 | L194 F195 F200 M201 V202 | L194-V198 WeakPolarHBondContact O-CG2 3.36Å; L194-V198 PolarHBondContact O-N 2.8Å; F195-V198 PolarHBondContact O-N 3.45Å; V198-F200 VanDerWaalsContact C-N 3.33Å; V198-F200 PolarHBondContact O-N 2.89Å; V198-M201 PolarHBondContact O-N 3.46Å; V198-V202 PolarHBondContact O-N 3.03Å |
| 199 | P | 76.5 | Confident | 80.5 | Confident | 37 Ų | 37 | 74.1 Ų | 74.1 | 24% | 0.24 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -56.1 | -45.2 | 174.2 | -25.3 | 33.1 | 0 | 0 | 0 | 112.7 | F195 R196 M201 V202 F203 F216 | F195-P199 WeakPolarHBondContact O-CD 3.38Å; R196-P199 WeakPolarHBondContact O-CD 3.41Å; P199-M201 VanDerWaalsContact C-N 3.31Å; P199-M201 PolarHBondContact O-N 2.89Å; P199-V202 WeakPolarHBondContact O-CB 3.39Å; P199-V202 PolarHBondContact O-N 3.28Å; P199-V202 VanDerWaalsContact O-N 3.15Å; P199-F203 HydrophobicContact CB-CE2 4.33Å; P199-F203 WeakPolarHBondContact O-CD2 3.19Å; P199-F203 PolarHBondContact O-N 2.82Å; P199-F203 VanDerWaalsContact O-N 3.15Å; P199-F216 HydrophobicContact CB-CE1 4.19Å; P199-F216 HydrophobicContact CB-CZ 3.75Å; P199-F216 HydrophobicContact CG-CZ 4.47Å |
| 200 | F | 75.8 | Confident | 80.4 | Confident | 32 Ų | 32 | 73 Ų | 73 | 14% | 0.14 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.2 | -35.6 | 179 | -61.1 | -77.5 | 0 | 0 | 0 | 112.9 | R196 L197 V198 V202 F203 I204 L213 F216 L217 L224 | R196-F200 WeakPolarHBondContact O-CD2 3.38Å; R196-F200 WeakPolarHBondContact O-CE2 3.5Å; L197-F200 HydrophobicContact CD1-CB 4.42Å; L197-F200 WeakPolarHBondContact O-CA 3.47Å; L197-F200 WeakPolarHBondContact O-CB 3.34Å; L197-F200 PolarHBondContact O-N 2.98Å; V198-F200 VanDerWaalsContact C-N 3.33Å; V198-F200 PolarHBondContact O-N 2.89Å; F200-V202 VanDerWaalsContact C-N 3.34Å; F200-F203 PolarHBondContact O-N 2.85Å; F200-I204 WeakPolarHBondContact O-CG1 3.46Å; F200-I204 PolarHBondContact O-N 3.48Å; F200-L213 HydrophobicContact CD1-CD2 3.95Å; F200-L213 HydrophobicContact CE1-CD2 4.33Å; F200-F216 HydrophobicContact CE1-CD1 4.36Å; F200-F216 HydrophobicContact CE1-CE1 4.29Å; F200-F216 HydrophobicContact CZ-CE1 4.26Å; F200-L217 HydrophobicContact CE1-CD2 3.96Å; F200-L217 HydrophobicContact CZ-CD2 4.16Å; F200-L224 HydrophobicContact CZ-CD2 4.1Å |
| 201 | M | 81 | Confident | 80.4 | Confident | 75 Ų | 75 | 80.9 Ų | 80.9 | 37% | 0.369 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.5 | -38 | 175.3 | -73.1 | -64.8 | 165.8 | 0 | 0 | 112.3 | F156 L197 V198 P199 F203 I204 I205 | F156-M201 HydrophobicContact CE2-CE 4.3Å; L197-M201 HydrophobicContact CD1-CE 4.27Å; L197-M201 HydrophobicContact CD2-CE 3.66Å; L197-M201 HydrophobicContact CG-CE 3.96Å; L197-M201 HydrophobicContact CG-CG 4.22Å; L197-M201 PolarHBondContact O-N 3.21Å; V198-M201 PolarHBondContact O-N 3.46Å; P199-M201 VanDerWaalsContact C-N 3.31Å; P199-M201 PolarHBondContact O-N 2.89Å; M201-F203 VanDerWaalsContact C-N 3.32Å; M201-F203 PolarHBondContact O-N 3.49Å; M201-I204 PolarHBondContact O-N 3.44Å; M201-I204 HydrophobicContact SD-CD1 4.44Å; M201-I205 WeakPolarHBondContact O-CG1 3.48Å; M201-I205 PolarHBondContact O-N 2.98Å; M201-I205 VanDerWaalsContact O-N 3.16Å |
| 202 | V | 83.2 | Confident | 80.1 | Confident | 72 Ų | 72 | 83.1 Ų | 83.1 | 44% | 0.436 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.2 | -37.8 | 175.2 | 178.9 | 0 | 0 | 0 | 0 | 111.1 | V198 P199 F200 I204 I205 V206 M209 | V198-V202 PolarHBondContact O-N 3.03Å; P199-V202 WeakPolarHBondContact O-CB 3.39Å; P199-V202 PolarHBondContact O-N 3.28Å; P199-V202 VanDerWaalsContact O-N 3.15Å; F200-V202 VanDerWaalsContact C-N 3.34Å; V202-I204 VanDerWaalsContact C-N 3.28Å; V202-I204 PolarHBondContact O-N 2.89Å; V202-I205 PolarHBondContact O-N 2.93Å; V202-V206 HydrophobicContact CG1-CG2 4.35Å; V202-V206 PolarHBondContact O-N 3.46Å; V202-V206 VanDerWaalsContact O-N 3.16Å; V202-M209 HydrophobicContact CG1-CE 4.07Å |
| 203 | F | 80.1 | Confident | 79.9 | Confident | 22 Ų | 22 | 83.2 Ų | 83.2 | 10% | 0.096 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -63.2 | -30.2 | 176 | -74 | -73.8 | 0 | 0 | 0 | 113.5 | P199 F200 M201 M209 L212 L213 F216 | P199-F203 HydrophobicContact CB-CE2 4.33Å; P199-F203 WeakPolarHBondContact O-CD2 3.19Å; P199-F203 PolarHBondContact O-N 2.82Å; P199-F203 VanDerWaalsContact O-N 3.15Å; F200-F203 PolarHBondContact O-N 2.85Å; M201-F203 VanDerWaalsContact C-N 3.32Å; M201-F203 PolarHBondContact O-N 3.49Å; F203-M209 HydrophobicContact CD1-CB 3.88Å; F203-M209 HydrophobicContact CD1-CG 3.17Å; F203-M209 VanDerWaalsContact CD1-O 3.32Å; F203-M209 WeakPolarHBondContact CD1-O 3.34Å; F203-M209 HydrophobicContact CE1-CG 3.48Å; F203-M209 VanDerWaalsContact CE1-CG 3.48Å; F203-M209 HydrophobicContact CG-CG 4.2Å; F203-L212 HydrophobicContact CE1-CB 3.99Å; F203-L213 HydrophobicContact CB-CD2 3.88Å; F203-L213 HydrophobicContact CB-CG 4.27Å; F203-L213 HydrophobicContact CD1-CD2 4.18Å; F203-L213 HydrophobicContact CD1-CG 4.39Å; F203-L213 HydrophobicContact CD2-CD2 3.78Å; F203-L213 HydrophobicContact CE2-CD2 4.44Å; F203-L213 HydrophobicContact CG-CD2 3.69Å; F203-L213 HydrophobicContact CG-CG 4.27Å; F203-F216 AromaticContact CE2-CD1 3.92Å; F203-F216 HydrophobicContact CE2-CD1 3.92Å; F203-F216 HydrophobicContact CE2-CD2 4.06Å; F203-F216 AromaticContact CE2-CE1 3.84Å; F203-F216 HydrophobicContact CE2-CE1 3.84Å; F203-F216 AromaticContact CE2-CE2 3.99Å; F203-F216 HydrophobicContact CE2-CE2 3.99Å; F203-F216 AromaticContact CE2-CG 4Å; F203-F216 HydrophobicContact CE2-CG 4Å; F203-F216 AromaticContact CE2-CZ 3.83Å; F203-F216 HydrophobicContact CE2-CZ 3.83Å; F203-F216 HydrophobicContact CZ-CB 4.33Å; F203-F216 HydrophobicContact CZ-CD1 4.32Å; F203-F216 AromaticContact CZ-CD2 3.82Å; F203-F216 HydrophobicContact CZ-CD2 3.82Å; F203-F216 HydrophobicContact CZ-CE2 4.07Å; F203-F216 AromaticContact CZ-CG 3.92Å; F203-F216 HydrophobicContact CZ-CG 3.92Å; F203-F216 HydrophobicContact CZ-CZ 4.38Å |
| 204 | I | 78.8 | Confident | 79.4 | Confident | 109 Ų | 109 | 87.1 Ų | 87.1 | 56% | 0.559 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -80.6 | -36.8 | 178.6 | -64.5 | 165.4 | 0 | 0 | 0 | 111.5 | F200 M201 V202 | F200-I204 WeakPolarHBondContact O-CG1 3.46Å; F200-I204 PolarHBondContact O-N 3.48Å; M201-I204 PolarHBondContact O-N 3.44Å; M201-I204 HydrophobicContact SD-CD1 4.44Å; V202-I204 VanDerWaalsContact C-N 3.28Å; V202-I204 PolarHBondContact O-N 2.89Å |
| 205 | I | 82.3 | Confident | 79.2 | Confident | 135 Ų | 135 | 87.2 Ų | 87.2 | 69% | 0.692 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -74.8 | -34 | -176.9 | -66.2 | 165.3 | 0 | 0 | 0 | 111.6 | M201 V202 P207 | M201-I205 WeakPolarHBondContact O-CG1 3.48Å; M201-I205 PolarHBondContact O-N 2.98Å; M201-I205 VanDerWaalsContact O-N 3.16Å; V202-I205 PolarHBondContact O-N 2.93Å; I205-P207 WeakPolarHBondContact O-CD 3.16Å |
| 206 | V | 83.9 | Confident | 78.8 | Confident | 58 Ų | 58 | 81.4 Ų | 81.4 | 35% | 0.352 | 42% | 0.421 | S | S | . | . | S | Bend | trans | -91.7 | 113.7 | -179 | -179.1 | 0 | 0 | 0 | 0 | 109.9 | V202 M209 | V202-V206 HydrophobicContact CG1-CG2 4.35Å; V202-V206 PolarHBondContact O-N 3.46Å; V202-V206 VanDerWaalsContact O-N 3.16Å; V206-M209 HydrophobicContact CB-CB 4.05Å; V206-M209 HydrophobicContact CB-CE 3.62Å; V206-M209 HydrophobicContact CG1-CB 4.15Å; V206-M209 HydrophobicContact CG1-CE 3.71Å; V206-M209 HydrophobicContact CG1-SD 4.24Å; V206-M209 HydrophobicContact CG2-CE 3.67Å; V206-M209 WeakPolarHBondContact O-CB 3.38Å; V206-M209 PolarHBondContact O-N 3.16Å |
| 207 | P | 78.9 | Confident | 78.7 | Confident | 101 Ų | 101 | 81 Ų | 81 | 66% | 0.656 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | 144.5 | 178.8 | 25.7 | -33.2 | 0 | 0 | 0 | 110.8 | I205 M209 | I205-P207 WeakPolarHBondContact O-CD 3.16Å; P207-M209 PolarHBondContact O-N 2.87Å |
| 208 | F | 76.8 | Confident | 78.5 | Confident | 192 Ų | 192 | 88.5 Ų | 88.5 | 84% | 0.842 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.2 | -7.9 | -175.4 | -55.5 | -84.1 | 0 | 0 | 0 | 117.1 | E210 F211 | F208-E210 PolarHBondContact O-N 2.92Å; F208-F211 PolarHBondContact O-N 3.5Å |
| 209 | M | 79.2 | Confident | 78.1 | Confident | 56 Ų | 56 | 90.5 Ų | 90.5 | 28% | 0.276 | 46% | 0.463 | S | S | . | . | G | 310 helix | trans | -70.8 | -20.4 | 175.6 | -153.3 | 105.3 | 87.1 | 0 | 0 | 112.2 | V202 F203 V206 P207 F211 L212 | V202-M209 HydrophobicContact CG1-CE 4.07Å; F203-M209 HydrophobicContact CD1-CB 3.88Å; F203-M209 HydrophobicContact CD1-CG 3.17Å; F203-M209 VanDerWaalsContact CD1-O 3.32Å; F203-M209 WeakPolarHBondContact CD1-O 3.34Å; F203-M209 HydrophobicContact CE1-CG 3.48Å; F203-M209 VanDerWaalsContact CE1-CG 3.48Å; F203-M209 HydrophobicContact CG-CG 4.2Å; V206-M209 HydrophobicContact CB-CB 4.05Å; V206-M209 HydrophobicContact CB-CE 3.62Å; V206-M209 HydrophobicContact CG1-CB 4.15Å; V206-M209 HydrophobicContact CG1-CE 3.71Å; V206-M209 HydrophobicContact CG1-SD 4.24Å; V206-M209 HydrophobicContact CG2-CE 3.67Å; V206-M209 WeakPolarHBondContact O-CB 3.38Å; V206-M209 PolarHBondContact O-N 3.16Å; P207-M209 PolarHBondContact O-N 2.87Å; M209-F211 PolarHBondContact O-N 2.94Å; M209-L212 WeakPolarHBondContact O-CB 3.27Å; M209-L212 PolarHBondContact O-N 2.86Å |
| 210 | E | 81.4 | Confident | 77.7 | Confident | 122 Ų | 122 | 93.7 Ų | 93.7 | 57% | 0.57 | 47% | 0.473 | S | S | * | . | G | 310 helix | trans | -55.3 | -31.2 | 175.1 | -62.3 | -178.8 | 177.2 | 0 | 0 | 113.4 | F208 L212 L213 | F208-E210 PolarHBondContact O-N 2.92Å; E210-L212 PolarHBondContact O-N 3.29Å; E210-L213 HydrophobicContact CB-CD1 4.37Å; E210-L213 VanDerWaalsContact O-CB 3.28Å; E210-L213 WeakPolarHBondContact O-CB 3.33Å; E210-L213 PolarHBondContact O-N 3.49Å |
| 211 | F | 82.2 | Confident | 77.1 | Confident | 174 Ų | 174 | 96.5 Ų | 96.5 | 76% | 0.763 | 50% | 0.495 | S | S | * | . | G | 310 helix | trans | -64.9 | -21.4 | 176.8 | -173 | -101.3 | 0 | 0 | 0 | 112.7 | F208 M209 P214 | F208-F211 PolarHBondContact O-N 3.5Å; M209-F211 PolarHBondContact O-N 2.94Å; F211-P214 WeakPolarHBondContact O-CD 3.43Å |
| 212 | L | 77.3 | Confident | 76.3 | Confident | 90 Ų | 90 | 97.2 Ų | 97.2 | 47% | 0.471 | 50% | 0.497 | S | S | . | . | G | 310 helix | trans | -84.5 | -13.1 | 175 | -76.9 | 77.5 | 0 | 0 | 0 | 112.4 | F203 M209 E210 V215 F216 | F203-L212 HydrophobicContact CE1-CB 3.99Å; M209-L212 WeakPolarHBondContact O-CB 3.27Å; M209-L212 PolarHBondContact O-N 2.86Å; E210-L212 PolarHBondContact O-N 3.29Å; L212-V215 PolarHBondContact O-N 3.33Å; L212-V215 VanDerWaalsContact O-N 3.15Å; L212-F216 VanDerWaalsContact O-CB 3.24Å; L212-F216 WeakPolarHBondContact O-CB 3.28Å; L212-F216 PolarHBondContact O-N 3.1Å |
| 213 | L | 76.8 | Confident | 75.3 | Confident | 43 Ų | 43 | 96 Ų | 96 | 23% | 0.225 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -56.8 | -44.7 | 179.1 | -72.9 | 171.5 | 0 | 0 | 0 | 113.3 | F200 F203 E210 V215 F216 L217 | F200-L213 HydrophobicContact CD1-CD2 3.95Å; F200-L213 HydrophobicContact CE1-CD2 4.33Å; F203-L213 HydrophobicContact CB-CD2 3.88Å; F203-L213 HydrophobicContact CB-CG 4.27Å; F203-L213 HydrophobicContact CD1-CD2 4.18Å; F203-L213 HydrophobicContact CD1-CG 4.39Å; F203-L213 HydrophobicContact CD2-CD2 3.78Å; F203-L213 HydrophobicContact CE2-CD2 4.44Å; F203-L213 HydrophobicContact CG-CD2 3.69Å; F203-L213 HydrophobicContact CG-CG 4.27Å; E210-L213 HydrophobicContact CB-CD1 4.37Å; E210-L213 VanDerWaalsContact O-CB 3.28Å; E210-L213 WeakPolarHBondContact O-CB 3.33Å; E210-L213 PolarHBondContact O-N 3.49Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 3.13Å; L213-F216 PolarHBondContact O-N 2.86Å; L213-L217 WeakPolarHBondContact O-CB 3.39Å; L213-L217 VanDerWaalsContact O-CG 3.23Å; L213-L217 WeakPolarHBondContact O-CG 3.4Å; L213-L217 PolarHBondContact O-N 2.99Å |
| 214 | P | 72.4 | Confident | 74.5 | Confident | 89 Ų | 89 | 97.1 Ų | 97.1 | 58% | 0.578 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.4 | -37 | 176.7 | -22.6 | 34.1 | 0 | 0 | 0 | 113.2 | F211 K218 | F211-P214 WeakPolarHBondContact O-CD 3.43Å; P214-K218 WeakPolarHBondContact O-CB 3.1Å; P214-K218 PolarHBondContact O-N 3.46Å |
| 215 | V | 77.2 | Confident | 73.6 | Confident | 84 Ų | 84 | 92 Ų | 92 | 51% | 0.509 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -72.6 | -42.1 | 177.5 | 179.6 | 0 | 0 | 0 | 0 | 110.4 | L212 L213 K218 L219 | L212-V215 PolarHBondContact O-N 3.33Å; L212-V215 VanDerWaalsContact O-N 3.15Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 3.13Å; V215-K218 WeakPolarHBondContact O-CB 3.37Å; V215-K218 PolarHBondContact O-N 2.96Å; V215-L219 HydrophobicContact CG1-CD1 3.88Å; V215-L219 WeakPolarHBondContact O-CG 3.26Å; V215-L219 PolarHBondContact O-N 2.94Å |
| 216 | F | 73 | Confident | 72.5 | Confident | 35 Ų | 35 | 86.2 Ų | 86.2 | 15% | 0.154 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -64.6 | -43.4 | 179.1 | -173.4 | -103.8 | 0 | 0 | 0 | 112.5 | P199 F200 F203 L212 L213 K218 L219 F220 M223 | P199-F216 HydrophobicContact CB-CE1 4.19Å; P199-F216 HydrophobicContact CB-CZ 3.75Å; P199-F216 HydrophobicContact CG-CZ 4.47Å; F200-F216 HydrophobicContact CE1-CD1 4.36Å; F200-F216 HydrophobicContact CE1-CE1 4.29Å; F200-F216 HydrophobicContact CZ-CE1 4.26Å; F203-F216 AromaticContact CE2-CD1 3.92Å; F203-F216 HydrophobicContact CE2-CD1 3.92Å; F203-F216 HydrophobicContact CE2-CD2 4.06Å; F203-F216 AromaticContact CE2-CE1 3.84Å; F203-F216 HydrophobicContact CE2-CE1 3.84Å; F203-F216 AromaticContact CE2-CE2 3.99Å; F203-F216 HydrophobicContact CE2-CE2 3.99Å; F203-F216 AromaticContact CE2-CG 4Å; F203-F216 HydrophobicContact CE2-CG 4Å; F203-F216 AromaticContact CE2-CZ 3.83Å; F203-F216 HydrophobicContact CE2-CZ 3.83Å; F203-F216 HydrophobicContact CZ-CB 4.33Å; F203-F216 HydrophobicContact CZ-CD1 4.32Å; F203-F216 AromaticContact CZ-CD2 3.82Å; F203-F216 HydrophobicContact CZ-CD2 3.82Å; F203-F216 HydrophobicContact CZ-CE2 4.07Å; F203-F216 AromaticContact CZ-CG 3.92Å; F203-F216 HydrophobicContact CZ-CG 3.92Å; F203-F216 HydrophobicContact CZ-CZ 4.38Å; L212-F216 VanDerWaalsContact O-CB 3.24Å; L212-F216 WeakPolarHBondContact O-CB 3.28Å; L212-F216 PolarHBondContact O-N 3.1Å; L213-F216 PolarHBondContact O-N 2.86Å; F216-K218 VanDerWaalsContact C-N 3.27Å; F216-K218 PolarHBondContact O-N 3.46Å; F216-L219 PolarHBondContact O-N 2.78Å; F216-F220 AromaticContact CD2-CD2 3.96Å; F216-F220 HydrophobicContact CD2-CD2 3.96Å; F216-F220 HydrophobicContact CD2-CE2 4.33Å; F216-F220 AromaticContact CE2-CD2 3.93Å; F216-F220 HydrophobicContact CE2-CD2 3.93Å; F216-F220 HydrophobicContact CE2-CE2 4.22Å; F216-F220 HydrophobicContact CZ-CD2 4.49Å; F216-F220 PolarHBondContact O-N 3.22Å; F216-M223 HydrophobicContact CD1-CE 4.3Å; F216-M223 HydrophobicContact CE1-CE 3.29Å; F216-M223 HydrophobicContact CE2-CE 3.78Å; F216-M223 HydrophobicContact CZ-CE 2.99Å |
| 217 | L | 74.6 | Confident | 71.3 | Confident | 71 Ų | 71 | 85.2 Ų | 85.2 | 37% | 0.372 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.4 | -30.7 | 175.3 | -70.7 | 172.2 | 0 | 0 | 0 | 112.5 | F200 L213 L224 | F200-L217 HydrophobicContact CE1-CD2 3.96Å; F200-L217 HydrophobicContact CZ-CD2 4.16Å; L213-L217 WeakPolarHBondContact O-CB 3.39Å; L213-L217 VanDerWaalsContact O-CG 3.23Å; L213-L217 WeakPolarHBondContact O-CG 3.4Å; L213-L217 PolarHBondContact O-N 2.99Å; L217-L224 HydrophobicContact CD2-CD2 3.84Å; L217-L224 HydrophobicContact CD2-CG 4.38Å |
| 218 | K | 74.8 | Confident | 70.2 | Confident | 185 Ų | 185 | 82 Ų | 82 | 80% | 0.804 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -73.2 | -33 | 174.8 | -169.1 | 169.5 | -178.4 | 168.1 | 0 | 112.5 | P214 V215 F216 | P214-K218 WeakPolarHBondContact O-CB 3.1Å; P214-K218 PolarHBondContact O-N 3.46Å; V215-K218 WeakPolarHBondContact O-CB 3.37Å; V215-K218 PolarHBondContact O-N 2.96Å; F216-K218 VanDerWaalsContact C-N 3.27Å; F216-K218 PolarHBondContact O-N 3.46Å |
| 219 | L | 73.5 | Confident | 69.5 | Low | 119 Ų | 119 | 74.9 Ų | 74.9 | 62% | 0.623 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -81.7 | -32.2 | 178.2 | -72.1 | 163.3 | 0 | 0 | 0 | 112.9 | V215 F216 | V215-L219 HydrophobicContact CG1-CD1 3.88Å; V215-L219 WeakPolarHBondContact O-CG 3.26Å; V215-L219 PolarHBondContact O-N 2.94Å; F216-L219 PolarHBondContact O-N 2.78Å |
| 220 | F | 69.3 | Low | 69 | Low | 103 Ų | 103 | 75.2 Ų | 75.2 | 45% | 0.452 | 38% | 0.384 | S | S | . | . | trans | -130.5 | 67.5 | -174.5 | -62.2 | -77.6 | 0 | 0 | 0 | 113 | F216 E222 M223 | F216-F220 AromaticContact CD2-CD2 3.96Å; F216-F220 HydrophobicContact CD2-CD2 3.96Å; F216-F220 HydrophobicContact CD2-CE2 4.33Å; F216-F220 AromaticContact CE2-CD2 3.93Å; F216-F220 HydrophobicContact CE2-CD2 3.93Å; F216-F220 HydrophobicContact CE2-CE2 4.22Å; F216-F220 HydrophobicContact CZ-CD2 4.49Å; F216-F220 PolarHBondContact O-N 3.22Å; F220-E222 PolarHBondContact O-N 3.14Å; F220-E222 VanDerWaalsContact O-N 3.12Å; F220-M223 HydrophobicContact CB-CB 4.31Å; F220-M223 HydrophobicContact CB-CE 3.39Å; F220-M223 HydrophobicContact CB-CG 3.89Å; F220-M223 HydrophobicContact CB-SD 3.98Å; F220-M223 HydrophobicContact CD1-CE 4.2Å; F220-M223 HydrophobicContact CD1-SD 4.08Å; F220-M223 HydrophobicContact CD2-CE 3.93Å; F220-M223 HydrophobicContact CG-CE 3.59Å; F220-M223 HydrophobicContact CG-SD 4.06Å; F220-M223 PolarHBondContact O-N 2.87Å | ||
| 221 | P | 63 | Low | 68.5 | Low | 91 Ų | 91 | 75.2 Ų | 75.2 | 59% | 0.591 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -16.3 | -177.3 | 26.3 | -35.1 | 0 | 0 | 0 | 114.3 | ||
| 222 | E | 63.7 | Low | 67.7 | Low | 90 Ų | 90 | 70.1 Ų | 70.1 | 42% | 0.421 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | -1.4 | -179.4 | -63 | -158.5 | 132.9 | 0 | 0 | 114.8 | R196 F220 L224 K237 Q326 | R196-E222 PolarHBondContact NH1-O 3.19Å; F220-E222 PolarHBondContact O-N 3.14Å; F220-E222 VanDerWaalsContact O-N 3.12Å; E222-L224 VanDerWaalsContact C-N 3.3Å; E222-K237 IonicContact OE1-NZ 2.87Å; E222-Q326 PolarHBondContact OE2-NE2 3.34Å |
| 223 | M | 62.8 | Low | 67.4 | Low | 47 Ų | 47 | 71 Ų | 71 | 23% | 0.232 | 37% | 0.37 | C | S | . | . | trans | -87.9 | 3.4 | 179.8 | -65.8 | -162.8 | -39.2 | 0 | 0 | 113.8 | R196 F216 F220 | R196-M223 VanDerWaalsContact CB-O 3.3Å; R196-M223 WeakPolarHBondContact CB-O 3.37Å; F216-M223 HydrophobicContact CD1-CE 4.3Å; F216-M223 HydrophobicContact CE1-CE 3.29Å; F216-M223 HydrophobicContact CE2-CE 3.78Å; F216-M223 HydrophobicContact CZ-CE 2.99Å; F220-M223 HydrophobicContact CB-CB 4.31Å; F220-M223 HydrophobicContact CB-CE 3.39Å; F220-M223 HydrophobicContact CB-CG 3.89Å; F220-M223 HydrophobicContact CB-SD 3.98Å; F220-M223 HydrophobicContact CD1-CE 4.2Å; F220-M223 HydrophobicContact CD1-SD 4.08Å; F220-M223 HydrophobicContact CD2-CE 3.93Å; F220-M223 HydrophobicContact CG-CE 3.59Å; F220-M223 HydrophobicContact CG-SD 4.06Å; F220-M223 PolarHBondContact O-N 2.87Å | ||
| 224 | L | 63.3 | Low | 67.2 | Low | 45 Ų | 45 | 71.7 Ų | 71.7 | 24% | 0.236 | 37% | 0.371 | C | S | . | . | S | Bend | trans | -68.8 | 135.3 | 171 | -68 | 170.8 | 0 | 0 | 0 | 109.5 | R196 F200 L217 E222 | R196-L224 PolarHBondContact NH1-O 3.11Å; F200-L224 HydrophobicContact CZ-CD2 4.1Å; L217-L224 HydrophobicContact CD2-CD2 3.84Å; L217-L224 HydrophobicContact CD2-CG 4.38Å; E222-L224 VanDerWaalsContact C-N 3.3Å |
| 225 | P | 59.8 | Low | 67.3 | Low | 3 Ų | 3 | 72.2 Ų | 72.2 | 2% | 0.019 | 37% | 0.366 | C | S | . | . | trans | -48.9 | 143.2 | 172.1 | -28.4 | 32.2 | 0 | 0 | 0 | 111.2 | D193 T227 F228 | D193-P225 HydrophobicContact CB-CB 4.44Å; P225-T227 PolarHBondContact O-N 2.8Å; P225-F228 HydrophobicContact CB-CD2 3.7Å; P225-F228 HydrophobicContact CB-CE2 3.97Å; P225-F228 HydrophobicContact CG-CD2 3.78Å; P225-F228 HydrophobicContact CG-CE2 3.86Å; P225-F228 PolarHBondContact O-N 3.06Å | ||
| 226 | S | 57.9 | Low | 67.2 | Low | 13 Ų | 13 | 73 Ų | 73 | 9% | 0.091 | 36% | 0.364 | C | S | . | . | G | 310 helix | trans | -59.8 | -16.5 | -174.9 | 78.9 | 0 | 0 | 0 | 0 | 113.8 | R189 D193 | R189-S226 PolarHBondContact NE-OG 2.91Å; R189-S226 PolarHBondContact NH2-OG 3.43Å; D193-S226 WeakPolarHBondContact OD1-CB 3.47Å; D193-S226 PolarHBondContact OD1-N 2.96Å; D193-S226 PolarHBondContact OD1-OG 3.41Å; D193-S226 PolarHBondContact OD2-OG 3.12Å |
| 227 | T | 59.8 | Low | 67.2 | Low | 36 Ų | 36 | 75.6 Ų | 75.6 | 22% | 0.221 | 38% | 0.375 | C | S | . | . | G | 310 helix | trans | -73.6 | -20 | 173.9 | 44.8 | 0 | 0 | 0 | 0 | 114.3 | L158 P225 | L158-T227 HydrophobicContact CD2-CG2 4.1Å; P225-T227 PolarHBondContact O-N 2.8Å |
| 228 | F | 54.8 | Low | 67.1 | Low | 34 Ų | 34 | 75.9 Ų | 75.9 | 15% | 0.149 | 38% | 0.375 | C | S | . | . | G | 310 helix | trans | -99 | 1.4 | 179 | -61.7 | -61.1 | 0 | 0 | 0 | 113.8 | Y152 P225 T230 | Y152-F228 AromaticContact CD1-CD1 3.72Å; Y152-F228 HydrophobicContact CD1-CD1 3.72Å; Y152-F228 AromaticContact CD1-CE1 3.35Å; Y152-F228 HydrophobicContact CD1-CE1 3.35Å; Y152-F228 AromaticContact CD1-CZ 3.81Å; Y152-F228 HydrophobicContact CD1-CZ 3.81Å; Y152-F228 AromaticContact CE1-CD1 3.8Å; Y152-F228 HydrophobicContact CE1-CD1 3.8Å; Y152-F228 AromaticContact CE1-CE1 3.92Å; Y152-F228 HydrophobicContact CE1-CE1 3.92Å; Y152-F228 HydrophobicContact CE1-CG 4.32Å; Y152-F228 HydrophobicContact CE1-CZ 4.44Å; Y152-F228 HydrophobicContact CG-CE1 4.29Å; P225-F228 HydrophobicContact CB-CD2 3.7Å; P225-F228 HydrophobicContact CB-CE2 3.97Å; P225-F228 HydrophobicContact CG-CD2 3.78Å; P225-F228 HydrophobicContact CG-CE2 3.86Å; P225-F228 PolarHBondContact O-N 3.06Å; F228-T230 PolarHBondContact O-N 3.27Å |
| 229 | E | 63.8 | Low | 67 | Low | 42 Ų | 42 | 73.7 Ų | 73.7 | 20% | 0.196 | 37% | 0.365 | C | S | . | . | trans | -76.4 | 116.5 | 173.3 | -70.7 | -169.1 | 157.1 | 0 | 0 | 110.4 | K234 K237 | E229-K234 HydrophobicContact CB-CG 4.25Å; E229-K234 WeakPolarHBondContact O-CE 3.33Å; E229-K237 IonicContact OE1-NZ 3.61Å; E229-K237 PolarHBondContact OE1-NZ 2.92Å | ||
| 230 | T | 68.3 | Low | 67.1 | Low | 63 Ų | 63 | 74.8 Ų | 74.8 | 39% | 0.387 | 37% | 0.365 | S | S | . | . | trans | -63 | 146.6 | 171.4 | 57.6 | 0 | 0 | 0 | 0 | 110.8 | F228 S232 K233 K234 | F228-T230 PolarHBondContact O-N 3.27Å; T230-S232 PolarHBondContact O-N 3.39Å; T230-S232 VanDerWaalsContact O-N 3.15Å; T230-S232 PolarHBondContact OG1-OG 3.34Å; T230-K233 PolarHBondContact O-N 3.42Å; T230-K233 WeakPolarHBondContact OG1-CG 3.19Å; T230-K234 PolarHBondContact O-N 2.84Å | ||
| 231 | E | 70.1 | Confident | 67.1 | Low | 123 Ų | 123 | 70.4 Ų | 70.4 | 58% | 0.575 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -53 | -37 | 178.6 | -66.1 | -57.5 | 128.5 | 0 | 0 | 112.1 | K233 K234 E235 | E231-K233 PolarHBondContact O-N 3.28Å; E231-K234 WeakPolarHBondContact O-CB 3.48Å; E231-K234 PolarHBondContact O-N 3.35Å; E231-K234 IonicContact OE1-NZ 3.73Å; E231-K234 PolarHBondContact OE1-NZ 2.88Å; E231-E235 WeakPolarHBondContact O-CG 3.36Å; E231-E235 PolarHBondContact O-N 3.38Å |
| 232 | S | 66.1 | Low | 67.4 | Low | 66 Ų | 66 | 69.9 Ų | 69.9 | 46% | 0.462 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -58.5 | -42.8 | 174.6 | 54.8 | 0 | 0 | 0 | 0 | 114 | T230 K234 E235 E236 | T230-S232 PolarHBondContact O-N 3.39Å; T230-S232 VanDerWaalsContact O-N 3.15Å; T230-S232 PolarHBondContact OG1-OG 3.34Å; S232-K234 VanDerWaalsContact C-N 3.32Å; S232-K234 PolarHBondContact O-N 2.89Å; S232-E235 PolarHBondContact O-N 2.88Å; S232-E236 WeakPolarHBondContact O-CG 3.33Å; S232-E236 PolarHBondContact O-N 2.94Å |
| 233 | K | 70.9 | Confident | 67.8 | Low | 109 Ų | 109 | 68 Ų | 68 | 47% | 0.474 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -68.1 | -35.1 | 177.8 | -73.3 | 178.8 | 179.8 | -179.9 | 0 | 111.2 | T230 E231 K237 | T230-K233 PolarHBondContact O-N 3.42Å; T230-K233 WeakPolarHBondContact OG1-CG 3.19Å; E231-K233 PolarHBondContact O-N 3.28Å; K233-K237 WeakPolarHBondContact O-CG 3.45Å; K233-K237 PolarHBondContact O-N 3.25Å; K233-K237 VanDerWaalsContact O-N 3.08Å |
| 234 | K | 73.1 | Confident | 68.1 | Low | 58 Ų | 58 | 66.6 Ų | 66.6 | 25% | 0.252 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -65.8 | -43.7 | 174.7 | -63 | 177.3 | -169.8 | 162.1 | 0 | 110.8 | E229 T230 E231 S232 K237 Q238 | E229-K234 HydrophobicContact CB-CG 4.25Å; E229-K234 WeakPolarHBondContact O-CE 3.33Å; T230-K234 PolarHBondContact O-N 2.84Å; E231-K234 WeakPolarHBondContact O-CB 3.48Å; E231-K234 PolarHBondContact O-N 3.35Å; E231-K234 IonicContact OE1-NZ 3.73Å; E231-K234 PolarHBondContact OE1-NZ 2.88Å; S232-K234 VanDerWaalsContact C-N 3.32Å; S232-K234 PolarHBondContact O-N 2.89Å; K234-K237 PolarHBondContact O-N 2.99Å; K234-Q238 VanDerWaalsContact O-CG 3.28Å; K234-Q238 WeakPolarHBondContact O-CG 3.39Å; K234-Q238 PolarHBondContact O-N 2.78Å |
| 235 | E | 74.1 | Confident | 68.4 | Low | 99 Ų | 99 | 65 Ų | 65 | 46% | 0.463 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 177 | -73.2 | -177.6 | -168.9 | 0 | 0 | 112.5 | E231 S232 K237 Q238 K239 | E231-E235 WeakPolarHBondContact O-CG 3.36Å; E231-E235 PolarHBondContact O-N 3.38Å; S232-E235 PolarHBondContact O-N 2.88Å; E235-K237 VanDerWaalsContact C-N 3.34Å; E235-K237 PolarHBondContact O-N 3.11Å; E235-Q238 WeakPolarHBondContact O-CB 3.4Å; E235-Q238 PolarHBondContact O-N 3.42Å; E235-K239 WeakPolarHBondContact O-CG 3.24Å; E235-K239 PolarHBondContact O-N 3.17Å |
| 236 | E | 75.3 | Confident | 68.9 | Low | 101 Ų | 101 | 69.5 Ų | 69.5 | 47% | 0.472 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.3 | -42.4 | 175.3 | -76 | -179.1 | -161.3 | 0 | 0 | 112.3 | S232 Q238 K239 K240 | S232-E236 WeakPolarHBondContact O-CG 3.33Å; S232-E236 PolarHBondContact O-N 2.94Å; E236-Q238 VanDerWaalsContact C-N 3.29Å; E236-Q238 PolarHBondContact O-N 3.02Å; E236-K239 PolarHBondContact O-N 3.28Å; E236-K240 WeakPolarHBondContact O-CB 3.43Å; E236-K240 VanDerWaalsContact O-CG 3.31Å; E236-K240 WeakPolarHBondContact O-CG 3.41Å; E236-K240 PolarHBondContact O-N 3.49Å |
| 237 | K | 72.9 | Confident | 69.5 | Low | 90 Ų | 90 | 75 Ų | 75 | 39% | 0.391 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.5 | -41 | 174 | -74.8 | 179.6 | 179.1 | -170.5 | 0 | 111.1 | E222 E229 K233 K234 E235 G241 | E222-K237 IonicContact OE1-NZ 2.87Å; E229-K237 IonicContact OE1-NZ 3.61Å; E229-K237 PolarHBondContact OE1-NZ 2.92Å; K233-K237 WeakPolarHBondContact O-CG 3.45Å; K233-K237 PolarHBondContact O-N 3.25Å; K233-K237 VanDerWaalsContact O-N 3.08Å; K234-K237 PolarHBondContact O-N 2.99Å; E235-K237 VanDerWaalsContact C-N 3.34Å; E235-K237 PolarHBondContact O-N 3.11Å; K237-G241 PolarHBondContact O-N 2.85Å |
| 238 | Q | 71.4 | Confident | 69.8 | Low | 77 Ų | 77 | 73.5 Ų | 73.5 | 36% | 0.36 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.9 | -44.8 | 175.5 | -70.4 | 174.6 | 40.2 | 0 | 0 | 111.9 | K234 E235 E236 G241 L242 | K234-Q238 VanDerWaalsContact O-CG 3.28Å; K234-Q238 WeakPolarHBondContact O-CG 3.39Å; K234-Q238 PolarHBondContact O-N 2.78Å; E235-Q238 WeakPolarHBondContact O-CB 3.4Å; E235-Q238 PolarHBondContact O-N 3.42Å; E236-Q238 VanDerWaalsContact C-N 3.29Å; E236-Q238 PolarHBondContact O-N 3.02Å; Q238-G241 PolarHBondContact O-N 3.47Å; Q238-L242 VanDerWaalsContact O-CG 3.31Å; Q238-L242 WeakPolarHBondContact O-CG 3.35Å; Q238-L242 PolarHBondContact O-N 2.95Å |
| 239 | K | 73.8 | Confident | 70.2 | Confident | 138 Ų | 138 | 72 Ų | 72 | 60% | 0.6 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -62.5 | -45.3 | 177.9 | -71.5 | 173.1 | -175.1 | 173.2 | 0 | 111.9 | E235 E236 G241 L242 A243 | E235-K239 WeakPolarHBondContact O-CG 3.24Å; E235-K239 PolarHBondContact O-N 3.17Å; E236-K239 PolarHBondContact O-N 3.28Å; K239-G241 VanDerWaalsContact C-N 3.33Å; K239-G241 PolarHBondContact O-N 3.26Å; K239-L242 PolarHBondContact O-N 2.99Å; K239-A243 PolarHBondContact O-N 2.87Å |
| 240 | K | 74.9 | Confident | 70.4 | Confident | 142 Ų | 142 | 76.4 Ų | 76.4 | 62% | 0.617 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -62.2 | -40.6 | 174.9 | -71.5 | 171.5 | -179.1 | 170.3 | 0 | 111.6 | E236 A243 A244 | E236-K240 WeakPolarHBondContact O-CB 3.43Å; E236-K240 VanDerWaalsContact O-CG 3.31Å; E236-K240 WeakPolarHBondContact O-CG 3.41Å; E236-K240 PolarHBondContact O-N 3.49Å; K240-A243 PolarHBondContact O-N 2.77Å; K240-A244 WeakPolarHBondContact O-CB 3.31Å; K240-A244 PolarHBondContact O-N 3.48Å |
| 241 | G | 70.3 | Confident | 70.4 | Confident | 12 Ų | 12 | 76.3 Ų | 76.3 | 12% | 0.124 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | K237 Q238 K239 K245 | K237-G241 PolarHBondContact O-N 2.85Å; Q238-G241 PolarHBondContact O-N 3.47Å; K239-G241 VanDerWaalsContact C-N 3.33Å; K239-G241 PolarHBondContact O-N 3.26Å; G241-K245 WeakPolarHBondContact O-CG 3.45Å; G241-K245 PolarHBondContact O-N 3.14Å |
| 242 | L | 68.1 | Low | 70.2 | Confident | 79 Ų | 79 | 70.7 Ų | 70.7 | 41% | 0.414 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.8 | -44.1 | 176 | -68.2 | 172.5 | 0 | 0 | 0 | 112.1 | Q238 K239 A244 K245 L246 L377 | Q238-L242 VanDerWaalsContact O-CG 3.31Å; Q238-L242 WeakPolarHBondContact O-CG 3.35Å; Q238-L242 PolarHBondContact O-N 2.95Å; K239-L242 PolarHBondContact O-N 2.99Å; L242-A244 PolarHBondContact O-N 3.35Å; L242-K245 WeakPolarHBondContact O-CB 3.25Å; L242-K245 PolarHBondContact O-N 3.34Å; L242-L246 PolarHBondContact O-N 3.31Å; L242-L246 VanDerWaalsContact O-N 3.12Å; L242-L377 HydrophobicContact CD1-CD1 4.11Å |
| 243 | A | 72.5 | Confident | 70.1 | Confident | 50 Ų | 50 | 69.8 Ų | 69.8 | 41% | 0.413 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.2 | -45.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | K239 K240 K245 L246 E247 | K239-A243 PolarHBondContact O-N 2.87Å; K240-A243 PolarHBondContact O-N 2.77Å; A243-K245 VanDerWaalsContact C-N 3.28Å; A243-K245 PolarHBondContact O-N 3.33Å; A243-L246 PolarHBondContact O-N 2.9Å; A243-L246 VanDerWaalsContact O-N 3.12Å; A243-E247 PolarHBondContact O-N 3.14Å; A243-E247 VanDerWaalsContact O-N 3.12Å |
| 244 | A | 69.9 | Low | 70 | Confident | 19 Ų | 19 | 70.9 Ų | 70.9 | 16% | 0.157 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -62.1 | -34.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | K240 L242 L248 K321 | K240-A244 WeakPolarHBondContact O-CB 3.31Å; K240-A244 PolarHBondContact O-N 3.48Å; L242-A244 PolarHBondContact O-N 3.35Å; A244-L248 VanDerWaalsContact O-CB 3.25Å; A244-L248 WeakPolarHBondContact O-CB 3.21Å; A244-L248 PolarHBondContact O-N 3.05Å; A244-K321 HydrophobicContact CB-CB 4.29Å; A244-K321 HydrophobicContact CB-CD 4.49Å |
| 245 | K | 69.6 | Low | 69.6 | Low | 12 Ų | 12 | 68.3 Ų | 68.3 | 5% | 0.052 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -67 | -35.5 | 174.7 | -72.5 | 171.3 | -172.2 | 178.6 | 0 | 112.4 | G241 L242 A243 A249 L322 E324 L413 | G241-K245 WeakPolarHBondContact O-CG 3.45Å; G241-K245 PolarHBondContact O-N 3.14Å; L242-K245 WeakPolarHBondContact O-CB 3.25Å; L242-K245 PolarHBondContact O-N 3.34Å; A243-K245 VanDerWaalsContact C-N 3.28Å; A243-K245 PolarHBondContact O-N 3.33Å; K245-A249 VanDerWaalsContact O-CB 3.29Å; K245-A249 WeakPolarHBondContact O-CB 3.1Å; K245-A249 PolarHBondContact O-N 3.32Å; K245-A249 VanDerWaalsContact O-N 3.11Å; K245-L322 HydrophobicContact CB-CD1 4.36Å; K245-L322 HydrophobicContact CD-CD1 4.36Å; K245-L322 VanDerWaalsContact CE-O 3.26Å; K245-L322 WeakPolarHBondContact CE-O 3.19Å; K245-L322 HydrophobicContact CG-CD1 3.79Å; K245-E324 IonicContact NZ-OE1 2.7Å; K245-E324 PolarHBondContact NZ-OE1 3.36Å; K245-L413 HydrophobicContact CB-CD2 4.13Å; K245-L413 HydrophobicContact CD-CD2 4.35Å |
| 246 | L | 70.1 | Confident | 69.2 | Low | 97 Ų | 97 | 64.3 Ų | 64.3 | 51% | 0.508 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -70.9 | -44.7 | 177.2 | -67.8 | 175.4 | 0 | 0 | 0 | 112.2 | L242 A243 L248 A249 K250 | L242-L246 PolarHBondContact O-N 3.31Å; L242-L246 VanDerWaalsContact O-N 3.12Å; A243-L246 PolarHBondContact O-N 2.9Å; A243-L246 VanDerWaalsContact O-N 3.12Å; L246-L248 VanDerWaalsContact C-N 3.34Å; L246-A249 PolarHBondContact O-N 2.87Å; L246-K250 PolarHBondContact O-N 3.36Å |
| 247 | E | 69.5 | Low | 68.6 | Low | 127 Ų | 127 | 61.6 Ų | 61.6 | 59% | 0.593 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -61.3 | -44.1 | 176.1 | -71.3 | 179.3 | 177.7 | 0 | 0 | 111.8 | A243 A249 K250 F251 | A243-E247 PolarHBondContact O-N 3.14Å; A243-E247 VanDerWaalsContact O-N 3.12Å; E247-A249 VanDerWaalsContact C-N 3.29Å; E247-A249 PolarHBondContact O-N 3.49Å; E247-K250 PolarHBondContact O-N 3.21Å; E247-F251 PolarHBondContact O-N 3.02Å |
| 248 | L | 66.1 | Low | 68.3 | Low | 5 Ų | 5 | 61 Ų | 61 | 3% | 0.026 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -55.4 | -48.3 | 174.2 | 165.8 | 66.6 | 0 | 0 | 0 | 111.8 | A244 L246 K250 F251 L252 A318 L322 | A244-L248 VanDerWaalsContact O-CB 3.25Å; A244-L248 WeakPolarHBondContact O-CB 3.21Å; A244-L248 PolarHBondContact O-N 3.05Å; L246-L248 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 2.87Å; L248-F251 CarbonylContact O-C 3.6Å; L248-F251 WeakPolarHBondContact O-CA 3.43Å; L248-F251 WeakPolarHBondContact O-CB 3.45Å; L248-F251 PolarHBondContact O-N 2.58Å; L248-L252 HydrophobicContact CD1-CD1 3.52Å; L248-L252 HydrophobicContact CD1-CD2 4.24Å; L248-L252 HydrophobicContact CD1-CG 3.54Å; L248-L252 HydrophobicContact CD2-CD1 4.09Å; L248-L252 HydrophobicContact CG-CD1 3.68Å; L248-L252 HydrophobicContact CG-CG 4.08Å; L248-L252 PolarHBondContact O-N 3.17Å; L248-A318 VanDerWaalsContact CD1-CA 3.43Å; L248-A318 HydrophobicContact CD1-CB 2.99Å; L248-A318 VanDerWaalsContact CD1-O 3.27Å; L248-A318 WeakPolarHBondContact CD1-O 3.26Å; L248-A318 WeakPolarHBondContact CD2-O 3.42Å; L248-A318 HydrophobicContact CG-CB 4.36Å; L248-L322 HydrophobicContact CD2-CB 3.26Å; L248-L322 HydrophobicContact CD2-CD1 3.57Å; L248-L322 HydrophobicContact CD2-CD2 3.81Å; L248-L322 HydrophobicContact CD2-CG 3.67Å |
| 249 | A | 64.1 | Low | 67.7 | Low | 2 Ų | 2 | 59.2 Ų | 59.2 | 2% | 0.017 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -69.3 | -31.4 | -168.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | K245 L246 E247 Q253 T414 | K245-A249 VanDerWaalsContact O-CB 3.29Å; K245-A249 WeakPolarHBondContact O-CB 3.1Å; K245-A249 PolarHBondContact O-N 3.32Å; K245-A249 VanDerWaalsContact O-N 3.11Å; L246-A249 PolarHBondContact O-N 2.87Å; E247-A249 VanDerWaalsContact C-N 3.29Å; E247-A249 PolarHBondContact O-N 3.49Å; A249-Q253 WeakPolarHBondContact O-CB 3.22Å; A249-Q253 WeakPolarHBondContact O-CG 3.48Å; A249-Q253 PolarHBondContact O-N 3.44Å; A249-T414 HydrophobicContact CB-CG2 3.14Å |
| 250 | K | 68.4 | Low | 67 | Low | 136 Ų | 136 | 53.9 Ų | 53.9 | 59% | 0.591 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -63.3 | -43.3 | 164.7 | -64.7 | 179.2 | -179.3 | -179.6 | 0 | 112.8 | L246 E247 L248 Q253 E254 | L246-K250 PolarHBondContact O-N 3.36Å; E247-K250 PolarHBondContact O-N 3.21Å; L248-K250 PolarHBondContact O-N 2.87Å; K250-Q253 VanDerWaalsContact O-CB 3.31Å; K250-Q253 WeakPolarHBondContact O-CB 3.46Å; K250-Q253 PolarHBondContact O-N 3.23Å; K250-E254 PolarHBondContact O-N 3.47Å |
| 251 | F | 67 | Low | 66.5 | Low | 61 Ų | 61 | 56 Ų | 56 | 27% | 0.268 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -65.6 | -40.2 | 178.7 | -177.6 | -96.5 | 0 | 0 | 0 | 113.3 | E247 L248 Q253 E254 T255 P314 Q315 A318 | E247-F251 PolarHBondContact O-N 3.02Å; L248-F251 CarbonylContact O-C 3.6Å; L248-F251 WeakPolarHBondContact O-CA 3.43Å; L248-F251 WeakPolarHBondContact O-CB 3.45Å; L248-F251 PolarHBondContact O-N 2.58Å; F251-Q253 VanDerWaalsContact C-N 3.32Å; F251-E254 PolarHBondContact O-N 3.44Å; F251-T255 VanDerWaalsContact CE1-OG1 3.25Å; F251-T255 WeakPolarHBondContact CE1-OG1 3.15Å; F251-T255 WeakPolarHBondContact CZ-OG1 3.1Å; F251-T255 VanDerWaalsContact O-CB 3.32Å; F251-T255 WeakPolarHBondContact O-CB 3.39Å; F251-T255 PolarHBondContact O-N 3.41Å; F251-T255 PolarHBondContact O-OG1 2.9Å; F251-P314 HydrophobicContact CE1-CB 3.8Å; F251-P314 HydrophobicContact CE2-CB 3.98Å; F251-P314 HydrophobicContact CZ-CB 3.29Å; F251-P314 HydrophobicContact CZ-CG 4.43Å; F251-Q315 HydrophobicContact CE1-CB 4.28Å; F251-Q315 HydrophobicContact CE1-CG 3.75Å; F251-Q315 HydrophobicContact CZ-CG 4.28Å; F251-A318 HydrophobicContact CD1-CB 3.75Å; F251-A318 HydrophobicContact CE1-CB 4.37Å |
| 252 | L | 66.2 | Low | 66.1 | Low | 4 Ų | 4 | 62 Ų | 62 | 2% | 0.021 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -68.1 | -33.8 | 174.8 | -71.5 | 174.1 | 0 | 0 | 0 | 111.4 | L248 T255 I256 L319 L407 A410 | L248-L252 HydrophobicContact CD1-CD1 3.52Å; L248-L252 HydrophobicContact CD1-CD2 4.24Å; L248-L252 HydrophobicContact CD1-CG 3.54Å; L248-L252 HydrophobicContact CD2-CD1 4.09Å; L248-L252 HydrophobicContact CG-CD1 3.68Å; L248-L252 HydrophobicContact CG-CG 4.08Å; L248-L252 PolarHBondContact O-N 3.17Å; L252-T255 PolarHBondContact O-N 3.24Å; L252-I256 WeakPolarHBondContact O-CB 3.41Å; L252-I256 VanDerWaalsContact O-CG1 3.3Å; L252-I256 WeakPolarHBondContact O-CG1 3.39Å; L252-I256 PolarHBondContact O-N 3.04Å; L252-L319 HydrophobicContact CD1-CD2 4.26Å; L252-L407 HydrophobicContact CB-CD1 4.46Å; L252-L407 HydrophobicContact CD1-CD1 3.87Å; L252-L407 HydrophobicContact CD2-CD1 3.74Å; L252-L407 HydrophobicContact CG-CD1 4.23Å; L252-A410 HydrophobicContact CD1-CB 3.61Å |
| 253 | Q | 64.4 | Low | 65.5 | Low | 48 Ų | 48 | 60.3 Ų | 60.3 | 22% | 0.224 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60 | -49.9 | 171.8 | -75.8 | 172.1 | -9.4 | 0 | 0 | 111.6 | A249 K250 F251 T255 I256 A257 M411 T414 | A249-Q253 WeakPolarHBondContact O-CB 3.22Å; A249-Q253 WeakPolarHBondContact O-CG 3.48Å; A249-Q253 PolarHBondContact O-N 3.44Å; K250-Q253 VanDerWaalsContact O-CB 3.31Å; K250-Q253 WeakPolarHBondContact O-CB 3.46Å; K250-Q253 PolarHBondContact O-N 3.23Å; F251-Q253 VanDerWaalsContact C-N 3.32Å; Q253-T255 VanDerWaalsContact C-N 3.35Å; Q253-I256 PolarHBondContact O-N 3.19Å; Q253-A257 WeakPolarHBondContact O-CB 3.37Å; Q253-A257 PolarHBondContact O-N 3.1Å; Q253-M411 HydrophobicContact CG-SD 4.25Å; Q253-T414 VanDerWaalsContact NE2-CB 3.34Å; Q253-T414 PolarHBondContact NE2-OG1 3.36Å |
| 254 | E | 68.3 | Low | 64.7 | Low | 132 Ų | 132 | 64 Ų | 64 | 62% | 0.617 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -62.6 | -43.7 | 177.5 | -72.5 | 173.6 | -173.9 | 0 | 0 | 111.3 | K250 F251 A257 E258 | K250-E254 PolarHBondContact O-N 3.47Å; F251-E254 PolarHBondContact O-N 3.44Å; E254-A257 PolarHBondContact O-N 3.07Å; E254-E258 WeakPolarHBondContact O-CB 3.28Å; E254-E258 PolarHBondContact O-N 3.42Å |
| 255 | T | 65.4 | Low | 63.9 | Low | 4 Ų | 4 | 67.7 Ų | 67.7 | 3% | 0.025 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -60 | -48.8 | 177.6 | -65 | 0 | 0 | 0 | 0 | 112 | F251 L252 Q253 A257 E258 M259 Q315 | F251-T255 VanDerWaalsContact CE1-OG1 3.25Å; F251-T255 WeakPolarHBondContact CE1-OG1 3.15Å; F251-T255 WeakPolarHBondContact CZ-OG1 3.1Å; F251-T255 VanDerWaalsContact O-CB 3.32Å; F251-T255 WeakPolarHBondContact O-CB 3.39Å; F251-T255 PolarHBondContact O-N 3.41Å; F251-T255 PolarHBondContact O-OG1 2.9Å; L252-T255 PolarHBondContact O-N 3.24Å; Q253-T255 VanDerWaalsContact C-N 3.35Å; T255-A257 VanDerWaalsContact C-N 3.33Å; T255-A257 PolarHBondContact O-N 2.82Å; T255-E258 CarbonylContact O-C 3.54Å; T255-E258 WeakPolarHBondContact O-CB 3.47Å; T255-E258 PolarHBondContact O-N 3.38Å; T255-M259 HydrophobicContact CG2-CE 3.97Å; T255-M259 HydrophobicContact CG2-CG 4.29Å; T255-M259 HydrophobicContact CG2-SD 4.17Å; T255-M259 WeakPolarHBondContact O-CG 3.48Å; T255-M259 PolarHBondContact O-N 2.93Å; T255-Q315 VanDerWaalsContact CG2-CD 3.43Å; T255-Q315 HydrophobicContact CG2-CG 3.72Å |
| 256 | I | 64.3 | Low | 63.4 | Low | 15 Ų | 15 | 72.2 Ų | 72.2 | 8% | 0.077 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -67.8 | -37.2 | -178.9 | -71.1 | 165.3 | 0 | 0 | 0 | 110.4 | L252 Q253 E258 M259 A260 F276 L407 M411 | L252-I256 WeakPolarHBondContact O-CB 3.41Å; L252-I256 VanDerWaalsContact O-CG1 3.3Å; L252-I256 WeakPolarHBondContact O-CG1 3.39Å; L252-I256 PolarHBondContact O-N 3.04Å; Q253-I256 PolarHBondContact O-N 3.19Å; I256-E258 VanDerWaalsContact C-N 3.28Å; I256-E258 PolarHBondContact O-N 2.84Å; I256-M259 HydrophobicContact CG1-CE 3.93Å; I256-M259 PolarHBondContact O-N 3.39Å; I256-A260 WeakPolarHBondContact O-CB 3.39Å; I256-A260 PolarHBondContact O-N 3.4Å; I256-F276 HydrophobicContact CG2-CE1 4.08Å; I256-L407 HydrophobicContact CD1-CD1 4.1Å; I256-L407 HydrophobicContact CD1-CD2 4.27Å; I256-L407 HydrophobicContact CD1-CG 4.22Å; I256-M411 HydrophobicContact CB-CE 4.48Å; I256-M411 HydrophobicContact CD1-CE 3.66Å; I256-M411 HydrophobicContact CD1-CG 4.08Å; I256-M411 HydrophobicContact CD1-SD 3.55Å; I256-M411 VanDerWaalsContact CD1-SD 3.55Å; I256-M411 HydrophobicContact CG2-CE 4.4Å |
| 257 | A | 64.3 | Low | 62.4 | Low | 43 Ų | 43 | 71.7 Ų | 71.7 | 36% | 0.355 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -61.8 | -38.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q253 E254 T255 R261 | Q253-A257 WeakPolarHBondContact O-CB 3.37Å; Q253-A257 PolarHBondContact O-N 3.1Å; E254-A257 PolarHBondContact O-N 3.07Å; T255-A257 VanDerWaalsContact C-N 3.33Å; T255-A257 PolarHBondContact O-N 2.82Å; A257-R261 WeakPolarHBondContact O-CB 3.33Å; A257-R261 WeakPolarHBondContact O-CG 3.47Å; A257-R261 PolarHBondContact O-N 2.83Å |
| 258 | E | 65.4 | Low | 61.8 | Low | 78 Ų | 78 | 74.3 Ų | 74.3 | 36% | 0.364 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -71.4 | -40.5 | 176.5 | -160.4 | -175.9 | 173.4 | 0 | 0 | 112.6 | E254 T255 I256 R261 R262 | E254-E258 WeakPolarHBondContact O-CB 3.28Å; E254-E258 PolarHBondContact O-N 3.42Å; T255-E258 CarbonylContact O-C 3.54Å; T255-E258 WeakPolarHBondContact O-CB 3.47Å; T255-E258 PolarHBondContact O-N 3.38Å; I256-E258 VanDerWaalsContact C-N 3.28Å; I256-E258 PolarHBondContact O-N 2.84Å; E258-R261 WeakPolarHBondContact O-CB 3.23Å; E258-R261 PolarHBondContact O-N 3.43Å; E258-R262 WeakPolarHBondContact O-CG 3.47Å; E258-R262 PolarHBondContact O-N 3.44Å; E258-R262 IonicContact OE1-CZ 3.34Å; E258-R262 VanDerWaalsContact OE1-CZ 3.29Å; E258-R262 IonicContact OE1-NH1 2.77Å; E258-R262 PolarHBondContact OE1-NH1 3.29Å; E258-R262 IonicContact OE1-NH2 2.73Å; E258-R262 PolarHBondContact OE1-NH2 3.39Å; E258-R262 IonicContact OE2-NH1 2.68Å |
| 259 | M | 59.1 | Low | 61.5 | Low | 40 Ų | 40 | 76 Ų | 76 | 20% | 0.197 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -67 | -42.1 | 174.4 | -69.2 | -169.1 | -53.1 | 0 | 0 | 111.8 | T255 I256 R261 R262 N263 L306 | T255-M259 HydrophobicContact CG2-CE 3.97Å; T255-M259 HydrophobicContact CG2-CG 4.29Å; T255-M259 HydrophobicContact CG2-SD 4.17Å; T255-M259 WeakPolarHBondContact O-CG 3.48Å; T255-M259 PolarHBondContact O-N 2.93Å; I256-M259 HydrophobicContact CG1-CE 3.93Å; I256-M259 PolarHBondContact O-N 3.39Å; M259-R261 PolarHBondContact O-N 2.97Å; M259-R262 PolarHBondContact O-N 2.96Å; M259-R262 VanDerWaalsContact O-N 3.11Å; M259-N263 WeakPolarHBondContact O-CB 3.5Å; M259-N263 PolarHBondContact O-N 2.95Å; M259-L306 HydrophobicContact CE-CD1 4.04Å |
| 260 | A | 60.1 | Low | 61.4 | Low | 25 Ų | 25 | 79.2 Ų | 79.2 | 21% | 0.207 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -60.5 | -35.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | I256 K264 T273 | I256-A260 WeakPolarHBondContact O-CB 3.39Å; I256-A260 PolarHBondContact O-N 3.4Å; A260-K264 PolarHBondContact O-N 3.37Å; A260-T273 HydrophobicContact CB-CG2 3.82Å |
| 261 | R | 63.7 | Low | 61.5 | Low | 187 Ų | 187 | 77.4 Ų | 77.4 | 71% | 0.706 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -67.8 | -41.7 | 172 | -75.2 | 170.6 | -172.4 | 163 | 2.2 | 112.3 | A257 E258 M259 N263 | A257-R261 WeakPolarHBondContact O-CB 3.33Å; A257-R261 WeakPolarHBondContact O-CG 3.47Å; A257-R261 PolarHBondContact O-N 2.83Å; E258-R261 WeakPolarHBondContact O-CB 3.23Å; E258-R261 PolarHBondContact O-N 3.43Å; M259-R261 PolarHBondContact O-N 2.97Å; R261-N263 VanDerWaalsContact C-N 3.33Å |
| 262 | R | 60.6 | Low | 61.5 | Low | 138 Ų | 138 | 76.4 Ų | 76.4 | 52% | 0.521 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.3 | -35.1 | 176.2 | -73.2 | -179.9 | 177 | 116.3 | 6.6 | 112.5 | E258 M259 | E258-R262 WeakPolarHBondContact O-CG 3.47Å; E258-R262 PolarHBondContact O-N 3.44Å; E258-R262 IonicContact OE1-CZ 3.34Å; E258-R262 VanDerWaalsContact OE1-CZ 3.29Å; E258-R262 IonicContact OE1-NH1 2.77Å; E258-R262 PolarHBondContact OE1-NH1 3.29Å; E258-R262 IonicContact OE1-NH2 2.73Å; E258-R262 PolarHBondContact OE1-NH2 3.39Å; E258-R262 IonicContact OE2-NH1 2.68Å; M259-R262 PolarHBondContact O-N 2.96Å; M259-R262 VanDerWaalsContact O-N 3.11Å |
| 263 | N | 56.3 | Low | 61.5 | Low | 44 Ų | 44 | 77.5 Ų | 77.5 | 24% | 0.235 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -86.5 | -5.5 | -174.4 | -77.1 | -10.9 | 0 | 0 | 0 | 115.4 | M259 R261 A265 K266 I269 E305 | M259-N263 WeakPolarHBondContact O-CB 3.5Å; M259-N263 PolarHBondContact O-N 2.95Å; R261-N263 VanDerWaalsContact C-N 3.33Å; N263-A265 PolarHBondContact O-N 3.01Å; N263-K266 PolarHBondContact O-N 3.2Å; N263-I269 HydrophobicContact CB-CG2 4.19Å; N263-E305 PolarHBondContact ND2-OE2 2.81Å |
| 264 | K | 55.4 | Low | 61.8 | Low | 128 Ų | 128 | 79.1 Ų | 79.1 | 56% | 0.557 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -12.8 | 169.8 | -91.5 | -172.3 | 172.2 | -168.5 | 0 | 114.3 | A260 K266 | A260-K264 PolarHBondContact O-N 3.37Å; K264-K266 VanDerWaalsContact C-N 3.3Å; K264-K266 PolarHBondContact O-N 3.45Å |
| 265 | A | 54.1 | Low | 62 | Low | 95 Ų | 95 | 78.9 Ų | 78.9 | 79% | 0.785 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | -7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | N263 | N263-A265 PolarHBondContact O-N 3.01Š|
| 266 | K | 57.9 | Low | 62.3 | Low | 108 Ų | 108 | 80.1 Ų | 80.1 | 47% | 0.47 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -112.2 | 108.6 | 178.9 | -65.6 | 178.4 | -176.4 | 176.8 | 0 | 110.4 | N263 K264 Q268 I269 E270 E305 | N263-K266 PolarHBondContact O-N 3.2Å; K264-K266 VanDerWaalsContact C-N 3.3Å; K264-K266 PolarHBondContact O-N 3.45Å; K266-Q268 VanDerWaalsContact C-N 3.34Å; K266-Q268 PolarHBondContact O-N 2.95Å; K266-Q268 VanDerWaalsContact O-N 3.14Å; K266-I269 HydrophobicContact CB-CB 4.16Å; K266-I269 HydrophobicContact CB-CD1 3.8Å; K266-I269 HydrophobicContact CB-CG1 4.37Å; K266-I269 HydrophobicContact CD-CD1 3.47Å; K266-I269 VanDerWaalsContact CD-CD1 3.47Å; K266-I269 HydrophobicContact CG-CD1 4.28Å; K266-I269 PolarHBondContact O-N 3.3Å; K266-E270 PolarHBondContact O-N 3.2Å; K266-E305 IonicContact NZ-OE1 2.65Å; K266-E305 PolarHBondContact NZ-OE1 3.46Å |
| 267 | A | 50.5 | Low | 62.5 | Low | 86 Ų | 86 | 81.8 Ų | 81.8 | 71% | 0.711 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -56.7 | -31.1 | -168.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 268 | Q | 56.4 | Low | 63.1 | Low | 181 Ų | 181 | 88.3 Ų | 88.3 | 85% | 0.846 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -80 | -24.2 | 175.6 | -76.2 | -164.3 | -20.7 | 0 | 0 | 113.8 | K266 E270 | K266-Q268 VanDerWaalsContact C-N 3.34Å; K266-Q268 PolarHBondContact O-N 2.95Å; K266-Q268 VanDerWaalsContact O-N 3.14Å; Q268-E270 VanDerWaalsContact C-N 3.34Å |
| 269 | I | 59.4 | Low | 63.5 | Low | 40 Ų | 40 | 85.6 Ų | 85.6 | 21% | 0.205 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -80.8 | -22.8 | 178.7 | -72.5 | 161.3 | 0 | 0 | 0 | 110 | N263 K266 T273 | N263-I269 HydrophobicContact CB-CG2 4.19Å; K266-I269 HydrophobicContact CB-CB 4.16Å; K266-I269 HydrophobicContact CB-CD1 3.8Å; K266-I269 HydrophobicContact CB-CG1 4.37Å; K266-I269 HydrophobicContact CD-CD1 3.47Å; K266-I269 VanDerWaalsContact CD-CD1 3.47Å; K266-I269 HydrophobicContact CG-CD1 4.28Å; K266-I269 PolarHBondContact O-N 3.3Å; I269-T273 VanDerWaalsContact CG2-OG1 3.23Å; I269-T273 WeakPolarHBondContact CG2-OG1 3.3Å; I269-T273 WeakPolarHBondContact O-CB 3.44Å; I269-T273 PolarHBondContact O-N 3.24Å; I269-T273 PolarHBondContact O-OG1 3.42Å |
| 270 | E | 62.9 | Low | 63.9 | Low | 70 Ų | 70 | 84.5 Ų | 84.5 | 33% | 0.327 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.8 | -47.3 | -177.9 | -167.9 | 167.1 | -165.9 | 0 | 0 | 113 | K266 Q268 T273 Q274 | K266-E270 PolarHBondContact O-N 3.2Å; Q268-E270 VanDerWaalsContact C-N 3.34Å; E270-T273 PolarHBondContact O-N 3.29Å; E270-Q274 WeakPolarHBondContact O-CB 3.48Å; E270-Q274 VanDerWaalsContact O-CG 3.26Å; E270-Q274 WeakPolarHBondContact O-CG 3.48Å; E270-Q274 PolarHBondContact O-N 3.28Å |
| 271 | D | 69.7 | Low | 64.4 | Low | 98 Ų | 98 | 90 Ų | 90 | 52% | 0.524 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 178.5 | -95.3 | -4.3 | 0 | 0 | 0 | 112.6 | Q274 R275 | D271-Q274 PolarHBondContact O-N 2.97Å; D271-R275 VanDerWaalsContact O-CG 3.25Å; D271-R275 WeakPolarHBondContact O-CG 3.32Å; D271-R275 PolarHBondContact O-N 3.39Å |
| 272 | E | 66.9 | Low | 64.8 | Low | 41 Ų | 41 | 87.2 Ų | 87.2 | 19% | 0.192 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -72.7 | -32.9 | 179.1 | -71.8 | -62 | 137.7 | 0 | 0 | 112.2 | R275 F276 L301 | E272-R275 PolarHBondContact O-N 3.16Å; E272-R275 IonicContact OE1-CZ 3.79Å; E272-R275 IonicContact OE1-NH1 2.81Å; E272-R275 PolarHBondContact OE1-NH1 3.41Å; E272-F276 WeakPolarHBondContact O-CB 3.45Å; E272-F276 PolarHBondContact O-N 3.42Å; E272-L301 HydrophobicContact CB-CD1 3.77Å; E272-L301 HydrophobicContact CB-CD2 3.52Å; E272-L301 HydrophobicContact CB-CG 4.27Å; E272-L301 HydrophobicContact CG-CD2 4.11Å |
| 273 | T | 66 | Low | 65.1 | Low | 26 Ų | 26 | 81.2 Ų | 81.2 | 16% | 0.16 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -68.9 | -37.4 | 173.4 | -59.9 | 0 | 0 | 0 | 0 | 111.6 | A260 I269 E270 F276 S277 | A260-T273 HydrophobicContact CB-CG2 3.82Å; I269-T273 VanDerWaalsContact CG2-OG1 3.23Å; I269-T273 WeakPolarHBondContact CG2-OG1 3.3Å; I269-T273 WeakPolarHBondContact O-CB 3.44Å; I269-T273 PolarHBondContact O-N 3.24Å; I269-T273 PolarHBondContact O-OG1 3.42Å; E270-T273 PolarHBondContact O-N 3.29Å; T273-F276 PolarHBondContact O-N 3.49Å; T273-S277 WeakPolarHBondContact O-CB 3.33Å; T273-S277 PolarHBondContact O-N 2.92Å; T273-S277 PolarHBondContact O-OG 2.81Å |
| 274 | Q | 70.7 | Confident | 65.4 | Low | 83 Ų | 83 | 83.1 Ų | 83.1 | 39% | 0.388 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -66.5 | -42.6 | 173.4 | -74.9 | -177.9 | 24.8 | 0 | 0 | 111.6 | E270 D271 S277 R278 | E270-Q274 WeakPolarHBondContact O-CB 3.48Å; E270-Q274 VanDerWaalsContact O-CG 3.26Å; E270-Q274 WeakPolarHBondContact O-CG 3.48Å; E270-Q274 PolarHBondContact O-N 3.28Å; D271-Q274 PolarHBondContact O-N 2.97Å; Q274-S277 PolarHBondContact O-N 2.95Å; Q274-R278 PolarHBondContact O-N 3.22Å |
| 275 | R | 72.3 | Confident | 65.9 | Low | 126 Ų | 126 | 80.4 Ų | 80.4 | 48% | 0.475 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 174.1 | -72.8 | 169.5 | -177.5 | -178.7 | 0.6 | 111.7 | D271 E272 R278 Y279 F298 | D271-R275 VanDerWaalsContact O-CG 3.25Å; D271-R275 WeakPolarHBondContact O-CG 3.32Å; D271-R275 PolarHBondContact O-N 3.39Å; E272-R275 PolarHBondContact O-N 3.16Å; E272-R275 IonicContact OE1-CZ 3.79Å; E272-R275 IonicContact OE1-NH1 2.81Å; E272-R275 PolarHBondContact OE1-NH1 3.41Å; R275-R278 PolarHBondContact O-N 3.28Å; R275-Y279 VanDerWaalsContact O-CB 3.27Å; R275-Y279 WeakPolarHBondContact O-CB 3.21Å; R275-Y279 PolarHBondContact O-N 2.88Å; R275-F298 HydrophobicContact CB-CE1 4.16Å; R275-F298 HydrophobicContact CB-CZ 4.42Å |
| 276 | F | 72.2 | Confident | 66.4 | Low | 31 Ų | 31 | 80.3 Ų | 80.3 | 14% | 0.136 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -61.4 | -42.6 | 173.8 | 178.4 | -105.4 | 0 | 0 | 0 | 112 | I256 E272 T273 Y279 V280 F298 F302 | I256-F276 HydrophobicContact CG2-CE1 4.08Å; E272-F276 WeakPolarHBondContact O-CB 3.45Å; E272-F276 PolarHBondContact O-N 3.42Å; T273-F276 PolarHBondContact O-N 3.49Å; F276-Y279 WeakPolarHBondContact O-CB 3.5Å; F276-Y279 PolarHBondContact O-N 3.05Å; F276-V280 HydrophobicContact CD1-CG2 4.22Å; F276-V280 HydrophobicContact CD2-CG2 4.24Å; F276-V280 HydrophobicContact CE1-CG2 3.79Å; F276-V280 HydrophobicContact CE2-CG2 3.81Å; F276-V280 HydrophobicContact CG-CG2 4.43Å; F276-V280 HydrophobicContact CZ-CG2 3.57Å; F276-V280 WeakPolarHBondContact O-CG2 3.4Å; F276-V280 PolarHBondContact O-N 3.33Å; F276-F298 HydrophobicContact CB-CD1 3.89Å; F276-F298 HydrophobicContact CB-CE1 3.95Å; F276-F298 HydrophobicContact CD2-CB 3.93Å; F276-F298 AromaticContact CD2-CD1 3.93Å; F276-F298 HydrophobicContact CD2-CD1 3.93Å; F276-F298 HydrophobicContact CD2-CD2 4.26Å; F276-F298 AromaticContact CD2-CG 3.78Å; F276-F298 HydrophobicContact CD2-CG 3.78Å; F276-F298 HydrophobicContact CE2-CB 4.37Å; F276-F298 HydrophobicContact CG-CD1 4.4Å; F276-F302 HydrophobicContact CD1-CZ 4.28Å; F276-F302 HydrophobicContact CD2-CE2 4.32Å; F276-F302 HydrophobicContact CE1-CE2 4.42Å; F276-F302 AromaticContact CE1-CZ 3.83Å; F276-F302 HydrophobicContact CE1-CZ 3.83Å; F276-F302 AromaticContact CE2-CE2 3.93Å; F276-F302 HydrophobicContact CE2-CE2 3.93Å; F276-F302 HydrophobicContact CE2-CZ 4.16Å; F276-F302 AromaticContact CZ-CE2 3.97Å; F276-F302 HydrophobicContact CZ-CE2 3.97Å; F276-F302 AromaticContact CZ-CZ 3.75Å; F276-F302 HydrophobicContact CZ-CZ 3.75Å |
| 277 | S | 68.6 | Low | 66.6 | Low | 49 Ų | 49 | 78 Ų | 78 | 34% | 0.343 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.7 | -44.6 | 178.5 | -60 | 0 | 0 | 0 | 0 | 112.1 | T273 Q274 Y279 V280 Q281 | T273-S277 WeakPolarHBondContact O-CB 3.33Å; T273-S277 PolarHBondContact O-N 2.92Å; T273-S277 PolarHBondContact O-OG 2.81Å; Q274-S277 PolarHBondContact O-N 2.95Å; S277-Y279 VanDerWaalsContact C-N 3.31Å; S277-Y279 PolarHBondContact O-N 3.44Å; S277-V280 PolarHBondContact O-N 3.03Å; S277-Q281 WeakPolarHBondContact O-CG 3.38Å; S277-Q281 PolarHBondContact O-N 3.39Å |
| 278 | R | 78 | Confident | 67.1 | Low | 181 Ų | 181 | 79.7 Ų | 79.7 | 68% | 0.683 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -62.6 | -39.7 | 173.1 | -73.4 | -176.5 | -176.3 | 168.9 | 4 | 111.7 | Q274 R275 Q281 K282 | Q274-R278 PolarHBondContact O-N 3.22Å; R275-R278 PolarHBondContact O-N 3.28Å; R278-Q281 PolarHBondContact O-N 3.33Å; R278-K282 WeakPolarHBondContact O-CB 3.48Å; R278-K282 PolarHBondContact O-N 3.46Å |
| 279 | Y | 72.3 | Confident | 67.4 | Low | 20 Ų | 20 | 76.4 Ų | 76.4 | 8% | 0.078 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.4 | -50.5 | 177.4 | -179.8 | -112 | 0 | 0 | 0 | 112.1 | R275 F276 S277 Q281 K282 V283 P290 S291 E294 F298 | R275-Y279 VanDerWaalsContact O-CB 3.27Å; R275-Y279 WeakPolarHBondContact O-CB 3.21Å; R275-Y279 PolarHBondContact O-N 2.88Å; F276-Y279 WeakPolarHBondContact O-CB 3.5Å; F276-Y279 PolarHBondContact O-N 3.05Å; S277-Y279 VanDerWaalsContact C-N 3.31Å; S277-Y279 PolarHBondContact O-N 3.44Å; Y279-Q281 VanDerWaalsContact C-N 3.3Å; Y279-Q281 PolarHBondContact O-N 3.18Å; Y279-K282 PolarHBondContact O-N 2.89Å; Y279-K282 VanDerWaalsContact O-N 3.16Å; Y279-V283 HydrophobicContact CD1-CG2 4.33Å; Y279-V283 HydrophobicContact CD2-CG2 4.09Å; Y279-V283 HydrophobicContact CE1-CG2 3.96Å; Y279-V283 HydrophobicContact CE2-CG2 3.65Å; Y279-V283 HydrophobicContact CG-CG2 4.42Å; Y279-V283 WeakPolarHBondContact O-CG2 3.5Å; Y279-V283 PolarHBondContact O-N 3.5Å; Y279-P290 HydrophobicContact CE1-CB 4.3Å; Y279-P290 WeakPolarHBondContact OH-CA 3.48Å; Y279-P290 WeakPolarHBondContact OH-CB 3.45Å; Y279-S291 PolarHBondContact OH-N 2.96Å; Y279-E294 HydrophobicContact CE2-CB 4.11Å; Y279-E294 VanDerWaalsContact CE2-CD 3.45Å; Y279-E294 HydrophobicContact CE2-CG 4.34Å; Y279-E294 WeakPolarHBondContact CE2-OE2 3.42Å; Y279-E294 VanDerWaalsContact CZ-OE2 3.3Å; Y279-E294 PolarHBondContact OH-OE2 3.12Å; Y279-F298 AromaticContact CD1-CD2 3.88Å; Y279-F298 HydrophobicContact CD1-CD2 3.88Å; Y279-F298 AromaticContact CD1-CE2 3.64Å; Y279-F298 HydrophobicContact CD1-CE2 3.64Å; Y279-F298 HydrophobicContact CD2-CE2 4.16Å; Y279-F298 HydrophobicContact CE1-CD2 4.14Å; Y279-F298 HydrophobicContact CE1-CE2 4.13Å; Y279-F298 HydrophobicContact CG-CD2 4.33Å; Y279-F298 AromaticContact CG-CE2 3.61Å; Y279-F298 HydrophobicContact CG-CE2 3.61Å; Y279-F298 HydrophobicContact CG-CZ 4.26Å |
| 280 | V | 68.1 | Low | 67.7 | Low | 17 Ų | 17 | 75 Ų | 75 | 10% | 0.103 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -59.4 | -42.1 | 177.1 | 171.3 | 0 | 0 | 0 | 0 | 111 | F276 S277 R284 M411 | F276-V280 HydrophobicContact CD1-CG2 4.22Å; F276-V280 HydrophobicContact CD2-CG2 4.24Å; F276-V280 HydrophobicContact CE1-CG2 3.79Å; F276-V280 HydrophobicContact CE2-CG2 3.81Å; F276-V280 HydrophobicContact CG-CG2 4.43Å; F276-V280 HydrophobicContact CZ-CG2 3.57Å; F276-V280 WeakPolarHBondContact O-CG2 3.4Å; F276-V280 PolarHBondContact O-N 3.33Å; S277-V280 PolarHBondContact O-N 3.03Å; V280-R284 VanDerWaalsContact CG1-CZ 3.49Å; V280-R284 WeakPolarHBondContact O-CB 3.41Å; V280-R284 VanDerWaalsContact O-CG 3.22Å; V280-R284 WeakPolarHBondContact O-CG 3.31Å; V280-R284 PolarHBondContact O-N 2.95Å; V280-M411 HydrophobicContact CG1-CE 4.14Å |
| 281 | Q | 69.6 | Low | 68 | Low | 140 Ų | 140 | 74.4 Ų | 74.4 | 65% | 0.654 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -63.3 | -42.6 | 175.6 | -75.7 | 177.6 | -8.9 | 0 | 0 | 112.4 | S277 R278 Y279 R284 G285 | S277-Q281 WeakPolarHBondContact O-CG 3.38Å; S277-Q281 PolarHBondContact O-N 3.39Å; R278-Q281 PolarHBondContact O-N 3.33Å; Y279-Q281 VanDerWaalsContact C-N 3.3Å; Y279-Q281 PolarHBondContact O-N 3.18Å; Q281-R284 PolarHBondContact O-N 3.36Å; Q281-G285 PolarHBondContact O-N 3.47Å |
| 282 | K | 72.7 | Confident | 68.1 | Low | 129 Ų | 129 | 72.1 Ų | 72.1 | 56% | 0.561 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -63.2 | -51 | 176.4 | -173.8 | -179.1 | 177.7 | -171.7 | 0 | 111.1 | R278 Y279 R284 G285 T286 | R278-K282 WeakPolarHBondContact O-CB 3.48Å; R278-K282 PolarHBondContact O-N 3.46Å; Y279-K282 PolarHBondContact O-N 2.89Å; Y279-K282 VanDerWaalsContact O-N 3.16Å; K282-R284 PolarHBondContact O-N 2.85Å; K282-G285 PolarHBondContact O-N 2.8Å; K282-T286 PolarHBondContact O-N 3.5Å; K282-T286 PolarHBondContact O-OG1 3.03Å |
| 283 | V | 66.6 | Low | 68.6 | Low | 13 Ų | 13 | 78.5 Ų | 78.5 | 8% | 0.079 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -61.3 | -35 | -178.8 | 179.1 | 0 | 0 | 0 | 0 | 111.4 | Y279 G287 E288 Y412 | Y279-V283 HydrophobicContact CD1-CG2 4.33Å; Y279-V283 HydrophobicContact CD2-CG2 4.09Å; Y279-V283 HydrophobicContact CE1-CG2 3.96Å; Y279-V283 HydrophobicContact CE2-CG2 3.65Å; Y279-V283 HydrophobicContact CG-CG2 4.42Å; Y279-V283 WeakPolarHBondContact O-CG2 3.5Å; Y279-V283 PolarHBondContact O-N 3.5Å; V283-G287 WeakPolarHBondContact O-CA 3.39Å; V283-G287 PolarHBondContact O-N 3.47Å; V283-E288 VanDerWaalsContact CG1-O 3.31Å; V283-E288 WeakPolarHBondContact CG1-O 3.42Å; V283-Y412 HydrophobicContact CB-CD1 4.5Å; V283-Y412 HydrophobicContact CB-CE1 3.94Å; V283-Y412 HydrophobicContact CG1-CD1 3.48Å; V283-Y412 VanDerWaalsContact CG1-CD1 3.48Å; V283-Y412 HydrophobicContact CG1-CE1 3.23Å; V283-Y412 HydrophobicContact CG2-CE1 4.36Å |
| 284 | R | 62.4 | Low | 69 | Low | 83 Ų | 83 | 80.8 Ų | 80.8 | 31% | 0.313 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -69.6 | -46.6 | 174.4 | -73.1 | -179.8 | -174.6 | 170.7 | 7.6 | 113.9 | V280 Q281 K282 T286 | V280-R284 VanDerWaalsContact CG1-CZ 3.49Å; V280-R284 WeakPolarHBondContact O-CB 3.41Å; V280-R284 VanDerWaalsContact O-CG 3.22Å; V280-R284 WeakPolarHBondContact O-CG 3.31Å; V280-R284 PolarHBondContact O-N 2.95Å; Q281-R284 PolarHBondContact O-N 3.36Å; K282-R284 PolarHBondContact O-N 2.85Å; R284-T286 VanDerWaalsContact C-N 3.33Å; R284-T286 PolarHBondContact O-N 3.3Å |
| 285 | G | 66.6 | Low | 69.1 | Low | 72 Ų | 72 | 77.3 Ų | 77.3 | 74% | 0.742 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -68.9 | -32.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q281 K282 | Q281-G285 PolarHBondContact O-N 3.47Å; K282-G285 PolarHBondContact O-N 2.8Å |
| 286 | T | 65.7 | Low | 69.1 | Low | 93 Ų | 93 | 72.4 Ų | 72.4 | 57% | 0.571 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -99.9 | -17.4 | -175.9 | -3.8 | 0 | 0 | 0 | 0 | 113.6 | K282 R284 E288 | K282-T286 PolarHBondContact O-N 3.5Å; K282-T286 PolarHBondContact O-OG1 3.03Å; R284-T286 VanDerWaalsContact C-N 3.33Å; R284-T286 PolarHBondContact O-N 3.3Å; T286-E288 PolarHBondContact O-N 3.45Å; T286-E288 VanDerWaalsContact O-N 3.14Å |
| 287 | G | 61.8 | Low | 69.3 | Low | 60 Ų | 60 | 78.4 Ų | 78.4 | 62% | 0.619 | 41% | 0.405 | S | S | * | . | trans | 64.3 | 12 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | V283 | V283-G287 WeakPolarHBondContact O-CA 3.39Å; V283-G287 PolarHBondContact O-N 3.47Å | ||
| 288 | E | 61.3 | Low | 69.3 | Low | 121 Ų | 121 | 77 Ų | 77 | 57% | 0.565 | 39% | 0.392 | S | S | * | . | P | Polyproline II helix | trans | -74.6 | 142.7 | -175 | -161.2 | 176.1 | -170 | 0 | 0 | 110.8 | V283 T286 | V283-E288 VanDerWaalsContact CG1-O 3.31Å; V283-E288 WeakPolarHBondContact CG1-O 3.42Å; T286-E288 PolarHBondContact O-N 3.45Å; T286-E288 VanDerWaalsContact O-N 3.14Å |
| 289 | Q | 60.7 | Low | 68.8 | Low | 112 Ų | 112 | 68.4 Ų | 68.4 | 52% | 0.523 | 36% | 0.36 | S | S | . | . | P | Polyproline II helix | trans | -68 | 129.3 | 178.6 | -71 | -162.5 | 38.8 | 0 | 0 | 110.4 | S291 | Q289-S291 PolarHBondContact O-N 3Š|
| 290 | P | 65.9 | Low | 68.7 | Low | 9 Ų | 9 | 73.9 Ų | 73.9 | 6% | 0.058 | 39% | 0.385 | C | S | . | . | P | Polyproline II helix | trans | -61.3 | 133 | -179.8 | 26.2 | -37.4 | 0 | 0 | 0 | 111.4 | Y279 I295 Q390 Y412 | Y279-P290 HydrophobicContact CE1-CB 4.3Å; Y279-P290 WeakPolarHBondContact OH-CA 3.48Å; Y279-P290 WeakPolarHBondContact OH-CB 3.45Å; P290-I295 HydrophobicContact CB-CD1 3.9Å; P290-I295 HydrophobicContact CB-CG1 3.94Å; P290-I295 HydrophobicContact CG-CD1 3.87Å; P290-I295 HydrophobicContact CG-CG1 4.38Å; P290-Q390 PolarHBondContact O-NE2 2.98Å; P290-Q390 VanDerWaalsContact O-NE2 3.1Å; P290-Y412 HydrophobicContact CB-CE1 4.32Å; P290-Y412 HydrophobicContact CB-CE2 4.45Å; P290-Y412 WeakPolarHBondContact CB-OH 3.34Å; P290-Y412 HydrophobicContact CG-CD2 4.34Å; P290-Y412 HydrophobicContact CG-CE1 4Å; P290-Y412 HydrophobicContact CG-CE2 3.69Å; P290-Y412 VanDerWaalsContact CG-CZ 3.49Å |
| 291 | S | 70.4 | Confident | 68.5 | Low | 59 Ų | 59 | 75.4 Ų | 75.4 | 41% | 0.413 | 39% | 0.392 | S | S | . | . | P | Polyproline II helix | trans | -66.4 | 134.4 | 177.8 | -179.5 | 0 | 0 | 0 | 0 | 110.7 | Y279 Q289 K293 E294 I295 | Y279-S291 PolarHBondContact OH-N 2.96Å; Q289-S291 PolarHBondContact O-N 3Å; S291-K293 PolarHBondContact O-N 3.49Å; S291-K293 VanDerWaalsContact O-N 3.08Å; S291-E294 WeakPolarHBondContact CB-OE2 3.26Å; S291-E294 PolarHBondContact N-OE2 3.36Å; S291-E294 PolarHBondContact O-N 3.49Å; S291-I295 WeakPolarHBondContact O-CG1 3.25Å; S291-I295 PolarHBondContact O-N 2.93Å; S291-I295 VanDerWaalsContact O-N 3.14Å |
| 292 | T | 71.3 | Confident | 68 | Low | 49 Ų | 49 | 70.8 Ų | 70.8 | 30% | 0.301 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -50.1 | -38.3 | 178.8 | -52.2 | 0 | 0 | 0 | 0 | 112.1 | E294 I295 V296 L394 | T292-E294 PolarHBondContact O-N 3.03Å; T292-I295 PolarHBondContact O-N 2.82Å; T292-V296 VanDerWaalsContact O-CG2 3.3Å; T292-V296 WeakPolarHBondContact O-CG2 3.34Å; T292-V296 PolarHBondContact O-N 3.03Å; T292-V296 VanDerWaalsContact O-N 3.11Å; T292-L394 HydrophobicContact CG2-CD2 3.52Å; T292-L394 HydrophobicContact CG2-CG 4.09Å |
| 293 | K | 78.3 | Confident | 67.4 | Low | 175 Ų | 175 | 68.2 Ų | 68.2 | 76% | 0.761 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -67 | -35.6 | -179.7 | -63.9 | -177 | -179.7 | 179.7 | 0 | 113.3 | S291 R297 | S291-K293 PolarHBondContact O-N 3.49Å; S291-K293 VanDerWaalsContact O-N 3.08Å; K293-R297 PolarHBondContact O-N 3.34Å; K293-R297 VanDerWaalsContact O-N 3.16Å |
| 294 | E | 73.6 | Confident | 66.5 | Low | 75 Ų | 75 | 74.4 Ų | 74.4 | 35% | 0.35 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -74.5 | -40.5 | 178.8 | -66 | 169 | 149.3 | 0 | 0 | 110.3 | Y279 S291 T292 V296 R297 F298 | Y279-E294 HydrophobicContact CE2-CB 4.11Å; Y279-E294 VanDerWaalsContact CE2-CD 3.45Å; Y279-E294 HydrophobicContact CE2-CG 4.34Å; Y279-E294 WeakPolarHBondContact CE2-OE2 3.42Å; Y279-E294 VanDerWaalsContact CZ-OE2 3.3Å; Y279-E294 PolarHBondContact OH-OE2 3.12Å; S291-E294 WeakPolarHBondContact CB-OE2 3.26Å; S291-E294 PolarHBondContact N-OE2 3.36Å; S291-E294 PolarHBondContact O-N 3.49Å; T292-E294 PolarHBondContact O-N 3.03Å; E294-V296 VanDerWaalsContact C-N 3.32Å; E294-V296 PolarHBondContact O-N 3.5Å; E294-R297 PolarHBondContact O-N 2.95Å; E294-R297 VanDerWaalsContact O-N 3.16Å; E294-F298 HydrophobicContact CB-CD2 4.33Å; E294-F298 HydrophobicContact CB-CE2 4.12Å; E294-F298 WeakPolarHBondContact O-CD2 3.25Å; E294-F298 PolarHBondContact O-N 2.9Å |
| 295 | I | 72.3 | Confident | 65.9 | Low | 9 Ų | 9 | 73.3 Ų | 73.3 | 5% | 0.046 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -58.9 | -45 | 175.8 | -59.6 | 168.4 | 0 | 0 | 0 | 110.7 | P290 S291 T292 R297 F298 S299 L394 L405 | P290-I295 HydrophobicContact CB-CD1 3.9Å; P290-I295 HydrophobicContact CB-CG1 3.94Å; P290-I295 HydrophobicContact CG-CD1 3.87Å; P290-I295 HydrophobicContact CG-CG1 4.38Å; S291-I295 WeakPolarHBondContact O-CG1 3.25Å; S291-I295 PolarHBondContact O-N 2.93Å; S291-I295 VanDerWaalsContact O-N 3.14Å; T292-I295 PolarHBondContact O-N 2.82Å; I295-R297 VanDerWaalsContact C-N 3.34Å; I295-F298 PolarHBondContact O-N 2.95Å; I295-S299 WeakPolarHBondContact O-CB 3.46Å; I295-S299 PolarHBondContact O-N 2.94Å; I295-L394 HydrophobicContact CB-CD2 4.24Å; I295-L394 HydrophobicContact CD1-CD1 3.93Å; I295-L394 HydrophobicContact CG2-CD1 4.12Å; I295-L394 HydrophobicContact CG2-CD2 4.06Å; I295-L405 HydrophobicContact CG2-CD2 4.49Å |
| 296 | V | 73.6 | Confident | 65.3 | Low | 24 Ų | 24 | 70.6 Ų | 70.6 | 15% | 0.145 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -66.3 | -35.3 | 177.6 | 174 | 0 | 0 | 0 | 0 | 112 | T292 E294 S299 L394 E398 V400 | T292-V296 VanDerWaalsContact O-CG2 3.3Å; T292-V296 WeakPolarHBondContact O-CG2 3.34Å; T292-V296 PolarHBondContact O-N 3.03Å; T292-V296 VanDerWaalsContact O-N 3.11Å; E294-V296 VanDerWaalsContact C-N 3.32Å; E294-V296 PolarHBondContact O-N 3.5Å; V296-S299 PolarHBondContact O-OG 3.34Å; V296-L394 HydrophobicContact CG2-CD2 3.78Å; V296-E398 HydrophobicContact CG2-CB 3.85Å; V296-E398 HydrophobicContact CG2-CG 3.68Å; V296-V400 HydrophobicContact CG2-CG2 4.42Å |
| 297 | R | 74.8 | Confident | 65.1 | Low | 157 Ų | 157 | 68.9 Ų | 68.9 | 59% | 0.592 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -65.4 | -48.3 | 175.7 | -174.6 | -176.1 | -63.6 | -175.7 | -0.7 | 110.8 | K293 E294 I295 S299 | K293-R297 PolarHBondContact O-N 3.34Å; K293-R297 VanDerWaalsContact O-N 3.16Å; E294-R297 PolarHBondContact O-N 2.95Å; E294-R297 VanDerWaalsContact O-N 3.16Å; I295-R297 VanDerWaalsContact C-N 3.34Å; R297-S299 VanDerWaalsContact C-N 3.32Å |
| 298 | F | 68.6 | Low | 65.2 | Low | 18 Ų | 18 | 67.3 Ų | 67.3 | 8% | 0.079 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -75.3 | -21.2 | -178.8 | -62.2 | -58.1 | 0 | 0 | 0 | 112.5 | R275 F276 Y279 E294 I295 K300 L301 F302 | R275-F298 HydrophobicContact CB-CE1 4.16Å; R275-F298 HydrophobicContact CB-CZ 4.42Å; F276-F298 HydrophobicContact CB-CD1 3.89Å; F276-F298 HydrophobicContact CB-CE1 3.95Å; F276-F298 HydrophobicContact CD2-CB 3.93Å; F276-F298 AromaticContact CD2-CD1 3.93Å; F276-F298 HydrophobicContact CD2-CD1 3.93Å; F276-F298 HydrophobicContact CD2-CD2 4.26Å; F276-F298 AromaticContact CD2-CG 3.78Å; F276-F298 HydrophobicContact CD2-CG 3.78Å; F276-F298 HydrophobicContact CE2-CB 4.37Å; F276-F298 HydrophobicContact CG-CD1 4.4Å; Y279-F298 AromaticContact CD1-CD2 3.88Å; Y279-F298 HydrophobicContact CD1-CD2 3.88Å; Y279-F298 AromaticContact CD1-CE2 3.64Å; Y279-F298 HydrophobicContact CD1-CE2 3.64Å; Y279-F298 HydrophobicContact CD2-CE2 4.16Å; Y279-F298 HydrophobicContact CE1-CD2 4.14Å; Y279-F298 HydrophobicContact CE1-CE2 4.13Å; Y279-F298 HydrophobicContact CG-CD2 4.33Å; Y279-F298 AromaticContact CG-CE2 3.61Å; Y279-F298 HydrophobicContact CG-CE2 3.61Å; Y279-F298 HydrophobicContact CG-CZ 4.26Å; E294-F298 HydrophobicContact CB-CD2 4.33Å; E294-F298 HydrophobicContact CB-CE2 4.12Å; E294-F298 WeakPolarHBondContact O-CD2 3.25Å; E294-F298 PolarHBondContact O-N 2.9Å; I295-F298 PolarHBondContact O-N 2.95Å; F298-K300 VanDerWaalsContact C-N 3.34Å; F298-K300 PolarHBondContact O-N 3.27Å; F298-L301 HydrophobicContact CB-CD1 4.46Å; F298-L301 HydrophobicContact CD1-CD1 3.74Å; F298-L301 WeakPolarHBondContact O-CB 3.39Å; F298-L301 PolarHBondContact O-N 3.14Å; F298-F302 WeakPolarHBondContact O-CD2 3.21Å |
| 299 | S | 67.6 | Low | 65.5 | Low | 1 Ų | 1 | 68.7 Ų | 68.7 | 1% | 0.007 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.4 | -38 | 176.8 | 71.1 | 0 | 0 | 0 | 0 | 112.5 | I295 V296 R297 L301 F302 E303 L404 | I295-S299 WeakPolarHBondContact O-CB 3.46Å; I295-S299 PolarHBondContact O-N 2.94Å; V296-S299 PolarHBondContact O-OG 3.34Å; R297-S299 VanDerWaalsContact C-N 3.32Å; S299-L301 PolarHBondContact O-N 3.13Å; S299-L301 VanDerWaalsContact O-N 3.13Å; S299-F302 PolarHBondContact O-N 2.9Å; S299-E303 PolarHBondContact O-N 3.46Å; S299-E303 VanDerWaalsContact O-N 3.11Å; S299-L404 WeakPolarHBondContact O-CD1 3.28Å |
| 300 | K | 70.2 | Confident | 66 | Low | 136 Ų | 136 | 69.8 Ų | 69.8 | 59% | 0.591 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -60.9 | -26.3 | 178.6 | -64.9 | -176.6 | -179.7 | -174.6 | 0 | 113.5 | F298 F302 | F298-K300 VanDerWaalsContact C-N 3.34Å; F298-K300 PolarHBondContact O-N 3.27Å; K300-F302 PolarHBondContact O-N 3.32Å |
| 301 | L | 64.3 | Low | 66.4 | Low | 49 Ų | 49 | 69.9 Ų | 69.9 | 26% | 0.257 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -70.2 | -21.5 | 175.6 | -63.8 | 159.4 | 0 | 0 | 0 | 112.8 | E272 F298 S299 | E272-L301 HydrophobicContact CB-CD1 3.77Å; E272-L301 HydrophobicContact CB-CD2 3.52Å; E272-L301 HydrophobicContact CB-CG 4.27Å; E272-L301 HydrophobicContact CG-CD2 4.11Å; F298-L301 HydrophobicContact CB-CD1 4.46Å; F298-L301 HydrophobicContact CD1-CD1 3.74Å; F298-L301 WeakPolarHBondContact O-CB 3.39Å; F298-L301 PolarHBondContact O-N 3.14Å; S299-L301 PolarHBondContact O-N 3.13Å; S299-L301 VanDerWaalsContact O-N 3.13Å |
| 302 | F | 59.9 | Low | 66.9 | Low | 42 Ų | 42 | 72.4 Ų | 72.4 | 18% | 0.184 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -107.5 | -11.3 | -178.4 | -61.6 | -78.6 | 0 | 0 | 0 | 113 | F276 F298 S299 K300 D304 L306 L404 | F276-F302 HydrophobicContact CD1-CZ 4.28Å; F276-F302 HydrophobicContact CD2-CE2 4.32Å; F276-F302 HydrophobicContact CE1-CE2 4.42Å; F276-F302 AromaticContact CE1-CZ 3.83Å; F276-F302 HydrophobicContact CE1-CZ 3.83Å; F276-F302 AromaticContact CE2-CE2 3.93Å; F276-F302 HydrophobicContact CE2-CE2 3.93Å; F276-F302 HydrophobicContact CE2-CZ 4.16Å; F276-F302 AromaticContact CZ-CE2 3.97Å; F276-F302 HydrophobicContact CZ-CE2 3.97Å; F276-F302 AromaticContact CZ-CZ 3.75Å; F276-F302 HydrophobicContact CZ-CZ 3.75Å; F298-F302 WeakPolarHBondContact O-CD2 3.21Å; S299-F302 PolarHBondContact O-N 2.9Å; K300-F302 PolarHBondContact O-N 3.32Å; F302-D304 PolarHBondContact O-N 3.42Å; F302-L306 HydrophobicContact CB-CB 3.92Å; F302-L306 HydrophobicContact CD1-CB 4.47Å; F302-L306 HydrophobicContact CD1-CD1 4.11Å; F302-L306 WeakPolarHBondContact O-CA 3.29Å; F302-L306 WeakPolarHBondContact O-CB 3.29Å; F302-L306 PolarHBondContact O-N 3.31Å; F302-L404 HydrophobicContact CB-CD1 3.68Å; F302-L404 HydrophobicContact CB-CG 4.02Å |
| 303 | E | 59.5 | Low | 67.5 | Low | 76 Ų | 76 | 76 Ų | 76 | 36% | 0.355 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | -179.5 | -82.8 | 169.1 | -155.3 | 0 | 0 | 112.7 | S299 P401 L404 | S299-E303 PolarHBondContact O-N 3.46Å; S299-E303 VanDerWaalsContact O-N 3.11Å; E303-P401 HydrophobicContact CG-CG 4.36Å; E303-L404 HydrophobicContact CG-CD1 4.23Å |
| 304 | D | 47.6 | Very low | 67.7 | Low | 143 Ų | 143 | 70.5 Ų | 70.5 | 77% | 0.765 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -24.7 | -175.8 | -70.6 | -30.3 | 0 | 0 | 0 | 114.1 | F302 | F302-D304 PolarHBondContact O-N 3.42Š|
| 305 | E | 49.3 | Very low | 67.9 | Low | 59 Ų | 59 | 67.3 Ų | 67.3 | 28% | 0.276 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108 | -20.6 | -175 | -66.8 | -167.5 | 168.3 | 0 | 0 | 114 | N263 K266 | N263-E305 PolarHBondContact ND2-OE2 2.81Å; K266-E305 IonicContact NZ-OE1 2.65Å; K266-E305 PolarHBondContact NZ-OE1 3.46Å |
| 306 | L | 54.2 | Low | 68.4 | Low | 15 Ų | 15 | 66.9 Ų | 66.9 | 8% | 0.079 | 32% | 0.316 | C | S | . | . | trans | -103.4 | 32.8 | -178.6 | -153.5 | 105.1 | 0 | 0 | 0 | 112.5 | M259 F302 L308 L311 L407 | M259-L306 HydrophobicContact CE-CD1 4.04Å; F302-L306 HydrophobicContact CB-CB 3.92Å; F302-L306 HydrophobicContact CD1-CB 4.47Å; F302-L306 HydrophobicContact CD1-CD1 4.11Å; F302-L306 WeakPolarHBondContact O-CA 3.29Å; F302-L306 WeakPolarHBondContact O-CB 3.29Å; F302-L306 PolarHBondContact O-N 3.31Å; L306-L308 PolarHBondContact O-N 3.43Å; L306-L311 HydrophobicContact CD1-CD2 4.29Å; L306-L311 HydrophobicContact CG-CD2 4.42Å; L306-L407 HydrophobicContact CD1-CD2 3.52Å; L306-L407 HydrophobicContact CD2-CB 4.39Å; L306-L407 HydrophobicContact CD2-CD2 3.44Å; L306-L407 VanDerWaalsContact CD2-CD2 3.44Å; L306-L407 HydrophobicContact CG-CD2 4.11Å | ||
| 307 | T | 61.6 | Low | 68.8 | Low | 57 Ų | 57 | 67 Ų | 67 | 35% | 0.35 | 32% | 0.316 | S | S | . | . | trans | -61.2 | 138.3 | 162.9 | 64.9 | 0 | 0 | 0 | 0 | 107.6 | E309 H310 | T307-E309 PolarHBondContact O-N 2.99Å; T307-H310 PolarHBondContact O-N 2.91Å; T307-H310 PolarHBondContact OG1-CE1 3.24Å; T307-H310 VanDerWaalsContact OG1-CE1 3.32Å; T307-H310 PolarHBondContact OG1-ND1 3.47Å | ||
| 308 | L | 65.1 | Low | 69.1 | Low | 27 Ų | 27 | 59.9 Ų | 59.9 | 14% | 0.141 | 29% | 0.291 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53 | -14.8 | -178.1 | -64.6 | 175.4 | 0 | 0 | 0 | 113.7 | L306 L311 R335 L338 L342 | L306-L308 PolarHBondContact O-N 3.43Å; L308-L311 HydrophobicContact CD2-CD1 3.78Å; L308-R335 WeakPolarHBondContact O-CD 3.29Å; L308-R335 PolarHBondContact O-NE 2.92Å; L308-L338 HydrophobicContact CD1-CD2 4.14Å; L308-L338 HydrophobicContact CD1-CG 4.1Å; L308-L338 HydrophobicContact CD2-CD2 3.4Å; L308-L338 VanDerWaalsContact CD2-CD2 3.4Å; L308-L338 HydrophobicContact CD2-CG 4.17Å; L308-L338 HydrophobicContact CG-CD2 4.35Å; L308-L342 HydrophobicContact CD1-CD1 3.76Å |
| 309 | E | 67.1 | Low | 69.5 | Low | 151 Ų | 151 | 59.4 Ų | 59.4 | 71% | 0.706 | 29% | 0.29 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.5 | -35.2 | 178.5 | -53.4 | -156.3 | 161.5 | 0 | 0 | 113.1 | T307 R335 | T307-E309 PolarHBondContact O-N 2.99Å; E309-R335 PolarHBondContact O-NH2 3.39Å |
| 310 | H | 71.3 | Confident | 70.4 | Confident | 134 Ų | 134 | 59.4 Ų | 59.4 | 62% | 0.62 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | -9 | -179.9 | -58.9 | 108.7 | 0 | 0 | 0 | 113.5 | T307 E312 | T307-H310 PolarHBondContact O-N 2.91Å; T307-H310 PolarHBondContact OG1-CE1 3.24Å; T307-H310 VanDerWaalsContact OG1-CE1 3.32Å; T307-H310 PolarHBondContact OG1-ND1 3.47Å; H310-E312 PolarHBondContact O-N 3.4Å |
| 311 | L | 74.9 | Confident | 71 | Confident | 11 Ų | 11 | 56.8 Ų | 56.8 | 6% | 0.058 | 28% | 0.278 | C | S | . | . | trans | -70.8 | 131.2 | 177.6 | -65 | 177.1 | 0 | 0 | 0 | 111 | L306 L308 Q315 L316 L319 R335 | L306-L311 HydrophobicContact CD1-CD2 4.29Å; L306-L311 HydrophobicContact CG-CD2 4.42Å; L308-L311 HydrophobicContact CD2-CD1 3.78Å; L311-Q315 VanDerWaalsContact CA-OE1 3.24Å; L311-Q315 HydrophobicContact CB-CB 4.32Å; L311-Q315 HydrophobicContact CD2-CB 4.39Å; L311-L316 HydrophobicContact CB-CD2 3.89Å; L311-L316 HydrophobicContact CB-CG 4.01Å; L311-L316 HydrophobicContact CD1-CD2 4.2Å; L311-L319 HydrophobicContact CD1-CD1 3.55Å; L311-R335 PolarHBondContact O-NH2 3.32Å | ||
| 312 | E | 80.6 | Confident | 71.6 | Confident | 113 Ų | 113 | 54.5 Ų | 54.5 | 53% | 0.528 | 27% | 0.266 | S | S | . | . | trans | -74.9 | 158.8 | 179.2 | -147.2 | 174 | -154.5 | 0 | 0 | 110.8 | H310 P314 Q315 L316 | H310-E312 PolarHBondContact O-N 3.4Å; E312-P314 VanDerWaalsContact C-CD 3.45Å; E312-P314 VanDerWaalsContact C-N 3.34Å; E312-Q315 HydrophobicContact CB-CG 4.37Å; E312-Q315 WeakPolarHBondContact O-CB 3.47Å; E312-Q315 PolarHBondContact O-N 3.1Å; E312-L316 PolarHBondContact O-N 3.48Å | ||
| 313 | R | 83.8 | Confident | 72.6 | Confident | 123 Ų | 123 | 52.7 Ų | 52.7 | 46% | 0.464 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -51.8 | -45.5 | -176.4 | -176.1 | 175.6 | -169.5 | -93.7 | -1.7 | 113.4 | Q315 L316 V317 N331 | R313-Q315 VanDerWaalsContact C-N 3.28Å; R313-Q315 PolarHBondContact O-N 3.22Å; R313-L316 PolarHBondContact O-N 2.84Å; R313-V317 HydrophobicContact CG-CG2 4.23Å; R313-V317 VanDerWaalsContact O-CG2 3.29Å; R313-V317 WeakPolarHBondContact O-CG2 3.34Å; R313-V317 PolarHBondContact O-N 3.37Å; R313-N331 VanDerWaalsContact CB-OD1 3.26Å; R313-N331 WeakPolarHBondContact CB-OD1 3.24Å; R313-N331 WeakPolarHBondContact CD-OD1 3.32Å; R313-N331 WeakPolarHBondContact CG-OD1 3.37Å |
| 314 | P | 81.8 | Confident | 73.7 | Confident | 61 Ų | 61 | 54 Ų | 54 | 40% | 0.396 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -57.3 | -42.7 | 177.9 | -27.3 | 38.5 | 0 | 0 | 0 | 112.2 | F251 E312 V317 A318 | F251-P314 HydrophobicContact CE1-CB 3.8Å; F251-P314 HydrophobicContact CE2-CB 3.98Å; F251-P314 HydrophobicContact CZ-CB 3.29Å; F251-P314 HydrophobicContact CZ-CG 4.43Å; E312-P314 VanDerWaalsContact C-CD 3.45Å; E312-P314 VanDerWaalsContact C-N 3.34Å; P314-V317 PolarHBondContact O-N 2.88Å; P314-A318 WeakPolarHBondContact O-CB 3.26Å; P314-A318 PolarHBondContact O-N 3.24Å |
| 315 | Q | 77.4 | Confident | 75.4 | Confident | 7 Ų | 7 | 49.1 Ų | 49.1 | 3% | 0.033 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -66.2 | -41.5 | -179.6 | -54.1 | 166.3 | -0.7 | 0 | 0 | 111.8 | F251 T255 L311 E312 R313 A318 L319 | F251-Q315 HydrophobicContact CE1-CB 4.28Å; F251-Q315 HydrophobicContact CE1-CG 3.75Å; F251-Q315 HydrophobicContact CZ-CG 4.28Å; T255-Q315 VanDerWaalsContact CG2-CD 3.43Å; T255-Q315 HydrophobicContact CG2-CG 3.72Å; L311-Q315 VanDerWaalsContact CA-OE1 3.24Å; L311-Q315 HydrophobicContact CB-CB 4.32Å; L311-Q315 HydrophobicContact CD2-CB 4.39Å; E312-Q315 HydrophobicContact CB-CG 4.37Å; E312-Q315 WeakPolarHBondContact O-CB 3.47Å; E312-Q315 PolarHBondContact O-N 3.1Å; R313-Q315 VanDerWaalsContact C-N 3.28Å; R313-Q315 PolarHBondContact O-N 3.22Å; Q315-A318 PolarHBondContact O-N 2.98Å; Q315-L319 WeakPolarHBondContact O-CG 3.37Å; Q315-L319 PolarHBondContact O-N 3.3Å |
| 316 | L | 82.4 | Confident | 77.1 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.1 | -46.8 | 175.3 | -69.4 | 170.5 | 0 | 0 | 0 | 112 | L311 E312 R313 A318 L319 C320 N331 L334 R335 L338 | L311-L316 HydrophobicContact CB-CD2 3.89Å; L311-L316 HydrophobicContact CB-CG 4.01Å; L311-L316 HydrophobicContact CD1-CD2 4.2Å; E312-L316 PolarHBondContact O-N 3.48Å; R313-L316 PolarHBondContact O-N 2.84Å; L316-A318 PolarHBondContact O-N 3.32Å; L316-L319 PolarHBondContact O-N 3.18Å; L316-C320 WeakPolarHBondContact O-CB 3.09Å; L316-C320 PolarHBondContact O-N 3.29Å; L316-C320 PolarHBondContact O-SG 3.05Å; L316-N331 HydrophobicContact CD1-CB 4.28Å; L316-L334 HydrophobicContact CB-CB 4.22Å; L316-L334 HydrophobicContact CB-CD1 4.17Å; L316-R335 HydrophobicContact CD1-CG 3.8Å; L316-R335 HydrophobicContact CD2-CG 3.75Å; L316-R335 HydrophobicContact CG-CG 4.45Å; L316-L338 HydrophobicContact CD2-CD2 4.4Å |
| 317 | V | 84 | Confident | 78.5 | Confident | 27 Ų | 27 | 52.8 Ų | 52.8 | 16% | 0.164 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.3 | -42.8 | 176.1 | 167.7 | 0 | 0 | 0 | 0 | 110.1 | R313 P314 C320 K321 P327 L334 | R313-V317 HydrophobicContact CG-CG2 4.23Å; R313-V317 VanDerWaalsContact O-CG2 3.29Å; R313-V317 WeakPolarHBondContact O-CG2 3.34Å; R313-V317 PolarHBondContact O-N 3.37Å; P314-V317 PolarHBondContact O-N 2.88Å; V317-C320 PolarHBondContact O-N 3.23Å; V317-K321 WeakPolarHBondContact O-CG 3.47Å; V317-K321 PolarHBondContact O-N 3.26Å; V317-P327 HydrophobicContact CB-CB 4.21Å; V317-P327 HydrophobicContact CG1-CB 3.85Å; V317-P327 HydrophobicContact CG1-CG 3.88Å; V317-P327 HydrophobicContact CG2-CB 4.13Å; V317-L334 HydrophobicContact CG2-CD1 3.72Å |
| 318 | A | 79.3 | Confident | 79.6 | Confident | 8 Ų | 8 | 54.9 Ų | 54.9 | 7% | 0.066 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.8 | -47.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | L248 F251 P314 Q315 L316 C320 K321 L322 | L248-A318 VanDerWaalsContact CD1-CA 3.43Å; L248-A318 HydrophobicContact CD1-CB 2.99Å; L248-A318 VanDerWaalsContact CD1-O 3.27Å; L248-A318 WeakPolarHBondContact CD1-O 3.26Å; L248-A318 WeakPolarHBondContact CD2-O 3.42Å; L248-A318 HydrophobicContact CG-CB 4.36Å; F251-A318 HydrophobicContact CD1-CB 3.75Å; F251-A318 HydrophobicContact CE1-CB 4.37Å; P314-A318 WeakPolarHBondContact O-CB 3.26Å; P314-A318 PolarHBondContact O-N 3.24Å; Q315-A318 PolarHBondContact O-N 2.98Å; L316-A318 PolarHBondContact O-N 3.32Å; A318-C320 VanDerWaalsContact C-N 3.31Å; A318-C320 PolarHBondContact O-N 3.43Å; A318-K321 WeakPolarHBondContact O-CB 3.29Å; A318-K321 PolarHBondContact O-N 2.86Å; A318-K321 VanDerWaalsContact O-N 3.15Å; A318-L322 PolarHBondContact O-N 3.49Å; A318-L322 VanDerWaalsContact O-N 3.07Å |
| 319 | L | 78.6 | Confident | 80.6 | Confident | 8 Ų | 8 | 55.4 Ų | 55.4 | 4% | 0.042 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.4 | -37.5 | 173.9 | -73.3 | 175.4 | 0 | 0 | 0 | 113 | L252 L311 Q315 L316 K321 L322 L323 L338 L406 | L252-L319 HydrophobicContact CD1-CD2 4.26Å; L311-L319 HydrophobicContact CD1-CD1 3.55Å; Q315-L319 WeakPolarHBondContact O-CG 3.37Å; Q315-L319 PolarHBondContact O-N 3.3Å; L316-L319 PolarHBondContact O-N 3.18Å; L319-K321 VanDerWaalsContact C-N 3.35Å; L319-K321 PolarHBondContact O-N 3.26Å; L319-L322 HydrophobicContact CD2-CD2 4.47Å; L319-L322 VanDerWaalsContact O-CB 3.26Å; L319-L322 WeakPolarHBondContact O-CB 3.31Å; L319-L322 PolarHBondContact O-N 2.85Å; L319-L323 PolarHBondContact O-N 3.37Å; L319-L338 HydrophobicContact CB-CD2 4.21Å; L319-L338 HydrophobicContact CD1-CD2 3.96Å; L319-L406 HydrophobicContact CD2-CD2 4.23Å |
| 320 | C | 85.1 | Confident | 81.7 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 174.6 | -69.7 | 0 | 0 | 0 | 0 | 111.1 | L316 V317 A318 L322 L323 E324 L325 P327 | L316-C320 WeakPolarHBondContact O-CB 3.09Å; L316-C320 PolarHBondContact O-N 3.29Å; L316-C320 PolarHBondContact O-SG 3.05Å; V317-C320 PolarHBondContact O-N 3.23Å; A318-C320 VanDerWaalsContact C-N 3.31Å; A318-C320 PolarHBondContact O-N 3.43Å; C320-L322 VanDerWaalsContact C-N 3.31Å; C320-L322 PolarHBondContact O-N 3.25Å; C320-L323 PolarHBondContact O-N 3.22Å; C320-E324 PolarHBondContact O-N 3.15Å; C320-L325 CarbonylContact C-O 3.53Å; C320-L325 HydrophobicContact CB-CB 4.1Å; C320-L325 WeakPolarHBondContact O-CA 3.4Å; C320-L325 WeakPolarHBondContact O-CB 3.48Å; C320-L325 PolarHBondContact O-N 2.94Å; C320-P327 HydrophobicContact CB-CB 4.08Å |
| 321 | K | 82.4 | Confident | 82.6 | Confident | 81 Ų | 81 | 49 Ų | 49 | 35% | 0.352 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.5 | -36.8 | 175.1 | -71.4 | 178.2 | 176.9 | -174.8 | 0 | 112.6 | A244 V317 A318 L319 L323 E324 P327 | A244-K321 HydrophobicContact CB-CB 4.29Å; A244-K321 HydrophobicContact CB-CD 4.49Å; V317-K321 WeakPolarHBondContact O-CG 3.47Å; V317-K321 PolarHBondContact O-N 3.26Å; A318-K321 WeakPolarHBondContact O-CB 3.29Å; A318-K321 PolarHBondContact O-N 2.86Å; A318-K321 VanDerWaalsContact O-N 3.15Å; L319-K321 VanDerWaalsContact C-N 3.35Å; L319-K321 PolarHBondContact O-N 3.26Å; K321-L323 VanDerWaalsContact C-N 3.32Å; K321-L323 PolarHBondContact O-N 3.07Å; K321-E324 PolarHBondContact O-N 3.04Å; K321-P327 HydrophobicContact CG-CG 4.24Å |
| 322 | L | 78.3 | Confident | 83.3 | Confident | 1 Ų | 1 | 54.1 Ų | 54.1 | 1% | 0.005 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -57.3 | -46.1 | 175.6 | -165.9 | 49.9 | 0 | 0 | 0 | 112.6 | K245 L248 A318 L319 C320 E324 L406 A410 L413 | K245-L322 HydrophobicContact CB-CD1 4.36Å; K245-L322 HydrophobicContact CD-CD1 4.36Å; K245-L322 VanDerWaalsContact CE-O 3.26Å; K245-L322 WeakPolarHBondContact CE-O 3.19Å; K245-L322 HydrophobicContact CG-CD1 3.79Å; L248-L322 HydrophobicContact CD2-CB 3.26Å; L248-L322 HydrophobicContact CD2-CD1 3.57Å; L248-L322 HydrophobicContact CD2-CD2 3.81Å; L248-L322 HydrophobicContact CD2-CG 3.67Å; A318-L322 PolarHBondContact O-N 3.49Å; A318-L322 VanDerWaalsContact O-N 3.07Å; L319-L322 HydrophobicContact CD2-CD2 4.47Å; L319-L322 VanDerWaalsContact O-CB 3.26Å; L319-L322 WeakPolarHBondContact O-CB 3.31Å; L319-L322 PolarHBondContact O-N 2.85Å; C320-L322 VanDerWaalsContact C-N 3.31Å; C320-L322 PolarHBondContact O-N 3.25Å; L322-E324 PolarHBondContact O-N 3.36Å; L322-L406 HydrophobicContact CD2-CD1 3.63Å; L322-L406 HydrophobicContact CD2-CD2 4.25Å; L322-L406 HydrophobicContact CD2-CG 3.72Å; L322-L406 HydrophobicContact CG-CD1 4.27Å; L322-A410 HydrophobicContact CD2-CB 3.85Å; L322-L413 HydrophobicContact CD1-CD2 4.25Å |
| 323 | L | 80.8 | Confident | 83.7 | Confident | 5 Ų | 5 | 52.2 Ų | 52.2 | 3% | 0.026 | 28% | 0.278 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.9 | 9.9 | -176.1 | -65.6 | 179.3 | 0 | 0 | 0 | 112.3 | L319 C320 K321 L325 L338 K341 I345 L406 | L319-L323 PolarHBondContact O-N 3.37Å; C320-L323 PolarHBondContact O-N 3.22Å; K321-L323 VanDerWaalsContact C-N 3.32Å; K321-L323 PolarHBondContact O-N 3.07Å; L323-L325 HydrophobicContact CB-CD1 4.16Å; L323-L325 HydrophobicContact CB-CG 3.99Å; L323-L325 HydrophobicContact CD1-CD1 4.47Å; L323-L325 PolarHBondContact O-N 3.5Å; L323-L338 HydrophobicContact CD1-CD1 3.31Å; L323-K341 HydrophobicContact CB-CG 4.39Å; L323-K341 HydrophobicContact CD1-CB 4.39Å; L323-K341 HydrophobicContact CD1-CG 3.78Å; L323-I345 HydrophobicContact CD2-CD1 4.4Å; L323-L406 HydrophobicContact CD1-CD2 3.63Å; L323-L406 HydrophobicContact CD2-CD1 3.55Å; L323-L406 HydrophobicContact CD2-CD2 3.69Å; L323-L406 HydrophobicContact CD2-CG 4.28Å; L323-L406 HydrophobicContact CG-CD1 4.37Å; L323-L406 HydrophobicContact CG-CD2 3.71Å |
| 324 | E | 82.3 | Confident | 84 | Confident | 103 Ų | 103 | 46.4 Ų | 46.4 | 48% | 0.481 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.4 | 32 | -178.2 | -60.9 | 166.9 | -167.7 | 0 | 0 | 111.9 | K245 C320 K321 L322 R370 | K245-E324 IonicContact NZ-OE1 2.7Å; K245-E324 PolarHBondContact NZ-OE1 3.36Å; C320-E324 PolarHBondContact O-N 3.15Å; K321-E324 PolarHBondContact O-N 3.04Å; L322-E324 PolarHBondContact O-N 3.36Å; E324-R370 WeakPolarHBondContact OE1-CD 3.45Å; E324-R370 VanDerWaalsContact OE1-CG 3.24Å; E324-R370 WeakPolarHBondContact OE1-CG 3.31Å |
| 325 | L | 84.1 | Confident | 84.3 | Confident | 41 Ų | 41 | 46 Ų | 46 | 22% | 0.215 | 25% | 0.246 | C | C | . | . | trans | -93.1 | 138.8 | 171.9 | -55 | 176.4 | 0 | 0 | 0 | 109.3 | C320 L323 P327 K341 | C320-L325 CarbonylContact C-O 3.53Å; C320-L325 HydrophobicContact CB-CB 4.1Å; C320-L325 WeakPolarHBondContact O-CA 3.4Å; C320-L325 WeakPolarHBondContact O-CB 3.48Å; C320-L325 PolarHBondContact O-N 2.94Å; L323-L325 HydrophobicContact CB-CD1 4.16Å; L323-L325 HydrophobicContact CB-CG 3.99Å; L323-L325 HydrophobicContact CD1-CD1 4.47Å; L323-L325 PolarHBondContact O-N 3.5Å; L325-P327 VanDerWaalsContact O-CD 3.31Å; L325-P327 WeakPolarHBondContact O-CD 3.44Å; L325-K341 HydrophobicContact CD1-CB 3.98Å; L325-K341 HydrophobicContact CD1-CG 4.12Å; L325-K341 HydrophobicContact CD2-CD 4.31Å | ||
| 326 | Q | 83.7 | Confident | 84.8 | Confident | 108 Ų | 108 | 50.9 Ų | 50.9 | 51% | 0.505 | 27% | 0.268 | S | S | . | . | trans | -74.9 | 118.6 | 171.8 | -77.2 | -172.3 | 56.3 | 0 | 0 | 109.9 | E222 I328 | E222-Q326 PolarHBondContact OE2-NE2 3.34Å; Q326-I328 VanDerWaalsContact C-N 3.33Å; Q326-I328 HydrophobicContact CB-CD1 3.96Å; Q326-I328 HydrophobicContact CB-CG1 4.13Å; Q326-I328 PolarHBondContact O-N 3.38Å | ||
| 327 | P | 83.5 | Confident | 85.2 | Confident | 42 Ų | 42 | 53.4 Ų | 53.4 | 27% | 0.273 | 28% | 0.28 | S | S | . | . | trans | -77.6 | 84.6 | -179.4 | 31.9 | -33.9 | 0 | 0 | 0 | 110 | V317 C320 K321 L325 L334 | V317-P327 HydrophobicContact CB-CB 4.21Å; V317-P327 HydrophobicContact CG1-CB 3.85Å; V317-P327 HydrophobicContact CG1-CG 3.88Å; V317-P327 HydrophobicContact CG2-CB 4.13Å; C320-P327 HydrophobicContact CB-CB 4.08Å; K321-P327 HydrophobicContact CG-CG 4.24Å; L325-P327 VanDerWaalsContact O-CD 3.31Å; L325-P327 WeakPolarHBondContact O-CD 3.44Å; P327-L334 HydrophobicContact CB-CD2 3.96Å | ||
| 328 | I | 84.3 | Confident | 85.3 | Confident | 102 Ų | 102 | 52.2 Ų | 52.2 | 52% | 0.523 | 27% | 0.272 | S | S | . | . | trans | -112.1 | 132.9 | 179.5 | -59.2 | 170 | 0 | 0 | 0 | 109.4 | Q326 | Q326-I328 VanDerWaalsContact C-N 3.33Å; Q326-I328 HydrophobicContact CB-CD1 3.96Å; Q326-I328 HydrophobicContact CB-CG1 4.13Å; Q326-I328 PolarHBondContact O-N 3.38Å | ||
| 329 | G | 86.8 | Confident | 85.7 | Confident | 38 Ų | 38 | 55 Ų | 55 | 39% | 0.392 | 29% | 0.285 | S | S | . | . | S | Bend | trans | 100.6 | -156.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 330 | T | 91.5 | Very high | 86.2 | Confident | 95 Ų | 95 | 58.7 Ų | 58.7 | 58% | 0.583 | 30% | 0.303 | S | S | * | . | trans | -83.8 | 164.7 | -175 | 63.4 | 0 | 0 | 0 | 0 | 112.1 | N332 L333 L334 | T330-N332 PolarHBondContact O-N 2.89Å; T330-L333 WeakPolarHBondContact O-CB 3.27Å; T330-L333 PolarHBondContact O-N 2.97Å; T330-L334 PolarHBondContact O-N 2.76Å | ||
| 331 | N | 89.1 | Confident | 86.3 | Confident | 56 Ų | 56 | 61.5 Ų | 61.5 | 30% | 0.299 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -56.2 | -38.6 | -178.2 | -61.4 | -5 | 0 | 0 | 0 | 112.7 | R313 L316 L333 L334 R335 | R313-N331 VanDerWaalsContact CB-OD1 3.26Å; R313-N331 WeakPolarHBondContact CB-OD1 3.24Å; R313-N331 WeakPolarHBondContact CD-OD1 3.32Å; R313-N331 WeakPolarHBondContact CG-OD1 3.37Å; L316-N331 HydrophobicContact CD1-CB 4.28Å; N331-L333 VanDerWaalsContact C-N 3.35Å; N331-L334 PolarHBondContact O-N 2.82Å; N331-R335 WeakPolarHBondContact O-CG 3.18Å; N331-R335 PolarHBondContact O-N 3.39Å |
| 332 | N | 89.1 | Confident | 86.6 | Confident | 117 Ų | 117 | 58.5 Ų | 58.5 | 63% | 0.626 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -67.5 | -37.3 | 178.7 | -63.1 | -22.3 | 0 | 0 | 0 | 111.7 | T330 R335 F336 | T330-N332 PolarHBondContact O-N 2.89Å; N332-R335 PolarHBondContact O-N 3.05Å; N332-R335 PolarHBondContact OD1-NH1 3.38Å; N332-F336 WeakPolarHBondContact O-CB 3.41Å; N332-F336 PolarHBondContact O-N 2.94Å |
| 333 | L | 90.3 | Very high | 87.1 | Confident | 74 Ų | 74 | 65.3 Ų | 65.3 | 39% | 0.387 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -67.6 | -42.3 | 175.4 | -174.4 | 61.3 | 0 | 0 | 0 | 111.2 | T330 N331 R335 F336 Q337 | T330-L333 WeakPolarHBondContact O-CB 3.27Å; T330-L333 PolarHBondContact O-N 2.97Å; N331-L333 VanDerWaalsContact C-N 3.35Å; L333-R335 VanDerWaalsContact C-N 3.34Å; L333-R335 PolarHBondContact O-N 2.91Å; L333-F336 PolarHBondContact O-N 2.97Å; L333-Q337 WeakPolarHBondContact O-CB 3.43Å; L333-Q337 VanDerWaalsContact O-CG 3.31Å; L333-Q337 WeakPolarHBondContact O-CG 3.39Å; L333-Q337 PolarHBondContact O-N 3Å |
| 334 | L | 89 | Confident | 87.6 | Confident | 1 Ų | 1 | 67.4 Ų | 67.4 | 1% | 0.005 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 174.9 | -65 | 176.6 | 0 | 0 | 0 | 111.6 | L316 V317 P327 T330 N331 F336 Q337 L338 | L316-L334 HydrophobicContact CB-CB 4.22Å; L316-L334 HydrophobicContact CB-CD1 4.17Å; V317-L334 HydrophobicContact CG2-CD1 3.72Å; P327-L334 HydrophobicContact CB-CD2 3.96Å; T330-L334 PolarHBondContact O-N 2.76Å; N331-L334 PolarHBondContact O-N 2.82Å; L334-F336 PolarHBondContact O-N 2.89Å; L334-Q337 PolarHBondContact O-N 2.68Å; L334-L338 WeakPolarHBondContact O-CB 3.49Å; L334-L338 PolarHBondContact O-N 3.34Å |
| 335 | R | 87.7 | Confident | 88 | Confident | 51 Ų | 51 | 62.9 Ų | 62.9 | 19% | 0.192 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -60.9 | -44.6 | 174.8 | -73.5 | 179.7 | -174.2 | 116.5 | 1.8 | 111.9 | L308 E309 L311 L316 N331 N332 L333 L338 M339 | L308-R335 WeakPolarHBondContact O-CD 3.29Å; L308-R335 PolarHBondContact O-NE 2.92Å; E309-R335 PolarHBondContact O-NH2 3.39Å; L311-R335 PolarHBondContact O-NH2 3.32Å; L316-R335 HydrophobicContact CD1-CG 3.8Å; L316-R335 HydrophobicContact CD2-CG 3.75Å; L316-R335 HydrophobicContact CG-CG 4.45Å; N331-R335 WeakPolarHBondContact O-CG 3.18Å; N331-R335 PolarHBondContact O-N 3.39Å; N332-R335 PolarHBondContact O-N 3.05Å; N332-R335 PolarHBondContact OD1-NH1 3.38Å; L333-R335 VanDerWaalsContact C-N 3.34Å; L333-R335 PolarHBondContact O-N 2.91Å; R335-L338 PolarHBondContact O-N 3.14Å; R335-M339 WeakPolarHBondContact O-CB 3.47Å; R335-M339 PolarHBondContact O-N 3.48Å |
| 336 | F | 89 | Confident | 88.3 | Confident | 110 Ų | 110 | 65.8 Ų | 65.8 | 48% | 0.482 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.9 | -46.2 | 176.9 | 178.3 | -99.1 | 0 | 0 | 0 | 111.8 | N332 L333 L334 L338 M339 M340 | N332-F336 WeakPolarHBondContact O-CB 3.41Å; N332-F336 PolarHBondContact O-N 2.94Å; L333-F336 PolarHBondContact O-N 2.97Å; L334-F336 PolarHBondContact O-N 2.89Å; F336-L338 VanDerWaalsContact C-N 3.33Å; F336-L338 PolarHBondContact O-N 3.37Å; F336-M339 HydrophobicContact CD2-CE 3.87Å; F336-M339 HydrophobicContact CE2-CE 4.26Å; F336-M339 PolarHBondContact O-N 3.36Å; F336-M340 HydrophobicContact CD1-CG 4.2Å; F336-M340 HydrophobicContact CD2-CG 4.42Å; F336-M340 HydrophobicContact CE1-CG 3.73Å; F336-M340 HydrophobicContact CE2-CG 3.98Å; F336-M340 HydrophobicContact CE2-SD 4.19Å; F336-M340 HydrophobicContact CZ-CG 3.61Å; F336-M340 HydrophobicContact CZ-SD 3.99Å; F336-M340 WeakPolarHBondContact O-CB 3.25Å; F336-M340 WeakPolarHBondContact O-CG 3.1Å; F336-M340 PolarHBondContact O-N 3.31Å |
| 337 | Q | 89.5 | Confident | 88.6 | Confident | 54 Ų | 54 | 62.1 Ų | 62.1 | 25% | 0.252 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -57.8 | -46.1 | 176.1 | -74 | 175.3 | 9.6 | 0 | 0 | 111.5 | L333 L334 M340 K341 | L333-Q337 WeakPolarHBondContact O-CB 3.43Å; L333-Q337 VanDerWaalsContact O-CG 3.31Å; L333-Q337 WeakPolarHBondContact O-CG 3.39Å; L333-Q337 PolarHBondContact O-N 3Å; L334-Q337 PolarHBondContact O-N 2.68Å; Q337-M340 PolarHBondContact O-N 3.05Å; Q337-K341 WeakPolarHBondContact O-CB 3.08Å; Q337-K341 PolarHBondContact O-N 3.19Å |
| 338 | L | 87.1 | Confident | 89 | Confident | 1 Ų | 1 | 61 Ų | 61 | 1% | 0.005 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.7 | -45.9 | 177.9 | -174.7 | 56.5 | 0 | 0 | 0 | 111.3 | L308 L316 L319 L323 L334 R335 F336 M340 K341 L342 | L308-L338 HydrophobicContact CD1-CD2 4.14Å; L308-L338 HydrophobicContact CD1-CG 4.1Å; L308-L338 HydrophobicContact CD2-CD2 3.4Å; L308-L338 VanDerWaalsContact CD2-CD2 3.4Å; L308-L338 HydrophobicContact CD2-CG 4.17Å; L308-L338 HydrophobicContact CG-CD2 4.35Å; L316-L338 HydrophobicContact CD2-CD2 4.4Å; L319-L338 HydrophobicContact CB-CD2 4.21Å; L319-L338 HydrophobicContact CD1-CD2 3.96Å; L323-L338 HydrophobicContact CD1-CD1 3.31Å; L334-L338 WeakPolarHBondContact O-CB 3.49Å; L334-L338 PolarHBondContact O-N 3.34Å; R335-L338 PolarHBondContact O-N 3.14Å; F336-L338 VanDerWaalsContact C-N 3.33Å; F336-L338 PolarHBondContact O-N 3.37Å; L338-M340 VanDerWaalsContact C-N 3.34Å; L338-M340 PolarHBondContact O-N 3.21Å; L338-K341 WeakPolarHBondContact O-CB 3.29Å; L338-K341 PolarHBondContact O-N 3.37Å; L338-K341 VanDerWaalsContact O-N 3.14Å; L338-L342 HydrophobicContact CD1-CD1 4.46Å; L338-L342 HydrophobicContact CD1-CG 4.39Å; L338-L342 HydrophobicContact CG-CD1 4.17Å; L338-L342 VanDerWaalsContact O-CG 3.26Å; L338-L342 WeakPolarHBondContact O-CG 3.26Å; L338-L342 PolarHBondContact O-N 3.24Å |
| 339 | M | 87.3 | Confident | 89.5 | Confident | 67 Ų | 67 | 56.1 Ų | 56.1 | 33% | 0.33 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.9 | -44.6 | 176.4 | -176.1 | 177.9 | 64.5 | 0 | 0 | 111.7 | R335 F336 K341 L342 R343 | R335-M339 WeakPolarHBondContact O-CB 3.47Å; R335-M339 PolarHBondContact O-N 3.48Å; F336-M339 HydrophobicContact CD2-CE 3.87Å; F336-M339 HydrophobicContact CE2-CE 4.26Å; F336-M339 PolarHBondContact O-N 3.36Å; M339-K341 VanDerWaalsContact C-N 3.32Å; M339-K341 PolarHBondContact O-N 3.48Å; M339-L342 PolarHBondContact O-N 3.4Å; M339-R343 WeakPolarHBondContact O-CG 3.48Å; M339-R343 PolarHBondContact O-N 3.21Å; M339-R343 PolarHBondContact SD-NH2 3.31Å; M339-R343 VanDerWaalsContact SD-NH2 3.36Å |
| 340 | M | 88.9 | Confident | 89.7 | Confident | 85 Ų | 85 | 59 Ų | 59 | 42% | 0.419 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.9 | -39.8 | 176.1 | -72.6 | -56.8 | -63.6 | 0 | 0 | 111.9 | F336 Q337 L338 R343 A344 | F336-M340 HydrophobicContact CD1-CG 4.2Å; F336-M340 HydrophobicContact CD2-CG 4.42Å; F336-M340 HydrophobicContact CE1-CG 3.73Å; F336-M340 HydrophobicContact CE2-CG 3.98Å; F336-M340 HydrophobicContact CE2-SD 4.19Å; F336-M340 HydrophobicContact CZ-CG 3.61Å; F336-M340 HydrophobicContact CZ-SD 3.99Å; F336-M340 WeakPolarHBondContact O-CB 3.25Å; F336-M340 WeakPolarHBondContact O-CG 3.1Å; F336-M340 PolarHBondContact O-N 3.31Å; Q337-M340 PolarHBondContact O-N 3.05Å; L338-M340 VanDerWaalsContact C-N 3.34Å; L338-M340 PolarHBondContact O-N 3.21Å; M340-R343 PolarHBondContact O-N 3.41Å; M340-A344 PolarHBondContact O-N 3.41Å |
| 341 | K | 88.9 | Confident | 89.7 | Confident | 59 Ų | 59 | 56.2 Ų | 56.2 | 26% | 0.257 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.4 | -42.5 | 176 | -173.8 | 61.5 | 169.4 | -170.1 | 0 | 112.2 | L323 L325 Q337 L338 M339 A344 I345 | L323-K341 HydrophobicContact CB-CG 4.39Å; L323-K341 HydrophobicContact CD1-CB 4.39Å; L323-K341 HydrophobicContact CD1-CG 3.78Å; L325-K341 HydrophobicContact CD1-CB 3.98Å; L325-K341 HydrophobicContact CD1-CG 4.12Å; L325-K341 HydrophobicContact CD2-CD 4.31Å; Q337-K341 WeakPolarHBondContact O-CB 3.08Å; Q337-K341 PolarHBondContact O-N 3.19Å; L338-K341 WeakPolarHBondContact O-CB 3.29Å; L338-K341 PolarHBondContact O-N 3.37Å; L338-K341 VanDerWaalsContact O-N 3.14Å; M339-K341 VanDerWaalsContact C-N 3.32Å; M339-K341 PolarHBondContact O-N 3.48Å; K341-A344 WeakPolarHBondContact O-CB 3.46Å; K341-A344 PolarHBondContact O-N 2.9Å; K341-I345 HydrophobicContact CG-CD1 4.32Å; K341-I345 WeakPolarHBondContact O-CG1 3.5Å; K341-I345 PolarHBondContact O-N 3Å |
| 342 | L | 88 | Confident | 89.9 | Confident | 18 Ų | 18 | 53.6 Ų | 53.6 | 9% | 0.094 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66 | -38.9 | 177.5 | -65 | 169.1 | 0 | 0 | 0 | 111.8 | L308 L338 M339 A344 I345 K346 P402 | L308-L342 HydrophobicContact CD1-CD1 3.76Å; L338-L342 HydrophobicContact CD1-CD1 4.46Å; L338-L342 HydrophobicContact CD1-CG 4.39Å; L338-L342 HydrophobicContact CG-CD1 4.17Å; L338-L342 VanDerWaalsContact O-CG 3.26Å; L338-L342 WeakPolarHBondContact O-CG 3.26Å; L338-L342 PolarHBondContact O-N 3.24Å; M339-L342 PolarHBondContact O-N 3.4Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 3.5Å; L342-I345 HydrophobicContact CD2-CD1 4.46Å; L342-I345 PolarHBondContact O-N 3.31Å; L342-K346 PolarHBondContact O-N 3.04Å; L342-P402 HydrophobicContact CD2-CB 3.86Å |
| 343 | R | 89.1 | Confident | 90 | Very high | 144 Ų | 144 | 51.5 Ų | 51.5 | 54% | 0.543 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -61.3 | -41.9 | 171.2 | -72.5 | 177.4 | -172.9 | 169.7 | -0.5 | 111.9 | M339 M340 K346 S347 | M339-R343 WeakPolarHBondContact O-CG 3.48Å; M339-R343 PolarHBondContact O-N 3.21Å; M339-R343 PolarHBondContact SD-NH2 3.31Å; M339-R343 VanDerWaalsContact SD-NH2 3.36Å; M340-R343 PolarHBondContact O-N 3.41Å; R343-K346 PolarHBondContact O-N 3.03Å; R343-S347 PolarHBondContact O-N 2.71Å |
| 344 | A | 90.4 | Very high | 90.1 | Very high | 50 Ų | 50 | 52.2 Ų | 52.2 | 41% | 0.413 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | M340 K341 L342 K346 S347 D348 | M340-A344 PolarHBondContact O-N 3.41Å; K341-A344 WeakPolarHBondContact O-CB 3.46Å; K341-A344 PolarHBondContact O-N 2.9Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 3.5Å; A344-K346 VanDerWaalsContact C-N 3.34Å; A344-S347 PolarHBondContact O-N 2.82Å; A344-S347 PolarHBondContact O-OG 2.84Å; A344-D348 PolarHBondContact O-N 3.05Å |
| 345 | I | 90.9 | Very high | 90.1 | Very high | 7 Ų | 7 | 55.5 Ų | 55.5 | 4% | 0.036 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.7 | -45.2 | 174 | -69.4 | 165.9 | 0 | 0 | 0 | 110.4 | L323 K341 L342 S347 D348 D349 S371 R372 W391 | L323-I345 HydrophobicContact CD2-CD1 4.4Å; K341-I345 HydrophobicContact CG-CD1 4.32Å; K341-I345 WeakPolarHBondContact O-CG1 3.5Å; K341-I345 PolarHBondContact O-N 3Å; L342-I345 HydrophobicContact CD2-CD1 4.46Å; L342-I345 PolarHBondContact O-N 3.31Å; I345-S347 PolarHBondContact O-N 3.25Å; I345-D348 CarbonylContact O-C 3.44Å; I345-D348 WeakPolarHBondContact O-CA 3.32Å; I345-D348 WeakPolarHBondContact O-CB 3.41Å; I345-D348 PolarHBondContact O-N 3.34Å; I345-D349 PolarHBondContact O-N 3.12Å; I345-S371 WeakPolarHBondContact CD1-O 3.47Å; I345-R372 HydrophobicContact CG2-CG 4.03Å; I345-W391 HydrophobicContact CG2-CZ2 4.11Å |
| 346 | K | 90.1 | Very high | 90.2 | Very high | 103 Ų | 103 | 54.4 Ų | 54.4 | 45% | 0.448 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -58.8 | -47.8 | 177.8 | 174.5 | 170.9 | -177.4 | 176.5 | 0 | 112.4 | L342 R343 A344 D348 D349 E350 | L342-K346 PolarHBondContact O-N 3.04Å; R343-K346 PolarHBondContact O-N 3.03Å; A344-K346 VanDerWaalsContact C-N 3.34Å; K346-D348 VanDerWaalsContact C-N 3.26Å; K346-D348 PolarHBondContact O-N 2.73Å; K346-D349 PolarHBondContact O-N 3.28Å; K346-E350 WeakPolarHBondContact CE-OE1 3.35Å; K346-E350 WeakPolarHBondContact O-CG 3.18Å; K346-E350 PolarHBondContact O-N 3.03Å |
| 347 | S | 90.9 | Very high | 90.3 | Very high | 31 Ų | 31 | 49.6 Ų | 49.6 | 22% | 0.217 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63 | -33.2 | 175.2 | 76.4 | 0 | 0 | 0 | 0 | 112.7 | R184 R343 A344 I345 M351 | R184-S347 PolarHBondContact NH1-OG 3.41Å; R184-S347 VanDerWaalsContact NH1-OG 3.16Å; R343-S347 PolarHBondContact O-N 2.71Å; A344-S347 PolarHBondContact O-N 2.82Å; A344-S347 PolarHBondContact O-OG 2.84Å; I345-S347 PolarHBondContact O-N 3.25Å; S347-M351 VanDerWaalsContact O-CG 3.32Å; S347-M351 WeakPolarHBondContact O-CG 3.25Å; S347-M351 PolarHBondContact O-N 3.34Å |
| 348 | D | 92.2 | Very high | 90.2 | Very high | 17 Ų | 17 | 50.8 Ų | 50.8 | 9% | 0.091 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -71.7 | -37 | 175.8 | -167.4 | 66.3 | 0 | 0 | 0 | 111.5 | R181 R185 A344 I345 K346 M351 I352 R372 | R181-D348 IonicContact CZ-OD1 3.63Å; R181-D348 IonicContact CZ-OD2 3.76Å; R181-D348 IonicContact NE-OD1 2.79Å; R181-D348 PolarHBondContact NE-OD1 3.45Å; R181-D348 IonicContact NE-OD2 3.62Å; R181-D348 IonicContact NH2-OD1 2.95Å; R181-D348 IonicContact NH2-OD2 3.46Å; R181-D348 PolarHBondContact NH2-OD2 3.39Å; R185-D348 IonicContact CZ-OD1 2.77Å; R185-D348 IonicContact NE-OD1 3.02Å; R185-D348 IonicContact NH2-OD1 3.48Å; R185-D348 PolarHBondContact NH2-OD1 3.26Å; R185-D348 IonicContact NH2-OD2 2.9Å; R185-D348 PolarHBondContact NH2-OD2 3.11Å; R185-D348 VanDerWaalsContact NH2-OD2 3.11Å; A344-D348 PolarHBondContact O-N 3.05Å; I345-D348 CarbonylContact O-C 3.44Å; I345-D348 WeakPolarHBondContact O-CA 3.32Å; I345-D348 WeakPolarHBondContact O-CB 3.41Å; I345-D348 PolarHBondContact O-N 3.34Å; K346-D348 VanDerWaalsContact C-N 3.26Å; K346-D348 PolarHBondContact O-N 2.73Å; D348-M351 HydrophobicContact CB-CE 4.28Å; D348-M351 PolarHBondContact O-N 3.1Å; D348-I352 WeakPolarHBondContact O-CD1 3.43Å; D348-I352 WeakPolarHBondContact O-CG1 3.36Å; D348-I352 PolarHBondContact O-N 3.48Å; D348-R372 IonicContact OD2-CZ 2.82Å; D348-R372 IonicContact OD2-NH1 3.88Å; D348-R372 PolarHBondContact OD2-NH1 3.4Å; D348-R372 IonicContact OD2-NH2 3.09Å; D348-R372 PolarHBondContact OD2-NH2 3.08Å |
| 349 | D | 93.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 55.4 Ų | 55.4 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64 | -44.6 | 175.8 | -73.9 | -25.6 | 0 | 0 | 0 | 111.8 | I345 K346 M351 I352 S353 R372 W391 L392 H395 L396 | I345-D349 PolarHBondContact O-N 3.12Å; K346-D349 PolarHBondContact O-N 3.28Å; D349-M351 PolarHBondContact O-N 3.12Å; D349-I352 PolarHBondContact O-N 2.97Å; D349-S353 WeakPolarHBondContact O-CB 3.44Å; D349-S353 PolarHBondContact O-N 3.45Å; D349-R372 IonicContact OD1-CZ 3.77Å; D349-R372 IonicContact OD1-NE 3.61Å; D349-R372 PolarHBondContact OD1-NE 3.06Å; D349-R372 IonicContact OD1-NH2 3.85Å; D349-R372 PolarHBondContact OD1-NH2 2.92Å; D349-W391 PolarHBondContact OD1-NE1 3.42Å; D349-W391 PolarHBondContact OD2-NE1 3.01Å; D349-L392 HydrophobicContact CB-CD2 3.58Å; D349-L392 VanDerWaalsContact OD1-CD2 3.31Å; D349-L392 WeakPolarHBondContact OD1-CD2 3.37Å; D349-H395 IonicContact OD2-CE1 3.82Å; D349-H395 PolarHBondContact OD2-CE1 3.35Å; D349-H395 IonicContact OD2-CG 3.77Å; D349-H395 IonicContact OD2-ND1 2.74Å; D349-H395 PolarHBondContact OD2-ND1 3.01Å; D349-L396 HydrophobicContact CB-CD2 4.37Å |
| 350 | E | 91.7 | Very high | 90.4 | Very high | 98 Ų | 98 | 52.6 Ų | 52.6 | 46% | 0.458 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.1 | -45.4 | 175 | -70.5 | 166.9 | -172.7 | 0 | 0 | 111.4 | K346 S353 A354 L396 | K346-E350 WeakPolarHBondContact CE-OE1 3.35Å; K346-E350 WeakPolarHBondContact O-CG 3.18Å; K346-E350 PolarHBondContact O-N 3.03Å; E350-S353 PolarHBondContact O-N 2.95Å; E350-A354 PolarHBondContact O-N 2.99Å; E350-L396 HydrophobicContact CG-CD2 4.24Å |
| 351 | M | 91.6 | Very high | 90.5 | Very high | 38 Ų | 38 | 50.8 Ų | 50.8 | 19% | 0.187 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.2 | -41.9 | 175.8 | -71.3 | -175.9 | -57 | 0 | 0 | 112.4 | R181 S347 D348 D349 S353 A354 E355 | R181-M351 HydrophobicContact CB-CB 4.32Å; R181-M351 HydrophobicContact CB-SD 4.41Å; R181-M351 HydrophobicContact CG-CB 4.49Å; R181-M351 HydrophobicContact CG-CE 4.14Å; S347-M351 VanDerWaalsContact O-CG 3.32Å; S347-M351 WeakPolarHBondContact O-CG 3.25Å; S347-M351 PolarHBondContact O-N 3.34Å; D348-M351 HydrophobicContact CB-CE 4.28Å; D348-M351 PolarHBondContact O-N 3.1Å; D349-M351 PolarHBondContact O-N 3.12Å; M351-S353 VanDerWaalsContact C-N 3.34Å; M351-A354 PolarHBondContact O-N 3.46Å; M351-E355 WeakPolarHBondContact O-CG 3.49Å; M351-E355 PolarHBondContact O-N 3.21Å |
| 352 | I | 93.2 | Very high | 90.6 | Very high | 1 Ų | 1 | 51.4 Ų | 51.4 | 1% | 0.005 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.7 | -40.2 | 177.4 | -64.9 | 160.2 | 0 | 0 | 0 | 111 | D348 D349 A354 E355 G356 V357 M360 L392 | D348-I352 WeakPolarHBondContact O-CD1 3.43Å; D348-I352 WeakPolarHBondContact O-CG1 3.36Å; D348-I352 PolarHBondContact O-N 3.48Å; D349-I352 PolarHBondContact O-N 2.97Å; I352-A354 PolarHBondContact O-N 3.03Å; I352-E355 PolarHBondContact O-N 3.38Å; I352-G356 WeakPolarHBondContact O-CA 3.3Å; I352-G356 PolarHBondContact O-N 3.44Å; I352-V357 HydrophobicContact CG2-CG2 3.76Å; I352-M360 HydrophobicContact CG1-SD 4.34Å; I352-M360 HydrophobicContact CG2-SD 3.87Å; I352-L392 HydrophobicContact CB-CD1 4.26Å; I352-L392 HydrophobicContact CB-CD2 4.48Å; I352-L392 HydrophobicContact CG2-CD1 3.58Å |
| 353 | S | 92.3 | Very high | 90.7 | Very high | 72 Ų | 72 | 54.3 Ų | 54.3 | 50% | 0.503 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64.5 | -33.5 | 178.4 | -171.5 | 0 | 0 | 0 | 0 | 111.9 | D349 E350 M351 L396 | D349-S353 WeakPolarHBondContact O-CB 3.44Å; D349-S353 PolarHBondContact O-N 3.45Å; E350-S353 PolarHBondContact O-N 2.95Å; M351-S353 VanDerWaalsContact C-N 3.34Å; S353-L396 VanDerWaalsContact CB-CD1 3.44Å |
| 354 | A | 91.3 | Very high | 90.7 | Very high | 89 Ų | 89 | 49.1 Ų | 49.1 | 74% | 0.736 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -72.2 | -39.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | E350 M351 I352 | E350-A354 PolarHBondContact O-N 2.99Å; M351-A354 PolarHBondContact O-N 3.46Å; I352-A354 PolarHBondContact O-N 3.03Å |
| 355 | E | 89.7 | Confident | 90.8 | Very high | 70 Ų | 70 | 46.7 Ų | 46.7 | 33% | 0.327 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -84.4 | -28 | -178.8 | -67.9 | 178.3 | 177.7 | 0 | 0 | 113.6 | R181 M351 I352 | R181-E355 VanDerWaalsContact CB-OE1 3.24Å; R181-E355 WeakPolarHBondContact CB-OE1 3.39Å; R181-E355 WeakPolarHBondContact CB-OE2 3.26Å; R181-E355 PolarHBondContact N-OE1 3.25Å; M351-E355 WeakPolarHBondContact O-CG 3.49Å; M351-E355 PolarHBondContact O-N 3.21Å; I352-E355 PolarHBondContact O-N 3.38Å |
| 356 | G | 89.6 | Confident | 90.8 | Very high | 28 Ų | 28 | 49 Ų | 49 | 29% | 0.289 | 30% | 0.302 | S | S | . | . | trans | 88.9 | 138.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | I352 A358 | I352-G356 WeakPolarHBondContact O-CA 3.3Å; I352-G356 PolarHBondContact O-N 3.44Å; G356-A358 VanDerWaalsContact C-N 3.3Å; G356-A358 PolarHBondContact O-N 3.13Å | ||
| 357 | V | 90.3 | Very high | 90.8 | Very high | 10 Ų | 10 | 46 Ų | 46 | 6% | 0.061 | 30% | 0.296 | C | S | . | . | G | 310 helix | trans | -68 | -27.6 | -178.6 | 178.3 | 0 | 0 | 0 | 0 | 112.7 | I352 V359 M360 L365 R385 L388 L392 | I352-V357 HydrophobicContact CG2-CG2 3.76Å; V357-V359 VanDerWaalsContact C-N 3.31Å; V357-V359 PolarHBondContact O-N 3.49Å; V357-M360 PolarHBondContact O-N 3.46Å; V357-L365 HydrophobicContact CG1-CD2 3.9Å; V357-R385 HydrophobicContact CG1-CB 4.15Å; V357-R385 HydrophobicContact CG1-CG 4.09Å; V357-L388 HydrophobicContact CG1-CD2 4.2Å; V357-L388 HydrophobicContact CG2-CD2 4.42Å; V357-L388 HydrophobicContact CG2-CG 4.49Å; V357-L392 HydrophobicContact CG2-CD1 3.47Å; V357-L392 VanDerWaalsContact CG2-CD1 3.47Å |
| 358 | A | 88.8 | Confident | 90.8 | Very high | 78 Ų | 78 | 44.5 Ų | 44.5 | 65% | 0.645 | 29% | 0.286 | S | S | * | . | G | 310 helix | trans | -66.3 | -31 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | G356 M360 | G356-A358 VanDerWaalsContact C-N 3.3Å; G356-A358 PolarHBondContact O-N 3.13Å; A358-M360 VanDerWaalsContact C-N 3.28Å; A358-M360 PolarHBondContact O-N 3.41Å |
| 359 | V | 89.3 | Confident | 90.7 | Very high | 98 Ų | 98 | 43.7 Ų | 43.7 | 59% | 0.594 | 28% | 0.282 | S | S | * | . | G | 310 helix | trans | -79.7 | -11.6 | -175.7 | -174.9 | 0 | 0 | 0 | 0 | 112.3 | R182 V357 | R182-V359 PolarHBondContact NH2-O 3.1Å; V357-V359 VanDerWaalsContact C-N 3.31Å; V357-V359 PolarHBondContact O-N 3.49Å |
| 360 | M | 87.9 | Confident | 90.4 | Very high | 8 Ų | 8 | 46.3 Ų | 46.3 | 4% | 0.039 | 29% | 0.291 | C | S | . | . | trans | -75.8 | 140.4 | -177.1 | -66 | -178.5 | 49.4 | 0 | 0 | 112.4 | R181 I352 V357 A358 E364 L365 A368 L388 | R181-M360 PolarHBondContact NH1-SD 3.46Å; I352-M360 HydrophobicContact CG1-SD 4.34Å; I352-M360 HydrophobicContact CG2-SD 3.87Å; V357-M360 PolarHBondContact O-N 3.46Å; A358-M360 VanDerWaalsContact C-N 3.28Å; A358-M360 PolarHBondContact O-N 3.41Å; M360-E364 HydrophobicContact CB-CB 4.33Å; M360-E364 HydrophobicContact CE-CB 3.86Å; M360-E364 WeakPolarHBondContact CE-O 3.16Å; M360-L365 HydrophobicContact CB-CD2 4.05Å; M360-L365 HydrophobicContact CB-CG 3.96Å; M360-L365 HydrophobicContact CE-CD2 3.91Å; M360-L365 HydrophobicContact CE-CG 4.2Å; M360-L365 HydrophobicContact SD-CD2 4.24Å; M360-A368 HydrophobicContact CE-CB 3.94Å; M360-L388 HydrophobicContact CE-CD2 3.94Å; M360-L388 HydrophobicContact SD-CD2 3.94Å | ||
| 361 | S | 91.1 | Very high | 90.2 | Very high | 48 Ų | 48 | 43 Ų | 43 | 34% | 0.336 | 28% | 0.28 | S | S | . | . | trans | -74.1 | 163.4 | 172.9 | 74.5 | 0 | 0 | 0 | 0 | 111.7 | S363 E364 L365 | S361-S363 VanDerWaalsContact C-N 3.29Å; S361-S363 PolarHBondContact O-N 3.21Å; S361-S363 PolarHBondContact OG-OG 3.32Å; S361-S363 VanDerWaalsContact OG-OG 3.12Å; S361-E364 PolarHBondContact N-OE2 3.45Å; S361-E364 PolarHBondContact O-N 3.26Å; S361-E364 VanDerWaalsContact O-N 3.14Å; S361-E364 VanDerWaalsContact OG-CG 3.26Å; S361-E364 WeakPolarHBondContact OG-CG 3.31Å; S361-E364 PolarHBondContact OG-N 2.82Å; S361-L365 WeakPolarHBondContact O-CG 3.27Å; S361-L365 PolarHBondContact O-N 2.85Å | ||
| 362 | V | 90.9 | Very high | 90.1 | Very high | 71 Ų | 71 | 41.2 Ų | 41.2 | 43% | 0.43 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -59 | -41 | 179.4 | -179.3 | 0 | 0 | 0 | 0 | 111.5 | E364 L365 Q366 | V362-E364 VanDerWaalsContact C-N 3.35Å; V362-E364 PolarHBondContact O-N 2.77Å; V362-L365 PolarHBondContact O-N 3.47Å; V362-Q366 HydrophobicContact CG1-CG 4.4Å; V362-Q366 WeakPolarHBondContact O-CB 3.44Å; V362-Q366 VanDerWaalsContact O-CG 3.25Å; V362-Q366 WeakPolarHBondContact O-CG 3.47Å; V362-Q366 PolarHBondContact O-N 3.21Å |
| 363 | S | 89.8 | Confident | 89.5 | Confident | 79 Ų | 79 | 41.2 Ų | 41.2 | 55% | 0.552 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -66.5 | -37.1 | 177.9 | 58 | 0 | 0 | 0 | 0 | 112.2 | S361 A367 | S361-S363 VanDerWaalsContact C-N 3.29Å; S361-S363 PolarHBondContact O-N 3.21Å; S361-S363 PolarHBondContact OG-OG 3.32Å; S361-S363 VanDerWaalsContact OG-OG 3.12Å; S363-A367 VanDerWaalsContact O-CB 3.29Å; S363-A367 WeakPolarHBondContact O-CB 3.43Å; S363-A367 PolarHBondContact O-N 3.38Å |
| 364 | E | 90.4 | Very high | 89.1 | Confident | 35 Ų | 35 | 38 Ų | 38 | 16% | 0.164 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -67.6 | -41.2 | 175.1 | -70.7 | 174.3 | 158.6 | 0 | 0 | 112 | R182 M360 S361 V362 A367 A368 | R182-E364 WeakPolarHBondContact CG-OE1 3.47Å; R182-E364 IonicContact CZ-OE1 3.49Å; R182-E364 IonicContact CZ-OE2 2.62Å; R182-E364 IonicContact NE-OE1 3.19Å; R182-E364 PolarHBondContact NE-OE1 3.37Å; R182-E364 IonicContact NE-OE2 3.11Å; R182-E364 PolarHBondContact NE-OE2 3.4Å; R182-E364 IonicContact NH2-OE1 2.8Å; R182-E364 IonicContact NH2-OE2 2.78Å; R182-E364 PolarHBondContact NH2-OE2 3.2Å; M360-E364 HydrophobicContact CB-CB 4.33Å; M360-E364 HydrophobicContact CE-CB 3.86Å; M360-E364 WeakPolarHBondContact CE-O 3.16Å; S361-E364 PolarHBondContact N-OE2 3.45Å; S361-E364 PolarHBondContact O-N 3.26Å; S361-E364 VanDerWaalsContact O-N 3.14Å; S361-E364 VanDerWaalsContact OG-CG 3.26Å; S361-E364 WeakPolarHBondContact OG-CG 3.31Å; S361-E364 PolarHBondContact OG-N 2.82Å; V362-E364 VanDerWaalsContact C-N 3.35Å; V362-E364 PolarHBondContact O-N 2.77Å; E364-A367 PolarHBondContact O-N 2.93Å; E364-A368 WeakPolarHBondContact O-CB 3.28Å; E364-A368 PolarHBondContact O-N 3.29Å |
| 365 | L | 92.2 | Very high | 88.6 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62.1 | -47.6 | 174.8 | -74.2 | 168.6 | 0 | 0 | 0 | 111.2 | V357 M360 S361 V362 A367 A368 C369 L384 R385 L388 | V357-L365 HydrophobicContact CG1-CD2 3.9Å; M360-L365 HydrophobicContact CB-CD2 4.05Å; M360-L365 HydrophobicContact CB-CG 3.96Å; M360-L365 HydrophobicContact CE-CD2 3.91Å; M360-L365 HydrophobicContact CE-CG 4.2Å; M360-L365 HydrophobicContact SD-CD2 4.24Å; S361-L365 WeakPolarHBondContact O-CG 3.27Å; S361-L365 PolarHBondContact O-N 2.85Å; V362-L365 PolarHBondContact O-N 3.47Å; L365-A367 PolarHBondContact O-N 3.43Å; L365-A368 PolarHBondContact O-N 3.26Å; L365-C369 WeakPolarHBondContact O-CB 3.48Å; L365-C369 PolarHBondContact O-N 3.06Å; L365-C369 PolarHBondContact O-SG 2.89Å; L365-L384 HydrophobicContact CB-CB 4.31Å; L365-R385 HydrophobicContact CD1-CG 3.62Å; L365-R385 HydrophobicContact CD2-CG 4.05Å; L365-L388 HydrophobicContact CD2-CD2 3.78Å |
| 366 | Q | 91.3 | Very high | 88.3 | Confident | 54 Ų | 54 | 34 Ų | 34 | 25% | 0.252 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61.3 | -45.5 | 177.2 | -72.5 | 179.2 | -8.2 | 0 | 0 | 111.7 | V362 C369 R370 S376 L384 | V362-Q366 HydrophobicContact CG1-CG 4.4Å; V362-Q366 WeakPolarHBondContact O-CB 3.44Å; V362-Q366 VanDerWaalsContact O-CG 3.25Å; V362-Q366 WeakPolarHBondContact O-CG 3.47Å; V362-Q366 PolarHBondContact O-N 3.21Å; Q366-C369 PolarHBondContact O-N 2.89Å; Q366-R370 VanDerWaalsContact O-CB 3.29Å; Q366-R370 WeakPolarHBondContact O-CB 3.34Å; Q366-R370 PolarHBondContact O-N 3.35Å; Q366-S376 WeakPolarHBondContact CG-O 3.33Å; Q366-S376 WeakPolarHBondContact O-CB 3.46Å; Q366-L384 HydrophobicContact CG-CD1 3.66Å |
| 367 | A | 89.1 | Confident | 87.9 | Confident | 41 Ų | 41 | 35.8 Ų | 35.8 | 34% | 0.339 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -63.8 | -41.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | S363 E364 L365 R370 S371 | S363-A367 VanDerWaalsContact O-CB 3.29Å; S363-A367 WeakPolarHBondContact O-CB 3.43Å; S363-A367 PolarHBondContact O-N 3.38Å; E364-A367 PolarHBondContact O-N 2.93Å; L365-A367 PolarHBondContact O-N 3.43Å; A367-R370 PolarHBondContact O-N 2.99Å; A367-S371 WeakPolarHBondContact O-CB 3.46Å; A367-S371 PolarHBondContact O-N 2.84Å; A367-S371 PolarHBondContact O-OG 3.2Å |
| 368 | A | 91.4 | Very high | 87.4 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.6 | -40.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | M360 E364 L365 S371 R372 L388 | M360-A368 HydrophobicContact CE-CB 3.94Å; E364-A368 WeakPolarHBondContact O-CB 3.28Å; E364-A368 PolarHBondContact O-N 3.29Å; L365-A368 PolarHBondContact O-N 3.26Å; A368-S371 PolarHBondContact O-OG 3.12Å; A368-R372 WeakPolarHBondContact O-CD 3.33Å; A368-R372 WeakPolarHBondContact O-CG 3.41Å; A368-R372 PolarHBondContact O-N 3.27Å; A368-R372 PolarHBondContact O-NH1 2.7Å; A368-L388 HydrophobicContact CB-CD1 4.29Å; A368-L388 HydrophobicContact CB-CD2 4.05Å |
| 369 | C | 89.5 | Confident | 87.1 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.7 | -45 | 174.7 | -68.8 | 0 | 0 | 0 | 0 | 110.9 | L365 Q366 S371 R372 G373 M374 L384 Q387 | L365-C369 WeakPolarHBondContact O-CB 3.48Å; L365-C369 PolarHBondContact O-N 3.06Å; L365-C369 PolarHBondContact O-SG 2.89Å; Q366-C369 PolarHBondContact O-N 2.89Å; C369-S371 PolarHBondContact O-N 3.17Å; C369-R372 PolarHBondContact O-N 2.9Å; C369-G373 PolarHBondContact O-N 3.48Å; C369-M374 HydrophobicContact CB-CB 4.27Å; C369-M374 HydrophobicContact CB-CE 4.45Å; C369-M374 WeakPolarHBondContact O-CB 3.42Å; C369-M374 PolarHBondContact O-N 3.45Å; C369-L384 HydrophobicContact CB-CD2 4.36Å; C369-Q387 PolarHBondContact SG-NE2 3.48Å; C369-Q387 VanDerWaalsContact SG-NE2 3.44Å |
| 370 | R | 86.9 | Confident | 87.1 | Confident | 54 Ų | 54 | 36.1 Ų | 36.1 | 20% | 0.204 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.2 | -43.5 | 178.8 | -170.6 | -177.6 | -58 | 161.8 | 0.7 | 112.4 | E324 Q366 A367 R372 G373 S376 | E324-R370 WeakPolarHBondContact OE1-CD 3.45Å; E324-R370 VanDerWaalsContact OE1-CG 3.24Å; E324-R370 WeakPolarHBondContact OE1-CG 3.31Å; Q366-R370 VanDerWaalsContact O-CB 3.29Å; Q366-R370 WeakPolarHBondContact O-CB 3.34Å; Q366-R370 PolarHBondContact O-N 3.35Å; A367-R370 PolarHBondContact O-N 2.99Å; R370-R372 PolarHBondContact O-N 2.96Å; R370-G373 PolarHBondContact O-N 2.89Å; R370-S376 PolarHBondContact NE-OG 2.95Å |
| 371 | S | 87.7 | Confident | 87.1 | Confident | 30 Ų | 30 | 37.8 Ų | 37.8 | 21% | 0.21 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.6 | -20.1 | -179.6 | 69.3 | 0 | 0 | 0 | 0 | 113.6 | I345 A367 A368 C369 | I345-S371 WeakPolarHBondContact CD1-O 3.47Å; A367-S371 WeakPolarHBondContact O-CB 3.46Å; A367-S371 PolarHBondContact O-N 2.84Å; A367-S371 PolarHBondContact O-OG 3.2Å; A368-S371 PolarHBondContact O-OG 3.12Å; C369-S371 PolarHBondContact O-N 3.17Å |
| 372 | R | 88.9 | Confident | 87.1 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -96.2 | 9.8 | 176 | -68.8 | 162.9 | -177.6 | 68.5 | 7 | 112.5 | I345 D348 D349 A368 C369 R370 M374 W391 L406 | I345-R372 HydrophobicContact CG2-CG 4.03Å; D348-R372 IonicContact OD2-CZ 2.82Å; D348-R372 IonicContact OD2-NH1 3.88Å; D348-R372 PolarHBondContact OD2-NH1 3.4Å; D348-R372 IonicContact OD2-NH2 3.09Å; D348-R372 PolarHBondContact OD2-NH2 3.08Å; D349-R372 IonicContact OD1-CZ 3.77Å; D349-R372 IonicContact OD1-NE 3.61Å; D349-R372 PolarHBondContact OD1-NE 3.06Å; D349-R372 IonicContact OD1-NH2 3.85Å; D349-R372 PolarHBondContact OD1-NH2 2.92Å; A368-R372 WeakPolarHBondContact O-CD 3.33Å; A368-R372 WeakPolarHBondContact O-CG 3.41Å; A368-R372 PolarHBondContact O-N 3.27Å; A368-R372 PolarHBondContact O-NH1 2.7Å; C369-R372 PolarHBondContact O-N 2.9Å; R370-R372 PolarHBondContact O-N 2.96Å; R372-M374 HydrophobicContact CB-CE 3.67Å; R372-M374 HydrophobicContact CB-CG 4.32Å; R372-M374 HydrophobicContact CG-CE 4.29Å; R372-M374 PolarHBondContact O-N 2.96Å; R372-W391 HydrophobicContact CB-CD2 4.33Å; R372-W391 HydrophobicContact CB-CE3 4.36Å; R372-W391 HydrophobicContact CB-CH2 4.23Å; R372-W391 HydrophobicContact CB-CZ2 4.19Å; R372-W391 HydrophobicContact CB-CZ3 4.31Å; R372-W391 HydrophobicContact CG-CD2 4.3Å; R372-W391 HydrophobicContact CG-CZ2 4Å; R372-L406 WeakPolarHBondContact O-CD1 3.32Å |
| 373 | G | 81.1 | Confident | 86.9 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 24% | 0.237 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 71.8 | 11.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | C369 R370 | C369-G373 PolarHBondContact O-N 3.48Å; R370-G373 PolarHBondContact O-N 2.89Å |
| 374 | M | 84.3 | Confident | 86.9 | Confident | 4 Ų | 4 | 36.3 Ų | 36.3 | 2% | 0.02 | 21% | 0.211 | C | C | . | . | trans | -88.7 | 161.2 | 179.8 | -58 | -174.6 | -78.6 | 0 | 0 | 111.9 | C369 R372 S376 Q387 L388 W391 R409 | C369-M374 HydrophobicContact CB-CB 4.27Å; C369-M374 HydrophobicContact CB-CE 4.45Å; C369-M374 WeakPolarHBondContact O-CB 3.42Å; C369-M374 PolarHBondContact O-N 3.45Å; R372-M374 HydrophobicContact CB-CE 3.67Å; R372-M374 HydrophobicContact CB-CG 4.32Å; R372-M374 HydrophobicContact CG-CE 4.29Å; R372-M374 PolarHBondContact O-N 2.96Å; M374-S376 PolarHBondContact O-N 3.44Å; M374-Q387 HydrophobicContact CB-CG 4.49Å; M374-Q387 HydrophobicContact CE-CG 4.41Å; M374-Q387 HydrophobicContact SD-CG 3.56Å; M374-Q387 VanDerWaalsContact SD-CG 3.56Å; M374-L388 HydrophobicContact CE-CD1 4.33Å; M374-W391 HydrophobicContact CE-CB 3.98Å; M374-W391 HydrophobicContact CE-CD2 4.16Å; M374-W391 HydrophobicContact CE-CE3 4.1Å; M374-W391 HydrophobicContact CE-CG 4.1Å; M374-W391 HydrophobicContact CG-CE3 4.47Å; M374-W391 HydrophobicContact SD-CB 4.28Å; M374-W391 HydrophobicContact SD-CD2 4.46Å; M374-W391 HydrophobicContact SD-CE3 3.88Å; M374-R409 HydrophobicContact CG-CB 4.4Å; M374-R409 HydrophobicContact CG-CG 4.2Å | ||
| 375 | R | 80.8 | Confident | 87 | Confident | 71 Ų | 71 | 38.4 Ų | 38.4 | 27% | 0.268 | 22% | 0.217 | S | C | . | . | trans | -63.5 | 127.9 | 174.9 | -173.8 | 176.1 | 178.2 | 166.9 | 0.9 | 109.4 | L377 L379 Q387 L413 L416 | R375-L377 PolarHBondContact NE-O 2.87Å; R375-L379 HydrophobicContact CB-CD1 3.92Å; R375-L379 HydrophobicContact CG-CD1 3.79Å; R375-L379 HydrophobicContact CG-CG 4.43Å; R375-L379 VanDerWaalsContact O-CD1 3.25Å; R375-L379 WeakPolarHBondContact O-CD1 3.41Å; R375-Q387 PolarHBondContact O-NE2 3.15Å; R375-L413 HydrophobicContact CB-CD1 3.79Å; R375-L416 VanDerWaalsContact NH1-CB 3.29Å; R375-L416 VanDerWaalsContact NH1-CD1 3.33Å | ||
| 376 | S | 82.8 | Confident | 86.9 | Confident | 6 Ų | 6 | 44 Ų | 44 | 4% | 0.042 | 24% | 0.243 | C | C | . | . | trans | -117.8 | -16.7 | 179.7 | 51 | 0 | 0 | 0 | 0 | 113.6 | Q366 R370 M374 | Q366-S376 WeakPolarHBondContact CG-O 3.33Å; Q366-S376 WeakPolarHBondContact O-CB 3.46Å; R370-S376 PolarHBondContact NE-OG 2.95Å; M374-S376 PolarHBondContact O-N 3.44Å | ||
| 377 | L | 81.4 | Confident | 86.8 | Confident | 64 Ų | 64 | 42.6 Ų | 42.6 | 34% | 0.335 | 24% | 0.237 | S | C | . | . | S | Bend | trans | -109.9 | 140.7 | -176.1 | -59.8 | 175.6 | 0 | 0 | 0 | 110.9 | L242 R375 | L242-L377 HydrophobicContact CD1-CD1 4.11Å; R375-L377 PolarHBondContact NE-O 2.87Å |
| 378 | G | 79.5 | Confident | 86.9 | Confident | 73 Ų | 73 | 40.7 Ų | 40.7 | 75% | 0.753 | 22% | 0.221 | S | C | * | . | S | Bend | trans | 74.7 | 23.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 379 | L | 82.7 | Confident | 87 | Confident | 44 Ų | 44 | 44.3 Ų | 44.3 | 23% | 0.23 | 24% | 0.238 | C | C | . | . | trans | -114.7 | 149.5 | 173.8 | -72.3 | 157.3 | 0 | 0 | 0 | 109.3 | R375 Q383 L384 | R375-L379 HydrophobicContact CB-CD1 3.92Å; R375-L379 HydrophobicContact CG-CD1 3.79Å; R375-L379 HydrophobicContact CG-CG 4.43Å; R375-L379 VanDerWaalsContact O-CD1 3.25Å; R375-L379 WeakPolarHBondContact O-CD1 3.41Å; L379-Q383 HydrophobicContact CB-CB 4.28Å; L379-Q383 HydrophobicContact CD2-CB 4.03Å; L379-L384 HydrophobicContact CB-CD2 4.06Å; L379-L384 HydrophobicContact CB-CG 3.94Å; L379-L384 HydrophobicContact CD1-CD2 3.87Å | ||
| 380 | T | 89 | Confident | 87 | Confident | 77 Ų | 77 | 45.3 Ų | 45.3 | 47% | 0.472 | 24% | 0.242 | S | C | . | . | trans | -70.1 | 161.6 | 172.1 | 67.1 | 0 | 0 | 0 | 0 | 110.8 | D382 Q383 L384 | T380-D382 PolarHBondContact O-N 2.99Å; T380-Q383 PolarHBondContact O-N 3.26Å; T380-Q383 VanDerWaalsContact OG1-CG 3.24Å; T380-Q383 WeakPolarHBondContact OG1-CG 3.17Å; T380-Q383 PolarHBondContact OG1-N 3.12Å; T380-Q383 PolarHBondContact OG1-OE1 3.16Å; T380-L384 WeakPolarHBondContact O-CG 3.46Å; T380-L384 PolarHBondContact O-N 3.16Å | ||
| 381 | S | 89.1 | Confident | 87.2 | Confident | 42 Ų | 42 | 42.8 Ų | 42.8 | 29% | 0.294 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -55.8 | -39 | 177.2 | 52.4 | 0 | 0 | 0 | 0 | 112.2 | L384 R385 | S381-L384 PolarHBondContact O-N 3.28Å; S381-R385 WeakPolarHBondContact O-CG 3.5Å; S381-R385 PolarHBondContact O-N 3.49Å |
| 382 | D | 89.8 | Confident | 87.4 | Confident | 89 Ų | 89 | 41.6 Ų | 41.6 | 48% | 0.476 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -76.2 | -35.8 | -175.2 | -56.3 | -29.5 | 0 | 0 | 0 | 111.4 | T380 L384 R385 Q386 | T380-D382 PolarHBondContact O-N 2.99Å; D382-L384 VanDerWaalsContact C-N 3.34Å; D382-L384 PolarHBondContact O-N 3.37Å; D382-R385 PolarHBondContact O-N 3.28Å; D382-R385 IonicContact OD1-NH1 3.29Å; D382-R385 PolarHBondContact OD1-NH1 2.99Å; D382-Q386 WeakPolarHBondContact O-CB 2.95Å; D382-Q386 VanDerWaalsContact O-CG 3.32Å; D382-Q386 WeakPolarHBondContact O-CG 3.17Å; D382-Q386 PolarHBondContact O-N 3.26Å |
| 383 | Q | 87.8 | Confident | 87.5 | Confident | 78 Ų | 78 | 43.5 Ų | 43.5 | 36% | 0.364 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.6 | -40.7 | 170.2 | -72.4 | 171.4 | -14.6 | 0 | 0 | 111.7 | L379 T380 Q386 Q387 | L379-Q383 HydrophobicContact CB-CB 4.28Å; L379-Q383 HydrophobicContact CD2-CB 4.03Å; T380-Q383 PolarHBondContact O-N 3.26Å; T380-Q383 VanDerWaalsContact OG1-CG 3.24Å; T380-Q383 WeakPolarHBondContact OG1-CG 3.17Å; T380-Q383 PolarHBondContact OG1-N 3.12Å; T380-Q383 PolarHBondContact OG1-OE1 3.16Å; Q383-Q386 PolarHBondContact O-N 3.37Å; Q383-Q387 VanDerWaalsContact O-CB 3.25Å; Q383-Q387 WeakPolarHBondContact O-CB 3.46Å; Q383-Q387 PolarHBondContact O-N 3.15Å |
| 384 | L | 90.1 | Very high | 87.7 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.7 | -40.8 | 175.2 | -72 | 168.1 | 0 | 0 | 0 | 111.8 | L365 Q366 C369 L379 T380 S381 D382 L388 | L365-L384 HydrophobicContact CB-CB 4.31Å; Q366-L384 HydrophobicContact CG-CD1 3.66Å; C369-L384 HydrophobicContact CB-CD2 4.36Å; L379-L384 HydrophobicContact CB-CD2 4.06Å; L379-L384 HydrophobicContact CB-CG 3.94Å; L379-L384 HydrophobicContact CD1-CD2 3.87Å; T380-L384 WeakPolarHBondContact O-CG 3.46Å; T380-L384 PolarHBondContact O-N 3.16Å; S381-L384 PolarHBondContact O-N 3.28Å; D382-L384 VanDerWaalsContact C-N 3.34Å; D382-L384 PolarHBondContact O-N 3.37Å; L384-L388 WeakPolarHBondContact O-CB 3.04Å; L384-L388 PolarHBondContact O-N 3.16Å |
| 385 | R | 92.1 | Very high | 87.9 | Confident | 80 Ų | 80 | 43.9 Ų | 43.9 | 30% | 0.302 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.9 | -48.4 | 175 | -72.9 | -178.7 | -178.6 | 121.5 | -4.3 | 111.6 | V357 L365 S381 D382 Q387 L388 Q389 | V357-R385 HydrophobicContact CG1-CB 4.15Å; V357-R385 HydrophobicContact CG1-CG 4.09Å; L365-R385 HydrophobicContact CD1-CG 3.62Å; L365-R385 HydrophobicContact CD2-CG 4.05Å; S381-R385 WeakPolarHBondContact O-CG 3.5Å; S381-R385 PolarHBondContact O-N 3.49Å; D382-R385 PolarHBondContact O-N 3.28Å; D382-R385 IonicContact OD1-NH1 3.29Å; D382-R385 PolarHBondContact OD1-NH1 2.99Å; R385-Q387 VanDerWaalsContact C-N 3.34Å; R385-Q387 PolarHBondContact O-N 3.39Å; R385-L388 PolarHBondContact O-N 3.33Å; R385-Q389 VanDerWaalsContact O-CB 3.27Å; R385-Q389 WeakPolarHBondContact O-CB 3.4Å; R385-Q389 PolarHBondContact O-N 2.84Å |
| 386 | Q | 90.1 | Very high | 88.2 | Confident | 116 Ų | 116 | 42.9 Ų | 42.9 | 54% | 0.542 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -59 | -45.7 | 177.3 | -75.1 | 175.3 | -4.6 | 0 | 0 | 111.4 | D382 Q383 L388 Q389 Q390 | D382-Q386 WeakPolarHBondContact O-CB 2.95Å; D382-Q386 VanDerWaalsContact O-CG 3.32Å; D382-Q386 WeakPolarHBondContact O-CG 3.17Å; D382-Q386 PolarHBondContact O-N 3.26Å; Q383-Q386 PolarHBondContact O-N 3.37Å; Q386-L388 PolarHBondContact O-N 3.04Å; Q386-Q389 PolarHBondContact O-N 2.87Å; Q386-Q390 WeakPolarHBondContact O-CB 3.47Å; Q386-Q390 PolarHBondContact O-N 3.49Å |
| 387 | Q | 88.8 | Confident | 88.4 | Confident | 26 Ų | 26 | 49.3 Ų | 49.3 | 12% | 0.121 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61 | -44.1 | 178.2 | -176.2 | -179.2 | -107.4 | 0 | 0 | 111.8 | C369 M374 R375 Q383 R385 W391 | C369-Q387 PolarHBondContact SG-NE2 3.48Å; C369-Q387 VanDerWaalsContact SG-NE2 3.44Å; M374-Q387 HydrophobicContact CB-CG 4.49Å; M374-Q387 HydrophobicContact CE-CG 4.41Å; M374-Q387 HydrophobicContact SD-CG 3.56Å; M374-Q387 VanDerWaalsContact SD-CG 3.56Å; R375-Q387 PolarHBondContact O-NE2 3.15Å; Q383-Q387 VanDerWaalsContact O-CB 3.25Å; Q383-Q387 WeakPolarHBondContact O-CB 3.46Å; Q383-Q387 PolarHBondContact O-N 3.15Å; R385-Q387 VanDerWaalsContact C-N 3.34Å; R385-Q387 PolarHBondContact O-N 3.39Å; Q387-W391 PolarHBondContact O-N 3.29Å; Q387-W391 VanDerWaalsContact O-N 3.11Å |
| 388 | L | 91.6 | Very high | 88.3 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -70.3 | -39.5 | 177.8 | -173.1 | 61.9 | 0 | 0 | 0 | 112 | V357 M360 L365 A368 M374 L384 R385 Q386 W391 L392 | V357-L388 HydrophobicContact CG1-CD2 4.2Å; V357-L388 HydrophobicContact CG2-CD2 4.42Å; V357-L388 HydrophobicContact CG2-CG 4.49Å; M360-L388 HydrophobicContact CE-CD2 3.94Å; M360-L388 HydrophobicContact SD-CD2 3.94Å; L365-L388 HydrophobicContact CD2-CD2 3.78Å; A368-L388 HydrophobicContact CB-CD1 4.29Å; A368-L388 HydrophobicContact CB-CD2 4.05Å; M374-L388 HydrophobicContact CE-CD1 4.33Å; L384-L388 WeakPolarHBondContact O-CB 3.04Å; L384-L388 PolarHBondContact O-N 3.16Å; R385-L388 PolarHBondContact O-N 3.33Å; Q386-L388 PolarHBondContact O-N 3.04Å; L388-W391 WeakPolarHBondContact O-CB 3.36Å; L388-W391 PolarHBondContact O-N 3.45Å; L388-L392 HydrophobicContact CG-CD1 4.41Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 2.83Å |
| 389 | Q | 92.7 | Very high | 88.4 | Confident | 77 Ų | 77 | 53.7 Ų | 53.7 | 36% | 0.36 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.3 | -45 | 176.9 | -171.6 | 62.1 | 49.8 | 0 | 0 | 111 | R385 Q386 W391 L392 D393 | R385-Q389 VanDerWaalsContact O-CB 3.27Å; R385-Q389 WeakPolarHBondContact O-CB 3.4Å; R385-Q389 PolarHBondContact O-N 2.84Å; Q386-Q389 PolarHBondContact O-N 2.87Å; Q389-W391 VanDerWaalsContact C-N 3.29Å; Q389-W391 PolarHBondContact O-N 3.26Å; Q389-L392 PolarHBondContact O-N 3.26Å; Q389-D393 PolarHBondContact NE2-OD1 3.48Å; Q389-D393 VanDerWaalsContact NE2-OD1 3.08Å; Q389-D393 WeakPolarHBondContact O-CB 3.44Å; Q389-D393 VanDerWaalsContact O-CG 3.23Å; Q389-D393 PolarHBondContact O-N 3.17Å |
| 390 | Q | 89.9 | Confident | 88.3 | Confident | 21 Ų | 21 | 51.6 Ų | 51.6 | 10% | 0.098 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61 | -39.8 | 175.8 | -168.6 | -172.2 | 27.6 | 0 | 0 | 111.4 | P290 Q386 L394 R409 | P290-Q390 PolarHBondContact O-NE2 2.98Å; P290-Q390 VanDerWaalsContact O-NE2 3.1Å; Q386-Q390 WeakPolarHBondContact O-CB 3.47Å; Q386-Q390 PolarHBondContact O-N 3.49Å; Q390-L394 HydrophobicContact CG-CD1 4.14Å; Q390-L394 WeakPolarHBondContact O-CB 3.32Å; Q390-L394 WeakPolarHBondContact O-CD1 3.35Å; Q390-L394 VanDerWaalsContact O-CG 3.25Å; Q390-L394 WeakPolarHBondContact O-CG 3.35Å; Q390-L394 PolarHBondContact O-N 3.4Å; Q390-R409 VanDerWaalsContact CD-NH2 3.29Å |
| 391 | W | 90.8 | Very high | 87.8 | Confident | 1 Ų | 1 | 50.1 Ų | 50.1 | 0% | 0.004 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.5 | -48.8 | 173.5 | 174.7 | -80.1 | 0 | 0 | 0 | 111.8 | I345 D349 R372 M374 Q387 L388 Q389 L394 H395 P402 L405 R409 | I345-W391 HydrophobicContact CG2-CZ2 4.11Å; D349-W391 PolarHBondContact OD1-NE1 3.42Å; D349-W391 PolarHBondContact OD2-NE1 3.01Å; R372-W391 HydrophobicContact CB-CD2 4.33Å; R372-W391 HydrophobicContact CB-CE3 4.36Å; R372-W391 HydrophobicContact CB-CH2 4.23Å; R372-W391 HydrophobicContact CB-CZ2 4.19Å; R372-W391 HydrophobicContact CB-CZ3 4.31Å; R372-W391 HydrophobicContact CG-CD2 4.3Å; R372-W391 HydrophobicContact CG-CZ2 4Å; M374-W391 HydrophobicContact CE-CB 3.98Å; M374-W391 HydrophobicContact CE-CD2 4.16Å; M374-W391 HydrophobicContact CE-CE3 4.1Å; M374-W391 HydrophobicContact CE-CG 4.1Å; M374-W391 HydrophobicContact CG-CE3 4.47Å; M374-W391 HydrophobicContact SD-CB 4.28Å; M374-W391 HydrophobicContact SD-CD2 4.46Å; M374-W391 HydrophobicContact SD-CE3 3.88Å; Q387-W391 PolarHBondContact O-N 3.29Å; Q387-W391 VanDerWaalsContact O-N 3.11Å; L388-W391 WeakPolarHBondContact O-CB 3.36Å; L388-W391 PolarHBondContact O-N 3.45Å; Q389-W391 VanDerWaalsContact C-N 3.29Å; Q389-W391 PolarHBondContact O-N 3.26Å; W391-L394 PolarHBondContact O-N 2.98Å; W391-H395 WeakPolarHBondContact O-CB 3.31Å; W391-H395 PolarHBondContact O-N 3.49Å; W391-P402 HydrophobicContact CZ2-CB 4.43Å; W391-L405 HydrophobicContact CD2-CD1 4.5Å; W391-L405 HydrophobicContact CE3-CB 4.12Å; W391-L405 HydrophobicContact CH2-CB 3.54Å; W391-L405 HydrophobicContact CZ2-CB 4.21Å; W391-L405 HydrophobicContact CZ2-CD1 4.42Å; W391-L405 HydrophobicContact CZ3-CB 3.5Å; W391-R409 HydrophobicContact CE3-CG 4.28Å; W391-R409 HydrophobicContact CZ3-CG 4.1Å |
| 392 | L | 92.2 | Very high | 87.4 | Confident | 5 Ų | 5 | 49 Ų | 49 | 3% | 0.026 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.9 | -40.5 | -179.5 | -67.2 | 170.9 | 0 | 0 | 0 | 111.9 | D349 I352 V357 L388 Q389 H395 L396 | D349-L392 HydrophobicContact CB-CD2 3.58Å; D349-L392 VanDerWaalsContact OD1-CD2 3.31Å; D349-L392 WeakPolarHBondContact OD1-CD2 3.37Å; I352-L392 HydrophobicContact CB-CD1 4.26Å; I352-L392 HydrophobicContact CB-CD2 4.48Å; I352-L392 HydrophobicContact CG2-CD1 3.58Å; V357-L392 HydrophobicContact CG2-CD1 3.47Å; V357-L392 VanDerWaalsContact CG2-CD1 3.47Å; L388-L392 HydrophobicContact CG-CD1 4.41Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 2.83Å; Q389-L392 PolarHBondContact O-N 3.26Å; L392-H395 PolarHBondContact O-N 2.82Å; L392-L396 HydrophobicContact CD2-CD1 4.16Å; L392-L396 VanDerWaalsContact O-CB 3.28Å; L392-L396 WeakPolarHBondContact O-CB 3.23Å; L392-L396 PolarHBondContact O-N 3.37Å |
| 393 | D | 90.3 | Very high | 86.8 | Confident | 40 Ų | 40 | 46 Ų | 46 | 21% | 0.214 | 23% | 0.225 | C | C | . | . | I | π-helix | trans | -62.1 | -45.5 | 177.2 | -69.9 | -19.9 | 0 | 0 | 0 | 110.8 | Q389 K397 E398 | Q389-D393 PolarHBondContact NE2-OD1 3.48Å; Q389-D393 VanDerWaalsContact NE2-OD1 3.08Å; Q389-D393 WeakPolarHBondContact O-CB 3.44Å; Q389-D393 VanDerWaalsContact O-CG 3.23Å; Q389-D393 PolarHBondContact O-N 3.17Å; D393-K397 HydrophobicContact CB-CD 4.16Å; D393-K397 WeakPolarHBondContact O-CA 3.28Å; D393-K397 WeakPolarHBondContact O-CB 3.35Å; D393-K397 PolarHBondContact O-N 2.97Å; D393-K397 VanDerWaalsContact OD1-CE 3.25Å; D393-K397 WeakPolarHBondContact OD1-CE 3.31Å; D393-K397 IonicContact OD1-NZ 2.71Å; D393-K397 PolarHBondContact OD1-NZ 3.33Å; D393-K397 IonicContact OD2-NZ 3.81Å; D393-E398 PolarHBondContact O-N 3.25Å |
| 394 | L | 86.4 | Confident | 86.3 | Confident | 1 Ų | 1 | 42.8 Ų | 42.8 | 1% | 0.005 | 21% | 0.21 | C | C | . | . | I | π-helix | trans | -65.9 | -40.6 | 177.2 | -72.5 | 166.7 | 0 | 0 | 0 | 112.8 | T292 I295 V296 Q390 W391 E398 V400 L405 | T292-L394 HydrophobicContact CG2-CD2 3.52Å; T292-L394 HydrophobicContact CG2-CG 4.09Å; I295-L394 HydrophobicContact CB-CD2 4.24Å; I295-L394 HydrophobicContact CD1-CD1 3.93Å; I295-L394 HydrophobicContact CG2-CD1 4.12Å; I295-L394 HydrophobicContact CG2-CD2 4.06Å; V296-L394 HydrophobicContact CG2-CD2 3.78Å; Q390-L394 HydrophobicContact CG-CD1 4.14Å; Q390-L394 WeakPolarHBondContact O-CB 3.32Å; Q390-L394 WeakPolarHBondContact O-CD1 3.35Å; Q390-L394 VanDerWaalsContact O-CG 3.25Å; Q390-L394 WeakPolarHBondContact O-CG 3.35Å; Q390-L394 PolarHBondContact O-N 3.4Å; W391-L394 PolarHBondContact O-N 2.98Å; L394-E398 WeakPolarHBondContact O-CB 3.31Å; L394-V400 WeakPolarHBondContact O-CB 3.24Å; L394-V400 WeakPolarHBondContact O-CG2 3.41Å; L394-V400 PolarHBondContact O-N 2.88Å; L394-V400 VanDerWaalsContact O-N 3.15Å; L394-L405 HydrophobicContact CB-CD1 4.13Å; L394-L405 HydrophobicContact CB-CD2 3.87Å; L394-L405 HydrophobicContact CD1-CD2 4.03Å; L394-L405 HydrophobicContact CG-CD2 4.47Å |
| 395 | H | 87.4 | Confident | 85.8 | Confident | 11 Ų | 11 | 42.8 Ų | 42.8 | 5% | 0.051 | 21% | 0.21 | C | C | . | . | I | π-helix | trans | -78.6 | -45.9 | -176.8 | 178.3 | -143.7 | 0 | 0 | 0 | 112.5 | D349 W391 L392 N399 V400 P402 L405 | D349-H395 IonicContact OD2-CE1 3.82Å; D349-H395 PolarHBondContact OD2-CE1 3.35Å; D349-H395 IonicContact OD2-CG 3.77Å; D349-H395 IonicContact OD2-ND1 2.74Å; D349-H395 PolarHBondContact OD2-ND1 3.01Å; W391-H395 WeakPolarHBondContact O-CB 3.31Å; W391-H395 PolarHBondContact O-N 3.49Å; L392-H395 PolarHBondContact O-N 2.82Å; H395-N399 VanDerWaalsContact O-CA 3.32Å; H395-N399 WeakPolarHBondContact O-CA 3.46Å; H395-N399 PolarHBondContact O-N 3.15Å; H395-V400 PolarHBondContact CD2-O 2.93Å; H395-P402 VanDerWaalsContact NE2-CG 3.27Å; H395-P402 WeakPolarHBondContact NE2-CG 3.38Å; H395-L405 HydrophobicContact CB-CD1 3.72Å |
| 396 | L | 88.6 | Confident | 85.1 | Confident | 50 Ų | 50 | 39 Ų | 39 | 26% | 0.262 | 20% | 0.196 | S | C | . | . | I | π-helix | trans | -92 | -36.7 | -171.9 | -59.5 | 177.1 | 0 | 0 | 0 | 113.3 | D349 E350 S353 L392 | D349-L396 HydrophobicContact CB-CD2 4.37Å; E350-L396 HydrophobicContact CG-CD2 4.24Å; S353-L396 VanDerWaalsContact CB-CD1 3.44Å; L392-L396 HydrophobicContact CD2-CD1 4.16Å; L392-L396 VanDerWaalsContact O-CB 3.28Å; L392-L396 WeakPolarHBondContact O-CB 3.23Å; L392-L396 PolarHBondContact O-N 3.37Å |
| 397 | K | 85.3 | Confident | 84.3 | Confident | 140 Ų | 140 | 34.1 Ų | 34.1 | 61% | 0.609 | 17% | 0.173 | S | C | * | . | I | π-helix | trans | -86.7 | -48.6 | -179.6 | -56.6 | 173.7 | 174.6 | 161.4 | 0 | 111.1 | D393 N399 | D393-K397 HydrophobicContact CB-CD 4.16Å; D393-K397 WeakPolarHBondContact O-CA 3.28Å; D393-K397 WeakPolarHBondContact O-CB 3.35Å; D393-K397 PolarHBondContact O-N 2.97Å; D393-K397 VanDerWaalsContact OD1-CE 3.25Å; D393-K397 WeakPolarHBondContact OD1-CE 3.31Å; D393-K397 IonicContact OD1-NZ 2.71Å; D393-K397 PolarHBondContact OD1-NZ 3.33Å; D393-K397 IonicContact OD2-NZ 3.81Å; K397-N399 VanDerWaalsContact C-N 3.34Å; K397-N399 PolarHBondContact O-ND2 3.47Å |
| 398 | E | 81.1 | Confident | 83.6 | Confident | 100 Ų | 100 | 34 Ų | 34 | 47% | 0.467 | 18% | 0.175 | S | C | . | . | S | Bend | trans | -87.9 | -1.9 | -177.2 | -57.7 | -68.8 | 161.5 | 0 | 0 | 113.1 | V296 D393 L394 V400 | V296-E398 HydrophobicContact CG2-CB 3.85Å; V296-E398 HydrophobicContact CG2-CG 3.68Å; D393-E398 PolarHBondContact O-N 3.25Å; L394-E398 WeakPolarHBondContact O-CB 3.31Å; E398-V400 HydrophobicContact CB-CG2 3.99Å; E398-V400 PolarHBondContact O-N 3.26Å; E398-V400 VanDerWaalsContact O-N 3.12Å |
| 399 | N | 80.4 | Confident | 82.8 | Confident | 129 Ų | 129 | 34.9 Ų | 34.9 | 69% | 0.69 | 18% | 0.179 | S | C | * | . | trans | 54.7 | 26 | 179 | -69.9 | -81.2 | 0 | 0 | 0 | 114.8 | H395 K397 | H395-N399 VanDerWaalsContact O-CA 3.32Å; H395-N399 WeakPolarHBondContact O-CA 3.46Å; H395-N399 PolarHBondContact O-N 3.15Å; K397-N399 VanDerWaalsContact C-N 3.34Å; K397-N399 PolarHBondContact O-ND2 3.47Å | ||
| 400 | V | 80.9 | Confident | 81.6 | Confident | 1 Ų | 1 | 31.2 Ų | 31.2 | 1% | 0.006 | 16% | 0.161 | C | C | . | . | trans | -70.5 | 129.4 | -179.8 | -176.1 | 0 | 0 | 0 | 0 | 109.8 | V296 L394 H395 E398 L404 L405 | V296-V400 HydrophobicContact CG2-CG2 4.42Å; L394-V400 WeakPolarHBondContact O-CB 3.24Å; L394-V400 WeakPolarHBondContact O-CG2 3.41Å; L394-V400 PolarHBondContact O-N 2.88Å; L394-V400 VanDerWaalsContact O-N 3.15Å; H395-V400 PolarHBondContact CD2-O 2.93Å; E398-V400 HydrophobicContact CB-CG2 3.99Å; E398-V400 PolarHBondContact O-N 3.26Å; E398-V400 VanDerWaalsContact O-N 3.12Å; V400-L404 HydrophobicContact CG1-CB 4.43Å; V400-L404 HydrophobicContact CG1-CD1 4.4Å; V400-L404 HydrophobicContact CG1-CD2 4.06Å; V400-L405 HydrophobicContact CB-CD1 4.32Å; V400-L405 HydrophobicContact CB-CD2 4.07Å; V400-L405 HydrophobicContact CB-CG 4.15Å; V400-L405 HydrophobicContact CG1-CD1 4.49Å; V400-L405 HydrophobicContact CG1-CD2 3.7Å; V400-L405 HydrophobicContact CG1-CG 3.79Å | ||
| 401 | P | 78.4 | Confident | 80.3 | Confident | 46 Ų | 46 | 30.8 Ų | 30.8 | 30% | 0.299 | 16% | 0.159 | S | C | . | . | trans | -56.2 | 133.5 | 180 | -27.4 | 34.8 | 0 | 0 | 0 | 113.1 | E303 S403 L404 L405 | E303-P401 HydrophobicContact CG-CG 4.36Å; P401-S403 PolarHBondContact O-N 2.89Å; P401-S403 VanDerWaalsContact O-N 3.14Å; P401-L404 HydrophobicContact CB-CB 4.45Å; P401-L404 WeakPolarHBondContact O-CB 2.95Å; P401-L404 PolarHBondContact O-N 3.22Å; P401-L405 PolarHBondContact O-N 2.8Å; P401-L405 VanDerWaalsContact O-N 3.14Å | ||
| 402 | P | 80.6 | Confident | 78.9 | Confident | 19 Ų | 19 | 33.9 Ų | 33.9 | 12% | 0.123 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.6 | -28.9 | 179.1 | -30.1 | 36.6 | 0 | 0 | 0 | 115.1 | L342 W391 H395 L404 L406 | L342-P402 HydrophobicContact CD2-CB 3.86Å; W391-P402 HydrophobicContact CZ2-CB 4.43Å; H395-P402 VanDerWaalsContact NE2-CG 3.27Å; H395-P402 WeakPolarHBondContact NE2-CG 3.38Å; P402-L404 VanDerWaalsContact C-N 3.33Å; P402-L406 VanDerWaalsContact O-CB 3.28Å; P402-L406 WeakPolarHBondContact O-CB 3.34Å; P402-L406 PolarHBondContact O-N 2.95Å |
| 403 | S | 77.3 | Confident | 77.5 | Confident | 25 Ų | 25 | 35.5 Ų | 35.5 | 18% | 0.175 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.6 | -41.3 | 175.5 | 43.6 | 0 | 0 | 0 | 0 | 111.8 | P401 L406 L407 | P401-S403 PolarHBondContact O-N 2.89Å; P401-S403 VanDerWaalsContact O-N 3.14Å; S403-L406 PolarHBondContact O-N 3.02Å; S403-L407 PolarHBondContact O-N 3.05Å; S403-L407 VanDerWaalsContact O-N 3.13Å |
| 404 | L | 77.2 | Confident | 75.7 | Confident | 10 Ų | 10 | 34.8 Ų | 34.8 | 5% | 0.052 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -72.7 | -44.8 | 179.8 | -168.5 | 165.9 | 0 | 0 | 0 | 110.4 | S299 F302 E303 V400 P401 P402 L406 L407 S408 | S299-L404 WeakPolarHBondContact O-CD1 3.28Å; F302-L404 HydrophobicContact CB-CD1 3.68Å; F302-L404 HydrophobicContact CB-CG 4.02Å; E303-L404 HydrophobicContact CG-CD1 4.23Å; V400-L404 HydrophobicContact CG1-CB 4.43Å; V400-L404 HydrophobicContact CG1-CD1 4.4Å; V400-L404 HydrophobicContact CG1-CD2 4.06Å; P401-L404 HydrophobicContact CB-CB 4.45Å; P401-L404 WeakPolarHBondContact O-CB 2.95Å; P401-L404 PolarHBondContact O-N 3.22Å; P402-L404 VanDerWaalsContact C-N 3.33Å; L404-L406 PolarHBondContact O-N 3.46Å; L404-L407 PolarHBondContact O-N 3.33Å; L404-L407 VanDerWaalsContact O-N 3.1Å; L404-S408 PolarHBondContact O-N 2.95Å |
| 405 | L | 79.4 | Confident | 73.9 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -58.7 | -38.4 | 174.4 | -67.2 | 178.1 | 0 | 0 | 0 | 111.9 | I295 W391 L394 H395 V400 P401 S408 R409 | I295-L405 HydrophobicContact CG2-CD2 4.49Å; W391-L405 HydrophobicContact CD2-CD1 4.5Å; W391-L405 HydrophobicContact CE3-CB 4.12Å; W391-L405 HydrophobicContact CH2-CB 3.54Å; W391-L405 HydrophobicContact CZ2-CB 4.21Å; W391-L405 HydrophobicContact CZ2-CD1 4.42Å; W391-L405 HydrophobicContact CZ3-CB 3.5Å; L394-L405 HydrophobicContact CB-CD1 4.13Å; L394-L405 HydrophobicContact CB-CD2 3.87Å; L394-L405 HydrophobicContact CD1-CD2 4.03Å; L394-L405 HydrophobicContact CG-CD2 4.47Å; H395-L405 HydrophobicContact CB-CD1 3.72Å; V400-L405 HydrophobicContact CB-CD1 4.32Å; V400-L405 HydrophobicContact CB-CD2 4.07Å; V400-L405 HydrophobicContact CB-CG 4.15Å; V400-L405 HydrophobicContact CG1-CD1 4.49Å; V400-L405 HydrophobicContact CG1-CD2 3.7Å; V400-L405 HydrophobicContact CG1-CG 3.79Å; P401-L405 PolarHBondContact O-N 2.8Å; P401-L405 VanDerWaalsContact O-N 3.14Å; L405-S408 PolarHBondContact O-OG 3.11Å; L405-R409 WeakPolarHBondContact O-CB 3.42Å; L405-R409 WeakPolarHBondContact O-CG 3.35Å; L405-R409 PolarHBondContact O-N 3.4Å |
| 406 | L | 78.8 | Confident | 72 | Confident | 2 Ų | 2 | 44.2 Ų | 44.2 | 1% | 0.01 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.7 | -43.9 | 175.2 | -175.8 | 69.6 | 0 | 0 | 0 | 111.7 | L319 L322 L323 R372 P402 S403 L404 R409 A410 | L319-L406 HydrophobicContact CD2-CD2 4.23Å; L322-L406 HydrophobicContact CD2-CD1 3.63Å; L322-L406 HydrophobicContact CD2-CD2 4.25Å; L322-L406 HydrophobicContact CD2-CG 3.72Å; L322-L406 HydrophobicContact CG-CD1 4.27Å; L323-L406 HydrophobicContact CD1-CD2 3.63Å; L323-L406 HydrophobicContact CD2-CD1 3.55Å; L323-L406 HydrophobicContact CD2-CD2 3.69Å; L323-L406 HydrophobicContact CD2-CG 4.28Å; L323-L406 HydrophobicContact CG-CD1 4.37Å; L323-L406 HydrophobicContact CG-CD2 3.71Å; R372-L406 WeakPolarHBondContact O-CD1 3.32Å; P402-L406 VanDerWaalsContact O-CB 3.28Å; P402-L406 WeakPolarHBondContact O-CB 3.34Å; P402-L406 PolarHBondContact O-N 2.95Å; S403-L406 PolarHBondContact O-N 3.02Å; L404-L406 PolarHBondContact O-N 3.46Å; L406-R409 PolarHBondContact O-N 2.9Å; L406-A410 WeakPolarHBondContact O-CB 3.28Å; L406-A410 PolarHBondContact O-N 3.3Å |
| 407 | L | 73.2 | Confident | 69.6 | Low | 13 Ų | 13 | 50.1 Ų | 50.1 | 7% | 0.068 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.7 | -45.6 | 178.2 | -176.4 | 63.6 | 0 | 0 | 0 | 111.6 | L252 I256 L306 S403 L404 R409 A410 M411 | L252-L407 HydrophobicContact CB-CD1 4.46Å; L252-L407 HydrophobicContact CD1-CD1 3.87Å; L252-L407 HydrophobicContact CD2-CD1 3.74Å; L252-L407 HydrophobicContact CG-CD1 4.23Å; I256-L407 HydrophobicContact CD1-CD1 4.1Å; I256-L407 HydrophobicContact CD1-CD2 4.27Å; I256-L407 HydrophobicContact CD1-CG 4.22Å; L306-L407 HydrophobicContact CD1-CD2 3.52Å; L306-L407 HydrophobicContact CD2-CB 4.39Å; L306-L407 HydrophobicContact CD2-CD2 3.44Å; L306-L407 VanDerWaalsContact CD2-CD2 3.44Å; L306-L407 HydrophobicContact CG-CD2 4.11Å; S403-L407 PolarHBondContact O-N 3.05Å; S403-L407 VanDerWaalsContact O-N 3.13Å; L404-L407 PolarHBondContact O-N 3.33Å; L404-L407 VanDerWaalsContact O-N 3.1Å; L407-R409 VanDerWaalsContact C-N 3.3Å; L407-R409 PolarHBondContact O-N 3.45Å; L407-A410 WeakPolarHBondContact O-CB 3.23Å; L407-A410 PolarHBondContact O-N 3.24Å; L407-M411 WeakPolarHBondContact O-CG 3.5Å; L407-M411 PolarHBondContact O-N 3.31Å |
| 408 | S | 72.9 | Confident | 67.4 | Low | 22 Ų | 22 | 48.1 Ų | 48.1 | 15% | 0.154 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.9 | -38.7 | 178.3 | 73.4 | 0 | 0 | 0 | 0 | 111.3 | L404 L405 M411 Y412 | L404-S408 PolarHBondContact O-N 2.95Å; L405-S408 PolarHBondContact O-OG 3.11Å; S408-M411 WeakPolarHBondContact O-CB 3.48Å; S408-M411 PolarHBondContact O-N 3.4Å; S408-Y412 WeakPolarHBondContact O-CD2 3.28Å; S408-Y412 WeakPolarHBondContact O-CE2 3.2Å |
| 409 | R | 74.4 | Confident | 65.4 | Low | 20 Ų | 20 | 51.8 Ų | 51.8 | 8% | 0.075 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -69.5 | -34.9 | 176.6 | -69.7 | -69.6 | -177.5 | 170.4 | 1 | 113.7 | M374 Q390 W391 L405 L406 L407 M411 Y412 L413 | M374-R409 HydrophobicContact CG-CB 4.4Å; M374-R409 HydrophobicContact CG-CG 4.2Å; Q390-R409 VanDerWaalsContact CD-NH2 3.29Å; W391-R409 HydrophobicContact CE3-CG 4.28Å; W391-R409 HydrophobicContact CZ3-CG 4.1Å; L405-R409 WeakPolarHBondContact O-CB 3.42Å; L405-R409 WeakPolarHBondContact O-CG 3.35Å; L405-R409 PolarHBondContact O-N 3.4Å; L406-R409 PolarHBondContact O-N 2.9Å; L407-R409 VanDerWaalsContact C-N 3.3Å; L407-R409 PolarHBondContact O-N 3.45Å; R409-M411 PolarHBondContact O-N 3.18Å; R409-Y412 PolarHBondContact O-N 2.82Å; R409-Y412 VanDerWaalsContact O-N 3.16Å; R409-L413 PolarHBondContact O-N 3.37Å |
| 410 | A | 68.6 | Low | 63.4 | Low | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.8 | -28.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L252 L322 L406 L407 Y412 L413 | L252-A410 HydrophobicContact CD1-CB 3.61Å; L322-A410 HydrophobicContact CD2-CB 3.85Å; L406-A410 WeakPolarHBondContact O-CB 3.28Å; L406-A410 PolarHBondContact O-N 3.3Å; L407-A410 WeakPolarHBondContact O-CB 3.23Å; L407-A410 PolarHBondContact O-N 3.24Å; A410-Y412 VanDerWaalsContact C-N 3.34Å; A410-Y412 PolarHBondContact O-N 3.46Å; A410-L413 PolarHBondContact O-N 3.22Å |
| 411 | M | 63.1 | Low | 61.5 | Low | 11 Ų | 11 | 55.8 Ų | 55.8 | 5% | 0.054 | 30% | 0.302 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | -22.3 | 178.7 | -64.6 | -68.1 | -88.4 | 0 | 0 | 114.5 | Q253 I256 V280 L407 S408 R409 T414 | Q253-M411 HydrophobicContact CG-SD 4.25Å; I256-M411 HydrophobicContact CB-CE 4.48Å; I256-M411 HydrophobicContact CD1-CE 3.66Å; I256-M411 HydrophobicContact CD1-CG 4.08Å; I256-M411 HydrophobicContact CD1-SD 3.55Å; I256-M411 VanDerWaalsContact CD1-SD 3.55Å; I256-M411 HydrophobicContact CG2-CE 4.4Å; V280-M411 HydrophobicContact CG1-CE 4.14Å; L407-M411 WeakPolarHBondContact O-CG 3.5Å; L407-M411 PolarHBondContact O-N 3.31Å; S408-M411 WeakPolarHBondContact O-CB 3.48Å; S408-M411 PolarHBondContact O-N 3.4Å; R409-M411 PolarHBondContact O-N 3.18Å; M411-T414 PolarHBondContact O-OG1 2.95Å; M411-T414 VanDerWaalsContact O-OG1 3.1Å |
| 412 | Y | 61.2 | Low | 59.8 | Low | 66 Ų | 66 | 59.1 Ų | 59.1 | 26% | 0.259 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.3 | -13.9 | 176.6 | -55.9 | -60.3 | 0 | 0 | 0 | 112.5 | V283 P290 S408 R409 A410 T414 | V283-Y412 HydrophobicContact CB-CD1 4.5Å; V283-Y412 HydrophobicContact CB-CE1 3.94Å; V283-Y412 HydrophobicContact CG1-CD1 3.48Å; V283-Y412 VanDerWaalsContact CG1-CD1 3.48Å; V283-Y412 HydrophobicContact CG1-CE1 3.23Å; V283-Y412 HydrophobicContact CG2-CE1 4.36Å; P290-Y412 HydrophobicContact CB-CE1 4.32Å; P290-Y412 HydrophobicContact CB-CE2 4.45Å; P290-Y412 WeakPolarHBondContact CB-OH 3.34Å; P290-Y412 HydrophobicContact CG-CD2 4.34Å; P290-Y412 HydrophobicContact CG-CE1 4Å; P290-Y412 HydrophobicContact CG-CE2 3.69Å; P290-Y412 VanDerWaalsContact CG-CZ 3.49Å; S408-Y412 WeakPolarHBondContact O-CD2 3.28Å; S408-Y412 WeakPolarHBondContact O-CE2 3.2Å; R409-Y412 PolarHBondContact O-N 2.82Å; R409-Y412 VanDerWaalsContact O-N 3.16Å; A410-Y412 VanDerWaalsContact C-N 3.34Å; A410-Y412 PolarHBondContact O-N 3.46Å; Y412-T414 PolarHBondContact O-N 3.02Å |
| 413 | L | 61.3 | Low | 58.2 | Low | 40 Ų | 40 | 64.3 Ų | 64.3 | 21% | 0.209 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.3 | -8.3 | -177.3 | -144.7 | 72.2 | 0 | 0 | 0 | 112.5 | K245 L322 R375 R409 A410 | K245-L413 HydrophobicContact CB-CD2 4.13Å; K245-L413 HydrophobicContact CD-CD2 4.35Å; L322-L413 HydrophobicContact CD1-CD2 4.25Å; R375-L413 HydrophobicContact CB-CD1 3.79Å; R409-L413 PolarHBondContact O-N 3.37Å; A410-L413 PolarHBondContact O-N 3.22Å |
| 414 | T | 52.6 | Low | 56.9 | Low | 24 Ų | 24 | 67.9 Ų | 67.9 | 15% | 0.147 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.8 | -28 | -165.2 | 41.3 | 0 | 0 | 0 | 0 | 115.8 | A249 Q253 M411 Y412 | A249-T414 HydrophobicContact CB-CG2 3.14Å; Q253-T414 VanDerWaalsContact NE2-CB 3.34Å; Q253-T414 PolarHBondContact NE2-OG1 3.36Å; M411-T414 PolarHBondContact O-OG1 2.95Å; M411-T414 VanDerWaalsContact O-OG1 3.1Å; Y412-T414 PolarHBondContact O-N 3.02Å |
| 415 | D | 50 | Low | 55.3 | Low | 89 Ų | 89 | 73.1 Ų | 73.1 | 48% | 0.476 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -122.7 | 18.3 | -155.5 | -62.2 | -46.7 | 0 | 0 | 0 | 116 | ||
| 416 | L | 46.2 | Very low | 53.5 | Low | 122 Ų | 122 | 78.6 Ų | 78.6 | 64% | 0.639 | 44% | 0.437 | S | S | * | . | trans | -116.4 | 93.7 | 168.9 | -63.6 | 175.9 | 0 | 0 | 0 | 109 | R375 | R375-L416 VanDerWaalsContact NH1-CB 3.29Å; R375-L416 VanDerWaalsContact NH1-CD1 3.33Å | ||
| 417 | Q | 38.4 | Very low | 51.6 | Low | 174 Ų | 174 | 84.2 Ų | 84.2 | 81% | 0.813 | 47% | 0.474 | S | S | * | . | trans | -39.5 | 126.6 | 159.6 | -72 | -67.8 | -35.8 | 0 | 0 | 107.8 | K419 | Q417-K419 PolarHBondContact O-N 3.15Š| ||
| 418 | P | 39 | Very low | 49.7 | Very low | 98 Ų | 98 | 92.3 Ų | 92.3 | 64% | 0.636 | 51% | 0.509 | S | S | * | . | trans | -57.2 | 108.8 | 178.4 | 21.5 | -29.9 | 0 | 0 | 0 | 107 | P420 | P418-P420 WeakPolarHBondContact O-CD 3.43Š| ||
| 419 | K | 39.7 | Very low | 48 | Very low | 177 Ų | 177 | 99.6 Ų | 99.6 | 77% | 0.77 | 55% | 0.545 | S | S | * | . | trans | -57.5 | 118.9 | 170.6 | -168.7 | 153.9 | -174.3 | 162.9 | 0 | 104.9 | Q417 | Q417-K419 PolarHBondContact O-N 3.15Š| ||
| 420 | P | 39 | Very low | 46.1 | Very low | 98 Ų | 98 | 107 Ų | 107 | 64% | 0.636 | 58% | 0.58 | S | S | * | * | trans | -53.9 | 143.6 | -178.9 | 20.3 | -30.9 | 0 | 0 | 0 | 108 | P418 V422 | P418-P420 WeakPolarHBondContact O-CD 3.43Å; P420-V422 PolarHBondContact O-N 3.24Å | ||
| 421 | P | 40.9 | Very low | 44.3 | Very low | 116 Ų | 116 | 116.6 Ų | 116.6 | 75% | 0.753 | 62% | 0.622 | S | S | * | * | trans | -55 | 112.6 | 174.5 | 23.3 | -31.3 | 0 | 0 | 0 | 107.1 | I423 | P421-I423 PolarHBondContact O-N 2.96Š| ||
| 422 | V | 41.6 | Very low | 42.6 | Very low | 115 Ų | 115 | 120.8 Ų | 120.8 | 70% | 0.697 | 66% | 0.658 | S | S | * | * | trans | -68.6 | 91.6 | 167 | 179.2 | 0 | 0 | 0 | 0 | 104 | P420 P424 | P420-V422 PolarHBondContact O-N 3.24Å; V422-P424 WeakPolarHBondContact O-CD 3.47Å | ||
| 423 | I | 47.9 | Very low | 41 | Very low | 129 Ų | 129 | 122.2 Ų | 122.2 | 66% | 0.662 | 68% | 0.683 | S | S | * | * | trans | -62.4 | 111.8 | 162 | -58.8 | 169.6 | 0 | 0 | 0 | 103.2 | P421 | P421-I423 PolarHBondContact O-N 2.96Š| ||
| 424 | P | 49.3 | Very low | 39.4 | Very low | 100 Ų | 100 | 125.7 Ų | 125.7 | 65% | 0.649 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 130.9 | 169.5 | 23.3 | -30.6 | 0 | 0 | 0 | 106.7 | V422 V426 | V422-P424 WeakPolarHBondContact O-CD 3.47Å; P424-V426 PolarHBondContact O-N 3.22Å |
| 425 | P | 44.8 | Very low | 38.2 | Very low | 120 Ų | 120 | 130.1 Ų | 130.1 | 78% | 0.779 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 116.5 | -177.6 | 19.5 | -28.9 | 0 | 0 | 0 | 108.3 | P427 | P425-P427 WeakPolarHBondContact O-CD 3.48Š|
| 426 | V | 39.7 | Very low | 37.1 | Very low | 115 Ų | 115 | 135.1 Ų | 135.1 | 70% | 0.697 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 121.9 | 167.3 | -176.2 | 0 | 0 | 0 | 0 | 105.7 | P424 K428 | P424-V426 PolarHBondContact O-N 3.22Å; V426-K428 PolarHBondContact O-N 2.91Å |
| 427 | P | 39.8 | Very low | 36.2 | Very low | 119 Ų | 119 | 134 Ų | 134 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | trans | -59.9 | 107.9 | 172.3 | -16.6 | 28.5 | 0 | 0 | 0 | 107.3 | P425 L429 | P425-P427 WeakPolarHBondContact O-CD 3.48Å; P427-L429 PolarHBondContact O-N 2.89Å | ||
| 428 | K | 33.4 | Very low | 35.6 | Very low | 184 Ų | 184 | 134.6 Ų | 134.6 | 80% | 0.8 | 78% | 0.775 | S | S | * | * | trans | -67.7 | 116.4 | 166.2 | -76.6 | 178.7 | -179.3 | 173.8 | 0 | 106.1 | V426 E430 | V426-K428 PolarHBondContact O-N 2.91Å; K428-E430 VanDerWaalsContact C-N 3.31Å; K428-E430 PolarHBondContact O-N 2.8Å | ||
| 429 | L | 37.9 | Very low | 35 | Very low | 174 Ų | 174 | 137.5 Ų | 137.5 | 91% | 0.911 | 79% | 0.785 | S | S | * | * | trans | -62.7 | 95.5 | 164.8 | -136.8 | 92.7 | 0 | 0 | 0 | 106.9 | P427 K431 | P427-L429 PolarHBondContact O-N 2.89Å; L429-K431 PolarHBondContact O-N 3.46Å; L429-K431 VanDerWaalsContact O-N 3.15Å | ||
| 430 | E | 33.9 | Very low | 34.6 | Very low | 177 Ų | 177 | 135.1 Ų | 135.1 | 83% | 0.827 | 79% | 0.788 | S | S | * | * | trans | -75.7 | 98.3 | 172.5 | -71.7 | -169.8 | 163.5 | 0 | 0 | 108.8 | K428 A432 | K428-E430 VanDerWaalsContact C-N 3.31Å; K428-E430 PolarHBondContact O-N 2.8Å; E430-A432 VanDerWaalsContact C-N 3.35Å; E430-A432 PolarHBondContact O-N 3.37Å | ||
| 431 | K | 30.3 | Very low | 34 | Very low | 201 Ų | 201 | 134.9 Ų | 134.9 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -76.4 | 93.8 | 157.8 | -172.4 | 171.6 | -176 | 175.3 | 0 | 106.8 | L429 A433 | L429-K431 PolarHBondContact O-N 3.46Å; L429-K431 VanDerWaalsContact O-N 3.15Å; K431-A433 PolarHBondContact O-N 2.89Å | ||
| 432 | A | 28.3 | Very low | 33.3 | Very low | 98 Ų | 98 | 133.8 Ų | 133.8 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | -56.7 | 118.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | E430 | E430-A432 VanDerWaalsContact C-N 3.35Å; E430-A432 PolarHBondContact O-N 3.37Å | ||
| 433 | A | 28.1 | Very low | 32.6 | Very low | 96 Ų | 96 | 134 Ų | 134 | 79% | 0.793 | 80% | 0.796 | S | S | * | * | trans | -104.2 | 124.1 | 161.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | K431 | K431-A433 PolarHBondContact O-N 2.89Š| ||
| 434 | S | 27.3 | Very low | 31.6 | Very low | 114 Ų | 114 | 136.4 Ų | 136.4 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -53 | 131.5 | -178.5 | 48.6 | 0 | 0 | 0 | 0 | 114.9 | ||
| 435 | S | 26.9 | Very low | 30.6 | Very low | 117 Ų | 117 | 136.7 Ų | 136.7 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 124.2 | 153.8 | 54.2 | 0 | 0 | 0 | 0 | 109.5 | ||
| 436 | H | 26.7 | Very low | 29.8 | Very low | 193 Ų | 193 | 140.4 Ų | 140.4 | 89% | 0.894 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 136.8 | 168.6 | -80.6 | -86.4 | 0 | 0 | 0 | 112 | ||
| 437 | A | 26.8 | Very low | 29.2 | Very low | 99 Ų | 99 | 146.4 Ų | 146.4 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -152.3 | 141.3 | 148.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 438 | E | 26 | Very low | 28.6 | Very low | 187 Ų | 187 | 148.8 Ų | 148.8 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | trans | -38.4 | 151.6 | -177.4 | -72.3 | 156.2 | 131.9 | 0 | 0 | 119.4 | ||||
| 439 | N | 26.6 | Very low | 28.3 | Very low | 158 Ų | 158 | 144.5 Ų | 144.5 | 85% | 0.845 | 83% | 0.83 | S | S | * | * | trans | -55.9 | 160.6 | 165.6 | -73.1 | -33.7 | 0 | 0 | 0 | 112.6 | ||||
| 440 | P | 32.2 | Very low | 27.8 | Very low | 128 Ų | 128 | 142.6 Ų | 142.6 | 83% | 0.831 | 82% | 0.821 | S | S | * | * | -135.5 | 151.7 | 104.9 | 32.7 | -18.9 | 0 | 0 | 0 | 115.6 | |||||
| 441 | A | 25.6 | Very low | 28.2 | Very low | 92 Ų | 92 | 140.1 Ų | 140.1 | 76% | 0.76 | 82% | 0.82 | S | S | * | * | trans | -1.5 | 127.6 | 161.4 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 442 | A | 26.3 | Very low | 28 | Very low | 93 Ų | 93 | 133.2 Ų | 133.2 | 77% | 0.769 | 80% | 0.801 | S | S | * | * | 47.2 | 127.9 | 125 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 443 | T | 26.6 | Very low | 28.1 | Very low | 120 Ų | 120 | 135.8 Ų | 135.8 | 74% | 0.736 | 81% | 0.806 | S | S | * | * | -175.8 | 122.6 | 116.2 | -56.6 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 444 | E | 27.8 | Very low | 28.1 | Very low | 179 Ų | 179 | 137.7 Ų | 137.7 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | trans | 31.1 | 151.1 | 144.1 | -52.4 | 172.1 | 176.5 | 0 | 0 | 121 | ||||
| 445 | S | 27.9 | Very low | 28.4 | Very low | 106 Ų | 106 | 139.1 Ų | 139.1 | 74% | 0.741 | 80% | 0.799 | S | S | * | * | cis | -173.8 | 140.3 | -4.1 | -121.2 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 446 | E | 27.4 | Very low | 28.5 | Very low | 198 Ų | 198 | 142.4 Ų | 142.4 | 93% | 0.925 | 80% | 0.798 | S | S | * | * | 163.6 | 136.1 | 125.1 | -91.5 | -168.7 | 133.6 | 0 | 0 | 112.8 | |||||
| 447 | R | 27.1 | Very low | 28.7 | Very low | 241 Ų | 241 | 140.4 Ų | 140.4 | 91% | 0.909 | 79% | 0.794 | S | S | * | * | trans | -83.5 | 146.4 | -174.2 | -66.8 | 167.5 | 162.8 | 173.7 | -5.3 | 111.1 | ||||
| 448 | L | 26.9 | Very low | 28.8 | Very low | 169 Ų | 169 | 146.1 Ų | 146.1 | 89% | 0.885 | 79% | 0.794 | S | S | * | * | -167.2 | 118.2 | 121.9 | -147.6 | 60.5 | 0 | 0 | 0 | 114.1 | |||||
| 449 | A | 27.2 | Very low | 29.1 | Very low | 95 Ų | 95 | 142.6 Ų | 142.6 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | 41.6 | 121.1 | 144.8 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 450 | D | 27.3 | Very low | 29.4 | Very low | 134 Ų | 134 | 140.2 Ų | 140.2 | 72% | 0.717 | 78% | 0.779 | S | S | * | * | trans | -69 | 166 | 153.2 | -153 | 8 | 0 | 0 | 0 | 110.9 | A452 | D450-A452 PolarHBondContact OD1-N 2.84Š| ||
| 451 | P | 42.7 | Very low | 29.2 | Very low | 124 Ų | 124 | 142.8 Ų | 142.8 | 81% | 0.805 | 78% | 0.78 | S | S | * | * | -144.1 | 132.8 | 71.6 | 33.6 | -12.6 | 0 | 0 | 0 | 116.9 | |||||
| 452 | A | 26.9 | Very low | 29.6 | Very low | 56 Ų | 56 | 146.3 Ų | 146.3 | 46% | 0.463 | 78% | 0.78 | S | S | . | * | trans | -1.1 | 142.9 | 136.1 | 0 | 0 | 0 | 0 | 0 | 120.7 | D450 I454 | D450-A452 PolarHBondContact OD1-N 2.84Å; A452-I454 HydrophobicContact CB-CG1 4.48Å | ||
| 453 | V | 29.1 | Very low | 29.7 | Very low | 152 Ų | 152 | 149 Ų | 149 | 92% | 0.921 | 78% | 0.781 | S | S | * | * | trans | -128.9 | 124.4 | 133.2 | 177.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 454 | I | 29.1 | Very low | 29.9 | Very low | 137 Ų | 137 | 153.4 Ų | 153.4 | 70% | 0.703 | 78% | 0.784 | S | S | * | * | trans | -98.4 | 163.5 | 178.8 | -66.4 | 163.6 | 0 | 0 | 0 | 109 | A452 | A452-I454 HydrophobicContact CB-CG1 4.48Š| ||
| 455 | I | 33 | Very low | 30 | Very low | 144 Ų | 144 | 151.8 Ų | 151.8 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | trans | 127.2 | 126.4 | 151.5 | -66.8 | 165.1 | 0 | 0 | 0 | 109.5 | ||||
| 456 | K | 29.9 | Very low | 30.1 | Very low | 185 Ų | 185 | 155.7 Ų | 155.7 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | cis | -165.3 | 168.7 | 2.4 | -115.4 | 175.3 | -167 | 174.4 | 0 | 109 | ||||
| 457 | D | 30.6 | Very low | 30.4 | Very low | 151 Ų | 151 | 150.3 Ų | 150.3 | 81% | 0.807 | 77% | 0.774 | S | S | * | * | trans | -59 | 151 | -177.3 | -56.5 | -73.3 | 0 | 0 | 0 | 118.7 | ||||
| 458 | R | 27.8 | Very low | 30.6 | Very low | 219 Ų | 219 | 145 Ų | 145 | 83% | 0.826 | 77% | 0.771 | S | S | * | * | trans | 2.8 | 158 | 148.1 | -102.6 | -167.1 | 161.9 | 158 | -6.2 | 120.6 | ||||
| 459 | P | 33.8 | Very low | 30.9 | Very low | 113 Ų | 113 | 143.3 Ų | 143.3 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | cis | -143.6 | 158.8 | 39.3 | 35.5 | -12.9 | 0 | 0 | 0 | 119.2 | ||||
| 460 | V | 31.6 | Very low | 31.1 | Very low | 109 Ų | 109 | 145.1 Ų | 145.1 | 66% | 0.661 | 77% | 0.769 | S | S | * | * | trans | 22.8 | 111.2 | 141.5 | -172.7 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 461 | E | 29.7 | Very low | 31.5 | Very low | 182 Ų | 182 | 145.8 Ų | 145.8 | 85% | 0.85 | 77% | 0.771 | S | S | * | * | trans | -134.6 | 120.2 | 146.4 | -127.8 | -169.7 | 178.6 | 0 | 0 | 109.7 | ||||
| 462 | E | 33.3 | Very low | 31.2 | Very low | 165 Ų | 165 | 147.3 Ų | 147.3 | 77% | 0.771 | 77% | 0.773 | S | S | * | * | trans | -67.2 | 122 | 166.3 | -90.5 | -175 | 122.5 | 0 | 0 | 109.1 | ||||
| 463 | L | 29 | Very low | 32.3 | Very low | 151 Ų | 151 | 153.3 Ų | 153.3 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | trans | -118.3 | 99.5 | 160.6 | -142.2 | 85.5 | 0 | 0 | 0 | 109.4 | ||||
| 464 | R | 30.8 | Very low | 32.9 | Very low | 211 Ų | 211 | 151.8 Ų | 151.8 | 80% | 0.796 | 78% | 0.782 | S | S | * | * | trans | -81.1 | 122.5 | 161.5 | -81.9 | -173.3 | 179.3 | -170.6 | 0.8 | 109.1 | ||||
| 465 | D | 28.6 | Very low | 33.7 | Very low | 146 Ų | 146 | 151.4 Ų | 151.4 | 78% | 0.781 | 78% | 0.781 | S | S | * | * | trans | -109.5 | 105.3 | 152.9 | -94.6 | -29.9 | 0 | 0 | 0 | 107.6 | ||||
| 466 | K | 31.3 | Very low | 35.2 | Very low | 187 Ų | 187 | 148.3 Ų | 148.3 | 81% | 0.813 | 77% | 0.768 | S | S | * | * | 70 | 83.7 | 72.8 | -67 | -91.4 | -177.4 | 171.9 | 0 | 113 | |||||
| 467 | A | 32 | Very low | 36.5 | Very low | 85 Ų | 85 | 144.6 Ų | 144.6 | 70% | 0.702 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 150.3 | 153 | 0 | 0 | 0 | 0 | 0 | 110.2 | V469 | A467-V469 PolarHBondContact O-N 3.43Š|
| 468 | P | 33.1 | Very low | 37.8 | Very low | 130 Ų | 130 | 140.5 Ų | 140.5 | 84% | 0.844 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 118.9 | -177 | 28.9 | -30.7 | 0 | 0 | 0 | 111.4 | ||
| 469 | V | 32.4 | Very low | 39.3 | Very low | 133 Ų | 133 | 134.9 Ų | 134.9 | 81% | 0.806 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -90.2 | 120.2 | 164.6 | 172.5 | 0 | 0 | 0 | 0 | 107.3 | A467 L471 | A467-V469 PolarHBondContact O-N 3.43Å; V469-L471 PolarHBondContact O-N 3.15Å |
| 470 | V | 31.8 | Very low | 40.6 | Very low | 134 Ų | 134 | 133.6 Ų | 133.6 | 81% | 0.812 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 117.3 | 167.1 | 175.1 | 0 | 0 | 0 | 0 | 107.3 | ||
| 471 | L | 34.5 | Very low | 41.9 | Very low | 147 Ų | 147 | 134.5 Ų | 134.5 | 77% | 0.77 | 72% | 0.723 | S | S | * | * | trans | -85.1 | 112.5 | -177.4 | -178.6 | 72.3 | 0 | 0 | 0 | 109.9 | V469 | V469-L471 PolarHBondContact O-N 3.15Š| ||
| 472 | D | 36.1 | Very low | 43.4 | Very low | 156 Ų | 156 | 133.1 Ų | 133.1 | 83% | 0.834 | 72% | 0.717 | S | S | * | * | trans | -64.5 | 126.4 | 161.8 | -74.6 | -46 | 0 | 0 | 0 | 109.7 | ||||
| 473 | K | 50.3 | Low | 44.5 | Very low | 183 Ų | 183 | 128.1 Ų | 128.1 | 80% | 0.796 | 70% | 0.704 | S | S | * | * | trans | -110.7 | 126.4 | 171.4 | -158.6 | 158.7 | -175 | 177.5 | 0 | 108 | ||||
| 474 | P | 41.9 | Very low | 45.8 | Very low | 119 Ų | 119 | 127.9 Ų | 127.9 | 77% | 0.773 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 133.1 | 179.8 | 27.5 | -30.5 | 0 | 0 | 0 | 110.3 | ||
| 475 | L | 47.1 | Very low | 46.9 | Very low | 130 Ų | 130 | 120.7 Ų | 120.7 | 68% | 0.681 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 143.6 | 175.6 | -96.6 | 72.1 | 0 | 0 | 0 | 111.3 | ||
| 476 | T | 63.8 | Low | 48.1 | Very low | 78 Ų | 78 | 116.9 Ų | 116.9 | 48% | 0.479 | 67% | 0.671 | S | S | . | * | P | Polyproline II helix | trans | -81.3 | 147.1 | 176.2 | 53 | 0 | 0 | 0 | 0 | 111.2 | A478 E479 | T476-A478 PolarHBondContact O-N 3.22Å; T476-E479 PolarHBondContact N-OE2 2.89Å; T476-E479 PolarHBondContact O-N 3.28Å; T476-E479 PolarHBondContact OG1-OE2 3.27Å |
| 477 | P | 56.2 | Low | 49.1 | Very low | 107 Ų | 107 | 111.9 Ų | 111.9 | 70% | 0.695 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -61.6 | -15.5 | -176.3 | 19.2 | -29.6 | 0 | 0 | 0 | 114.7 | ||
| 478 | A | 57.9 | Low | 50 | Low | 65 Ų | 65 | 112.9 Ų | 112.9 | 54% | 0.537 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -73.2 | -30.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | T476 Q482 | T476-A478 PolarHBondContact O-N 3.22Å; A478-Q482 PolarHBondContact O-N 3.4Å |
| 479 | E | 61.1 | Low | 51 | Low | 102 Ų | 102 | 112 Ų | 112 | 48% | 0.477 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -77.9 | -29.5 | 179.8 | -67.2 | 169.3 | 139.3 | 0 | 0 | 111.6 | T476 A483 | T476-E479 PolarHBondContact N-OE2 2.89Å; T476-E479 PolarHBondContact O-N 3.28Å; T476-E479 PolarHBondContact OG1-OE2 3.27Å; E479-A483 WeakPolarHBondContact O-CB 3.42Å; E479-A483 PolarHBondContact O-N 2.99Å; E479-A483 VanDerWaalsContact O-N 3.1Å |
| 480 | V | 60.3 | Low | 51.5 | Low | 85 Ų | 85 | 109.3 Ų | 109.3 | 52% | 0.515 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -71 | -32.1 | 176 | -179.4 | 0 | 0 | 0 | 0 | 111.8 | K484 | V480-K484 PolarHBondContact O-N 2.87Å |
| 481 | L | 59.2 | Low | 52.3 | Low | 128 Ų | 128 | 109.8 Ų | 109.8 | 67% | 0.67 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -74.4 | -34 | 176.9 | -72.3 | 170.8 | 0 | 0 | 0 | 112.6 | A485 | L481-A485 PolarHBondContact O-N 2.78Å |
| 482 | Q | 61.1 | Low | 52.9 | Low | 153 Ų | 153 | 111.6 Ų | 111.6 | 72% | 0.715 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -73 | -35.9 | 174.2 | -72.5 | -173.9 | -3.5 | 0 | 0 | 112.4 | A478 K484 A485 A486 | A478-Q482 PolarHBondContact O-N 3.4Å; Q482-K484 VanDerWaalsContact C-N 3.35Å; Q482-K484 PolarHBondContact O-N 2.97Å; Q482-A485 PolarHBondContact O-N 3.38Å; Q482-A486 PolarHBondContact O-N 3.08Å; Q482-A486 VanDerWaalsContact O-N 3.13Å |
| 483 | A | 55.8 | Low | 53.5 | Low | 60 Ų | 60 | 109.1 Ų | 109.1 | 50% | 0.496 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.9 | -35.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | E479 T487 | E479-A483 WeakPolarHBondContact O-CB 3.42Å; E479-A483 PolarHBondContact O-N 2.99Å; E479-A483 VanDerWaalsContact O-N 3.1Å; A483-T487 PolarHBondContact O-N 2.82Å; A483-T487 PolarHBondContact O-OG1 3.25Å |
| 484 | K | 56.5 | Low | 53.4 | Low | 147 Ų | 147 | 109.2 Ų | 109.2 | 64% | 0.639 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -70.5 | -39.6 | 175 | -115.5 | -169.4 | 174.4 | -170.4 | 0 | 113 | V480 Q482 A486 T487 D488 | V480-K484 PolarHBondContact O-N 2.87Å; Q482-K484 VanDerWaalsContact C-N 3.35Å; Q482-K484 PolarHBondContact O-N 2.97Å; K484-A486 VanDerWaalsContact C-N 3.33Å; K484-A486 PolarHBondContact O-N 3.33Å; K484-T487 PolarHBondContact O-N 2.88Å; K484-T487 PolarHBondContact O-OG1 2.94Å; K484-D488 PolarHBondContact O-N 2.87Å |
| 485 | A | 54.7 | Low | 53.9 | Low | 59 Ų | 59 | 111.6 Ų | 111.6 | 49% | 0.488 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -66.1 | -33.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L481 Q482 V489 | L481-A485 PolarHBondContact O-N 2.78Å; Q482-A485 PolarHBondContact O-N 3.38Å; A485-V489 WeakPolarHBondContact O-CG2 3.22Å; A485-V489 PolarHBondContact O-N 3.32Å |
| 486 | A | 52.8 | Low | 54.1 | Low | 67 Ų | 67 | 111.1 Ų | 111.1 | 55% | 0.554 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -70.1 | -31.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q482 K484 S490 | Q482-A486 PolarHBondContact O-N 3.08Å; Q482-A486 VanDerWaalsContact O-N 3.13Å; K484-A486 VanDerWaalsContact C-N 3.33Å; K484-A486 PolarHBondContact O-N 3.33Å; A486-S490 PolarHBondContact O-N 2.91Å |
| 487 | T | 53.2 | Low | 53.5 | Low | 81 Ų | 81 | 111.6 Ų | 111.6 | 50% | 0.497 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -77.4 | -33.1 | 178 | 47.6 | 0 | 0 | 0 | 0 | 113.6 | A483 K484 S490 Q491 | A483-T487 PolarHBondContact O-N 2.82Å; A483-T487 PolarHBondContact O-OG1 3.25Å; K484-T487 PolarHBondContact O-N 2.88Å; K484-T487 PolarHBondContact O-OG1 2.94Å; T487-S490 PolarHBondContact O-N 3.31Å; T487-Q491 PolarHBondContact O-N 3.34Å |
| 488 | D | 51.3 | Low | 53 | Low | 106 Ų | 106 | 114.9 Ų | 114.9 | 57% | 0.567 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -71.6 | -31.9 | 177.7 | -89.1 | -42.5 | 0 | 0 | 0 | 112.8 | K484 K492 | K484-D488 PolarHBondContact O-N 2.87Å; D488-K492 PolarHBondContact O-N 2.98Å |
| 489 | V | 52.9 | Low | 52.1 | Low | 111 Ų | 111 | 115.5 Ų | 115.5 | 67% | 0.673 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -71.6 | -32.8 | 174.4 | 177 | 0 | 0 | 0 | 0 | 111.4 | A485 | A485-V489 WeakPolarHBondContact O-CG2 3.22Å; A485-V489 PolarHBondContact O-N 3.32Å |
| 490 | S | 43.2 | Very low | 50.9 | Low | 78 Ų | 78 | 121.2 Ų | 121.2 | 55% | 0.545 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -78.8 | -22.4 | 178.8 | -170.4 | 0 | 0 | 0 | 0 | 114 | A486 T487 | A486-S490 PolarHBondContact O-N 2.91Å; T487-S490 PolarHBondContact O-N 3.31Å |
| 491 | Q | 48.1 | Very low | 50.4 | Low | 143 Ų | 143 | 123 Ų | 123 | 67% | 0.668 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -81 | -26.4 | 175.1 | -81.9 | -169.8 | -26.9 | 0 | 0 | 113.1 | T487 | T487-Q491 PolarHBondContact O-N 3.34Å |
| 492 | K | 47.9 | Very low | 50 | Low | 186 Ų | 186 | 122.7 Ų | 122.7 | 81% | 0.809 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -78.7 | -16.7 | 179.3 | -147.3 | 169.5 | -174.5 | 177.4 | 0 | 114.2 | D488 | D488-K492 PolarHBondContact O-N 2.98Å |
| 493 | S | 48.9 | Very low | 49.4 | Very low | 104 Ų | 104 | 121.1 Ų | 121.1 | 73% | 0.727 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | 0.4 | -179.6 | -165.9 | 0 | 0 | 0 | 0 | 115.1 | ||
| 494 | K | 48 | Very low | 49 | Very low | 185 Ų | 185 | 124.6 Ų | 124.6 | 80% | 0.804 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -113.2 | 4.9 | 177.5 | -73.5 | -173.6 | 178.2 | 177.1 | 0 | 114.8 | ||
| 495 | M | 51.3 | Low | 48.5 | Very low | 169 Ų | 169 | 123.3 Ų | 123.3 | 83% | 0.833 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -109.7 | 56.3 | 173 | -75.9 | 165.6 | 62.5 | 0 | 0 | 110.7 | ||
| 496 | S | 52.1 | Low | 48.1 | Very low | 120 Ų | 120 | 127.5 Ų | 127.5 | 84% | 0.839 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -164.8 | 64.4 | 163.7 | -161 | 0 | 0 | 0 | 0 | 110.4 | ||
| 497 | A | 51.3 | Low | 47.8 | Very low | 87 Ų | 87 | 131.9 Ų | 131.9 | 72% | 0.719 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -170.4 | 70.2 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||
| 498 | N | 45.8 | Very low | 47.4 | Very low | 177 Ų | 177 | 135.8 Ų | 135.8 | 95% | 0.947 | 79% | 0.79 | S | S | * | * | trans | 167.6 | 107 | 149.3 | -87.8 | -16.7 | 0 | 0 | 0 | 108.8 | ||||
| 499 | G | 39.4 | Very low | 47 | Very low | 77 Ų | 77 | 138.3 Ų | 138.3 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -166.7 | 80.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 500 | V | 35.4 | Very low | 46.5 | Very low | 222 Ų | 222 | 140.7 Ų | 140.7 | 100% | 1.345 | 82% | 0.821 | S | S | * | * | -111.9 | 0 | 128.7 | 173.7 | 0 | 0 | 0 | 0 | 105.5 |
Retrieved 500 of 500 residues in 189.5 ms
(Link to these results)