| 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 | P | 36.1 | Very low | 35.1 | Very low | 171 Ų | 171 | 149.3 Ų | 149.3 | 100% | 1.11 | 83% | 0.829 | S | S | * | * | 0 | 93.2 | 0 | 26.2 | -3.8 | 0 | 0 | 0 | 110.7 | |||||
| 2 | S | 34.2 | Very low | 35 | Very low | 98 Ų | 98 | 150.3 Ų | 150.3 | 69% | 0.685 | 83% | 0.831 | S | S | * | * | 96.2 | 113 | 61.3 | 61.4 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 3 | L | 36.2 | Very low | 34.9 | Very low | 159 Ų | 159 | 150.8 Ų | 150.8 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | trans | 71.6 | 149.8 | 156 | -50.9 | 165.5 | 0 | 0 | 0 | 115.7 | ||||
| 4 | T | 37.2 | Very low | 34.8 | Very low | 108 Ų | 108 | 149.9 Ų | 149.9 | 66% | 0.663 | 82% | 0.817 | S | S | * | * | cis | -159.9 | 136.7 | -7.7 | 9.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 5 | Q | 37.7 | Very low | 34.6 | Very low | 187 Ų | 187 | 147.9 Ų | 147.9 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | 53.3 | 130.4 | 125.6 | -150.9 | 163.6 | 27.7 | 0 | 0 | 122.4 | |||||
| 6 | S | 37.7 | Very low | 34.3 | Very low | 125 Ų | 125 | 150.5 Ų | 150.5 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | trans | -91.5 | 155.7 | 174 | -76.3 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 7 | G | 33.1 | Very low | 34.5 | Very low | 76 Ų | 76 | 147.8 Ų | 147.8 | 78% | 0.784 | 80% | 0.802 | S | S | * | * | trans | -166.7 | 100.4 | 162.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 8 | K | 34.1 | Very low | 34.4 | Very low | 209 Ų | 209 | 144.4 Ų | 144.4 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | trans | -92.1 | 119.1 | 173 | -75.1 | -176.5 | 177.6 | -179.8 | 0 | 109.7 | ||||
| 9 | I | 31.2 | Very low | 34.3 | Very low | 147 Ų | 147 | 147.6 Ų | 147.6 | 75% | 0.754 | 80% | 0.803 | S | S | * | * | trans | -110.7 | 128.6 | 161.4 | -63.7 | 179 | 0 | 0 | 0 | 106.8 | ||||
| 10 | F | 34.5 | Very low | 34.5 | Very low | 191 Ų | 191 | 150.4 Ų | 150.4 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | trans | -125.6 | 111.4 | 164.9 | -111.3 | -90.6 | 0 | 0 | 0 | 107.4 | ||||
| 11 | Q | 34.3 | Very low | 34.6 | Very low | 171 Ų | 171 | 147.2 Ų | 147.2 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -87.3 | 142 | 160.3 | -69.5 | 179.2 | 1.4 | 0 | 0 | 107.7 | ||||
| 12 | L | 34 | Very low | 34.7 | Very low | 162 Ų | 162 | 151.1 Ų | 151.1 | 85% | 0.848 | 80% | 0.797 | S | S | * | * | trans | -133.9 | 123.1 | 163.7 | -106 | 165.9 | 0 | 0 | 0 | 108.2 | ||||
| 13 | Q | 34 | Very low | 34.6 | Very low | 157 Ų | 157 | 150.4 Ų | 150.4 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | trans | -83.6 | 142.8 | 172.3 | -163.3 | 84.6 | 8.2 | 0 | 0 | 108.1 | ||||
| 14 | D | 33.7 | Very low | 34.5 | Very low | 138 Ų | 138 | 146.6 Ų | 146.6 | 74% | 0.738 | 80% | 0.804 | S | S | * | * | 156 | 117.6 | 120.9 | -84.3 | -39.3 | 0 | 0 | 0 | 115.3 | |||||
| 15 | N | 30.8 | Very low | 34.6 | Very low | 119 Ų | 119 | 149.8 Ų | 149.8 | 64% | 0.636 | 82% | 0.816 | S | S | * | * | 65.7 | 107.8 | 120 | -152.4 | -2 | 0 | 0 | 0 | 120.3 | |||||
| 16 | F | 30.6 | Very low | 34.6 | Very low | 190 Ų | 190 | 148 Ų | 148 | 83% | 0.833 | 81% | 0.813 | S | S | * | * | -173.6 | 161.5 | 106 | -120.5 | -94.9 | 0 | 0 | 0 | 114.5 | |||||
| 17 | S | 36.6 | Very low | 34.7 | Very low | 104 Ų | 104 | 150 Ų | 150 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -92.2 | 173.4 | -171.8 | -56.5 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 18 | A | 33.3 | Very low | 35 | Very low | 88 Ų | 88 | 154.8 Ų | 154.8 | 73% | 0.727 | 82% | 0.819 | S | S | * | * | trans | 97.7 | 115.2 | 157.5 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 19 | F | 31.8 | Very low | 34.9 | Very low | 204 Ų | 204 | 148 Ų | 148 | 90% | 0.895 | 81% | 0.808 | S | S | * | * | 178.6 | 89 | 126.1 | -103.9 | -72.4 | 0 | 0 | 0 | 110.3 | |||||
| 20 | H | 40.2 | Very low | 35.2 | Very low | 203 Ų | 203 | 148.9 Ų | 148.9 | 94% | 0.94 | 81% | 0.813 | S | S | * | * | trans | -128.9 | 89 | 168.3 | -101.4 | -82.3 | 0 | 0 | 0 | 109.9 | ||||
| 21 | A | 35.9 | Very low | 35.3 | Very low | 84 Ų | 84 | 147.8 Ų | 147.8 | 69% | 0.694 | 81% | 0.811 | S | S | * | * | trans | -166.8 | 114.8 | 163.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 22 | R | 38.6 | Very low | 35.3 | Very low | 254 Ų | 254 | 146.9 Ų | 146.9 | 96% | 0.958 | 81% | 0.811 | S | S | * | * | 155.9 | 125.9 | 128.8 | -79.3 | -100.6 | 160.8 | 170.1 | -7.5 | 111.9 | |||||
| 23 | G | 32.3 | Very low | 35.4 | Very low | 83 Ų | 83 | 148.1 Ų | 148.1 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | trans | 97.1 | 103.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 24 | G | 33.6 | Very low | 35.4 | Very low | 78 Ų | 78 | 150.9 Ų | 150.9 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | cis | 112.1 | 82.3 | -3.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 25 | L | 38 | Very low | 35.6 | Very low | 176 Ų | 176 | 149.9 Ų | 149.9 | 92% | 0.921 | 81% | 0.814 | S | S | * | * | trans | -144.8 | 146.6 | 160.6 | -97.9 | 174.5 | 0 | 0 | 0 | 110.1 | ||||
| 26 | N | 39.6 | Very low | 35.5 | Very low | 150 Ų | 150 | 151.2 Ų | 151.2 | 80% | 0.802 | 82% | 0.822 | S | S | * | * | trans | -77.3 | 145 | -165.6 | -87.3 | -65.2 | 0 | 0 | 0 | 114.6 | ||||
| 27 | I | 38.6 | Very low | 35.8 | Very low | 167 Ų | 167 | 147.3 Ų | 147.3 | 86% | 0.856 | 81% | 0.813 | S | S | * | * | trans | -140.1 | 94.6 | 156.4 | -6.1 | 172.7 | 0 | 0 | 0 | 108.6 | ||||
| 28 | L | 40.6 | Very low | 35.7 | Very low | 176 Ų | 176 | 148.6 Ų | 148.6 | 92% | 0.921 | 82% | 0.823 | S | S | * | * | trans | -162.7 | 126.2 | 172.8 | -106.3 | 142.5 | 0 | 0 | 0 | 109.2 | ||||
| 29 | G | 30.3 | Very low | 35.4 | Very low | 67 Ų | 67 | 147.9 Ų | 147.9 | 69% | 0.691 | 82% | 0.823 | S | S | * | * | trans | 126.2 | 90.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 30 | L | 37.4 | Very low | 35.4 | Very low | 164 Ų | 164 | 142.5 Ų | 142.5 | 86% | 0.859 | 82% | 0.817 | S | S | * | * | 156.1 | 90.6 | 120.9 | -83.6 | 161.3 | 0 | 0 | 0 | 111.9 | |||||
| 31 | Q | 37 | Very low | 34.9 | Very low | 169 Ų | 169 | 139.7 Ų | 139.7 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | -112.4 | 141.2 | 147.3 | -109.7 | 81.2 | 98.4 | 0 | 0 | 107.7 | ||||
| 32 | D | 34.3 | Very low | 34.7 | Very low | 151 Ų | 151 | 140.7 Ų | 140.7 | 81% | 0.807 | 81% | 0.811 | S | S | * | * | trans | 54.1 | 116.1 | 157.7 | -53 | -42.5 | 0 | 0 | 0 | 121.2 | ||||
| 33 | M | 35.9 | Very low | 34.4 | Very low | 189 Ų | 189 | 134.4 Ų | 134.4 | 93% | 0.931 | 81% | 0.806 | S | S | * | * | trans | -145.7 | 127.4 | 147.2 | -95.5 | -93.3 | -73.8 | 0 | 0 | 107.9 | ||||
| 34 | Y | 35.2 | Very low | 34.4 | Very low | 214 Ų | 214 | 134.1 Ų | 134.1 | 84% | 0.839 | 80% | 0.795 | S | S | * | * | trans | -133.1 | 139.1 | -174.3 | -172.9 | -114.8 | 0 | 0 | 0 | 110.1 | ||||
| 35 | L | 38.1 | Very low | 34.4 | Very low | 117 Ų | 117 | 136.3 Ų | 136.3 | 61% | 0.613 | 79% | 0.793 | S | S | * | * | trans | 62.9 | 141.4 | -178 | -102.4 | 73.3 | 0 | 0 | 0 | 116.3 | ||||
| 36 | D | 28.5 | Very low | 34.1 | Very low | 147 Ų | 147 | 135.8 Ų | 135.8 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | -143.8 | -179 | 62.2 | -151.8 | -10.8 | 0 | 0 | 0 | 115.3 | |||||
| 37 | T | 36.2 | Very low | 33.7 | Very low | 108 Ų | 108 | 133.8 Ų | 133.8 | 66% | 0.663 | 79% | 0.788 | S | S | * | * | trans | -122.3 | 132.2 | -162 | 12.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 38 | S | 33.5 | Very low | 34.9 | Very low | 132 Ų | 132 | 130.4 Ų | 130.4 | 92% | 0.923 | 78% | 0.777 | S | S | * | * | trans | 161 | 146.7 | 151.7 | 44.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 39 | G | 28.5 | Very low | 34.8 | Very low | 72 Ų | 72 | 128.3 Ų | 128.3 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | cis | 173.7 | 161.9 | -9.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 40 | A | 30.8 | Very low | 35.2 | Very low | 91 Ų | 91 | 131.6 Ų | 131.6 | 75% | 0.752 | 77% | 0.774 | S | S | * | * | trans | 81.8 | 132.7 | 159.8 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 41 | N | 30.4 | Very low | 35.3 | Very low | 145 Ų | 145 | 129.8 Ų | 129.8 | 78% | 0.775 | 77% | 0.77 | S | S | * | * | trans | 85.9 | 82.4 | 143.9 | -58.9 | -13.6 | 0 | 0 | 0 | 121.8 | ||||
| 42 | S | 32 | Very low | 36.1 | Very low | 105 Ų | 105 | 127 Ų | 127 | 73% | 0.734 | 77% | 0.766 | S | S | * | * | 35.3 | 144.3 | 107.4 | -46.4 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 43 | S | 32 | Very low | 36.2 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | trans | 77.8 | 148.5 | 156.8 | -57.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 44 | A | 31.2 | Very low | 36.5 | Very low | 76 Ų | 76 | 122.3 Ų | 122.3 | 63% | 0.628 | 75% | 0.754 | S | S | * | * | cis | -169.8 | 159.3 | -18.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 45 | T | 34.4 | Very low | 37.4 | Very low | 125 Ų | 125 | 117.6 Ų | 117.6 | 77% | 0.767 | 75% | 0.749 | S | S | * | * | trans | 45.6 | 136.6 | 155.2 | 58.4 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 46 | L | 31.2 | Very low | 37.2 | Very low | 164 Ų | 164 | 119.3 Ų | 119.3 | 86% | 0.859 | 76% | 0.759 | S | S | * | * | -172 | 142.1 | 76.3 | -83.9 | 162.1 | 0 | 0 | 0 | 110.8 | |||||
| 47 | S | 32.3 | Very low | 38.2 | Very low | 108 Ų | 108 | 117.3 Ų | 117.3 | 76% | 0.755 | 76% | 0.755 | S | S | * | * | trans | -104 | 179.8 | 159.6 | -51 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 48 | P | 62.3 | Low | 38.1 | Very low | 97 Ų | 97 | 117.5 Ų | 117.5 | 63% | 0.63 | 76% | 0.76 | S | S | * | * | cis | -123.7 | -149.9 | -44.1 | 32.9 | -12.9 | 0 | 0 | 0 | 109.2 | I50 | P48-I50 HydrophobicContact CG-CD1 4.25Å; P48-I50 HydrophobicContact CG-CG1 3.8Å | ||
| 49 | P | 39.8 | Very low | 38.2 | Very low | 131 Ų | 131 | 117.9 Ų | 117.9 | 85% | 0.851 | 76% | 0.757 | S | S | * | * | -127.1 | 164.3 | 124 | 36.4 | -30.9 | 0 | 0 | 0 | 113.9 | |||||
| 50 | I | 37.8 | Very low | 38.6 | Very low | 137 Ų | 137 | 120 Ų | 120 | 70% | 0.703 | 76% | 0.761 | S | S | * | * | trans | -128.8 | 165.8 | -166.8 | -42 | 172.6 | 0 | 0 | 0 | 109.1 | P48 | P48-I50 HydrophobicContact CG-CD1 4.25Å; P48-I50 HydrophobicContact CG-CG1 3.8Å | ||
| 51 | T | 40.9 | Very low | 39.2 | Very low | 125 Ų | 125 | 120.6 Ų | 120.6 | 77% | 0.767 | 77% | 0.765 | S | S | * | * | trans | 109.4 | 154.5 | 150.2 | 74.9 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 52 | P | 53.7 | Low | 39.5 | Very low | 110 Ų | 110 | 122.7 Ų | 122.7 | 71% | 0.714 | 77% | 0.77 | S | S | * | * | -143.8 | -161.4 | -63.9 | 39.2 | -19.3 | 0 | 0 | 0 | 115.3 | |||||
| 53 | V | 36 | Very low | 39.8 | Very low | 118 Ų | 118 | 123.1 Ų | 123.1 | 72% | 0.715 | 77% | 0.773 | S | S | * | * | trans | 89.2 | 92 | 161.2 | -161.8 | 0 | 0 | 0 | 0 | 117 | ||||
| 54 | T | 41.6 | Very low | 40.2 | Very low | 125 Ų | 125 | 123.5 Ų | 123.5 | 77% | 0.767 | 77% | 0.771 | S | S | * | * | 65.6 | 155.1 | 80.7 | 53 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 55 | P | 53.3 | Low | 40.6 | Very low | 114 Ų | 114 | 127.2 Ų | 127.2 | 74% | 0.74 | 78% | 0.775 | S | S | * | * | cis | -134.2 | 162.9 | -10.8 | 29.4 | -7.3 | 0 | 0 | 0 | 118 | ||||
| 56 | D | 34.2 | Very low | 40.9 | Very low | 153 Ų | 153 | 129.6 Ų | 129.6 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | 13.4 | 171 | 139.6 | -92.9 | -45.3 | 0 | 0 | 0 | 124.8 | ||||
| 57 | P | 50.6 | Low | 41.9 | Very low | 106 Ų | 106 | 127 Ų | 127 | 69% | 0.688 | 77% | 0.768 | S | S | * | * | cis | -136.4 | 168.3 | -5.2 | 33.4 | -13.5 | 0 | 0 | 0 | 117.2 | ||||
| 58 | S | 32.7 | Very low | 42.4 | Very low | 112 Ų | 112 | 130.3 Ų | 130.3 | 78% | 0.783 | 77% | 0.769 | S | S | * | * | trans | -179.6 | 100.2 | 133.6 | -81.9 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 59 | T | 36 | Very low | 42 | Very low | 139 Ų | 139 | 133.6 Ų | 133.6 | 85% | 0.853 | 78% | 0.78 | S | S | * | * | trans | 36.6 | 101.7 | 135.2 | -37.3 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 60 | S | 36.5 | Very low | 42.5 | Very low | 117 Ų | 117 | 130.8 Ų | 130.8 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | -168.9 | 127.2 | 117.2 | 52 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 61 | A | 43.3 | Very low | 43.1 | Very low | 103 Ų | 103 | 129.8 Ų | 129.8 | 85% | 0.851 | 76% | 0.764 | S | S | * | * | trans | -82 | 126.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 62 | Q | 37.1 | Very low | 44.1 | Very low | 189 Ų | 189 | 127 Ų | 127 | 88% | 0.883 | 75% | 0.75 | S | S | * | * | trans | -134.3 | 131 | 154.8 | -70.5 | -163.9 | -1.2 | 0 | 0 | 110.2 | ||||
| 63 | S | 37.8 | Very low | 44.6 | Very low | 114 Ų | 114 | 125 Ų | 125 | 80% | 0.797 | 74% | 0.742 | S | S | * | * | trans | -68.4 | 131.3 | -171.8 | 45.4 | 0 | 0 | 0 | 0 | 113.1 | H65 | S63-H65 PolarHBondContact O-N 3.34Š| ||
| 64 | T | 40.7 | Very low | 46.1 | Very low | 131 Ų | 131 | 122.6 Ų | 122.6 | 80% | 0.804 | 74% | 0.735 | S | S | * | * | trans | -70.8 | 91.1 | 168.8 | 48.6 | 0 | 0 | 0 | 0 | 111.1 | F66 | T64-F66 PolarHBondContact O-N 2.99Š| ||
| 65 | H | 40.5 | Very low | 47.7 | Very low | 153 Ų | 153 | 120.1 Ų | 120.1 | 71% | 0.708 | 72% | 0.72 | S | S | * | * | trans | -77.3 | 104.6 | 168.5 | -175.7 | -57.4 | 0 | 0 | 0 | 109.9 | S63 P67 | S63-H65 PolarHBondContact O-N 3.34Å; H65-P67 WeakPolarHBondContact O-CD 3.34Å | ||
| 66 | F | 41.3 | Very low | 48.7 | Very low | 176 Ų | 176 | 116.8 Ų | 116.8 | 77% | 0.772 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 122.1 | 166.9 | -89 | -94.6 | 0 | 0 | 0 | 110.2 | T64 F68 | T64-F66 PolarHBondContact O-N 2.99Å; F66-F68 PolarHBondContact O-N 3.43Å |
| 67 | P | 51.6 | Low | 51 | Low | 110 Ų | 110 | 114.4 Ų | 114.4 | 71% | 0.714 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 129.5 | 170.1 | -16.8 | 31.8 | 0 | 0 | 0 | 109.8 | H65 | H65-P67 WeakPolarHBondContact O-CD 3.34Š|
| 68 | F | 42.1 | Very low | 52.7 | Low | 176 Ų | 176 | 112.6 Ų | 112.6 | 77% | 0.772 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 137.8 | 179.8 | -100.8 | -113.7 | 0 | 0 | 0 | 111.9 | F66 A70 | F66-F68 PolarHBondContact O-N 3.43Å; F68-A70 HydrophobicContact CB-CB 4.41Å; F68-A70 PolarHBondContact O-N 3.37Å |
| 69 | L | 54.4 | Low | 55.4 | Low | 166 Ų | 166 | 112.3 Ų | 112.3 | 87% | 0.869 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | 48 | 173.4 | -70 | 167.5 | 0 | 0 | 0 | 112.5 | ||
| 70 | A | 49.3 | Very low | 58 | Low | 72 Ų | 72 | 109 Ų | 109 | 60% | 0.595 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.3 | -31.9 | -178 | 0 | 0 | 0 | 0 | 0 | 113.6 | F68 S72 | F68-A70 HydrophobicContact CB-CB 4.41Å; F68-A70 PolarHBondContact O-N 3.37Å; A70-S72 VanDerWaalsContact C-N 3.3Å; A70-S72 PolarHBondContact O-N 3.39Å |
| 71 | D | 52 | Low | 60.7 | Low | 116 Ų | 116 | 109.2 Ų | 109.2 | 62% | 0.62 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | -2.5 | -174.2 | -65.4 | -47 | 0 | 0 | 0 | 114.6 | A73 A74 T75 | D71-A73 VanDerWaalsContact C-N 3.25Å; D71-A73 PolarHBondContact O-N 2.87Å; D71-A73 VanDerWaalsContact O-N 3.14Å; D71-A74 PolarHBondContact O-N 3.44Å; D71-A74 VanDerWaalsContact O-N 3.14Å; D71-T75 PolarHBondContact O-N 3.19Å; D71-T75 PolarHBondContact O-OG1 3.03Å |
| 72 | S | 62.3 | Low | 63.1 | Low | 67 Ų | 67 | 110.5 Ų | 110.5 | 47% | 0.469 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -54.7 | -35.9 | -172.7 | -45.1 | 0 | 0 | 0 | 0 | 113.7 | A70 T75 A76 | A70-S72 VanDerWaalsContact C-N 3.3Å; A70-S72 PolarHBondContact O-N 3.39Å; S72-T75 WeakPolarHBondContact CA-OG1 3.38Å; S72-T75 PolarHBondContact O-OG1 2.97Å; S72-A76 WeakPolarHBondContact O-CB 3.15Å; S72-A76 PolarHBondContact O-N 2.85Å |
| 73 | A | 63 | Low | 65.8 | Low | 67 Ų | 67 | 108.9 Ų | 108.9 | 55% | 0.554 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -78.6 | -33.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | D71 N77 | D71-A73 VanDerWaalsContact C-N 3.25Å; D71-A73 PolarHBondContact O-N 2.87Å; D71-A73 VanDerWaalsContact O-N 3.14Å; A73-N77 WeakPolarHBondContact O-CB 3.43Å; A73-N77 PolarHBondContact O-N 3.19Å; A73-N77 VanDerWaalsContact O-N 3.13Å; A73-N77 PolarHBondContact O-ND2 3.14Å |
| 74 | A | 68.1 | Low | 68.5 | Low | 68 Ų | 68 | 108.7 Ų | 108.7 | 56% | 0.562 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -75.4 | -41.8 | 177 | 0 | 0 | 0 | 0 | 0 | 110.9 | D71 N77 S78 | D71-A74 PolarHBondContact O-N 3.44Å; D71-A74 VanDerWaalsContact O-N 3.14Å; A74-N77 PolarHBondContact O-N 3.01Å; A74-S78 PolarHBondContact O-N 3.36Å; A74-S78 PolarHBondContact O-OG 2.95Å |
| 75 | T | 74.1 | Confident | 71.2 | Confident | 73 Ų | 73 | 109.7 Ų | 109.7 | 45% | 0.448 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -66.7 | -37.7 | 173.3 | 50.3 | 0 | 0 | 0 | 0 | 112.5 | D71 S72 S78 L79 | D71-T75 PolarHBondContact O-N 3.19Å; D71-T75 PolarHBondContact O-OG1 3.03Å; S72-T75 WeakPolarHBondContact CA-OG1 3.38Å; S72-T75 PolarHBondContact O-OG1 2.97Å; T75-S78 WeakPolarHBondContact CA-OG 3.37Å; T75-S78 PolarHBondContact O-OG 2.81Å; T75-L79 WeakPolarHBondContact O-CB 3.23Å; T75-L79 VanDerWaalsContact O-CG 3.27Å; T75-L79 WeakPolarHBondContact O-CG 3.12Å; T75-L79 PolarHBondContact O-N 3.05Å |
| 76 | A | 74.1 | Confident | 73.8 | Confident | 44 Ų | 44 | 108.2 Ų | 108.2 | 36% | 0.364 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.2 | -40.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | S72 L80 | S72-A76 WeakPolarHBondContact O-CB 3.15Å; S72-A76 PolarHBondContact O-N 2.85Å; A76-L80 WeakPolarHBondContact O-CB 3.49Å; A76-L80 WeakPolarHBondContact O-CD1 3.27Å; A76-L80 WeakPolarHBondContact O-CG 3.27Å; A76-L80 PolarHBondContact O-N 3.33Å |
| 77 | N | 83.9 | Confident | 76.4 | Confident | 103 Ų | 103 | 107.6 Ų | 107.6 | 55% | 0.551 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.4 | -40 | 177.1 | -89.3 | -71.7 | 0 | 0 | 0 | 112.8 | A73 A74 L80 M81 | A73-N77 WeakPolarHBondContact O-CB 3.43Å; A73-N77 PolarHBondContact O-N 3.19Å; A73-N77 VanDerWaalsContact O-N 3.13Å; A73-N77 PolarHBondContact O-ND2 3.14Å; A74-N77 PolarHBondContact O-N 3.01Å; N77-L80 WeakPolarHBondContact O-CB 3.47Å; N77-L80 PolarHBondContact O-N 3.44Å; N77-M81 PolarHBondContact O-N 3.14Å |
| 78 | S | 86.4 | Confident | 78.6 | Confident | 69 Ų | 69 | 108.4 Ų | 108.4 | 48% | 0.483 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -67.4 | -39.4 | 176.1 | 57.3 | 0 | 0 | 0 | 0 | 112.1 | A74 T75 M81 Q82 | A74-S78 PolarHBondContact O-N 3.36Å; A74-S78 PolarHBondContact O-OG 2.95Å; T75-S78 WeakPolarHBondContact CA-OG 3.37Å; T75-S78 PolarHBondContact O-OG 2.81Å; S78-M81 PolarHBondContact O-N 3.12Å; S78-Q82 WeakPolarHBondContact O-CB 3.4Å; S78-Q82 PolarHBondContact O-N 3.26Å |
| 79 | L | 88.8 | Confident | 81.2 | Confident | 106 Ų | 106 | 103.4 Ų | 103.4 | 56% | 0.555 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.7 | -36.4 | 171.9 | -70.9 | 170.4 | 0 | 0 | 0 | 112.8 | T75 R83 | T75-L79 WeakPolarHBondContact O-CB 3.23Å; T75-L79 VanDerWaalsContact O-CG 3.27Å; T75-L79 WeakPolarHBondContact O-CG 3.12Å; T75-L79 PolarHBondContact O-N 3.05Å; L79-R83 WeakPolarHBondContact O-CB 3.2Å; L79-R83 PolarHBondContact O-N 3.36Å |
| 80 | L | 91 | Very high | 83.2 | Confident | 68 Ų | 68 | 99.9 Ų | 99.9 | 36% | 0.356 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.1 | -49.7 | 172.8 | -89.8 | 159 | 0 | 0 | 0 | 111.8 | A76 N77 R83 Q84 | A76-L80 WeakPolarHBondContact O-CB 3.49Å; A76-L80 WeakPolarHBondContact O-CD1 3.27Å; A76-L80 WeakPolarHBondContact O-CG 3.27Å; A76-L80 PolarHBondContact O-N 3.33Å; N77-L80 WeakPolarHBondContact O-CB 3.47Å; N77-L80 PolarHBondContact O-N 3.44Å; L80-R83 VanDerWaalsContact CD2-NH1 3.33Å; L80-R83 PolarHBondContact O-N 3.01Å; L80-Q84 WeakPolarHBondContact O-CG 3.29Å; L80-Q84 PolarHBondContact O-N 3.28Å |
| 81 | M | 92 | Very high | 85.5 | Confident | 123 Ų | 123 | 101 Ų | 101 | 61% | 0.606 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.4 | -44 | 176 | -85.5 | -68.9 | 138.2 | 0 | 0 | 112.2 | N77 S78 R83 Q84 Y85 | N77-M81 PolarHBondContact O-N 3.14Å; S78-M81 PolarHBondContact O-N 3.12Å; M81-R83 VanDerWaalsContact C-N 3.31Å; M81-R83 PolarHBondContact O-N 2.96Å; M81-Q84 PolarHBondContact O-N 3.13Å; M81-Y85 WeakPolarHBondContact O-CB 3.17Å; M81-Y85 PolarHBondContact O-N 3.48Å |
| 82 | Q | 93.6 | Very high | 87.6 | Confident | 130 Ų | 130 | 100.2 Ų | 100.2 | 61% | 0.607 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.1 | -40.6 | 177.4 | -170.2 | 177.2 | 11.2 | 0 | 0 | 111.6 | S78 H86 | S78-Q82 WeakPolarHBondContact O-CB 3.4Å; S78-Q82 PolarHBondContact O-N 3.26Å; Q82-H86 WeakPolarHBondContact O-CB 3.28Å; Q82-H86 PolarHBondContact O-N 2.96Å |
| 83 | R | 94.8 | Very high | 89.2 | Confident | 154 Ų | 154 | 103.2 Ų | 103.2 | 58% | 0.581 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.5 | -42.8 | 174.9 | -167.7 | -178.6 | 73.7 | -107.5 | 3.8 | 112.1 | L79 L80 M81 H86 Y87 | L79-R83 WeakPolarHBondContact O-CB 3.2Å; L79-R83 PolarHBondContact O-N 3.36Å; L80-R83 VanDerWaalsContact CD2-NH1 3.33Å; L80-R83 PolarHBondContact O-N 3.01Å; M81-R83 VanDerWaalsContact C-N 3.31Å; M81-R83 PolarHBondContact O-N 2.96Å; R83-H86 PolarHBondContact O-N 3.27Å; R83-Y87 WeakPolarHBondContact O-CB 3.31Å; R83-Y87 PolarHBondContact O-N 3.21Å |
| 84 | Q | 95 | Very high | 90.8 | Very high | 110 Ų | 110 | 106.8 Ų | 106.8 | 51% | 0.514 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.1 | -42.6 | 177.2 | -74.9 | -179.6 | -52.8 | 0 | 0 | 112 | L80 M81 H86 Y87 H88 | L80-Q84 WeakPolarHBondContact O-CG 3.29Å; L80-Q84 PolarHBondContact O-N 3.28Å; M81-Q84 PolarHBondContact O-N 3.13Å; Q84-H86 PolarHBondContact O-N 3.22Å; Q84-Y87 PolarHBondContact O-N 2.99Å; Q84-H88 PolarHBondContact O-N 3.32Å |
| 85 | Y | 95.9 | Very high | 92.1 | Very high | 152 Ų | 152 | 110 Ų | 110 | 60% | 0.596 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -59 | -46.3 | 173.7 | 177.5 | -98.9 | 0 | 0 | 0 | 111.9 | M81 Y87 H88 L89 | M81-Y85 WeakPolarHBondContact O-CB 3.17Å; M81-Y85 PolarHBondContact O-N 3.48Å; Y85-Y87 VanDerWaalsContact C-N 3.33Å; Y85-Y87 PolarHBondContact O-N 2.95Å; Y85-H88 PolarHBondContact O-N 2.73Å; Y85-L89 HydrophobicContact CD1-CD1 4.22Å; Y85-L89 HydrophobicContact CD2-CD1 4.28Å; Y85-L89 HydrophobicContact CE1-CD1 3.7Å; Y85-L89 HydrophobicContact CE1-CD2 4.19Å; Y85-L89 HydrophobicContact CE2-CD1 3.77Å; Y85-L89 HydrophobicContact CG-CD1 4.49Å; Y85-L89 VanDerWaalsContact CZ-CD1 3.45Å; Y85-L89 PolarHBondContact O-N 2.88Å |
| 86 | H | 95.8 | Very high | 93.1 | Very high | 123 Ų | 123 | 111.9 Ų | 111.9 | 57% | 0.569 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.4 | -39.2 | 178.6 | -157.8 | 81.3 | 0 | 0 | 0 | 112.2 | Q82 R83 Q84 H88 L89 L90 | Q82-H86 WeakPolarHBondContact O-CB 3.28Å; Q82-H86 PolarHBondContact O-N 2.96Å; R83-H86 PolarHBondContact O-N 3.27Å; Q84-H86 PolarHBondContact O-N 3.22Å; H86-H88 VanDerWaalsContact C-N 3.34Å; H86-H88 PolarHBondContact O-N 3.3Å; H86-L89 PolarHBondContact O-N 3.04Å; H86-L90 PolarHBondContact O-N 3.48Å; H86-L90 VanDerWaalsContact O-N 3.07Å |
| 87 | Y | 96.6 | Very high | 94.1 | Very high | 162 Ų | 162 | 114.8 Ų | 114.8 | 64% | 0.635 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.9 | -39.3 | 174.9 | -151.6 | -94.5 | 0 | 0 | 0 | 112.1 | R83 Q84 Y85 L90 L91 | R83-Y87 WeakPolarHBondContact O-CB 3.31Å; R83-Y87 PolarHBondContact O-N 3.21Å; Q84-Y87 PolarHBondContact O-N 2.99Å; Y85-Y87 VanDerWaalsContact C-N 3.33Å; Y85-Y87 PolarHBondContact O-N 2.95Å; Y87-L90 WeakPolarHBondContact O-CB 3.46Å; Y87-L90 PolarHBondContact O-N 2.95Å; Y87-L91 HydrophobicContact CD1-CD1 3.56Å; Y87-L91 HydrophobicContact CE1-CD1 3.52Å; Y87-L91 WeakPolarHBondContact O-CD1 3.41Å; Y87-L91 PolarHBondContact O-N 3.26Å |
| 88 | H | 96.6 | Very high | 94.7 | Very high | 127 Ų | 127 | 112.4 Ų | 112.4 | 59% | 0.588 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.7 | -37.9 | 176.9 | -163.9 | -91.3 | 0 | 0 | 0 | 112.5 | Q84 Y85 H86 L90 L91 Q92 | Q84-H88 PolarHBondContact O-N 3.32Å; Y85-H88 PolarHBondContact O-N 2.73Å; H86-H88 VanDerWaalsContact C-N 3.34Å; H86-H88 PolarHBondContact O-N 3.3Å; H88-L90 VanDerWaalsContact C-N 3.35Å; H88-L91 PolarHBondContact O-N 3.35Å; H88-Q92 PolarHBondContact O-N 2.92Å |
| 89 | L | 97.5 | Very high | 95.1 | Very high | 71 Ų | 71 | 114.4 Ų | 114.4 | 37% | 0.372 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -61.9 | -41.6 | 170.5 | -102 | 70.5 | 0 | 0 | 0 | 112 | Y85 H86 Q92 Q93 | Y85-L89 HydrophobicContact CD1-CD1 4.22Å; Y85-L89 HydrophobicContact CD2-CD1 4.28Å; Y85-L89 HydrophobicContact CE1-CD1 3.7Å; Y85-L89 HydrophobicContact CE1-CD2 4.19Å; Y85-L89 HydrophobicContact CE2-CD1 3.77Å; Y85-L89 HydrophobicContact CG-CD1 4.49Å; Y85-L89 VanDerWaalsContact CZ-CD1 3.45Å; Y85-L89 PolarHBondContact O-N 2.88Å; H86-L89 PolarHBondContact O-N 3.04Å; L89-Q92 PolarHBondContact O-N 3.39Å; L89-Q93 PolarHBondContact O-N 3.01Å |
| 90 | L | 97.4 | Very high | 95.4 | Very high | 93 Ų | 93 | 111.9 Ų | 111.9 | 49% | 0.487 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 178.2 | -124.8 | 77.6 | 0 | 0 | 0 | 112 | H86 Y87 H88 Q93 Q94 | H86-L90 PolarHBondContact O-N 3.48Å; H86-L90 VanDerWaalsContact O-N 3.07Å; Y87-L90 WeakPolarHBondContact O-CB 3.46Å; Y87-L90 PolarHBondContact O-N 2.95Å; H88-L90 VanDerWaalsContact C-N 3.35Å; L90-Q93 PolarHBondContact O-N 2.89Å; L90-Q94 WeakPolarHBondContact O-CB 3.42Å; L90-Q94 PolarHBondContact O-N 2.94Å |
| 91 | L | 96.9 | Very high | 95.5 | Very high | 94 Ų | 94 | 114.6 Ų | 114.6 | 49% | 0.492 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.3 | -42.7 | 174.7 | -94.3 | 82.5 | 0 | 0 | 0 | 112 | Y87 H88 Q94 Q95 | Y87-L91 HydrophobicContact CD1-CD1 3.56Å; Y87-L91 HydrophobicContact CE1-CD1 3.52Å; Y87-L91 WeakPolarHBondContact O-CD1 3.41Å; Y87-L91 PolarHBondContact O-N 3.26Å; H88-L91 PolarHBondContact O-N 3.35Å; L91-Q94 PolarHBondContact O-N 3.46Å; L91-Q95 WeakPolarHBondContact O-CB 3.45Å; L91-Q95 PolarHBondContact O-N 3.3Å |
| 92 | Q | 96.3 | Very high | 95.6 | Very high | 101 Ų | 101 | 114.8 Ų | 114.8 | 47% | 0.472 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 178.5 | -175.5 | 176.3 | 98.9 | 0 | 0 | 111.6 | H88 L89 Q95 Q96 | H88-Q92 PolarHBondContact O-N 2.92Å; L89-Q92 PolarHBondContact O-N 3.39Å; Q92-Q95 PolarHBondContact O-N 3.13Å; Q92-Q96 WeakPolarHBondContact O-CG 3.34Å; Q92-Q96 PolarHBondContact O-N 3.03Å |
| 93 | Q | 96.1 | Very high | 95.7 | Very high | 130 Ų | 130 | 114.9 Ų | 114.9 | 61% | 0.607 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.2 | -45.4 | 175.4 | -173 | -168.3 | 100.7 | 0 | 0 | 111.4 | L89 L90 Q95 Q96 L97 | L89-Q93 PolarHBondContact O-N 3.01Å; L90-Q93 PolarHBondContact O-N 2.89Å; Q93-Q95 VanDerWaalsContact C-N 3.33Å; Q93-Q95 PolarHBondContact O-N 3.5Å; Q93-Q96 PolarHBondContact O-N 3.39Å; Q93-L97 PolarHBondContact O-N 3.28Å |
| 94 | Q | 95.6 | Very high | 95.5 | Very high | 141 Ų | 141 | 113.3 Ų | 113.3 | 66% | 0.659 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -60.6 | -42.2 | 178.2 | -173.6 | -175.5 | 91.4 | 0 | 0 | 111.7 | L90 L91 L97 A98 | L90-Q94 WeakPolarHBondContact O-CB 3.42Å; L90-Q94 PolarHBondContact O-N 2.94Å; L91-Q94 PolarHBondContact O-N 3.46Å; Q94-L97 PolarHBondContact O-N 2.92Å; Q94-A98 WeakPolarHBondContact O-CB 3.5Å; Q94-A98 PolarHBondContact O-N 3.19Å |
| 95 | Q | 95.6 | Very high | 95.4 | Very high | 137 Ų | 137 | 110.5 Ų | 110.5 | 64% | 0.64 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.5 | -40.4 | 177.6 | -174.7 | 174.6 | 84.8 | 0 | 0 | 112.3 | L91 Q92 Q93 A98 M99 | L91-Q95 WeakPolarHBondContact O-CB 3.45Å; L91-Q95 PolarHBondContact O-N 3.3Å; Q92-Q95 PolarHBondContact O-N 3.13Å; Q93-Q95 VanDerWaalsContact C-N 3.33Å; Q93-Q95 PolarHBondContact O-N 3.5Å; Q95-A98 PolarHBondContact O-N 3.33Å; Q95-M99 PolarHBondContact O-N 3.21Å |
| 96 | Q | 95.2 | Very high | 95.2 | Very high | 112 Ų | 112 | 108 Ų | 108 | 52% | 0.523 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 173.2 | -72 | 172.3 | 6.8 | 0 | 0 | 111.6 | Q92 Q93 M99 A100 | Q92-Q96 WeakPolarHBondContact O-CG 3.34Å; Q92-Q96 PolarHBondContact O-N 3.03Å; Q93-Q96 PolarHBondContact O-N 3.39Å; Q96-M99 PolarHBondContact O-N 3.3Å; Q96-A100 WeakPolarHBondContact O-CB 3.49Å; Q96-A100 PolarHBondContact O-N 3.39Å |
| 97 | L | 95.8 | Very high | 94.9 | Very high | 104 Ų | 104 | 104.9 Ų | 104.9 | 55% | 0.545 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.3 | -41.4 | 178.3 | -160.8 | 75.1 | 0 | 0 | 0 | 111.8 | Q93 Q94 A100 Q101 | Q93-L97 PolarHBondContact O-N 3.28Å; Q94-L97 PolarHBondContact O-N 2.92Å; L97-A100 PolarHBondContact O-N 2.85Å; L97-Q101 WeakPolarHBondContact O-CB 3.42Å; L97-Q101 WeakPolarHBondContact O-CG 3.39Å; L97-Q101 PolarHBondContact O-N 3.18Å |
| 98 | A | 96 | Very high | 94.4 | Very high | 53 Ų | 53 | 100 Ų | 100 | 44% | 0.438 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.6 | -42.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q94 Q95 Q101 H102 | Q94-A98 WeakPolarHBondContact O-CB 3.5Å; Q94-A98 PolarHBondContact O-N 3.19Å; Q95-A98 PolarHBondContact O-N 3.33Å; A98-Q101 PolarHBondContact O-N 3.01Å; A98-H102 WeakPolarHBondContact O-CB 3.42Å; A98-H102 PolarHBondContact O-N 2.95Å |
| 99 | M | 94.8 | Very high | 93.9 | Very high | 111 Ų | 111 | 97.8 Ų | 97.8 | 55% | 0.547 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.9 | -40.8 | 173.9 | -73.4 | -150.3 | -63.2 | 0 | 0 | 112.5 | Q95 Q96 H102 Q103 | Q95-M99 PolarHBondContact O-N 3.21Å; Q96-M99 PolarHBondContact O-N 3.3Å; M99-H102 PolarHBondContact O-N 3.11Å; M99-Q103 WeakPolarHBondContact O-CG 3.36Å; M99-Q103 PolarHBondContact O-N 2.87Å |
| 100 | A | 94.1 | Very high | 93.1 | Very high | 53 Ų | 53 | 97.3 Ų | 97.3 | 44% | 0.438 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | Q96 L97 Q103 L104 | Q96-A100 WeakPolarHBondContact O-CB 3.49Å; Q96-A100 PolarHBondContact O-N 3.39Å; L97-A100 PolarHBondContact O-N 2.85Å; A100-Q103 PolarHBondContact O-N 3.29Å; A100-L104 WeakPolarHBondContact O-CB 3.25Å; A100-L104 PolarHBondContact O-N 3.41Å |
| 101 | Q | 93.3 | Very high | 92.2 | Very high | 126 Ų | 126 | 95.4 Ų | 95.4 | 59% | 0.589 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.8 | -39.3 | 174.5 | -75 | -179.5 | -18.2 | 0 | 0 | 112.2 | L97 A98 L104 A105 | L97-Q101 WeakPolarHBondContact O-CB 3.42Å; L97-Q101 WeakPolarHBondContact O-CG 3.39Å; L97-Q101 PolarHBondContact O-N 3.18Å; A98-Q101 PolarHBondContact O-N 3.01Å; Q101-L104 PolarHBondContact O-N 3.05Å; Q101-A105 WeakPolarHBondContact O-CB 3.42Å; Q101-A105 PolarHBondContact O-N 3.08Å |
| 102 | H | 94.8 | Very high | 91.1 | Very high | 126 Ų | 126 | 94 Ų | 94 | 58% | 0.583 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.4 | -45.8 | 175.3 | -174.3 | 67.3 | 0 | 0 | 0 | 111.8 | A98 M99 L104 A105 L106 | A98-H102 WeakPolarHBondContact O-CB 3.42Å; A98-H102 PolarHBondContact O-N 2.95Å; M99-H102 PolarHBondContact O-N 3.11Å; H102-L104 VanDerWaalsContact C-N 3.33Å; H102-L104 PolarHBondContact O-N 3.24Å; H102-A105 PolarHBondContact O-N 2.79Å; H102-L106 WeakPolarHBondContact NE2-CD1 3.38Å; H102-L106 WeakPolarHBondContact O-CD1 3.26Å; H102-L106 PolarHBondContact O-N 3.43Å |
| 103 | Q | 94.9 | Very high | 90 | Very high | 132 Ų | 132 | 91.8 Ų | 91.8 | 62% | 0.617 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60.9 | -41.6 | 174.9 | -70.4 | 175.9 | 26.3 | 0 | 0 | 112 | M99 A100 A105 L106 A107 | M99-Q103 WeakPolarHBondContact O-CG 3.36Å; M99-Q103 PolarHBondContact O-N 2.87Å; A100-Q103 PolarHBondContact O-N 3.29Å; Q103-A105 VanDerWaalsContact C-N 3.34Å; Q103-A105 PolarHBondContact O-N 3.19Å; Q103-L106 PolarHBondContact O-N 3.09Å; Q103-A107 WeakPolarHBondContact O-CB 3.09Å; Q103-A107 PolarHBondContact O-N 3.36Å |
| 104 | L | 92.4 | Very high | 88.7 | Confident | 121 Ų | 121 | 88.8 Ų | 88.8 | 63% | 0.634 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.2 | -39.5 | 175.5 | -175.5 | 63 | 0 | 0 | 0 | 111.9 | A100 Q101 H102 A107 A108 | A100-L104 WeakPolarHBondContact O-CB 3.25Å; A100-L104 PolarHBondContact O-N 3.41Å; Q101-L104 PolarHBondContact O-N 3.05Å; H102-L104 VanDerWaalsContact C-N 3.33Å; H102-L104 PolarHBondContact O-N 3.24Å; L104-A107 PolarHBondContact O-N 2.79Å; L104-A108 VanDerWaalsContact O-CB 3.28Å; L104-A108 WeakPolarHBondContact O-CB 3.47Å; L104-A108 PolarHBondContact O-N 3.36Å |
| 105 | A | 92.6 | Very high | 87.3 | Confident | 51 Ų | 51 | 84.7 Ų | 84.7 | 42% | 0.421 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.4 | -41.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q101 H102 Q103 S109 | Q101-A105 WeakPolarHBondContact O-CB 3.42Å; Q101-A105 PolarHBondContact O-N 3.08Å; H102-A105 PolarHBondContact O-N 2.79Å; Q103-A105 VanDerWaalsContact C-N 3.34Å; Q103-A105 PolarHBondContact O-N 3.19Å; A105-S109 WeakPolarHBondContact O-CB 3.18Å; A105-S109 PolarHBondContact O-N 2.97Å; A105-S109 PolarHBondContact O-OG 2.88Å |
| 106 | L | 91.9 | Very high | 85.7 | Confident | 101 Ų | 101 | 81.7 Ų | 81.7 | 53% | 0.529 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.2 | -45.1 | 171.2 | -87.7 | 92.1 | 0 | 0 | 0 | 111.9 | H102 Q103 A108 S109 A110 | H102-L106 WeakPolarHBondContact NE2-CD1 3.38Å; H102-L106 WeakPolarHBondContact O-CD1 3.26Å; H102-L106 PolarHBondContact O-N 3.43Å; Q103-L106 PolarHBondContact O-N 3.09Å; L106-A108 PolarHBondContact O-N 3.49Å; L106-S109 PolarHBondContact O-N 3.31Å; L106-A110 WeakPolarHBondContact O-CB 3.41Å; L106-A110 PolarHBondContact O-N 2.65Å |
| 107 | A | 88.6 | Confident | 84.2 | Confident | 57 Ų | 57 | 82.4 Ų | 82.4 | 47% | 0.471 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q103 L104 A110 A111 | Q103-A107 WeakPolarHBondContact O-CB 3.09Å; Q103-A107 PolarHBondContact O-N 3.36Å; L104-A107 PolarHBondContact O-N 2.79Å; A107-A110 PolarHBondContact O-N 3.5Å; A107-A111 VanDerWaalsContact O-CB 3.31Å; A107-A111 WeakPolarHBondContact O-CB 3.19Å; A107-A111 PolarHBondContact O-N 3.07Å |
| 108 | A | 86.7 | Confident | 82.8 | Confident | 58 Ų | 58 | 82.9 Ų | 82.9 | 48% | 0.479 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.1 | -39 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | L104 L106 A111 A112 | L104-A108 VanDerWaalsContact O-CB 3.28Å; L104-A108 WeakPolarHBondContact O-CB 3.47Å; L104-A108 PolarHBondContact O-N 3.36Å; L106-A108 PolarHBondContact O-N 3.49Å; A108-A111 PolarHBondContact O-N 3.02Å; A108-A112 WeakPolarHBondContact O-CB 3.32Å; A108-A112 PolarHBondContact O-N 2.98Å |
| 109 | S | 84.9 | Confident | 81.5 | Confident | 81 Ų | 81 | 86.5 Ų | 86.5 | 57% | 0.566 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67.7 | -41.3 | 177.1 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | A105 L106 A112 A113 | A105-S109 WeakPolarHBondContact O-CB 3.18Å; A105-S109 PolarHBondContact O-N 2.97Å; A105-S109 PolarHBondContact O-OG 2.88Å; L106-S109 PolarHBondContact O-N 3.31Å; S109-A112 PolarHBondContact O-N 3.4Å; S109-A113 PolarHBondContact O-N 3.3Å |
| 110 | A | 80.6 | Confident | 80.4 | Confident | 62 Ų | 62 | 84.9 Ų | 84.9 | 51% | 0.512 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.3 | -42 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L106 A107 A113 S114 | L106-A110 WeakPolarHBondContact O-CB 3.41Å; L106-A110 PolarHBondContact O-N 2.65Å; A107-A110 PolarHBondContact O-N 3.5Å; A110-A113 PolarHBondContact O-N 3.22Å; A110-S114 PolarHBondContact O-N 3.47Å; A110-S114 PolarHBondContact O-OG 2.99Å |
| 111 | A | 78.4 | Confident | 79.5 | Confident | 53 Ų | 53 | 87.2 Ų | 87.2 | 44% | 0.438 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65 | -38.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | A107 A108 S114 A115 | A107-A111 VanDerWaalsContact O-CB 3.31Å; A107-A111 WeakPolarHBondContact O-CB 3.19Å; A107-A111 PolarHBondContact O-N 3.07Å; A108-A111 PolarHBondContact O-N 3.02Å; A111-S114 WeakPolarHBondContact CA-OG 3.41Å; A111-S114 PolarHBondContact O-N 2.94Å; A111-S114 PolarHBondContact O-OG 2.77Å; A111-A115 VanDerWaalsContact O-CB 3.27Å; A111-A115 WeakPolarHBondContact O-CB 3.45Å; A111-A115 PolarHBondContact O-N 2.84Å |
| 112 | A | 75.4 | Confident | 79 | Confident | 64 Ų | 64 | 86.3 Ų | 86.3 | 53% | 0.529 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A108 S109 A115 S116 | A108-A112 WeakPolarHBondContact O-CB 3.32Å; A108-A112 PolarHBondContact O-N 2.98Å; S109-A112 PolarHBondContact O-N 3.4Å; A112-A115 PolarHBondContact O-N 2.77Å; A112-S116 PolarHBondContact O-N 2.86Å; A112-S116 VanDerWaalsContact O-N 3.11Å |
| 113 | A | 71.8 | Confident | 78.5 | Confident | 55 Ų | 55 | 84.6 Ų | 84.6 | 46% | 0.455 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64 | -43.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | S109 A110 H117 | S109-A113 PolarHBondContact O-N 3.3Å; A110-A113 PolarHBondContact O-N 3.22Å; A113-H117 PolarHBondContact O-N 2.72Å |
| 114 | S | 68.8 | Low | 78 | Confident | 67 Ų | 67 | 81 Ų | 81 | 47% | 0.469 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.6 | -37.3 | 176.3 | 59.2 | 0 | 0 | 0 | 0 | 112.9 | A110 A111 H117 Q118 | A110-S114 PolarHBondContact O-N 3.47Å; A110-S114 PolarHBondContact O-OG 2.99Å; A111-S114 WeakPolarHBondContact CA-OG 3.41Å; A111-S114 PolarHBondContact O-N 2.94Å; A111-S114 PolarHBondContact O-OG 2.77Å; S114-H117 PolarHBondContact O-N 3.33Å; S114-Q118 VanDerWaalsContact O-CB 3.3Å; S114-Q118 WeakPolarHBondContact O-CB 3.48Å; S114-Q118 PolarHBondContact O-N 3.15Å |
| 115 | A | 66.3 | Low | 77.7 | Confident | 54 Ų | 54 | 83.7 Ų | 83.7 | 45% | 0.446 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.5 | -41.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | A111 A112 Q118 Q119 | A111-A115 VanDerWaalsContact O-CB 3.27Å; A111-A115 WeakPolarHBondContact O-CB 3.45Å; A111-A115 PolarHBondContact O-N 2.84Å; A112-A115 PolarHBondContact O-N 2.77Å; A115-Q118 PolarHBondContact O-N 3.45Å; A115-Q119 WeakPolarHBondContact O-CB 3.49Å; A115-Q119 PolarHBondContact O-N 3.01Å |
| 116 | S | 63.3 | Low | 77.6 | Confident | 74 Ų | 74 | 84.5 Ų | 84.5 | 52% | 0.517 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.5 | -47.3 | 175.5 | -172.4 | 0 | 0 | 0 | 0 | 111.9 | A112 Q119 T120 | A112-S116 PolarHBondContact O-N 2.86Å; A112-S116 VanDerWaalsContact O-N 3.11Å; S116-Q119 PolarHBondContact O-N 3.21Å; S116-T120 PolarHBondContact O-N 2.77Å; S116-T120 PolarHBondContact O-OG1 2.65Å |
| 117 | H | 63 | Low | 77.5 | Confident | 127 Ų | 127 | 84.9 Ų | 84.9 | 59% | 0.588 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.9 | -47 | 175.8 | -89.2 | -69.5 | 0 | 0 | 0 | 112.4 | A113 S114 Q119 T120 D121 | A113-H117 PolarHBondContact O-N 2.72Å; S114-H117 PolarHBondContact O-N 3.33Å; H117-Q119 VanDerWaalsContact C-N 3.31Å; H117-Q119 PolarHBondContact O-N 2.87Å; H117-T120 PolarHBondContact O-N 3.3Å; H117-T120 VanDerWaalsContact O-N 3.12Å; H117-T120 PolarHBondContact O-OG1 3.38Å; H117-D121 PolarHBondContact O-N 3.35Å |
| 118 | Q | 66.7 | Low | 77.4 | Confident | 114 Ų | 114 | 88.7 Ų | 88.7 | 53% | 0.533 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.4 | -41.5 | 179.6 | -176.1 | 176.5 | -12.1 | 0 | 0 | 111.8 | S114 A115 T120 D121 E122 | S114-Q118 VanDerWaalsContact O-CB 3.3Å; S114-Q118 WeakPolarHBondContact O-CB 3.48Å; S114-Q118 PolarHBondContact O-N 3.15Å; A115-Q118 PolarHBondContact O-N 3.45Å; Q118-T120 PolarHBondContact O-N 3.5Å; Q118-D121 PolarHBondContact O-N 3.29Å; Q118-E122 HydrophobicContact CG-CG 4.48Å; Q118-E122 WeakPolarHBondContact CG-OE1 3.16Å; Q118-E122 PolarHBondContact NE2-OE1 2.96Å; Q118-E122 WeakPolarHBondContact O-CB 3.23Å; Q118-E122 WeakPolarHBondContact O-CG 3.46Å; Q118-E122 PolarHBondContact O-N 3.33Å |
| 119 | Q | 68.8 | Low | 77.4 | Confident | 130 Ų | 130 | 90.2 Ų | 90.2 | 61% | 0.607 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.1 | -41.5 | 176.5 | -170.6 | 176.6 | 6.1 | 0 | 0 | 111.9 | A115 S116 H117 I123 | A115-Q119 WeakPolarHBondContact O-CB 3.49Å; A115-Q119 PolarHBondContact O-N 3.01Å; S116-Q119 PolarHBondContact O-N 3.21Å; H117-Q119 VanDerWaalsContact C-N 3.31Å; H117-Q119 PolarHBondContact O-N 2.87Å; Q119-I123 HydrophobicContact CG-CD1 4.21Å; Q119-I123 WeakPolarHBondContact O-CD1 3.44Å; Q119-I123 VanDerWaalsContact O-CG1 3.28Å; Q119-I123 WeakPolarHBondContact O-CG1 3.44Å; Q119-I123 PolarHBondContact O-N 3.35Å; Q119-I123 VanDerWaalsContact O-N 3.14Å |
| 120 | T | 70.8 | Confident | 77.5 | Confident | 76 Ų | 76 | 93 Ų | 93 | 47% | 0.466 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.7 | -37 | 175.5 | 53.4 | 0 | 0 | 0 | 0 | 112.9 | S116 H117 Q118 I123 A124 | S116-T120 PolarHBondContact O-N 2.77Å; S116-T120 PolarHBondContact O-OG1 2.65Å; H117-T120 PolarHBondContact O-N 3.3Å; H117-T120 VanDerWaalsContact O-N 3.12Å; H117-T120 PolarHBondContact O-OG1 3.38Å; Q118-T120 PolarHBondContact O-N 3.5Å; T120-I123 PolarHBondContact O-N 3.24Å; T120-A124 WeakPolarHBondContact O-CB 3.41Å; T120-A124 PolarHBondContact O-N 3.28Å |
| 121 | D | 75.4 | Confident | 77.7 | Confident | 102 Ų | 102 | 92.1 Ų | 92.1 | 55% | 0.545 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70.9 | -35 | 178.7 | -73.7 | -28.3 | 0 | 0 | 0 | 112.4 | H117 Q118 R125 | H117-D121 PolarHBondContact O-N 3.35Å; Q118-D121 PolarHBondContact O-N 3.29Å; D121-R125 WeakPolarHBondContact O-CB 3.38Å; D121-R125 PolarHBondContact O-N 2.67Å |
| 122 | E | 84.1 | Confident | 77.9 | Confident | 107 Ų | 107 | 95.1 Ų | 95.1 | 50% | 0.5 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -70.2 | -37.4 | 174.6 | -74.2 | 178.7 | -165.7 | 0 | 0 | 112.1 | Q118 S126 | Q118-E122 HydrophobicContact CG-CG 4.48Å; Q118-E122 WeakPolarHBondContact CG-OE1 3.16Å; Q118-E122 PolarHBondContact NE2-OE1 2.96Å; Q118-E122 WeakPolarHBondContact O-CB 3.23Å; Q118-E122 WeakPolarHBondContact O-CG 3.46Å; Q118-E122 PolarHBondContact O-N 3.33Å; E122-S126 WeakPolarHBondContact O-CB 3.46Å; E122-S126 PolarHBondContact O-N 3.2Å; E122-S126 PolarHBondContact O-OG 2.98Å |
| 123 | I | 83.6 | Confident | 77.9 | Confident | 90 Ų | 90 | 97 Ų | 97 | 46% | 0.462 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.5 | -47.3 | 171.7 | -66.6 | 165.3 | 0 | 0 | 0 | 110.3 | Q119 T120 R125 S126 L127 | Q119-I123 HydrophobicContact CG-CD1 4.21Å; Q119-I123 WeakPolarHBondContact O-CD1 3.44Å; Q119-I123 VanDerWaalsContact O-CG1 3.28Å; Q119-I123 WeakPolarHBondContact O-CG1 3.44Å; Q119-I123 PolarHBondContact O-N 3.35Å; Q119-I123 VanDerWaalsContact O-N 3.14Å; T120-I123 PolarHBondContact O-N 3.24Å; I123-R125 VanDerWaalsContact C-N 3.35Å; I123-R125 PolarHBondContact O-N 2.93Å; I123-S126 WeakPolarHBondContact CA-OG 3.32Å; I123-S126 PolarHBondContact O-N 3.43Å; I123-S126 PolarHBondContact O-OG 3.3Å; I123-L127 HydrophobicContact CG2-CD1 3.89Å; I123-L127 HydrophobicContact CG2-CG 4.46Å; I123-L127 WeakPolarHBondContact O-CB 3.36Å; I123-L127 VanDerWaalsContact O-CG 3.3Å; I123-L127 WeakPolarHBondContact O-CG 3.14Å; I123-L127 PolarHBondContact O-N 3.41Å |
| 124 | A | 84.6 | Confident | 78 | Confident | 56 Ų | 56 | 98 Ų | 98 | 46% | 0.463 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.1 | -40.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | T120 K128 | T120-A124 WeakPolarHBondContact O-CB 3.41Å; T120-A124 PolarHBondContact O-N 3.28Å; A124-K128 VanDerWaalsContact O-CB 3.28Å; A124-K128 WeakPolarHBondContact O-CB 3.37Å; A124-K128 PolarHBondContact O-N 2.71Å |
| 125 | R | 86.1 | Confident | 77.9 | Confident | 179 Ų | 179 | 98.4 Ų | 98.4 | 68% | 0.675 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.8 | -45.3 | 176.6 | 178.3 | -177.5 | -78.1 | -167.5 | -3 | 111.8 | D121 I123 K128 I129 | D121-R125 WeakPolarHBondContact O-CB 3.38Å; D121-R125 PolarHBondContact O-N 2.67Å; I123-R125 VanDerWaalsContact C-N 3.35Å; I123-R125 PolarHBondContact O-N 2.93Å; R125-K128 PolarHBondContact O-N 3.02Å; R125-I129 HydrophobicContact CG-CD1 3.91Å; R125-I129 WeakPolarHBondContact O-CG1 3.49Å; R125-I129 PolarHBondContact O-N 2.86Å |
| 126 | S | 89.9 | Confident | 77.4 | Confident | 67 Ų | 67 | 97 Ų | 97 | 47% | 0.469 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.8 | -41 | 179.2 | 53.2 | 0 | 0 | 0 | 0 | 112 | E122 I123 K128 I129 F130 | E122-S126 WeakPolarHBondContact O-CB 3.46Å; E122-S126 PolarHBondContact O-N 3.2Å; E122-S126 PolarHBondContact O-OG 2.98Å; I123-S126 WeakPolarHBondContact CA-OG 3.32Å; I123-S126 PolarHBondContact O-N 3.43Å; I123-S126 PolarHBondContact O-OG 3.3Å; S126-K128 VanDerWaalsContact C-N 3.35Å; S126-K128 PolarHBondContact O-N 3.48Å; S126-I129 PolarHBondContact O-N 3.06Å; S126-F130 WeakPolarHBondContact O-CB 3.45Å; S126-F130 PolarHBondContact O-N 3.06Å |
| 127 | L | 89.2 | Confident | 76.8 | Confident | 109 Ų | 109 | 97 Ų | 97 | 57% | 0.571 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.6 | -39.8 | 171 | -71.7 | 171.4 | 0 | 0 | 0 | 112.3 | I123 F130 A131 | I123-L127 HydrophobicContact CG2-CD1 3.89Å; I123-L127 HydrophobicContact CG2-CG 4.46Å; I123-L127 WeakPolarHBondContact O-CB 3.36Å; I123-L127 VanDerWaalsContact O-CG 3.3Å; I123-L127 WeakPolarHBondContact O-CG 3.14Å; I123-L127 PolarHBondContact O-N 3.41Å; L127-F130 PolarHBondContact O-N 2.73Å; L127-A131 WeakPolarHBondContact O-CB 3.45Å; L127-A131 PolarHBondContact O-N 2.91Å |
| 128 | K | 86.9 | Confident | 76.2 | Confident | 138 Ų | 138 | 94.6 Ų | 94.6 | 60% | 0.6 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.5 | -42.9 | 176.1 | -176.4 | 175.8 | -179.1 | 176.7 | 0 | 112.5 | A124 R125 S126 A131 Q132 | A124-K128 VanDerWaalsContact O-CB 3.28Å; A124-K128 WeakPolarHBondContact O-CB 3.37Å; A124-K128 PolarHBondContact O-N 2.71Å; R125-K128 PolarHBondContact O-N 3.02Å; S126-K128 VanDerWaalsContact C-N 3.35Å; S126-K128 PolarHBondContact O-N 3.48Å; K128-A131 PolarHBondContact O-N 2.9Å; K128-Q132 WeakPolarHBondContact O-CG 3.39Å; K128-Q132 PolarHBondContact O-N 3.39Å |
| 129 | I | 86.8 | Confident | 75.5 | Confident | 89 Ų | 89 | 95.6 Ų | 95.6 | 46% | 0.456 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.5 | -43.9 | 175.9 | -68.3 | 165.9 | 0 | 0 | 0 | 110.1 | R125 S126 A131 Q132 V133 | R125-I129 HydrophobicContact CG-CD1 3.91Å; R125-I129 WeakPolarHBondContact O-CG1 3.49Å; R125-I129 PolarHBondContact O-N 2.86Å; S126-I129 PolarHBondContact O-N 3.06Å; I129-A131 PolarHBondContact O-N 3.3Å; I129-Q132 PolarHBondContact O-N 2.84Å; I129-V133 HydrophobicContact CG2-CG2 4.45Å; I129-V133 WeakPolarHBondContact O-CG2 3.36Å; I129-V133 PolarHBondContact O-N 3.31Å |
| 130 | F | 87.7 | Confident | 74.6 | Confident | 141 Ų | 141 | 95.9 Ų | 95.9 | 62% | 0.618 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -57.9 | -48 | 175.4 | -179.3 | -97.5 | 0 | 0 | 0 | 111.4 | S126 L127 Q132 V133 T134 | S126-F130 WeakPolarHBondContact O-CB 3.45Å; S126-F130 PolarHBondContact O-N 3.06Å; L127-F130 PolarHBondContact O-N 2.73Å; F130-Q132 PolarHBondContact O-N 3.43Å; F130-V133 PolarHBondContact O-N 3.28Å; F130-T134 HydrophobicContact CD1-CG2 4.35Å; F130-T134 HydrophobicContact CE1-CG2 3.95Å; F130-T134 HydrophobicContact CE2-CG2 4.38Å; F130-T134 HydrophobicContact CZ-CG2 3.96Å; F130-T134 WeakPolarHBondContact O-CG2 3.43Å; F130-T134 PolarHBondContact O-N 3.42Å; F130-T134 PolarHBondContact O-OG1 3.39Å |
| 131 | A | 85 | Confident | 73.6 | Confident | 43 Ų | 43 | 96.5 Ų | 96.5 | 36% | 0.355 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -55.9 | -49.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L127 K128 I129 V133 T134 T135 | L127-A131 WeakPolarHBondContact O-CB 3.45Å; L127-A131 PolarHBondContact O-N 2.91Å; K128-A131 PolarHBondContact O-N 2.9Å; I129-A131 PolarHBondContact O-N 3.3Å; A131-V133 VanDerWaalsContact C-N 3.33Å; A131-V133 PolarHBondContact O-N 3.04Å; A131-T134 WeakPolarHBondContact CA-OG1 3.45Å; A131-T134 PolarHBondContact O-N 3.42Å; A131-T134 VanDerWaalsContact O-N 3.09Å; A131-T134 PolarHBondContact O-OG1 2.94Å; A131-T135 WeakPolarHBondContact O-CG2 3.28Å; A131-T135 PolarHBondContact O-N 3.42Å; A131-T135 PolarHBondContact O-OG1 3Å |
| 132 | Q | 81.3 | Confident | 72.5 | Confident | 115 Ų | 115 | 96 Ų | 96 | 54% | 0.537 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.2 | -38 | 178.1 | -74.8 | 177 | -35.1 | 0 | 0 | 113.4 | K128 I129 F130 T135 G136 | K128-Q132 WeakPolarHBondContact O-CG 3.39Å; K128-Q132 PolarHBondContact O-N 3.39Å; I129-Q132 PolarHBondContact O-N 2.84Å; F130-Q132 PolarHBondContact O-N 3.43Å; Q132-T135 PolarHBondContact O-OG1 2.94Å; Q132-G136 PolarHBondContact O-N 3.26Å |
| 133 | V | 77.1 | Confident | 71.2 | Confident | 103 Ų | 103 | 93 Ų | 93 | 62% | 0.624 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -68.7 | -37.4 | 175.1 | 172.7 | 0 | 0 | 0 | 0 | 111 | I129 F130 A131 | I129-V133 HydrophobicContact CG2-CG2 4.45Å; I129-V133 WeakPolarHBondContact O-CG2 3.36Å; I129-V133 PolarHBondContact O-N 3.31Å; F130-V133 PolarHBondContact O-N 3.28Å; A131-V133 VanDerWaalsContact C-N 3.33Å; A131-V133 PolarHBondContact O-N 3.04Å |
| 134 | T | 72.8 | Confident | 70.5 | Confident | 77 Ų | 77 | 91.9 Ų | 91.9 | 47% | 0.472 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -73 | -31.9 | 176.4 | 57.5 | 0 | 0 | 0 | 0 | 113.9 | F130 A131 | F130-T134 HydrophobicContact CD1-CG2 4.35Å; F130-T134 HydrophobicContact CE1-CG2 3.95Å; F130-T134 HydrophobicContact CE2-CG2 4.38Å; F130-T134 HydrophobicContact CZ-CG2 3.96Å; F130-T134 WeakPolarHBondContact O-CG2 3.43Å; F130-T134 PolarHBondContact O-N 3.42Å; F130-T134 PolarHBondContact O-OG1 3.39Å; A131-T134 WeakPolarHBondContact CA-OG1 3.45Å; A131-T134 PolarHBondContact O-N 3.42Å; A131-T134 VanDerWaalsContact O-N 3.09Å; A131-T134 PolarHBondContact O-OG1 2.94Å |
| 135 | T | 66.4 | Low | 69.7 | Low | 76 Ų | 76 | 96.4 Ų | 96.4 | 47% | 0.466 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -82.6 | -40.2 | 176.6 | 61.4 | 0 | 0 | 0 | 0 | 112.2 | A131 Q132 A137 A138 | A131-T135 WeakPolarHBondContact O-CG2 3.28Å; A131-T135 PolarHBondContact O-N 3.42Å; A131-T135 PolarHBondContact O-OG1 3Å; Q132-T135 PolarHBondContact O-OG1 2.94Å; T135-A137 PolarHBondContact O-N 3.04Å; T135-A137 VanDerWaalsContact O-N 3.07Å; T135-A138 WeakPolarHBondContact O-CB 3.44Å; T135-A138 PolarHBondContact O-N 3.39Å |
| 136 | G | 55.2 | Low | 68.8 | Low | 24 Ų | 24 | 93.9 Ų | 93.9 | 25% | 0.247 | 56% | 0.561 | C | S | . | * | H | α-helix | trans | -60.3 | -21.2 | 179 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q132 N140 | Q132-G136 PolarHBondContact O-N 3.26Å; G136-N140 PolarHBondContact O-ND2 3.35Å |
| 137 | A | 52.5 | Low | 68.1 | Low | 74 Ų | 74 | 96 Ų | 96 | 61% | 0.612 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -74 | -22.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | T135 | T135-A137 PolarHBondContact O-N 3.04Å; T135-A137 VanDerWaalsContact O-N 3.07Å |
| 138 | A | 49.3 | Very low | 67.5 | Low | 77 Ų | 77 | 95.1 Ų | 95.1 | 64% | 0.636 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -88.3 | -28.7 | -180 | 0 | 0 | 0 | 0 | 0 | 113 | T135 | T135-A138 WeakPolarHBondContact O-CB 3.44Å; T135-A138 PolarHBondContact O-N 3.39Å |
| 139 | E | 52.8 | Low | 67.1 | Low | 134 Ų | 134 | 94.2 Ų | 94.2 | 63% | 0.626 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -92.4 | -13.4 | -174.1 | 52 | -156.8 | 130.6 | 0 | 0 | 114.7 | ||
| 140 | N | 49.9 | Very low | 66.6 | Low | 137 Ų | 137 | 95.7 Ų | 95.7 | 73% | 0.733 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -95.2 | 0.6 | 173.2 | -72 | -78.5 | 0 | 0 | 0 | 114.6 | G136 A142 | G136-N140 PolarHBondContact O-ND2 3.35Å; N140-A142 VanDerWaalsContact C-N 3.34Å |
| 141 | A | 49.4 | Very low | 66.1 | Low | 88 Ų | 88 | 94.7 Ų | 94.7 | 73% | 0.727 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -1.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 142 | A | 52 | Low | 65.6 | Low | 91 Ų | 91 | 99.5 Ų | 99.5 | 75% | 0.752 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.8 | 1.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | N140 S144 | N140-A142 VanDerWaalsContact C-N 3.34Å; A142-S144 PolarHBondContact O-N 2.91Å; A142-S144 VanDerWaalsContact O-N 3.09Å |
| 143 | G | 56.4 | Low | 65.3 | Low | 46 Ų | 46 | 97 Ų | 97 | 47% | 0.474 | 58% | 0.579 | S | S | . | * | trans | -67 | 104 | 167.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 144 | S | 69.1 | Low | 65.1 | Low | 66 Ų | 66 | 96.8 Ų | 96.8 | 46% | 0.462 | 58% | 0.578 | S | S | . | * | trans | -53.9 | 142 | 173.7 | -174.6 | 0 | 0 | 0 | 0 | 110 | A142 Q146 D147 | A142-S144 PolarHBondContact O-N 2.91Å; A142-S144 VanDerWaalsContact O-N 3.09Å; S144-Q146 PolarHBondContact O-N 3.2Å; S144-Q146 PolarHBondContact OG-OE1 3.36Å; S144-D147 VanDerWaalsContact O-CB 3.31Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 3.44Å | ||
| 145 | M | 67.9 | Low | 65.1 | Low | 150 Ų | 150 | 97.6 Ų | 97.6 | 74% | 0.739 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.2 | -22 | -179.5 | -70.1 | -147.3 | -63.4 | 0 | 0 | 112.8 | D147 M149 | M145-D147 VanDerWaalsContact C-N 3.29Å; M145-D147 PolarHBondContact O-N 3.49Å; M145-M149 WeakPolarHBondContact O-CE 3.34Å; M145-M149 WeakPolarHBondContact O-CG 3.46Å; M145-M149 PolarHBondContact O-N 2.98Å; M145-M149 VanDerWaalsContact O-N 3.12Å |
| 146 | Q | 67.7 | Low | 64.8 | Low | 127 Ų | 127 | 96.8 Ų | 96.8 | 59% | 0.593 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -56.9 | -38.5 | 168 | -80.9 | 72.2 | 13.6 | 0 | 0 | 113 | S144 M149 Q150 | S144-Q146 PolarHBondContact O-N 3.2Å; S144-Q146 PolarHBondContact OG-OE1 3.36Å; Q146-M149 PolarHBondContact O-N 3.47Å; Q146-Q150 VanDerWaalsContact O-CB 3.29Å; Q146-Q150 WeakPolarHBondContact O-CB 3.45Å; Q146-Q150 PolarHBondContact O-N 2.95Å |
| 147 | D | 74.5 | Confident | 64.8 | Low | 111 Ų | 111 | 105.2 Ų | 105.2 | 59% | 0.594 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -71.8 | -41.7 | -175.8 | -143.7 | 21.5 | 0 | 0 | 0 | 111 | S144 M145 M149 Q150 E151 | S144-D147 VanDerWaalsContact O-CB 3.31Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 3.44Å; M145-D147 VanDerWaalsContact C-N 3.29Å; M145-D147 PolarHBondContact O-N 3.49Å; D147-M149 PolarHBondContact O-N 3.39Å; D147-Q150 WeakPolarHBondContact O-CB 3.39Å; D147-Q150 PolarHBondContact O-N 2.94Å; D147-E151 PolarHBondContact O-N 3.31Å |
| 148 | V | 77.8 | Confident | 65.4 | Low | 91 Ų | 91 | 105 Ų | 105 | 55% | 0.552 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -64.7 | -38.8 | 173.7 | -177.3 | 0 | 0 | 0 | 0 | 111.6 | F152 | V148-F152 WeakPolarHBondContact O-CB 3.31Å; V148-F152 PolarHBondContact O-N 2.89Å; V148-F152 VanDerWaalsContact O-N 3.07Å |
| 149 | M | 76.7 | Confident | 65.6 | Low | 118 Ų | 118 | 106.6 Ų | 106.6 | 58% | 0.581 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -70 | -34.3 | 174 | -72.7 | -172.7 | -69.4 | 0 | 0 | 112.3 | M145 Q146 D147 A153 | M145-M149 WeakPolarHBondContact O-CE 3.34Å; M145-M149 WeakPolarHBondContact O-CG 3.46Å; M145-M149 PolarHBondContact O-N 2.98Å; M145-M149 VanDerWaalsContact O-N 3.12Å; Q146-M149 PolarHBondContact O-N 3.47Å; D147-M149 PolarHBondContact O-N 3.39Å; M149-A153 WeakPolarHBondContact O-CB 3.46Å; M149-A153 PolarHBondContact O-N 3.49Å |
| 150 | Q | 77.3 | Confident | 65.5 | Low | 121 Ų | 121 | 107.6 Ų | 107.6 | 57% | 0.565 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.8 | -45.4 | 175.3 | -168 | 66.8 | 44.5 | 0 | 0 | 110.9 | Q146 D147 F152 A153 T154 | Q146-Q150 VanDerWaalsContact O-CB 3.29Å; Q146-Q150 WeakPolarHBondContact O-CB 3.45Å; Q146-Q150 PolarHBondContact O-N 2.95Å; D147-Q150 WeakPolarHBondContact O-CB 3.39Å; D147-Q150 PolarHBondContact O-N 2.94Å; Q150-F152 PolarHBondContact O-N 3.43Å; Q150-A153 PolarHBondContact O-N 2.84Å; Q150-T154 WeakPolarHBondContact O-CG2 3.27Å; Q150-T154 PolarHBondContact O-N 3.42Å; Q150-T154 PolarHBondContact O-OG1 2.97Å |
| 151 | E | 77.4 | Confident | 65.5 | Low | 119 Ų | 119 | 108 Ų | 108 | 56% | 0.556 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -57.3 | -48.2 | 174.1 | 179.4 | 175.7 | -158.1 | 0 | 0 | 111 | D147 A153 T154 N155 | D147-E151 PolarHBondContact O-N 3.31Å; E151-A153 VanDerWaalsContact C-N 3.34Å; E151-A153 PolarHBondContact O-N 2.88Å; E151-T154 WeakPolarHBondContact CA-OG1 3.41Å; E151-T154 PolarHBondContact O-N 3.35Å; E151-T154 PolarHBondContact O-OG1 3.04Å; E151-N155 VanDerWaalsContact CG-ND2 3.33Å; E151-N155 WeakPolarHBondContact CG-ND2 3.4Å; E151-N155 PolarHBondContact O-N 3.08Å; E151-N155 PolarHBondContact O-ND2 3.1Å |
| 152 | F | 74.2 | Confident | 65.7 | Low | 144 Ų | 144 | 112.1 Ų | 112.1 | 63% | 0.632 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -58.8 | -43 | 176.9 | -174.8 | -96.8 | 0 | 0 | 0 | 112.5 | V148 Q150 N155 | V148-F152 WeakPolarHBondContact O-CB 3.31Å; V148-F152 PolarHBondContact O-N 2.89Å; V148-F152 VanDerWaalsContact O-N 3.07Å; Q150-F152 PolarHBondContact O-N 3.43Å; F152-N155 PolarHBondContact O-N 3.41Å |
| 153 | A | 74.3 | Confident | 65.1 | Low | 62 Ų | 62 | 110.8 Ų | 110.8 | 51% | 0.512 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -65.6 | -38.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | M149 Q150 E151 | M149-A153 WeakPolarHBondContact O-CB 3.46Å; M149-A153 PolarHBondContact O-N 3.49Å; Q150-A153 PolarHBondContact O-N 2.84Å; E151-A153 VanDerWaalsContact C-N 3.34Å; E151-A153 PolarHBondContact O-N 2.88Å |
| 154 | T | 74.4 | Confident | 64.4 | Low | 99 Ų | 99 | 118.9 Ų | 118.9 | 61% | 0.607 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -73.3 | -23.7 | 178.5 | 53.2 | 0 | 0 | 0 | 0 | 114.3 | Q150 E151 G156 | Q150-T154 WeakPolarHBondContact O-CG2 3.27Å; Q150-T154 PolarHBondContact O-N 3.42Å; Q150-T154 PolarHBondContact O-OG1 2.97Å; E151-T154 WeakPolarHBondContact CA-OG1 3.41Å; E151-T154 PolarHBondContact O-N 3.35Å; E151-T154 PolarHBondContact O-OG1 3.04Å; T154-G156 PolarHBondContact O-N 2.71Å |
| 155 | N | 71.7 | Confident | 63 | Low | 95 Ų | 95 | 122.8 Ų | 122.8 | 51% | 0.508 | 66% | 0.662 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.9 | 3.3 | -179.4 | -82.2 | -53 | 0 | 0 | 0 | 114.5 | E151 F152 Y157 | E151-N155 VanDerWaalsContact CG-ND2 3.33Å; E151-N155 WeakPolarHBondContact CG-ND2 3.4Å; E151-N155 PolarHBondContact O-N 3.08Å; E151-N155 PolarHBondContact O-ND2 3.1Å; F152-N155 PolarHBondContact O-N 3.41Å; N155-Y157 WeakPolarHBondContact O-CD2 3.38Å; N155-Y157 WeakPolarHBondContact O-CE2 3.36Å; N155-Y157 PolarHBondContact O-N 3.23Å |
| 156 | G | 59.8 | Low | 61.5 | Low | 59 Ų | 59 | 121.5 Ų | 121.5 | 61% | 0.608 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 77.1 | 12.4 | 158.9 | 0 | 0 | 0 | 0 | 0 | 117.5 | T154 | T154-G156 PolarHBondContact O-N 2.71Š|
| 157 | Y | 56.3 | Low | 60.2 | Low | 200 Ų | 200 | 126.9 Ų | 126.9 | 78% | 0.784 | 68% | 0.684 | S | S | * | * | trans | -98.3 | 9.6 | 179.5 | -67.9 | -75.6 | 0 | 0 | 0 | 114.8 | N155 S159 | N155-Y157 WeakPolarHBondContact O-CD2 3.38Å; N155-Y157 WeakPolarHBondContact O-CE2 3.36Å; N155-Y157 PolarHBondContact O-N 3.23Å; Y157-S159 PolarHBondContact O-N 2.98Å | ||
| 158 | A | 63.7 | Low | 58.3 | Low | 71 Ų | 71 | 124.9 Ų | 124.9 | 59% | 0.587 | 69% | 0.69 | S | S | * | * | trans | -76 | 117.4 | 169 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 159 | S | 54.4 | Low | 56.4 | Low | 109 Ų | 109 | 126.4 Ų | 126.4 | 76% | 0.762 | 71% | 0.705 | S | S | * | * | trans | -138.4 | 116 | 173.2 | -69.5 | 0 | 0 | 0 | 0 | 109.6 | Y157 D161 | Y157-S159 PolarHBondContact O-N 2.98Å; S159-D161 PolarHBondContact O-N 2.88Å | ||
| 160 | D | 51.5 | Low | 54.6 | Low | 155 Ų | 155 | 125.3 Ų | 125.3 | 83% | 0.829 | 71% | 0.714 | S | S | * | * | trans | -88.5 | 85.7 | -179.7 | -23.9 | -73.1 | 0 | 0 | 0 | 109.1 | L162 | D160-L162 VanDerWaalsContact C-N 3.29Å; D160-L162 PolarHBondContact O-N 2.9Å | ||
| 161 | D | 48.8 | Very low | 53 | Low | 147 Ų | 147 | 125.4 Ų | 125.4 | 79% | 0.786 | 73% | 0.725 | S | S | * | * | trans | -76.8 | 83.6 | 176.7 | -154.9 | -48 | 0 | 0 | 0 | 110.8 | S159 | S159-D161 PolarHBondContact O-N 2.88Š| ||
| 162 | L | 53.1 | Low | 51.3 | Low | 174 Ų | 174 | 125.4 Ų | 125.4 | 91% | 0.911 | 74% | 0.736 | S | S | * | * | trans | -118.3 | 46.7 | 172.4 | -148.7 | 77.8 | 0 | 0 | 0 | 110.7 | D160 | D160-L162 VanDerWaalsContact C-N 3.29Å; D160-L162 PolarHBondContact O-N 2.9Å | ||
| 163 | G | 39.4 | Very low | 49.9 | Very low | 63 Ų | 63 | 127.5 Ų | 127.5 | 65% | 0.649 | 75% | 0.748 | S | S | * | * | trans | -143.3 | 46.8 | -168.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | M165 | G163-M165 PolarHBondContact O-N 3.37Š| ||
| 164 | R | 42.1 | Very low | 47.9 | Very low | 215 Ų | 215 | 130.9 Ų | 130.9 | 81% | 0.811 | 76% | 0.762 | S | S | * | * | trans | -63.9 | 134 | 179.5 | -160.9 | -167.7 | 169.4 | -163.1 | -3.2 | 111.9 | ||||
| 165 | M | 41.1 | Very low | 46.1 | Very low | 148 Ų | 148 | 134.3 Ų | 134.3 | 73% | 0.729 | 77% | 0.771 | S | S | * | * | trans | 87 | 105 | 163.5 | -43.3 | -173.3 | -144.2 | 0 | 0 | 118.7 | G163 | G163-M165 PolarHBondContact O-N 3.37Š| ||
| 166 | S | 35.2 | Very low | 44.7 | Very low | 123 Ų | 123 | 138 Ų | 138 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | -155.9 | 142.1 | 115.4 | -152.5 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 167 | Y | 41.3 | Very low | 43.8 | Very low | 240 Ų | 240 | 140.7 Ų | 140.7 | 94% | 0.941 | 79% | 0.794 | S | S | * | * | trans | -84.3 | 137.7 | 176.9 | -87.9 | -103.8 | 0 | 0 | 0 | 110.4 | ||||
| 168 | G | 33.8 | Very low | 43 | Very low | 69 Ų | 69 | 137.3 Ų | 137.3 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | 170.6 | 92 | 169.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 169 | S | 37 | Very low | 41.5 | Very low | 124 Ų | 124 | 142.9 Ų | 142.9 | 87% | 0.867 | 81% | 0.81 | S | S | * | * | trans | 56.3 | 130.1 | 138.2 | -53.6 | 0 | 0 | 0 | 0 | 123 | ||||
| 170 | A | 39.7 | Very low | 40.5 | Very low | 94 Ų | 94 | 146.2 Ų | 146.2 | 78% | 0.777 | 81% | 0.814 | S | S | * | * | trans | 78.4 | 135.6 | 156.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 171 | P | 44.3 | Very low | 39.7 | Very low | 123 Ų | 123 | 147.3 Ų | 147.3 | 80% | 0.799 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 135.6 | 174.5 | 34.8 | -31.8 | 0 | 0 | 0 | 112.3 | ||
| 172 | P | 41.8 | Very low | 39 | Very low | 120 Ų | 120 | 148.6 Ų | 148.6 | 78% | 0.779 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 135.1 | 169 | 32 | -31 | 0 | 0 | 0 | 111.9 | ||
| 173 | Q | 43.6 | Very low | 38 | Very low | 188 Ų | 188 | 148.4 Ų | 148.4 | 88% | 0.879 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 138.5 | 165.1 | -69.6 | -92.1 | -66.8 | 0 | 0 | 110 | ||
| 174 | V | 33.4 | Very low | 37.7 | Very low | 133 Ų | 133 | 154.5 Ų | 154.5 | 81% | 0.806 | 82% | 0.821 | S | S | * | * | trans | -139.4 | 115.8 | 162.3 | -174.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 175 | Q | 36.8 | Very low | 37.3 | Very low | 171 Ų | 171 | 152.6 Ų | 152.6 | 80% | 0.799 | 82% | 0.821 | S | S | * | * | trans | -5.8 | 133.3 | 157.9 | -114.8 | 68.8 | -2.6 | 0 | 0 | 119.9 | ||||
| 176 | M | 40.8 | Very low | 36.9 | Very low | 172 Ų | 172 | 154.7 Ų | 154.7 | 85% | 0.847 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 153.7 | 150.9 | -64.7 | -148.8 | -52.6 | 0 | 0 | 111 | ||
| 177 | P | 42.6 | Very low | 36.6 | Very low | 116 Ų | 116 | 152.6 Ų | 152.6 | 75% | 0.753 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 158.1 | 176.4 | 30.2 | -35.2 | 0 | 0 | 0 | 113 | ||
| 178 | P | 39.6 | Very low | 36.5 | Very low | 129 Ų | 129 | 149.8 Ų | 149.8 | 84% | 0.838 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 138.7 | -167.7 | 31.1 | -35.6 | 0 | 0 | 0 | 114.1 | ||
| 179 | Q | 31.7 | Very low | 36.4 | Very low | 188 Ų | 188 | 154.9 Ų | 154.9 | 88% | 0.879 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 132.1 | 162.7 | -69.4 | -154.4 | -41.1 | 0 | 0 | 110.8 | Q181 | Q179-Q181 PolarHBondContact O-N 2.99Š|
| 180 | Q | 33.7 | Very low | 36.3 | Very low | 179 Ų | 179 | 156.3 Ų | 156.3 | 84% | 0.836 | 83% | 0.829 | S | S | * | * | trans | -78 | 112.5 | 168.2 | -76.1 | -174.4 | -19 | 0 | 0 | 110.4 | ||||
| 181 | Q | 33.1 | Very low | 36.4 | Very low | 177 Ų | 177 | 157.6 Ų | 157.6 | 83% | 0.827 | 83% | 0.83 | S | S | * | * | trans | -70.8 | 124.8 | 167.5 | -67.8 | 176 | -39.2 | 0 | 0 | 109.8 | Q179 | Q179-Q181 PolarHBondContact O-N 2.99Š| ||
| 182 | H | 34.8 | Very low | 35.8 | Very low | 174 Ų | 174 | 159.6 Ų | 159.6 | 81% | 0.806 | 83% | 0.833 | S | S | * | * | trans | -99.7 | 110.9 | 157.7 | -86.5 | 81.6 | 0 | 0 | 0 | 108.8 | ||||
| 183 | Q | 33.5 | Very low | 35.1 | Very low | 170 Ų | 170 | 157.4 Ų | 157.4 | 79% | 0.794 | 83% | 0.832 | S | S | * | * | trans | -88.3 | 116.3 | -174.9 | -167.4 | 167.3 | 68 | 0 | 0 | 109.3 | ||||
| 184 | Q | 32.3 | Very low | 34.5 | Very low | 191 Ų | 191 | 160.5 Ų | 160.5 | 89% | 0.893 | 84% | 0.836 | S | S | * | * | trans | -88.4 | 113.4 | 176.8 | -171.3 | 176.5 | 91.6 | 0 | 0 | 109 | ||||
| 185 | Q | 33.6 | Very low | 34.4 | Very low | 176 Ų | 176 | 161.4 Ų | 161.4 | 82% | 0.822 | 84% | 0.836 | S | S | * | * | trans | -121.8 | 137.3 | 174.7 | -165.7 | 165.9 | 74.2 | 0 | 0 | 110.1 | ||||
| 186 | Q | 33.3 | Very low | 35.2 | Very low | 191 Ų | 191 | 159 Ų | 159 | 89% | 0.893 | 84% | 0.835 | S | S | * | * | trans | -84 | 142 | -172.3 | -61.2 | 172.3 | -1.7 | 0 | 0 | 111.1 | ||||
| 187 | G | 27.9 | Very low | 34.7 | Very low | 80 Ų | 80 | 154.9 Ų | 154.9 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | -157.7 | 123.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 188 | L | 39.3 | Very low | 34.1 | Very low | 180 Ų | 180 | 157.9 Ų | 157.9 | 94% | 0.942 | 83% | 0.833 | S | S | * | * | trans | -83.6 | 127.1 | 179.9 | -77.9 | 154.4 | 0 | 0 | 0 | 111.5 | ||||
| 189 | H | 31.3 | Very low | 33.9 | Very low | 176 Ų | 176 | 159.6 Ų | 159.6 | 82% | 0.815 | 83% | 0.834 | S | S | * | * | trans | -162.9 | 150.1 | 137.9 | 48.2 | -147 | 0 | 0 | 0 | 113.7 | ||||
| 190 | L | 35.8 | Very low | 33.9 | Very low | 154 Ų | 154 | 159.1 Ų | 159.1 | 81% | 0.806 | 83% | 0.832 | S | S | * | * | trans | -95.1 | 152.4 | 157.5 | -107.4 | 70.1 | 0 | 0 | 0 | 107.9 | ||||
| 191 | P | 40.4 | Very low | 33.8 | Very low | 121 Ų | 121 | 156 Ų | 156 | 79% | 0.786 | 83% | 0.825 | S | S | * | * | -147.8 | 174 | 98.6 | 36.8 | -19.3 | 0 | 0 | 0 | 116.3 | |||||
| 192 | L | 31.8 | Very low | 33.8 | Very low | 165 Ų | 165 | 155.3 Ų | 155.3 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -62.3 | 137.5 | 178.5 | -87.4 | 52.1 | 0 | 0 | 0 | 114.8 | ||||
| 193 | G | 27.7 | Very low | 33.7 | Very low | 74 Ų | 74 | 150.9 Ų | 150.9 | 76% | 0.763 | 83% | 0.828 | S | S | * | * | 104.5 | 147.7 | 112.9 | 0 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 194 | R | 31.3 | Very low | 33.6 | Very low | 254 Ų | 254 | 146.2 Ų | 146.2 | 96% | 0.958 | 83% | 0.825 | S | S | * | * | trans | 95.7 | 120.5 | 154.7 | -140.2 | 170.5 | -167.6 | 168 | 2.1 | 118.6 | ||||
| 195 | N | 30.2 | Very low | 34.1 | Very low | 152 Ų | 152 | 145.3 Ų | 145.3 | 81% | 0.813 | 83% | 0.827 | S | S | * | * | trans | -77.6 | -171.9 | 170.6 | -61.1 | -44.2 | 0 | 0 | 0 | 111.6 | ||||
| 196 | P | 54.5 | Low | 34.6 | Very low | 120 Ų | 120 | 144.7 Ų | 144.7 | 78% | 0.779 | 83% | 0.828 | S | S | * | * | -128.7 | 170.7 | -71 | 39.2 | -24.6 | 0 | 0 | 0 | 111.5 | |||||
| 197 | A | 30.1 | Very low | 35.3 | Very low | 86 Ų | 86 | 143.8 Ų | 143.8 | 71% | 0.711 | 83% | 0.826 | S | S | * | * | trans | 174.3 | 165.7 | 146.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 198 | Q | 31.3 | Very low | 36.4 | Very low | 179 Ų | 179 | 145.7 Ų | 145.7 | 84% | 0.836 | 82% | 0.824 | S | S | * | * | trans | 82 | 105.5 | 161.4 | -56.3 | -57.5 | -75 | 0 | 0 | 118.5 | ||||
| 199 | L | 34.6 | Very low | 37.1 | Very low | 165 Ų | 165 | 143.2 Ų | 143.2 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | trans | -78.9 | 139.7 | 153.8 | -73.7 | 72.4 | 0 | 0 | 0 | 109.1 | ||||
| 200 | Q | 32.5 | Very low | 38.5 | Very low | 178 Ų | 178 | 138.8 Ų | 138.8 | 83% | 0.832 | 80% | 0.797 | S | S | * | * | -170 | 120 | 120 | -110.1 | 174.9 | -10.1 | 0 | 0 | 113.7 | |||||
| 201 | T | 31.4 | Very low | 39.5 | Very low | 112 Ų | 112 | 139.1 Ų | 139.1 | 69% | 0.687 | 80% | 0.799 | S | S | * | * | trans | 32.3 | 123.6 | 138.1 | 58.9 | 0 | 0 | 0 | 0 | 119 | ||||
| 202 | N | 33 | Very low | 40.1 | Very low | 164 Ų | 164 | 136.2 Ų | 136.2 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | -168.2 | 149.8 | 72.9 | -122.2 | -26.8 | 0 | 0 | 0 | 115.3 | |||||
| 203 | G | 31.2 | Very low | 41.3 | Very low | 80 Ų | 80 | 130.7 Ų | 130.7 | 83% | 0.825 | 76% | 0.759 | S | S | * | * | trans | 76.8 | 74.9 | 139.4 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 204 | G | 31.6 | Very low | 42.7 | Very low | 72 Ų | 72 | 133.4 Ų | 133.4 | 74% | 0.742 | 75% | 0.751 | S | S | * | * | trans | -176.3 | 108.5 | 163 | 0 | 0 | 0 | 0 | 0 | 113.4 | L206 | G204-L206 PolarHBondContact O-N 3.11Š| ||
| 205 | N | 44.1 | Very low | 44.1 | Very low | 172 Ų | 172 | 128.5 Ų | 128.5 | 92% | 0.92 | 73% | 0.733 | S | S | * | * | trans | -69.4 | 101 | -176.6 | -84.3 | -43.8 | 0 | 0 | 0 | 112.4 | ||||
| 206 | L | 43.8 | Very low | 45.6 | Very low | 164 Ų | 164 | 125.4 Ų | 125.4 | 86% | 0.859 | 72% | 0.716 | S | S | * | * | trans | -131.1 | 114.4 | 160.4 | -73.1 | 171.7 | 0 | 0 | 0 | 108.4 | G204 | G204-L206 PolarHBondContact O-N 3.11Š| ||
| 207 | M | 48.3 | Very low | 45.9 | Very low | 172 Ų | 172 | 123 Ų | 123 | 85% | 0.847 | 70% | 0.696 | S | S | * | * | trans | -65.9 | 130.6 | 177.7 | -62.4 | -71.7 | -96.3 | 0 | 0 | 109.2 | I209 | M207-I209 PolarHBondContact O-N 2.76Å; M207-I209 VanDerWaalsContact O-N 3.15Å | ||
| 208 | P | 50 | Low | 47.9 | Very low | 119 Ų | 119 | 122.8 Ų | 122.8 | 77% | 0.773 | 68% | 0.683 | S | S | * | * | trans | -68 | 116 | 174.6 | 27.4 | -32.3 | 0 | 0 | 0 | 109.2 | ||||
| 209 | I | 54.7 | Low | 49.9 | Very low | 128 Ų | 128 | 120.6 Ų | 120.6 | 66% | 0.656 | 67% | 0.668 | S | S | * | * | trans | -58.7 | 124.4 | 171.4 | -62.7 | 175.1 | 0 | 0 | 0 | 107.5 | M207 T213 | M207-I209 PolarHBondContact O-N 2.76Å; M207-I209 VanDerWaalsContact O-N 3.15Å; I209-T213 VanDerWaalsContact CG2-CB 3.46Å; I209-T213 HydrophobicContact CG2-CG2 4.15Å; I209-T213 WeakPolarHBondContact CG2-OG1 3.19Å | ||
| 210 | P | 60.3 | Low | 51.7 | Low | 83 Ų | 83 | 121.3 Ų | 121.3 | 54% | 0.539 | 66% | 0.659 | S | S | . | * | trans | -63.4 | 146.6 | -177.3 | 24.9 | -32.3 | 0 | 0 | 0 | 110.5 | A212 T213 | P210-A212 PolarHBondContact O-N 3.41Å; P210-T213 PolarHBondContact O-N 3.33Å; P210-T213 PolarHBondContact O-OG1 3.44Å | ||
| 211 | L | 56.6 | Low | 53.5 | Low | 161 Ų | 161 | 118.2 Ų | 118.2 | 84% | 0.843 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -54.4 | -25 | -179.4 | -76.2 | 108.3 | 0 | 0 | 0 | 113.3 | T213 H214 | L211-T213 PolarHBondContact O-N 3.23Å; L211-H214 PolarHBondContact O-N 3.48Å; L211-H214 VanDerWaalsContact O-N 3.14Å |
| 212 | A | 54.3 | Low | 55.5 | Low | 61 Ų | 61 | 118.9 Ų | 118.9 | 50% | 0.504 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -60 | -17 | 171.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | P210 W215 | P210-A212 PolarHBondContact O-N 3.41Å; A212-W215 PolarHBondContact O-NE1 2.96Å |
| 213 | T | 54.9 | Low | 57.1 | Low | 49 Ų | 49 | 115.3 Ų | 115.3 | 30% | 0.301 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -95.4 | -22.8 | 175 | -27.5 | 0 | 0 | 0 | 0 | 112.3 | I209 P210 L211 L216 N217 | I209-T213 VanDerWaalsContact CG2-CB 3.46Å; I209-T213 HydrophobicContact CG2-CG2 4.15Å; I209-T213 WeakPolarHBondContact CG2-OG1 3.19Å; P210-T213 PolarHBondContact O-N 3.33Å; P210-T213 PolarHBondContact O-OG1 3.44Å; L211-T213 PolarHBondContact O-N 3.23Å; T213-L216 PolarHBondContact O-N 2.88Å; T213-N217 PolarHBondContact O-N 3.14Å; T213-N217 VanDerWaalsContact O-N 3.13Å; T213-N217 PolarHBondContact O-ND2 2.9Å |
| 214 | H | 58.2 | Low | 59 | Low | 130 Ų | 130 | 116 Ų | 116 | 60% | 0.602 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.3 | -36.9 | -179.1 | -167.6 | 81.7 | 0 | 0 | 0 | 112.2 | L211 N218 | L211-H214 PolarHBondContact O-N 3.48Å; L211-H214 VanDerWaalsContact O-N 3.14Å; H214-N218 PolarHBondContact CD2-ND2 3.4Å; H214-N218 VanDerWaalsContact CD2-ND2 3.28Å; H214-N218 PolarHBondContact NE2-ND2 3.2Å; H214-N218 VanDerWaalsContact NE2-ND2 3.12Å; H214-N218 WeakPolarHBondContact O-CB 3.39Å; H214-N218 PolarHBondContact O-N 2.98Å; H214-N218 PolarHBondContact O-ND2 3.38Å |
| 215 | W | 60.1 | Low | 60.9 | Low | 152 Ų | 152 | 116.8 Ų | 116.8 | 58% | 0.576 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.2 | -38.1 | 174.6 | 84.6 | -87.6 | 0 | 0 | 0 | 112.1 | A212 N218 Y219 | A212-W215 PolarHBondContact O-NE1 2.96Å; W215-N218 PolarHBondContact O-N 2.95Å; W215-Y219 VanDerWaalsContact O-CB 3.28Å; W215-Y219 WeakPolarHBondContact O-CB 3.44Å; W215-Y219 PolarHBondContact O-N 3.39Å |
| 216 | L | 61.5 | Low | 62.3 | Low | 87 Ų | 87 | 111.9 Ų | 111.9 | 46% | 0.455 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.5 | -41.3 | 176.8 | -81.5 | 169.7 | 0 | 0 | 0 | 111.9 | T213 Y219 R220 | T213-L216 PolarHBondContact O-N 2.88Å; L216-Y219 PolarHBondContact O-N 2.87Å; L216-R220 WeakPolarHBondContact O-CB 3.4Å; L216-R220 PolarHBondContact O-N 3.46Å |
| 217 | N | 61.8 | Low | 63.3 | Low | 70 Ų | 70 | 112.9 Ų | 112.9 | 37% | 0.374 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.8 | -48.6 | 175.5 | -71.4 | -24 | 0 | 0 | 0 | 111.5 | T213 Y219 R220 E221 | T213-N217 PolarHBondContact O-N 3.14Å; T213-N217 VanDerWaalsContact O-N 3.13Å; T213-N217 PolarHBondContact O-ND2 2.9Å; N217-Y219 VanDerWaalsContact C-N 3.27Å; N217-Y219 PolarHBondContact O-N 3.35Å; N217-R220 WeakPolarHBondContact O-CB 3.38Å; N217-R220 PolarHBondContact O-N 3.46Å; N217-R220 VanDerWaalsContact O-N 3.11Å; N217-E221 WeakPolarHBondContact O-CG 3.4Å; N217-E221 PolarHBondContact O-N 2.89Å |
| 218 | N | 70.8 | Confident | 64.2 | Low | 81 Ų | 81 | 112.7 Ų | 112.7 | 43% | 0.433 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -53.7 | -43.8 | 173.7 | -91.4 | -97.3 | 0 | 0 | 0 | 112 | H214 W215 E221 H222 | H214-N218 PolarHBondContact CD2-ND2 3.4Å; H214-N218 VanDerWaalsContact CD2-ND2 3.28Å; H214-N218 PolarHBondContact NE2-ND2 3.2Å; H214-N218 VanDerWaalsContact NE2-ND2 3.12Å; H214-N218 WeakPolarHBondContact O-CB 3.39Å; H214-N218 PolarHBondContact O-N 2.98Å; H214-N218 PolarHBondContact O-ND2 3.38Å; W215-N218 PolarHBondContact O-N 2.95Å; N218-E221 PolarHBondContact O-N 2.86Å; N218-H222 VanDerWaalsContact O-CB 3.31Å; N218-H222 WeakPolarHBondContact O-CB 3.43Å; N218-H222 PolarHBondContact O-N 3.46Å |
| 219 | Y | 73.8 | Confident | 64.7 | Low | 133 Ų | 133 | 112.9 Ų | 112.9 | 52% | 0.522 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.3 | -41.7 | 179.3 | -171 | -104.4 | 0 | 0 | 0 | 112.1 | W215 L216 N217 E221 H222 L223 | W215-Y219 VanDerWaalsContact O-CB 3.28Å; W215-Y219 WeakPolarHBondContact O-CB 3.44Å; W215-Y219 PolarHBondContact O-N 3.39Å; L216-Y219 PolarHBondContact O-N 2.87Å; N217-Y219 VanDerWaalsContact C-N 3.27Å; N217-Y219 PolarHBondContact O-N 3.35Å; Y219-E221 VanDerWaalsContact C-N 3.35Å; Y219-E221 PolarHBondContact O-N 3.25Å; Y219-H222 PolarHBondContact O-N 3.11Å; Y219-L223 HydrophobicContact CD1-CD1 4.01Å; Y219-L223 HydrophobicContact CD1-CG 4.48Å; Y219-L223 HydrophobicContact CE1-CD1 3.54Å; Y219-L223 HydrophobicContact CE1-CG 4.18Å; Y219-L223 WeakPolarHBondContact O-CG 3.28Å; Y219-L223 PolarHBondContact O-N 3.46Å |
| 220 | R | 72.1 | Confident | 64.7 | Low | 180 Ų | 180 | 113.5 Ų | 113.5 | 68% | 0.679 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.8 | -40.6 | 175.6 | -126.8 | 174.5 | -178 | 151.4 | 0.2 | 112.3 | L216 N217 N224 | L216-R220 WeakPolarHBondContact O-CB 3.4Å; L216-R220 PolarHBondContact O-N 3.46Å; N217-R220 WeakPolarHBondContact O-CB 3.38Å; N217-R220 PolarHBondContact O-N 3.46Å; N217-R220 VanDerWaalsContact O-N 3.11Å; R220-N224 PolarHBondContact O-N 2.95Å; R220-N224 VanDerWaalsContact O-N 3.16Å; R220-N224 PolarHBondContact O-ND2 3.04Å |
| 221 | E | 71.5 | Confident | 64.4 | Low | 113 Ų | 113 | 112.7 Ų | 112.7 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -68.8 | -41.9 | 176.4 | -70.8 | 163.1 | -150 | 0 | 0 | 111 | N217 N218 Y219 L223 N224 N225 | N217-E221 WeakPolarHBondContact O-CG 3.4Å; N217-E221 PolarHBondContact O-N 2.89Å; N218-E221 PolarHBondContact O-N 2.86Å; Y219-E221 VanDerWaalsContact C-N 3.35Å; Y219-E221 PolarHBondContact O-N 3.25Å; E221-L223 PolarHBondContact O-N 2.99Å; E221-N224 PolarHBondContact O-N 3.28Å; E221-N225 PolarHBondContact O-N 2.94Å; E221-N225 PolarHBondContact O-ND2 2.9Å; E221-N225 VanDerWaalsContact O-ND2 3.14Å |
| 222 | H | 72.8 | Confident | 64.2 | Low | 125 Ų | 125 | 114.7 Ų | 114.7 | 58% | 0.579 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.1 | -45.2 | 176.7 | -158.5 | 85.4 | 0 | 0 | 0 | 112 | N218 Y219 N224 N225 V226 | N218-H222 VanDerWaalsContact O-CB 3.31Å; N218-H222 WeakPolarHBondContact O-CB 3.43Å; N218-H222 PolarHBondContact O-N 3.46Å; Y219-H222 PolarHBondContact O-N 3.11Å; H222-N224 PolarHBondContact O-N 3.33Å; H222-N225 PolarHBondContact O-N 3.46Å; H222-V226 WeakPolarHBondContact O-CG2 3.46Å; H222-V226 PolarHBondContact O-N 3.25Å |
| 223 | L | 66.9 | Low | 63.8 | Low | 90 Ų | 90 | 118.4 Ų | 118.4 | 47% | 0.471 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.3 | -39 | 175.2 | -69.8 | -179.1 | 0 | 0 | 0 | 112.7 | Y219 E221 V226 W227 | Y219-L223 HydrophobicContact CD1-CD1 4.01Å; Y219-L223 HydrophobicContact CD1-CG 4.48Å; Y219-L223 HydrophobicContact CE1-CD1 3.54Å; Y219-L223 HydrophobicContact CE1-CG 4.18Å; Y219-L223 WeakPolarHBondContact O-CG 3.28Å; Y219-L223 PolarHBondContact O-N 3.46Å; E221-L223 PolarHBondContact O-N 2.99Å; L223-V226 PolarHBondContact O-N 3.16Å; L223-W227 WeakPolarHBondContact O-CB 3.3Å; L223-W227 PolarHBondContact O-N 3.47Å |
| 224 | N | 70.8 | Confident | 63.1 | Low | 93 Ų | 93 | 121 Ų | 121 | 50% | 0.497 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.7 | -39.8 | 174.2 | -87.3 | -81.8 | 0 | 0 | 0 | 112.1 | R220 E221 H222 W227 R228 | R220-N224 PolarHBondContact O-N 2.95Å; R220-N224 VanDerWaalsContact O-N 3.16Å; R220-N224 PolarHBondContact O-ND2 3.04Å; E221-N224 PolarHBondContact O-N 3.28Å; H222-N224 PolarHBondContact O-N 3.33Å; N224-W227 PolarHBondContact O-N 3.49Å; N224-R228 WeakPolarHBondContact O-CB 3.45Å; N224-R228 VanDerWaalsContact O-CG 3.26Å; N224-R228 WeakPolarHBondContact O-CG 3.45Å; N224-R228 PolarHBondContact O-N 2.99Å |
| 225 | N | 71.7 | Confident | 62.6 | Low | 89 Ų | 89 | 119.9 Ų | 119.9 | 48% | 0.476 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -66.5 | -41.6 | 176.6 | -73.4 | -38.2 | 0 | 0 | 0 | 112 | E221 H222 R228 N229 | E221-N225 PolarHBondContact O-N 2.94Å; E221-N225 PolarHBondContact O-ND2 2.9Å; E221-N225 VanDerWaalsContact O-ND2 3.14Å; H222-N225 PolarHBondContact O-N 3.46Å; N225-R228 PolarHBondContact O-N 2.88Å; N225-N229 WeakPolarHBondContact O-CB 3.26Å; N225-N229 VanDerWaalsContact O-CG 3.27Å; N225-N229 PolarHBondContact O-N 3.37Å |
| 226 | V | 73.6 | Confident | 61.8 | Low | 70 Ų | 70 | 116.5 Ų | 116.5 | 42% | 0.424 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -61.5 | -44.5 | 173 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | H222 L223 N229 M230 | H222-V226 WeakPolarHBondContact O-CG2 3.46Å; H222-V226 PolarHBondContact O-N 3.25Å; L223-V226 PolarHBondContact O-N 3.16Å; V226-N229 PolarHBondContact O-N 3.48Å; V226-M230 WeakPolarHBondContact O-CB 3.4Å; V226-M230 PolarHBondContact O-N 3.39Å |
| 227 | W | 64.5 | Low | 61.1 | Low | 184 Ų | 184 | 118 Ų | 118 | 70% | 0.697 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.7 | -39.1 | 179.1 | -171.7 | 83.9 | 0 | 0 | 0 | 113.1 | L223 N224 M230 S231 | L223-W227 WeakPolarHBondContact O-CB 3.3Å; L223-W227 PolarHBondContact O-N 3.47Å; N224-W227 PolarHBondContact O-N 3.49Å; W227-M230 PolarHBondContact O-N 3.34Å; W227-S231 PolarHBondContact O-N 2.91Å; W227-S231 PolarHBondContact O-OG 2.99Å |
| 228 | R | 66.8 | Low | 60.4 | Low | 168 Ų | 168 | 122.6 Ų | 122.6 | 63% | 0.634 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -68.3 | -34.2 | 174.5 | -72 | 175.9 | 112.7 | -113.8 | -0.3 | 112.9 | N224 N225 S231 | N224-R228 WeakPolarHBondContact O-CB 3.45Å; N224-R228 VanDerWaalsContact O-CG 3.26Å; N224-R228 WeakPolarHBondContact O-CG 3.45Å; N224-R228 PolarHBondContact O-N 2.99Å; N225-R228 PolarHBondContact O-N 2.88Å; R228-S231 WeakPolarHBondContact CA-OG 3.43Å; R228-S231 PolarHBondContact O-OG 2.82Å; R228-S231 VanDerWaalsContact O-OG 3.11Å |
| 229 | N | 60.8 | Low | 58.9 | Low | 124 Ų | 124 | 125.1 Ų | 125.1 | 66% | 0.663 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -77.1 | -32.8 | 175.5 | -70.6 | -10.7 | 0 | 0 | 0 | 112.4 | N225 V226 S231 | N225-N229 WeakPolarHBondContact O-CB 3.26Å; N225-N229 VanDerWaalsContact O-CG 3.27Å; N225-N229 PolarHBondContact O-N 3.37Å; V226-N229 PolarHBondContact O-N 3.48Å; N229-S231 VanDerWaalsContact C-N 3.26Å; N229-S231 PolarHBondContact O-N 2.96Å |
| 230 | M | 56.1 | Low | 57.3 | Low | 140 Ų | 140 | 128.6 Ų | 128.6 | 69% | 0.69 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -71.7 | -19.9 | 176.3 | -160.1 | 72.7 | 80.8 | 0 | 0 | 113 | V226 W227 | V226-M230 WeakPolarHBondContact O-CB 3.4Å; V226-M230 PolarHBondContact O-N 3.39Å; W227-M230 PolarHBondContact O-N 3.34Å |
| 231 | S | 52.6 | Low | 55.6 | Low | 67 Ų | 67 | 123.6 Ų | 123.6 | 47% | 0.469 | 67% | 0.673 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.7 | 0 | -179.4 | 40.8 | 0 | 0 | 0 | 0 | 114.7 | W227 R228 N229 | W227-S231 PolarHBondContact O-N 2.91Å; W227-S231 PolarHBondContact O-OG 2.99Å; R228-S231 WeakPolarHBondContact CA-OG 3.43Å; R228-S231 PolarHBondContact O-OG 2.82Å; R228-S231 VanDerWaalsContact O-OG 3.11Å; N229-S231 VanDerWaalsContact C-N 3.26Å; N229-S231 PolarHBondContact O-N 2.96Å |
| 232 | Y | 52.4 | Low | 54 | Low | 203 Ų | 203 | 126.4 Ų | 126.4 | 80% | 0.796 | 69% | 0.69 | S | S | * | * | trans | -131.9 | 70.9 | 175 | -96.7 | -90 | 0 | 0 | 0 | 112.2 | P234 | Y232-P234 WeakPolarHBondContact O-CD 3.31Š| ||
| 233 | I | 46.2 | Very low | 52.2 | Low | 138 Ų | 138 | 129.1 Ų | 129.1 | 71% | 0.708 | 70% | 0.704 | S | S | * | * | trans | -106 | 98.4 | 157 | -58.2 | 177.1 | 0 | 0 | 0 | 107.7 | A235 | I233-A235 PolarHBondContact O-N 2.91Š| ||
| 234 | P | 41.2 | Very low | 50.6 | Low | 104 Ų | 104 | 129.5 Ų | 129.5 | 68% | 0.675 | 72% | 0.72 | S | S | * | * | trans | -71.5 | 122.6 | 165.3 | 29 | -29.4 | 0 | 0 | 0 | 108.4 | Y232 A236 | Y232-P234 WeakPolarHBondContact O-CD 3.31Å; P234-A236 PolarHBondContact O-N 3.43Å | ||
| 235 | A | 46.3 | Very low | 49 | Very low | 106 Ų | 106 | 133.5 Ų | 133.5 | 88% | 0.876 | 74% | 0.735 | S | S | * | * | trans | -69 | 99.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | I233 | I233-A235 PolarHBondContact O-N 2.91Š| ||
| 236 | A | 43.4 | Very low | 47.1 | Very low | 81 Ų | 81 | 135.7 Ų | 135.7 | 67% | 0.669 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -100.6 | 141.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | P234 | P234-A236 PolarHBondContact O-N 3.43Š|
| 237 | P | 48.1 | Very low | 45.1 | Very low | 120 Ų | 120 | 137.2 Ų | 137.2 | 78% | 0.779 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 149.8 | -179.1 | 31.6 | -35.1 | 0 | 0 | 0 | 112.2 | T239 | P237-T239 PolarHBondContact O-N 3.46Š|
| 238 | N | 46.5 | Very low | 43.8 | Very low | 165 Ų | 165 | 132.8 Ų | 132.8 | 88% | 0.882 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 116.6 | 179.3 | -65.3 | -59.6 | 0 | 0 | 0 | 112.1 | ||
| 239 | T | 39.5 | Very low | 42.1 | Very low | 135 Ų | 135 | 132 Ų | 132 | 83% | 0.828 | 79% | 0.788 | S | S | * | * | trans | -141.3 | 118.4 | 157 | 47.1 | 0 | 0 | 0 | 0 | 109.9 | P237 | P237-T239 PolarHBondContact O-N 3.46Š| ||
| 240 | M | 40.7 | Very low | 40.7 | Very low | 205 Ų | 205 | 132.3 Ų | 132.3 | 100% | 1.01 | 80% | 0.795 | S | S | * | * | trans | -79.6 | 141.3 | 172.1 | -66.6 | -174.5 | 174.2 | 0 | 0 | 110.7 | ||||
| 241 | G | 35.8 | Very low | 39.5 | Very low | 75 Ų | 75 | 130.2 Ų | 130.2 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | -169.9 | 137 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 242 | L | 36.6 | Very low | 38.7 | Very low | 172 Ų | 172 | 133.3 Ų | 133.3 | 90% | 0.901 | 81% | 0.81 | S | S | * | * | trans | -75.3 | 140 | -169.5 | -80.6 | 80.9 | 0 | 0 | 0 | 114.5 | ||||
| 243 | Q | 35.9 | Very low | 37.8 | Very low | 183 Ų | 183 | 130.8 Ų | 130.8 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | trans | 23.5 | 118.5 | 130.2 | -172.4 | 146.4 | -12.3 | 0 | 0 | 120.6 | ||||
| 244 | A | 33.8 | Very low | 37.2 | Very low | 98 Ų | 98 | 132 Ų | 132 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | -170.7 | 154.2 | 124.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 245 | Q | 37.2 | Very low | 36.7 | Very low | 176 Ų | 176 | 130.3 Ų | 130.3 | 82% | 0.822 | 82% | 0.819 | S | S | * | * | trans | -90.2 | 152.1 | 174.4 | -61 | 160.4 | -12.5 | 0 | 0 | 110.6 | ||||
| 246 | T | 31 | Very low | 36.1 | Very low | 135 Ų | 135 | 132.8 Ų | 132.8 | 83% | 0.828 | 82% | 0.823 | S | S | * | * | 169 | 146.5 | 114.1 | 35.2 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 247 | A | 32.6 | Very low | 35.4 | Very low | 102 Ų | 102 | 131.9 Ų | 131.9 | 84% | 0.843 | 82% | 0.821 | S | S | * | * | trans | 46.7 | 138.1 | 144.4 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 248 | A | 35.5 | Very low | 34.9 | Very low | 92 Ų | 92 | 135.4 Ų | 135.4 | 76% | 0.76 | 83% | 0.83 | S | S | * | * | trans | -89.1 | 162.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 249 | T | 31.2 | Very low | 34.3 | Very low | 150 Ų | 150 | 131 Ų | 131 | 92% | 0.92 | 82% | 0.823 | S | S | * | * | trans | -159.1 | 170.7 | 146.5 | 18 | 0 | 0 | 0 | 0 | 111 | ||||
| 250 | V | 31.2 | Very low | 34.1 | Very low | 131 Ų | 131 | 133.5 Ų | 133.5 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | -120.6 | 154.3 | -160.3 | -151.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 251 | S | 32.1 | Very low | 33.7 | Very low | 96 Ų | 96 | 127.1 Ų | 127.1 | 67% | 0.671 | 82% | 0.817 | S | S | * | * | trans | 84.8 | 127.5 | 147.7 | -75.1 | 0 | 0 | 0 | 0 | 123 | ||||
| 252 | T | 34.8 | Very low | 33.8 | Very low | 133 Ų | 133 | 131.2 Ų | 131.2 | 82% | 0.816 | 82% | 0.82 | S | S | * | * | trans | 75.3 | 121.1 | 132.7 | 56.9 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 253 | N | 35.1 | Very low | 34.3 | Very low | 149 Ų | 149 | 129 Ų | 129 | 80% | 0.797 | 82% | 0.817 | S | S | * | * | 123.1 | 152 | 123.1 | -144.6 | 4.9 | 0 | 0 | 0 | 118 | |||||
| 254 | L | 32.4 | Very low | 34.3 | Very low | 165 Ų | 165 | 126.1 Ų | 126.1 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | trans | -59.2 | 151.3 | -171.1 | -83.6 | 47.3 | 0 | 0 | 0 | 116.4 | ||||
| 255 | G | 30.8 | Very low | 34.2 | Very low | 68 Ų | 68 | 130.7 Ų | 130.7 | 70% | 0.701 | 82% | 0.816 | S | S | * | * | 138.9 | 122.4 | 125.3 | 0 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 256 | V | 34.5 | Very low | 34 | Very low | 157 Ų | 157 | 125.4 Ų | 125.4 | 95% | 0.952 | 81% | 0.808 | S | S | * | * | trans | 78 | 112.1 | 149 | -167.6 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 257 | G | 29.1 | Very low | 34 | Very low | 62 Ų | 62 | 127.9 Ų | 127.9 | 64% | 0.639 | 81% | 0.81 | S | S | * | * | 119.9 | 121.1 | 119.6 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 258 | M | 37 | Very low | 34 | Very low | 195 Ų | 195 | 131.6 Ų | 131.6 | 96% | 0.961 | 81% | 0.811 | S | S | * | * | trans | 67 | 127.7 | 166.7 | -48.8 | -59.6 | 179.7 | 0 | 0 | 115.5 | ||||
| 259 | G | 34.4 | Very low | 33.9 | Very low | 71 Ų | 71 | 134.9 Ų | 134.9 | 73% | 0.732 | 81% | 0.814 | S | S | * | * | cis | 103.9 | 126.6 | 37.7 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 260 | L | 35.3 | Very low | 34.1 | Very low | 188 Ų | 188 | 139.2 Ų | 139.2 | 98% | 0.984 | 81% | 0.814 | S | S | * | * | cis | -153 | 168.1 | 29.9 | -59.3 | 158.6 | 0 | 0 | 0 | 107.6 | ||||
| 261 | G | 31 | Very low | 34.1 | Very low | 72 Ų | 72 | 136.3 Ų | 136.3 | 74% | 0.742 | 81% | 0.81 | S | S | * | * | cis | 172.7 | 146.1 | -3.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 262 | L | 39.1 | Very low | 34.1 | Very low | 160 Ų | 160 | 136.5 Ų | 136.5 | 84% | 0.838 | 82% | 0.817 | S | S | * | * | trans | -148.5 | 144.5 | 170.2 | -97.5 | 172.1 | 0 | 0 | 0 | 107.9 | ||||
| 263 | P | 46.7 | Very low | 34.5 | Very low | 127 Ų | 127 | 135.3 Ų | 135.3 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | trans | -132.6 | 164.8 | 143.6 | 25.7 | -7.3 | 0 | 0 | 0 | 113.3 | ||||
| 264 | V | 36.3 | Very low | 34.7 | Very low | 122 Ų | 122 | 135.4 Ų | 135.4 | 74% | 0.739 | 82% | 0.815 | S | S | * | * | trans | -124.8 | 165.5 | -170.2 | -174.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 265 | Q | 30.4 | Very low | 34.9 | Very low | 194 Ų | 194 | 132.5 Ų | 132.5 | 91% | 0.907 | 81% | 0.808 | S | S | * | * | trans | 87.2 | 141.2 | 169.7 | -48.8 | 173.1 | 3.1 | 0 | 0 | 115.3 | ||||
| 266 | G | 32.9 | Very low | 35.2 | Very low | 64 Ų | 64 | 134.8 Ų | 134.8 | 66% | 0.66 | 81% | 0.814 | S | S | * | * | cis | -175.3 | 165.3 | -4.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 267 | E | 32.2 | Very low | 35.5 | Very low | 187 Ų | 187 | 134.9 Ų | 134.9 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | 51.3 | 124.9 | 156 | -66.7 | 166 | 94.5 | 0 | 0 | 123.4 | ||||
| 268 | Q | 32.8 | Very low | 36.1 | Very low | 181 Ų | 181 | 139.1 Ų | 139.1 | 85% | 0.846 | 82% | 0.817 | S | S | * | * | 176.6 | 114.5 | 111.8 | -93.9 | 168.9 | -3.3 | 0 | 0 | 116.1 | |||||
| 269 | L | 33.8 | Very low | 36.5 | Very low | 160 Ų | 160 | 135.9 Ų | 135.9 | 84% | 0.838 | 80% | 0.804 | S | S | * | * | trans | 34 | 124.8 | 139.6 | -60.1 | 166 | 0 | 0 | 0 | 123.4 | ||||
| 270 | R | 34.5 | Very low | 37 | Very low | 242 Ų | 242 | 138.9 Ų | 138.9 | 91% | 0.913 | 80% | 0.803 | S | S | * | * | 148.7 | 132.2 | 103.1 | -175.1 | 176.2 | -77.6 | -117.6 | 2.5 | 116.2 | |||||
| 271 | G | 31.5 | Very low | 37.7 | Very low | 69 Ų | 69 | 137.2 Ų | 137.2 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | 98 | 93.9 | 152.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 272 | A | 32.5 | Very low | 38.6 | Very low | 100 Ų | 100 | 140.7 Ų | 140.7 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | 77.5 | 96.4 | 80.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 273 | S | 41.7 | Very low | 39 | Very low | 109 Ų | 109 | 142.3 Ų | 142.3 | 76% | 0.762 | 80% | 0.797 | S | S | * | * | 167 | 171.2 | 94.4 | 50.1 | 0 | 0 | 0 | 0 | 107.7 | |||||
| 274 | N | 40.2 | Very low | 39.2 | Very low | 151 Ų | 151 | 142 Ų | 142 | 81% | 0.807 | 79% | 0.792 | S | S | * | * | cis | -159.6 | 159.8 | -3.9 | -118 | -10 | 0 | 0 | 0 | 106.1 | ||||
| 275 | S | 35.7 | Very low | 40 | Very low | 103 Ų | 103 | 145.3 Ų | 145.3 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | cis | -160.6 | 153.8 | -11.3 | -176.9 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 276 | S | 38.9 | Very low | 40.8 | Very low | 117 Ų | 117 | 145.5 Ų | 145.5 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -127.2 | 112.1 | 178.3 | -79.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 277 | N | 39.3 | Very low | 41.4 | Very low | 159 Ų | 159 | 152.6 Ų | 152.6 | 85% | 0.85 | 80% | 0.798 | S | S | * | * | trans | -97.8 | 104 | 177.6 | -156.8 | 3.2 | 0 | 0 | 0 | 109.4 | ||||
| 278 | N | 41.4 | Very low | 42.4 | Very low | 150 Ų | 150 | 155 Ų | 155 | 80% | 0.802 | 80% | 0.8 | S | S | * | * | trans | -129.3 | 115.1 | -176.8 | -163.3 | -1.6 | 0 | 0 | 0 | 109 | ||||
| 279 | N | 46.7 | Very low | 43.3 | Very low | 128 Ų | 128 | 152.9 Ų | 152.9 | 68% | 0.684 | 80% | 0.795 | S | S | * | * | trans | -137.7 | 104.9 | -178.7 | -112.2 | -32.5 | 0 | 0 | 0 | 111.8 | ||||
| 280 | N | 45 | Very low | 44.1 | Very low | 134 Ų | 134 | 150.9 Ų | 150.9 | 72% | 0.717 | 80% | 0.795 | S | S | * | * | trans | 67.5 | 97.4 | 146.1 | -57.6 | -28.9 | 0 | 0 | 0 | 120.4 | N282 | N280-N282 PolarHBondContact O-N 2.93Š| ||
| 281 | N | 49.4 | Very low | 44.8 | Very low | 153 Ų | 153 | 148.1 Ų | 148.1 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | -12.5 | 111.2 | 125.9 | -68 | -37.1 | 0 | 0 | 0 | 115.3 | |||||
| 282 | N | 50.5 | Low | 45.9 | Very low | 144 Ų | 144 | 149.4 Ų | 149.4 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | 179.6 | 113.7 | 118.9 | -103.8 | -30.4 | 0 | 0 | 0 | 113.1 | N280 | N280-N282 PolarHBondContact O-N 2.93Š| |||
| 283 | K | 46.3 | Very low | 46.6 | Very low | 194 Ų | 194 | 153.4 Ų | 153.4 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | trans | 176.2 | 93.7 | 135.4 | -96.2 | 152.7 | -171.3 | 172.1 | 0 | 111 | Y285 | K283-Y285 PolarHBondContact O-N 2.83Å; K283-Y285 VanDerWaalsContact O-N 3.08Å | ||
| 284 | V | 50.9 | Low | 47.3 | Very low | 121 Ų | 121 | 156.2 Ų | 156.2 | 73% | 0.733 | 79% | 0.793 | S | S | * | * | trans | -77.2 | 16.7 | -173.7 | 170.6 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 285 | Y | 52.5 | Low | 48.1 | Very low | 191 Ų | 191 | 155.5 Ų | 155.5 | 75% | 0.749 | 79% | 0.788 | S | S | * | * | trans | -133.2 | 48.2 | -164.6 | -34.6 | -69 | 0 | 0 | 0 | 115.8 | K283 | K283-Y285 PolarHBondContact O-N 2.83Å; K283-Y285 VanDerWaalsContact O-N 3.08Å | ||
| 286 | K | 47.8 | Very low | 49.5 | Very low | 198 Ų | 198 | 155.3 Ų | 155.3 | 86% | 0.861 | 79% | 0.786 | S | S | * | * | trans | -146.3 | 75.9 | 161.5 | -134.3 | 167.6 | -175.4 | 175.7 | 0 | 110.8 | ||||
| 287 | R | 45.5 | Very low | 51.4 | Low | 214 Ų | 214 | 157.4 Ų | 157.4 | 81% | 0.808 | 78% | 0.776 | S | S | * | * | 60.7 | 89.7 | 100.4 | -65.8 | -170.2 | -168.2 | -158.7 | 4.1 | 113.5 | N289 | R287-N289 PolarHBondContact O-N 3.29Å; R287-N289 VanDerWaalsContact O-N 3.1Å | |||
| 288 | Y | 52.6 | Low | 53.9 | Low | 236 Ų | 236 | 152.6 Ų | 152.6 | 93% | 0.925 | 75% | 0.748 | S | S | * | * | S | Bend | trans | 23 | 71.7 | 143.6 | -47.5 | -84.1 | 0 | 0 | 0 | 117.8 | ||
| 289 | N | 52.3 | Low | 56.4 | Low | 137 Ų | 137 | 145.4 Ų | 145.4 | 73% | 0.733 | 71% | 0.71 | S | S | * | * | trans | -152.7 | 53 | 153.9 | -163.6 | 0.2 | 0 | 0 | 0 | 111.4 | R287 K291 | R287-N289 PolarHBondContact O-N 3.29Å; R287-N289 VanDerWaalsContact O-N 3.1Å; N289-K291 PolarHBondContact O-N 3.48Å | ||
| 290 | S | 50.2 | Low | 58.7 | Low | 119 Ų | 119 | 143.4 Ų | 143.4 | 83% | 0.832 | 70% | 0.702 | S | S | * | * | trans | -87.6 | 92.2 | 164.4 | -59.3 | 0 | 0 | 0 | 0 | 107.5 | A292 | S290-A292 PolarHBondContact O-N 2.75Š| ||
| 291 | K | 50.8 | Low | 61 | Low | 184 Ų | 184 | 139.2 Ų | 139.2 | 80% | 0.8 | 68% | 0.678 | S | S | * | * | trans | -46.3 | 131.6 | 157.2 | -69.7 | -173 | 177.9 | -178 | 0 | 106.8 | N289 K293 | N289-K291 PolarHBondContact O-N 3.48Å; K291-K293 PolarHBondContact O-N 2.92Å | ||
| 292 | A | 53.1 | Low | 63.2 | Low | 96 Ų | 96 | 132 Ų | 132 | 79% | 0.793 | 64% | 0.639 | S | S | * | * | trans | -43.3 | 120.2 | -172.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | S290 E294 | S290-A292 PolarHBondContact O-N 2.75Å; A292-E294 VanDerWaalsContact C-N 3.28Å; A292-E294 PolarHBondContact O-N 3.12Å | ||
| 293 | K | 48.3 | Very low | 65.2 | Low | 183 Ų | 183 | 129.7 Ų | 129.7 | 80% | 0.796 | 62% | 0.623 | S | S | * | * | trans | -58 | 99.1 | -176.4 | 177.9 | 174.8 | -177.4 | -74.3 | 0 | 106.6 | K291 I295 | K291-K293 PolarHBondContact O-N 2.92Å; K293-I295 PolarHBondContact O-N 2.85Å | ||
| 294 | E | 54.9 | Low | 67.5 | Low | 169 Ų | 169 | 126.4 Ų | 126.4 | 79% | 0.79 | 62% | 0.615 | S | S | * | * | trans | -57.5 | 104.8 | -179 | -173.6 | 166.3 | -152.2 | 0 | 0 | 105.6 | A292 S296 | A292-E294 VanDerWaalsContact C-N 3.28Å; A292-E294 PolarHBondContact O-N 3.12Å; E294-S296 PolarHBondContact O-N 3.14Å | ||
| 295 | I | 58.6 | Low | 69.5 | Low | 136 Ų | 136 | 124.2 Ų | 124.2 | 70% | 0.697 | 60% | 0.6 | S | S | * | * | trans | -64.7 | 101 | 172 | -64.9 | 101.2 | 0 | 0 | 0 | 102.8 | K293 R297 | K293-I295 PolarHBondContact O-N 2.85Å; I295-R297 WeakPolarHBondContact O-CG 3.34Å; I295-R297 PolarHBondContact O-N 3.24Å | ||
| 296 | S | 64.1 | Low | 71.5 | Confident | 98 Ų | 98 | 122.3 Ų | 122.3 | 69% | 0.685 | 60% | 0.602 | S | S | * | * | trans | -52.5 | 97.7 | -171.5 | 49.6 | 0 | 0 | 0 | 0 | 109.1 | E294 H298 | E294-S296 PolarHBondContact O-N 3.14Å; S296-H298 PolarHBondContact O-N 3.48Å | ||
| 297 | R | 79.4 | Confident | 73.6 | Confident | 161 Ų | 161 | 114.9 Ų | 114.9 | 61% | 0.608 | 57% | 0.571 | S | S | * | * | trans | -81.1 | 59.5 | -176.2 | -62.8 | -164.8 | 178.9 | -175.7 | -0.4 | 108.8 | I295 I312 N313 S314 H315 | I295-R297 WeakPolarHBondContact O-CG 3.34Å; I295-R297 PolarHBondContact O-N 3.24Å; R297-I312 VanDerWaalsContact O-O 3.05Å; R297-N313 CarbonylContact O-C 3.32Å; R297-N313 WeakPolarHBondContact O-CA 3.34Å; R297-S314 WeakPolarHBondContact CD-O 3.37Å; R297-S314 PolarHBondContact O-N 3.43Å; R297-H315 CarbonylContact C-O 3.18Å; R297-H315 CarbonylContact O-C 3.54Å; R297-H315 VanDerWaalsContact O-C 3.32Å; R297-H315 PolarHBondContact O-N 2.92Å | ||
| 298 | H | 91.7 | Very high | 75.9 | Confident | 58 Ų | 58 | 108.4 Ų | 108.4 | 27% | 0.269 | 56% | 0.556 | S | S | . | * | trans | -96.3 | 127.1 | -172.4 | 168.2 | 84.4 | 0 | 0 | 0 | 110.3 | S296 E303 I312 H315 | S296-H298 PolarHBondContact O-N 3.48Å; H298-E303 VanDerWaalsContact CE1-CD 3.46Å; H298-E303 IonicContact CE1-OE1 3.51Å; H298-E303 IonicContact CE1-OE2 3.33Å; H298-E303 PolarHBondContact CE1-OE2 3.43Å; H298-E303 IonicContact NE2-OE2 3.36Å; H298-E303 PolarHBondContact NE2-OE2 3.47Å; H298-I312 CarbonylContact C-O 3.53Å; H298-I312 WeakPolarHBondContact CA-O 3.49Å; H298-I312 WeakPolarHBondContact ND1-CG2 3.41Å; H298-H315 CarbonylContact C-O 2.9Å; H298-H315 VanDerWaalsContact C-O 3.23Å | ||
| 299 | C | 94.6 | Very high | 77.7 | Confident | 0 Ų | 0 | 104.1 Ų | 104.1 | 0% | 0 | 54% | 0.544 | C | S | . | . | trans | -107.7 | 97.9 | 179.9 | -173.4 | 0 | 0 | 0 | 0 | 111.6 | F301 C302 E303 I312 H315 | C299-F301 PolarHBondContact O-N 3.48Å; C299-F301 VanDerWaalsContact O-N 3.13Å; C299-C302 HydrophobicContact CB-CB 3.98Å; C299-C302 PolarHBondContact O-N 3.26Å; C299-C302 PolarHBondContact SG-N 2.75Å; C299-C302 VanDerWaalsContact SG-N 3.44Å; C299-E303 PolarHBondContact O-N 3.11Å; C299-I312 PolarHBondContact N-O 2.87Å; C299-H315 WeakPolarHBondContact CB-NE2 3.16Å; C299-H315 VanDerWaalsContact CB-O 3.26Å; C299-H315 WeakPolarHBondContact CB-O 3.3Å; C299-H315 PolarHBondContact N-O 3.26Å; C299-H315 PolarHBondContact SG-NE2 3.14Å | ||
| 300 | V | 93.8 | Very high | 79.5 | Confident | 85 Ų | 85 | 101.6 Ų | 101.6 | 52% | 0.515 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -53.5 | -33 | 174.5 | -172.7 | 0 | 0 | 0 | 0 | 112.2 | E303 N304 V317 | V300-E303 PolarHBondContact O-N 2.99Å; V300-N304 WeakPolarHBondContact O-CB 3.5Å; V300-N304 PolarHBondContact O-N 3.45Å; V300-V317 HydrophobicContact CB-CG2 4.19Å |
| 301 | F | 94.4 | Very high | 81.4 | Confident | 47 Ų | 47 | 98.1 Ų | 98.1 | 21% | 0.206 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -68.3 | -41.6 | 177 | -176.5 | -98.7 | 0 | 0 | 0 | 112.5 | C299 N305 V317 K328 L329 T346 | C299-F301 PolarHBondContact O-N 3.48Å; C299-F301 VanDerWaalsContact O-N 3.13Å; F301-N305 WeakPolarHBondContact CE1-ND2 3.45Å; F301-N305 WeakPolarHBondContact CZ-ND2 3.39Å; F301-N305 VanDerWaalsContact O-CG 3.23Å; F301-N305 PolarHBondContact O-N 2.86Å; F301-N305 PolarHBondContact O-ND2 3.43Å; F301-V317 HydrophobicContact CB-CG1 4.43Å; F301-V317 HydrophobicContact CB-CG2 4.34Å; F301-K328 HydrophobicContact CD1-CB 4.44Å; F301-K328 HydrophobicContact CE1-CB 3.99Å; F301-L329 HydrophobicContact CD1-CB 4Å; F301-L329 HydrophobicContact CE1-CB 3.89Å; F301-L329 HydrophobicContact CE1-CD1 4.45Å; F301-L329 HydrophobicContact CE2-CD1 4.01Å; F301-L329 HydrophobicContact CG-CB 4.45Å; F301-L329 HydrophobicContact CZ-CB 4.29Å; F301-L329 HydrophobicContact CZ-CD1 3.97Å; F301-T346 HydrophobicContact CE2-CG2 3.79Å; F301-T346 HydrophobicContact CZ-CG2 4.32Å |
| 302 | C | 94 | Very high | 83.4 | Confident | 0 Ų | 0 | 90.3 Ų | 90.3 | 0% | 0 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -72.2 | -33.9 | 174.8 | -75.2 | 0 | 0 | 0 | 0 | 112 | C299 N305 N306 E307 V311 I312 C326 | C299-C302 HydrophobicContact CB-CB 3.98Å; C299-C302 PolarHBondContact O-N 3.26Å; C299-C302 PolarHBondContact SG-N 2.75Å; C299-C302 VanDerWaalsContact SG-N 3.44Å; C302-N305 CarbonylContact O-C 3.23Å; C302-N305 PolarHBondContact O-N 2.89Å; C302-N306 PolarHBondContact O-N 3.45Å; C302-E307 HydrophobicContact CB-CB 3.96Å; C302-E307 HydrophobicContact CB-CG 3.94Å; C302-E307 WeakPolarHBondContact O-CB 3.4Å; C302-E307 PolarHBondContact O-N 2.96Å; C302-V311 HydrophobicContact CB-CG1 4.46Å; C302-I312 HydrophobicContact CB-CG1 4.2Å; C302-C326 VanDerWaalsContact SG-SG 3.63Å |
| 303 | E | 93.4 | Very high | 85.3 | Confident | 96 Ų | 96 | 89.3 Ų | 89.3 | 45% | 0.449 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.5 | -50 | 173.6 | -178.7 | 179.9 | -128 | 0 | 0 | 111.7 | H298 C299 V300 N305 N306 I312 | H298-E303 VanDerWaalsContact CE1-CD 3.46Å; H298-E303 IonicContact CE1-OE1 3.51Å; H298-E303 IonicContact CE1-OE2 3.33Å; H298-E303 PolarHBondContact CE1-OE2 3.43Å; H298-E303 IonicContact NE2-OE2 3.36Å; H298-E303 PolarHBondContact NE2-OE2 3.47Å; C299-E303 PolarHBondContact O-N 3.11Å; V300-E303 PolarHBondContact O-N 2.99Å; E303-N305 PolarHBondContact O-N 3.09Å; E303-N306 PolarHBondContact O-N 3.24Å; E303-I312 HydrophobicContact CB-CD1 4.08Å; E303-I312 HydrophobicContact CB-CG1 4.38Å; E303-I312 HydrophobicContact CB-CG2 4.07Å; E303-I312 HydrophobicContact CG-CD1 4.4Å |
| 304 | N | 94.6 | Very high | 87.3 | Confident | 126 Ų | 126 | 83.2 Ų | 83.2 | 67% | 0.674 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -62.5 | -25.5 | 177.2 | -173.5 | 87.3 | 0 | 0 | 0 | 113.1 | V300 N306 | V300-N304 WeakPolarHBondContact O-CB 3.5Å; V300-N304 PolarHBondContact O-N 3.45Å; N304-N306 VanDerWaalsContact C-N 3.32Å |
| 305 | N | 92.6 | Very high | 89.1 | Confident | 75 Ų | 75 | 76.3 Ų | 76.3 | 40% | 0.401 | 41% | 0.413 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | 7.1 | 175.3 | -66.8 | -29.7 | 0 | 0 | 0 | 113.4 | F301 C302 E303 E307 | F301-N305 WeakPolarHBondContact CE1-ND2 3.45Å; F301-N305 WeakPolarHBondContact CZ-ND2 3.39Å; F301-N305 VanDerWaalsContact O-CG 3.23Å; F301-N305 PolarHBondContact O-N 2.86Å; F301-N305 PolarHBondContact O-ND2 3.43Å; C302-N305 CarbonylContact O-C 3.23Å; C302-N305 PolarHBondContact O-N 2.89Å; E303-N305 PolarHBondContact O-N 3.09Å; N305-E307 HydrophobicContact CB-CG 4.35Å; N305-E307 PolarHBondContact O-N 2.92Å |
| 306 | N | 94 | Very high | 90.8 | Very high | 150 Ų | 150 | 71.9 Ų | 71.9 | 80% | 0.802 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 35 | -178 | -56.7 | 119 | 0 | 0 | 0 | 114.4 | C302 E303 N304 | C302-N306 PolarHBondContact O-N 3.45Å; E303-N306 PolarHBondContact O-N 3.24Å; N304-N306 VanDerWaalsContact C-N 3.32Å |
| 307 | E | 93.6 | Very high | 92.2 | Very high | 43 Ų | 43 | 69 Ų | 69 | 20% | 0.201 | 37% | 0.372 | C | S | . | . | trans | -63.7 | 156.7 | 169.6 | -66.4 | -80.7 | 179.2 | 0 | 0 | 110.5 | C302 N305 V311 I312 K328 | C302-E307 HydrophobicContact CB-CB 3.96Å; C302-E307 HydrophobicContact CB-CG 3.94Å; C302-E307 WeakPolarHBondContact O-CB 3.4Å; C302-E307 PolarHBondContact O-N 2.96Å; N305-E307 HydrophobicContact CB-CG 4.35Å; N305-E307 PolarHBondContact O-N 2.92Å; E307-V311 HydrophobicContact CB-CB 4.33Å; E307-V311 HydrophobicContact CB-CG1 4.17Å; E307-I312 HydrophobicContact CB-CG1 4.42Å; E307-I312 WeakPolarHBondContact O-CD1 3.46Å; E307-K328 WeakPolarHBondContact OE1-CE 3.45Å; E307-K328 IonicContact OE1-NZ 2.65Å; E307-K328 PolarHBondContact OE1-NZ 2.99Å; E307-K328 IonicContact OE2-NZ 3.58Å | ||
| 308 | P | 92.6 | Very high | 92.8 | Very high | 78 Ų | 78 | 67.9 Ų | 67.9 | 51% | 0.506 | 37% | 0.368 | S | S | . | . | trans | -62.3 | 148.4 | 179.3 | 25.2 | -34.4 | 0 | 0 | 0 | 111.8 | A310 V311 I312 | P308-A310 PolarHBondContact O-N 3.29Å; P308-A310 VanDerWaalsContact O-N 3.08Å; P308-V311 HydrophobicContact CG-CB 4.17Å; P308-V311 HydrophobicContact CG-CG2 3.79Å; P308-V311 WeakPolarHBondContact O-CA 3.5Å; P308-V311 WeakPolarHBondContact O-CB 3.36Å; P308-V311 PolarHBondContact O-N 2.94Å; P308-I312 PolarHBondContact O-N 2.88Å | ||
| 309 | E | 91.7 | Very high | 92.7 | Very high | 145 Ų | 145 | 66.8 Ų | 66.8 | 68% | 0.678 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -53.6 | -35.9 | -176.2 | -174.3 | 178 | -178.6 | 0 | 0 | 113.3 | V311 I312 N313 | E309-V311 VanDerWaalsContact C-N 3.25Å; E309-V311 PolarHBondContact O-N 3.07Å; E309-I312 PolarHBondContact O-N 3.38Å; E309-N313 VanDerWaalsContact CG-ND2 3.32Å; E309-N313 WeakPolarHBondContact CG-ND2 3.38Å; E309-N313 WeakPolarHBondContact O-CB 3.32Å; E309-N313 PolarHBondContact O-N 3.37Å; E309-N313 PolarHBondContact OE1-ND2 2.84Å |
| 310 | A | 89.3 | Confident | 92.5 | Very high | 85 Ų | 85 | 74.2 Ų | 74.2 | 70% | 0.702 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -59.9 | -31.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | P308 S314 | P308-A310 PolarHBondContact O-N 3.29Å; P308-A310 VanDerWaalsContact O-N 3.08Å; A310-S314 WeakPolarHBondContact O-CB 3.28Å |
| 311 | V | 90.4 | Very high | 92.2 | Very high | 45 Ų | 45 | 77.8 Ų | 77.8 | 27% | 0.273 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -81.8 | -43.2 | 174.3 | 173.6 | 0 | 0 | 0 | 0 | 110.3 | C302 E307 P308 E309 N313 S314 H315 | C302-V311 HydrophobicContact CB-CG1 4.46Å; E307-V311 HydrophobicContact CB-CB 4.33Å; E307-V311 HydrophobicContact CB-CG1 4.17Å; P308-V311 HydrophobicContact CG-CB 4.17Å; P308-V311 HydrophobicContact CG-CG2 3.79Å; P308-V311 WeakPolarHBondContact O-CA 3.5Å; P308-V311 WeakPolarHBondContact O-CB 3.36Å; P308-V311 PolarHBondContact O-N 2.94Å; E309-V311 VanDerWaalsContact C-N 3.25Å; E309-V311 PolarHBondContact O-N 3.07Å; V311-N313 VanDerWaalsContact C-N 3.28Å; V311-N313 PolarHBondContact O-N 3.23Å; V311-S314 PolarHBondContact O-N 3.13Å; V311-S314 PolarHBondContact O-OG 3.06Å; V311-H315 PolarHBondContact O-CE1 2.95Å; V311-H315 PolarHBondContact O-ND1 3.44Å |
| 312 | I | 93.3 | Very high | 92 | Very high | 21 Ų | 21 | 81.3 Ų | 81.3 | 11% | 0.108 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -55.2 | -45.4 | 176.7 | -62.7 | 172.2 | 0 | 0 | 0 | 110.8 | R297 H298 C299 C302 E303 E307 P308 E309 S314 | R297-I312 VanDerWaalsContact O-O 3.05Å; H298-I312 CarbonylContact C-O 3.53Å; H298-I312 WeakPolarHBondContact CA-O 3.49Å; H298-I312 WeakPolarHBondContact ND1-CG2 3.41Å; C299-I312 PolarHBondContact N-O 2.87Å; C302-I312 HydrophobicContact CB-CG1 4.2Å; E303-I312 HydrophobicContact CB-CD1 4.08Å; E303-I312 HydrophobicContact CB-CG1 4.38Å; E303-I312 HydrophobicContact CB-CG2 4.07Å; E303-I312 HydrophobicContact CG-CD1 4.4Å; E307-I312 HydrophobicContact CB-CG1 4.42Å; E307-I312 WeakPolarHBondContact O-CD1 3.46Å; P308-I312 PolarHBondContact O-N 2.88Å; E309-I312 PolarHBondContact O-N 3.38Å; I312-S314 PolarHBondContact O-N 2.92Å |
| 313 | N | 92.5 | Very high | 91.9 | Very high | 74 Ų | 74 | 86.6 Ų | 86.6 | 40% | 0.396 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | 10.8 | -175.7 | -66.4 | -24.4 | 0 | 0 | 0 | 114.1 | R297 E309 V311 | R297-N313 CarbonylContact O-C 3.32Å; R297-N313 WeakPolarHBondContact O-CA 3.34Å; E309-N313 VanDerWaalsContact CG-ND2 3.32Å; E309-N313 WeakPolarHBondContact CG-ND2 3.38Å; E309-N313 WeakPolarHBondContact O-CB 3.32Å; E309-N313 PolarHBondContact O-N 3.37Å; E309-N313 PolarHBondContact OE1-ND2 2.84Å; V311-N313 VanDerWaalsContact C-N 3.28Å; V311-N313 PolarHBondContact O-N 3.23Å |
| 314 | S | 90.8 | Very high | 92 | Very high | 56 Ų | 56 | 82.1 Ų | 82.1 | 39% | 0.392 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.6 | -26.7 | 179.5 | 64.5 | 0 | 0 | 0 | 0 | 114.8 | R297 A310 V311 I312 | R297-S314 WeakPolarHBondContact CD-O 3.37Å; R297-S314 PolarHBondContact O-N 3.43Å; A310-S314 WeakPolarHBondContact O-CB 3.28Å; V311-S314 PolarHBondContact O-N 3.13Å; V311-S314 PolarHBondContact O-OG 3.06Å; I312-S314 PolarHBondContact O-N 2.92Å |
| 315 | H | 91.9 | Very high | 92 | Very high | 23 Ų | 23 | 79.4 Ų | 79.4 | 11% | 0.106 | 42% | 0.418 | C | S | . | . | trans | -152.4 | 156.3 | -171.4 | 62.1 | -83.2 | 0 | 0 | 0 | 112.3 | R297 H298 C299 V311 C326 | R297-H315 CarbonylContact C-O 3.18Å; R297-H315 CarbonylContact O-C 3.54Å; R297-H315 VanDerWaalsContact O-C 3.32Å; R297-H315 PolarHBondContact O-N 2.92Å; H298-H315 CarbonylContact C-O 2.9Å; H298-H315 VanDerWaalsContact C-O 3.23Å; C299-H315 WeakPolarHBondContact CB-NE2 3.16Å; C299-H315 VanDerWaalsContact CB-O 3.26Å; C299-H315 WeakPolarHBondContact CB-O 3.3Å; C299-H315 PolarHBondContact N-O 3.26Å; C299-H315 PolarHBondContact SG-NE2 3.14Å; V311-H315 PolarHBondContact O-CE1 2.95Å; V311-H315 PolarHBondContact O-ND1 3.44Å; H315-C326 VanDerWaalsContact CD2-CA 3.42Å; H315-C326 WeakPolarHBondContact CD2-CA 3.4Å; H315-C326 PolarHBondContact NE2-SG 3.47Å | ||
| 316 | S | 93.5 | Very high | 92.1 | Very high | 43 Ų | 43 | 75.9 Ų | 75.9 | 30% | 0.301 | 40% | 0.399 | S | S | . | . | trans | -86.5 | 161.9 | 167.3 | 56.4 | 0 | 0 | 0 | 0 | 111.3 | R318 L325 | S316-R318 PolarHBondContact O-N 3.34Å; S316-R318 PolarHBondContact OG-O 2.87Å; S316-L325 WeakPolarHBondContact O-CB 3.38Å | ||
| 317 | V | 93.3 | Very high | 92.1 | Very high | 39 Ų | 39 | 72.1 Ų | 72.1 | 24% | 0.236 | 38% | 0.383 | C | S | . | . | S | Bend | trans | -62.2 | -43.9 | 175.7 | -173.1 | 0 | 0 | 0 | 0 | 111.2 | V300 F301 L325 C326 L329 | V300-V317 HydrophobicContact CB-CG2 4.19Å; F301-V317 HydrophobicContact CB-CG1 4.43Å; F301-V317 HydrophobicContact CB-CG2 4.34Å; V317-L325 PolarHBondContact O-N 3.12Å; V317-C326 PolarHBondContact O-N 3.28Å; V317-L329 HydrophobicContact CG1-CD2 4.31Å |
| 318 | R | 92.6 | Very high | 92.1 | Very high | 136 Ų | 136 | 74.9 Ų | 74.9 | 51% | 0.513 | 40% | 0.395 | S | S | . | . | B | Isolated β-bridge | trans | -131.6 | 158.4 | -180 | -65.6 | -175.6 | -178 | 177.7 | 0.3 | 112.3 | S316 R323 | S316-R318 PolarHBondContact O-N 3.34Å; S316-R318 PolarHBondContact OG-O 2.87Å; R318-R323 CarbonylContact C-O 3.57Å; R318-R323 VanDerWaalsContact CA-O 3.23Å; R318-R323 WeakPolarHBondContact CA-O 3.28Å |
| 319 | D | 90.8 | Very high | 92.2 | Very high | 35 Ų | 35 | 71.7 Ų | 71.7 | 19% | 0.187 | 37% | 0.373 | C | S | . | . | trans | -85.4 | 167.5 | 174.6 | -165.4 | 7 | 0 | 0 | 0 | 112 | F321 N322 R323 L325 | D319-F321 PolarHBondContact O-N 3.21Å; D319-F321 VanDerWaalsContact O-N 3.15Å; D319-N322 PolarHBondContact O-N 2.83Å; D319-R323 HydrophobicContact CB-CB 4.38Å; D319-R323 PolarHBondContact N-O 3.48Å; D319-R323 IonicContact OD2-CZ 3.47Å; D319-R323 IonicContact OD2-NE 3.39Å; D319-R323 PolarHBondContact OD2-NE 2.95Å; D319-R323 IonicContact OD2-NH2 2.71Å; D319-R323 PolarHBondContact OD2-NH2 3.18Å; D319-L325 HydrophobicContact CB-CD1 3.74Å; D319-L325 HydrophobicContact CB-CD2 4.14Å; D319-L325 HydrophobicContact CB-CG 3.79Å | ||
| 320 | N | 90.3 | Very high | 92.4 | Very high | 156 Ų | 156 | 68.8 Ų | 68.8 | 83% | 0.834 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.6 | -26.7 | 169.7 | -67.6 | 104.8 | 0 | 0 | 0 | 112.8 | N322 | N320-N322 VanDerWaalsContact C-N 3.29Å; N320-N322 PolarHBondContact O-N 2.97Å |
| 321 | F | 87.6 | Confident | 92.6 | Very high | 161 Ų | 161 | 70 Ų | 70 | 71% | 0.706 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.7 | 17.1 | 174.9 | -60.7 | -79.7 | 0 | 0 | 0 | 113.8 | D319 R323 | D319-F321 PolarHBondContact O-N 3.21Å; D319-F321 VanDerWaalsContact O-N 3.15Å; F321-R323 HydrophobicContact CB-CG 4.39Å; F321-R323 PolarHBondContact O-N 2.94Å |
| 322 | N | 88.9 | Confident | 92.9 | Very high | 120 Ų | 120 | 72 Ų | 72 | 64% | 0.642 | 36% | 0.358 | S | S | * | . | S | Bend | trans | 60.1 | 3 | -177 | -81.5 | -63.5 | 0 | 0 | 0 | 117 | D319 N320 | D319-N322 PolarHBondContact O-N 2.83Å; N320-N322 VanDerWaalsContact C-N 3.29Å; N320-N322 PolarHBondContact O-N 2.97Å |
| 323 | R | 92.3 | Very high | 93 | Very high | 111 Ų | 111 | 75.1 Ų | 75.1 | 42% | 0.419 | 38% | 0.378 | S | S | . | . | trans | -68.1 | 144.9 | 172.6 | -57.6 | 178.5 | -63.5 | -177.3 | 0 | 110.9 | R318 D319 F321 L325 D342 | R318-R323 CarbonylContact C-O 3.57Å; R318-R323 VanDerWaalsContact CA-O 3.23Å; R318-R323 WeakPolarHBondContact CA-O 3.28Å; D319-R323 HydrophobicContact CB-CB 4.38Å; D319-R323 PolarHBondContact N-O 3.48Å; D319-R323 IonicContact OD2-CZ 3.47Å; D319-R323 IonicContact OD2-NE 3.39Å; D319-R323 PolarHBondContact OD2-NE 2.95Å; D319-R323 IonicContact OD2-NH2 2.71Å; D319-R323 PolarHBondContact OD2-NH2 3.18Å; F321-R323 HydrophobicContact CB-CG 4.39Å; F321-R323 PolarHBondContact O-N 2.94Å; R323-L325 PolarHBondContact O-N 3.27Å; R323-D342 HydrophobicContact CB-CB 4.43Å; R323-D342 HydrophobicContact CG-CB 4.48Å | ||
| 324 | V | 95.3 | Very high | 93.2 | Very high | 3 Ų | 3 | 71.7 Ų | 71.7 | 2% | 0.018 | 36% | 0.36 | C | S | . | . | B | Isolated β-bridge | trans | -70.7 | 124.5 | 174.1 | -179.3 | 0 | 0 | 0 | 0 | 110.8 | C326 L329 R330 D342 A344 | V324-C326 HydrophobicContact CG1-CB 4.38Å; V324-L329 HydrophobicContact CG1-CB 3.87Å; V324-L329 HydrophobicContact CG1-CD2 3.79Å; V324-L329 HydrophobicContact CG1-CG 3.86Å; V324-L329 HydrophobicContact CG2-CD2 4.34Å; V324-R330 HydrophobicContact CB-CG 4.27Å; V324-R330 HydrophobicContact CG1-CG 3.91Å; V324-R330 WeakPolarHBondContact O-CD 3.37Å; V324-R330 PolarHBondContact O-NH1 2.89Å; V324-D342 PolarHBondContact N-O 2.86Å; V324-A344 VanDerWaalsContact CG2-O 3.29Å; V324-A344 WeakPolarHBondContact CG2-O 3.39Å |
| 325 | L | 94.4 | Very high | 93.5 | Very high | 69 Ų | 69 | 74.1 Ų | 74.1 | 36% | 0.361 | 37% | 0.374 | S | S | . | . | trans | -97.6 | -25.6 | 174.8 | -70.6 | 177 | 0 | 0 | 0 | 113 | S316 V317 D319 R323 P327 | S316-L325 WeakPolarHBondContact O-CB 3.38Å; V317-L325 PolarHBondContact O-N 3.12Å; D319-L325 HydrophobicContact CB-CD1 3.74Å; D319-L325 HydrophobicContact CB-CD2 4.14Å; D319-L325 HydrophobicContact CB-CG 3.79Å; R323-L325 PolarHBondContact O-N 3.27Å; L325-P327 WeakPolarHBondContact O-CD 3.48Å | ||
| 326 | C | 94.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 80.5 Ų | 80.5 | 0% | 0 | 41% | 0.407 | C | S | . | . | trans | -61.4 | 117.5 | -178.1 | 177 | 0 | 0 | 0 | 0 | 112.2 | C302 H315 V317 V324 K328 L329 R330 | C302-C326 VanDerWaalsContact SG-SG 3.63Å; H315-C326 VanDerWaalsContact CD2-CA 3.42Å; H315-C326 WeakPolarHBondContact CD2-CA 3.4Å; H315-C326 PolarHBondContact NE2-SG 3.47Å; V317-C326 PolarHBondContact O-N 3.28Å; V324-C326 HydrophobicContact CG1-CB 4.38Å; C326-K328 VanDerWaalsContact C-N 3.3Å; C326-K328 PolarHBondContact O-N 3.43Å; C326-L329 HydrophobicContact CB-CB 4.01Å; C326-L329 PolarHBondContact O-N 3.26Å; C326-R330 VanDerWaalsContact O-CG 3.25Å; C326-R330 WeakPolarHBondContact O-CG 3.43Å; C326-R330 PolarHBondContact O-N 3.32Å | ||
| 327 | P | 94.2 | Very high | 93.9 | Very high | 72 Ų | 72 | 82.2 Ų | 82.2 | 47% | 0.468 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63.1 | -35.7 | -175.6 | 24.7 | -33.4 | 0 | 0 | 0 | 112.5 | L325 R330 T331 | L325-P327 WeakPolarHBondContact O-CD 3.48Å; P327-R330 PolarHBondContact O-N 3.25Å; P327-T331 PolarHBondContact O-N 3.02Å; P327-T331 VanDerWaalsContact O-N 3.09Å; P327-T331 PolarHBondContact O-OG1 3.48Å |
| 328 | K | 93.8 | Very high | 93.9 | Very high | 101 Ų | 101 | 82.7 Ų | 82.7 | 44% | 0.439 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.1 | -45 | 176.6 | -64.4 | -74.8 | 178 | 128.3 | 0 | 111.8 | F301 E307 C326 T331 Y332 | F301-K328 HydrophobicContact CD1-CB 4.44Å; F301-K328 HydrophobicContact CE1-CB 3.99Å; E307-K328 WeakPolarHBondContact OE1-CE 3.45Å; E307-K328 IonicContact OE1-NZ 2.65Å; E307-K328 PolarHBondContact OE1-NZ 2.99Å; E307-K328 IonicContact OE2-NZ 3.58Å; C326-K328 VanDerWaalsContact C-N 3.3Å; C326-K328 PolarHBondContact O-N 3.43Å; K328-T331 PolarHBondContact O-N 3.44Å; K328-T331 PolarHBondContact O-OG1 3.07Å; K328-Y332 PolarHBondContact O-N 3.2Å |
| 329 | L | 94.8 | Very high | 94 | Very high | 11 Ų | 11 | 77.1 Ų | 77.1 | 6% | 0.058 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -69.6 | -38.7 | 176.5 | -173.2 | 56.7 | 0 | 0 | 0 | 111.2 | F301 V317 V324 C326 T331 Y332 A344 T346 | F301-L329 HydrophobicContact CD1-CB 4Å; F301-L329 HydrophobicContact CE1-CB 3.89Å; F301-L329 HydrophobicContact CE1-CD1 4.45Å; F301-L329 HydrophobicContact CE2-CD1 4.01Å; F301-L329 HydrophobicContact CG-CB 4.45Å; F301-L329 HydrophobicContact CZ-CB 4.29Å; F301-L329 HydrophobicContact CZ-CD1 3.97Å; V317-L329 HydrophobicContact CG1-CD2 4.31Å; V324-L329 HydrophobicContact CG1-CB 3.87Å; V324-L329 HydrophobicContact CG1-CD2 3.79Å; V324-L329 HydrophobicContact CG1-CG 3.86Å; V324-L329 HydrophobicContact CG2-CD2 4.34Å; C326-L329 HydrophobicContact CB-CB 4.01Å; C326-L329 PolarHBondContact O-N 3.26Å; L329-T331 VanDerWaalsContact C-N 3.26Å; L329-T331 PolarHBondContact O-N 3.39Å; L329-Y332 VanDerWaalsContact O-CB 3.28Å; L329-Y332 WeakPolarHBondContact O-CB 3.37Å; L329-Y332 PolarHBondContact O-N 3.4Å; L329-A344 HydrophobicContact CG-CB 4.29Å; L329-A344 WeakPolarHBondContact O-CB 3.46Å; L329-T346 HydrophobicContact CD1-CG2 3.99Å |
| 330 | R | 95.9 | Very high | 94.2 | Very high | 84 Ų | 84 | 77.6 Ų | 77.6 | 32% | 0.317 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -59.1 | -33.6 | 175 | -71 | 175.2 | 74.7 | 82.3 | 8.4 | 113.3 | V324 C326 P327 Y332 S340 G341 D342 | V324-R330 HydrophobicContact CB-CG 4.27Å; V324-R330 HydrophobicContact CG1-CG 3.91Å; V324-R330 WeakPolarHBondContact O-CD 3.37Å; V324-R330 PolarHBondContact O-NH1 2.89Å; C326-R330 VanDerWaalsContact O-CG 3.25Å; C326-R330 WeakPolarHBondContact O-CG 3.43Å; C326-R330 PolarHBondContact O-N 3.32Å; P327-R330 PolarHBondContact O-N 3.25Å; R330-Y332 VanDerWaalsContact C-N 3.31Å; R330-S340 PolarHBondContact O-OG 3.43Å; R330-S340 VanDerWaalsContact O-OG 3.11Å; R330-G341 WeakPolarHBondContact O-CA 3.31Å; R330-G341 PolarHBondContact O-N 3.48Å; R330-D342 IonicContact CZ-OD1 3.16Å; R330-D342 IonicContact NH1-OD1 2.65Å; R330-D342 PolarHBondContact NH1-OD1 3.21Å; R330-D342 IonicContact NH2-OD1 2.77Å; R330-D342 PolarHBondContact NH2-OD1 3.09Å |
| 331 | T | 94.2 | Very high | 94.4 | Very high | 110 Ų | 110 | 71 Ų | 71 | 68% | 0.675 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.1 | -12.1 | 175.7 | 47.7 | 0 | 0 | 0 | 0 | 114.1 | P327 K328 L329 | P327-T331 PolarHBondContact O-N 3.02Å; P327-T331 VanDerWaalsContact O-N 3.09Å; P327-T331 PolarHBondContact O-OG1 3.48Å; K328-T331 PolarHBondContact O-N 3.44Å; K328-T331 PolarHBondContact O-OG1 3.07Å; L329-T331 VanDerWaalsContact C-N 3.26Å; L329-T331 PolarHBondContact O-N 3.39Å |
| 332 | Y | 95.4 | Very high | 94.7 | Very high | 86 Ų | 86 | 67.1 Ų | 67.1 | 34% | 0.337 | 38% | 0.376 | S | S | . | . | trans | -72.7 | 141.9 | 174.4 | -172.7 | -104.8 | 0 | 0 | 0 | 110.3 | K328 L329 R330 C334 P335 S340 H345 | K328-Y332 PolarHBondContact O-N 3.2Å; L329-Y332 VanDerWaalsContact O-CB 3.28Å; L329-Y332 WeakPolarHBondContact O-CB 3.37Å; L329-Y332 PolarHBondContact O-N 3.4Å; R330-Y332 VanDerWaalsContact C-N 3.31Å; Y332-C334 HydrophobicContact CE1-CB 4.41Å; Y332-P335 VanDerWaalsContact OH-CD 3.23Å; Y332-P335 WeakPolarHBondContact OH-CD 3.49Å; Y332-S340 WeakPolarHBondContact O-CA 3.11Å; Y332-S340 VanDerWaalsContact O-CB 3.31Å; Y332-S340 WeakPolarHBondContact O-CB 3.42Å; Y332-S340 PolarHBondContact O-OG 3.02Å; Y332-H345 WeakPolarHBondContact CD1-O 3.29Å; Y332-H345 WeakPolarHBondContact CE1-O 3.42Å | ||
| 333 | V | 95.8 | Very high | 94.9 | Very high | 87 Ų | 87 | 65.1 Ų | 65.1 | 53% | 0.527 | 37% | 0.371 | S | S | . | . | trans | -117.3 | 116.4 | 173.3 | -178 | 0 | 0 | 0 | 0 | 106.5 | P335 | V333-P335 WeakPolarHBondContact O-CD 3.46Š| ||
| 334 | C | 97.4 | Very high | 95 | Very high | 3 Ų | 3 | 59.9 Ų | 59.9 | 2% | 0.02 | 35% | 0.352 | C | S | . | . | trans | -62.5 | 123 | -179.1 | 173.8 | 0 | 0 | 0 | 0 | 110.4 | Y332 I336 G338 A339 H345 | Y332-C334 HydrophobicContact CE1-CB 4.41Å; C334-I336 PolarHBondContact O-N 2.98Å; C334-G338 VanDerWaalsContact O-CA 3.27Å; C334-G338 WeakPolarHBondContact O-CA 3.33Å; C334-G338 PolarHBondContact O-N 2.87Å; C334-A339 PolarHBondContact N-O 3.12Å; C334-H345 PolarHBondContact SG-NE2 2.8Å; C334-H345 VanDerWaalsContact SG-NE2 3.39Å | ||
| 335 | P | 96 | Very high | 94.9 | Very high | 107 Ų | 107 | 63.3 Ų | 63.3 | 70% | 0.695 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -13.5 | -176.7 | 28.4 | -35.5 | 0 | 0 | 0 | 113.4 | Y332 V333 | Y332-P335 VanDerWaalsContact OH-CD 3.23Å; Y332-P335 WeakPolarHBondContact OH-CD 3.49Å; V333-P335 WeakPolarHBondContact O-CD 3.46Å |
| 336 | I | 96.9 | Very high | 94.8 | Very high | 156 Ų | 156 | 65.9 Ų | 65.9 | 80% | 0.8 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -41 | -178.6 | -55.5 | 174.1 | 0 | 0 | 0 | 111.3 | C334 | C334-I336 PolarHBondContact O-N 2.98Š|
| 337 | C | 96.7 | Very high | 94.8 | Very high | 79 Ų | 79 | 69.2 Ų | 69.2 | 53% | 0.534 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -126.4 | -3.8 | -172.9 | 71.8 | 0 | 0 | 0 | 0 | 115.4 | A339 H345 | C337-A339 PolarHBondContact O-N 3.02Å; C337-A339 VanDerWaalsContact SG-CB 3.52Å; C337-H345 PolarHBondContact SG-CE1 2.85Å; C337-H345 PolarHBondContact SG-NE2 3.05Å; C337-H345 VanDerWaalsContact SG-NE2 3.44Å |
| 338 | G | 93.8 | Very high | 94.9 | Very high | 49 Ų | 49 | 69 Ų | 69 | 51% | 0.505 | 40% | 0.402 | S | S | . | . | trans | 73 | 2.7 | -179 | 0 | 0 | 0 | 0 | 0 | 115.7 | C334 | C334-G338 VanDerWaalsContact O-CA 3.27Å; C334-G338 WeakPolarHBondContact O-CA 3.33Å; C334-G338 PolarHBondContact O-N 2.87Å | ||
| 339 | A | 95.4 | Very high | 94.9 | Very high | 20 Ų | 20 | 67.2 Ų | 67.2 | 17% | 0.165 | 40% | 0.4 | C | S | . | . | trans | -64 | 139.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | C334 C337 | C334-A339 PolarHBondContact N-O 3.12Å; C337-A339 PolarHBondContact O-N 3.02Å; C337-A339 VanDerWaalsContact SG-CB 3.52Å | ||
| 340 | S | 95 | Very high | 94.9 | Very high | 45 Ų | 45 | 70.5 Ų | 70.5 | 32% | 0.315 | 42% | 0.421 | S | S | . | . | trans | -156.6 | 173.5 | -177.1 | -165.4 | 0 | 0 | 0 | 0 | 110.6 | R330 Y332 D342 S343 | R330-S340 PolarHBondContact O-OG 3.43Å; R330-S340 VanDerWaalsContact O-OG 3.11Å; Y332-S340 WeakPolarHBondContact O-CA 3.11Å; Y332-S340 VanDerWaalsContact O-CB 3.31Å; Y332-S340 WeakPolarHBondContact O-CB 3.42Å; Y332-S340 PolarHBondContact O-OG 3.02Å; S340-D342 PolarHBondContact O-N 3.45Å; S340-S343 PolarHBondContact O-OG 2.92Å | ||
| 341 | G | 94.1 | Very high | 94.9 | Very high | 18 Ų | 18 | 69.7 Ų | 69.7 | 19% | 0.186 | 43% | 0.427 | C | S | . | . | G | 310 helix | trans | 63.5 | -123.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | R330 S343 A344 | R330-G341 WeakPolarHBondContact O-CA 3.31Å; R330-G341 PolarHBondContact O-N 3.48Å; G341-S343 VanDerWaalsContact C-N 3.25Å; G341-S343 PolarHBondContact O-N 3.15Å; G341-A344 WeakPolarHBondContact O-CB 3.44Å; G341-A344 PolarHBondContact O-N 3.16Å |
| 342 | D | 94.4 | Very high | 94.9 | Very high | 79 Ų | 79 | 67 Ų | 67 | 42% | 0.422 | 41% | 0.411 | S | S | . | . | G | 310 helix | trans | -63 | -28.3 | -174.9 | -69.1 | -13.8 | 0 | 0 | 0 | 113.7 | R323 V324 R330 S340 | R323-D342 HydrophobicContact CB-CB 4.43Å; R323-D342 HydrophobicContact CG-CB 4.48Å; V324-D342 PolarHBondContact N-O 2.86Å; R330-D342 IonicContact CZ-OD1 3.16Å; R330-D342 IonicContact NH1-OD1 2.65Å; R330-D342 PolarHBondContact NH1-OD1 3.21Å; R330-D342 IonicContact NH2-OD1 2.77Å; R330-D342 PolarHBondContact NH2-OD1 3.09Å; S340-D342 PolarHBondContact O-N 3.45Å |
| 343 | S | 93.1 | Very high | 94.9 | Very high | 77 Ų | 77 | 65.6 Ų | 65.6 | 54% | 0.538 | 42% | 0.416 | S | S | . | . | G | 310 helix | trans | -106.5 | 11.6 | -178.1 | 59.4 | 0 | 0 | 0 | 0 | 113.9 | S340 G341 H345 | S340-S343 PolarHBondContact O-OG 2.92Å; G341-S343 VanDerWaalsContact C-N 3.25Å; G341-S343 PolarHBondContact O-N 3.15Å; S343-H345 PolarHBondContact O-ND1 2.91Å; S343-H345 VanDerWaalsContact O-ND1 3.12Å |
| 344 | A | 94.5 | Very high | 94.8 | Very high | 2 Ų | 2 | 64 Ų | 64 | 2% | 0.017 | 41% | 0.407 | C | S | . | . | trans | -59.6 | 141.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | V324 L329 G341 | V324-A344 VanDerWaalsContact CG2-O 3.29Å; V324-A344 WeakPolarHBondContact CG2-O 3.39Å; L329-A344 HydrophobicContact CG-CB 4.29Å; L329-A344 WeakPolarHBondContact O-CB 3.46Å; G341-A344 WeakPolarHBondContact O-CB 3.44Å; G341-A344 PolarHBondContact O-N 3.16Å | ||
| 345 | H | 93.4 | Very high | 94.6 | Very high | 74 Ų | 74 | 69.1 Ų | 69.1 | 34% | 0.343 | 44% | 0.439 | S | S | . | . | trans | -154.5 | 151.7 | 174.8 | 55.5 | -87.9 | 0 | 0 | 0 | 108.7 | Y332 C334 C337 S343 | Y332-H345 WeakPolarHBondContact CD1-O 3.29Å; Y332-H345 WeakPolarHBondContact CE1-O 3.42Å; C334-H345 PolarHBondContact SG-NE2 2.8Å; C334-H345 VanDerWaalsContact SG-NE2 3.39Å; C337-H345 PolarHBondContact SG-CE1 2.85Å; C337-H345 PolarHBondContact SG-NE2 3.05Å; C337-H345 VanDerWaalsContact SG-NE2 3.44Å; S343-H345 PolarHBondContact O-ND1 2.91Å; S343-H345 VanDerWaalsContact O-ND1 3.12Å | ||
| 346 | T | 91.9 | Very high | 94.5 | Very high | 123 Ų | 123 | 65.6 Ų | 65.6 | 76% | 0.755 | 42% | 0.416 | S | S | * | . | trans | -81.5 | 0 | 169.5 | 53.7 | 0 | 0 | 0 | 0 | 110.8 | F301 L329 | F301-T346 HydrophobicContact CE2-CG2 3.79Å; F301-T346 HydrophobicContact CZ-CG2 4.32Å; L329-T346 HydrophobicContact CD1-CG2 3.99Å |
Retrieved 346 of 346 residues in 161.1 ms
(Link to these results)