| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.5 | Very low | 34.6 | Very low | 248 Ų | 248 | 134.9 Ų | 134.9 | 100% | 1.222 | 82% | 0.822 | S | S | * | * | 0 | 142.8 | 0 | -53.9 | 175.4 | -167.4 | 0 | 0 | 107.2 | |||||
| 2 | A | 30.8 | Very low | 34.6 | Very low | 93 Ų | 93 | 136.1 Ų | 136.1 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | cis | -166.6 | 154.9 | -21.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 3 | A | 33.1 | Very low | 34.5 | Very low | 95 Ų | 95 | 140.5 Ų | 140.5 | 79% | 0.785 | 82% | 0.824 | S | S | * | * | trans | 62.9 | 167.3 | 165 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 4 | S | 37.7 | Very low | 34.5 | Very low | 104 Ų | 104 | 140.9 Ų | 140.9 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | cis | -168.8 | 149.2 | -44.8 | -94.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 5 | V | 36.6 | Very low | 34.4 | Very low | 123 Ų | 123 | 138.2 Ų | 138.2 | 75% | 0.745 | 82% | 0.822 | S | S | * | * | trans | 39.7 | 122.2 | 138.6 | -178.1 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 6 | L | 37 | Very low | 34.3 | Very low | 174 Ų | 174 | 144.3 Ų | 144.3 | 91% | 0.911 | 83% | 0.826 | S | S | * | * | -146.5 | 156.2 | 122.9 | -109.6 | 177.2 | 0 | 0 | 0 | 112 | |||||
| 7 | E | 38.5 | Very low | 34.1 | Very low | 160 Ų | 160 | 149.9 Ų | 149.9 | 75% | 0.748 | 83% | 0.833 | S | S | * | * | trans | -131.5 | 170.5 | -167.5 | -130.1 | -171.9 | 103.7 | 0 | 0 | 108.4 | ||||
| 8 | V | 35.1 | Very low | 34 | Very low | 131 Ų | 131 | 144.6 Ų | 144.6 | 79% | 0.794 | 82% | 0.817 | S | S | * | * | cis | -148.8 | 154.7 | 22.4 | -171.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 9 | G | 30.9 | Very low | 34 | Very low | 70 Ų | 70 | 143.9 Ų | 143.9 | 72% | 0.722 | 82% | 0.823 | S | S | * | * | trans | 162.9 | 111.1 | 156.9 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 10 | N | 35.1 | Very low | 33.8 | Very low | 159 Ų | 159 | 142.4 Ų | 142.4 | 85% | 0.85 | 82% | 0.821 | S | S | * | * | trans | -77.4 | 162.5 | 164.6 | -76 | -30.3 | 0 | 0 | 0 | 110.5 | ||||
| 11 | V | 31.6 | Very low | 34.1 | Very low | 127 Ų | 127 | 141.9 Ų | 141.9 | 77% | 0.77 | 82% | 0.823 | S | S | * | * | -163.7 | 130.3 | 61.7 | 160.8 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 12 | I | 34.3 | Very low | 34 | Very low | 149 Ų | 149 | 138.2 Ų | 138.2 | 76% | 0.764 | 81% | 0.807 | S | S | * | * | trans | 3.8 | 137.3 | 141 | -9.8 | 175 | 0 | 0 | 0 | 116.5 | ||||
| 13 | E | 33.3 | Very low | 34.1 | Very low | 193 Ų | 193 | 138 Ų | 138 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | cis | -146.4 | 164.2 | 42.9 | -77.8 | -170.5 | 121.1 | 0 | 0 | 115.2 | ||||
| 14 | D | 35.1 | Very low | 34.3 | Very low | 146 Ų | 146 | 142.3 Ų | 142.3 | 78% | 0.781 | 81% | 0.812 | S | S | * | * | trans | -141.2 | 143.2 | -178.9 | -165.9 | -8.6 | 0 | 0 | 0 | 110.8 | ||||
| 15 | A | 32 | Very low | 34.1 | Very low | 101 Ų | 101 | 145.6 Ų | 145.6 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -156.2 | 74 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 16 | R | 34 | Very low | 33.9 | Very low | 235 Ų | 235 | 146.6 Ų | 146.6 | 89% | 0.887 | 83% | 0.827 | S | S | * | * | trans | -95.5 | 143.4 | 162.2 | -63.6 | -170.6 | -176.6 | -154.6 | 2.3 | 111 | ||||
| 17 | Y | 30.8 | Very low | 33.7 | Very low | 241 Ų | 241 | 142.2 Ų | 142.2 | 95% | 0.945 | 82% | 0.816 | S | S | * | * | trans | -137.4 | 150.5 | 168.6 | -138.6 | -88.8 | 0 | 0 | 0 | 111.3 | ||||
| 18 | G | 31.6 | Very low | 33.5 | Very low | 54 Ų | 54 | 141.6 Ų | 141.6 | 56% | 0.557 | 82% | 0.823 | S | S | * | * | trans | 178.2 | -166.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 19 | S | 33.4 | Very low | 33.2 | Very low | 131 Ų | 131 | 140.2 Ų | 140.2 | 92% | 0.916 | 82% | 0.818 | S | S | * | * | trans | 83 | 146.5 | 174.1 | -56.9 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 20 | S | 30.9 | Very low | 33.3 | Very low | 113 Ų | 113 | 144.2 Ų | 144.2 | 79% | 0.79 | 82% | 0.823 | S | S | * | * | trans | -65.9 | 151.5 | -168.9 | -45.1 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 21 | P | 40.6 | Very low | 33.3 | Very low | 133 Ų | 133 | 145.3 Ų | 145.3 | 86% | 0.864 | 82% | 0.82 | S | S | * | * | trans | -92 | 99 | 171.7 | 34.4 | -30.9 | 0 | 0 | 0 | 112.5 | ||||
| 22 | L | 31.6 | Very low | 33.2 | Very low | 170 Ų | 170 | 148.2 Ų | 148.2 | 89% | 0.89 | 82% | 0.823 | S | S | * | * | trans | -153.1 | 53.5 | 169.4 | -139.9 | 171 | 0 | 0 | 0 | 113.9 | ||||
| 23 | A | 32.4 | Very low | 33 | Very low | 89 Ų | 89 | 144.4 Ų | 144.4 | 74% | 0.736 | 82% | 0.82 | S | S | * | * | trans | -156.6 | 175.3 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 24 | M | 37 | Very low | 33 | Very low | 186 Ų | 186 | 140.7 Ų | 140.7 | 92% | 0.916 | 82% | 0.816 | S | S | * | * | trans | 83.5 | 71.4 | 174.7 | -60.5 | -66 | 135.2 | 0 | 0 | 117.7 | ||||
| 25 | L | 35.3 | Very low | 32.8 | Very low | 173 Ų | 173 | 140.7 Ų | 140.7 | 91% | 0.906 | 82% | 0.821 | S | S | * | * | trans | -116.7 | 112.6 | 150 | -107.1 | 169.1 | 0 | 0 | 0 | 108 | ||||
| 26 | T | 32.2 | Very low | 33 | Very low | 143 Ų | 143 | 141.4 Ų | 141.4 | 88% | 0.877 | 82% | 0.82 | S | S | * | * | trans | 172.2 | 145.2 | 146.2 | -76.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 27 | A | 31.4 | Very low | 33.7 | Very low | 83 Ų | 83 | 135.8 Ų | 135.8 | 69% | 0.686 | 81% | 0.814 | S | S | * | * | trans | -60.4 | 162.1 | -169.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 28 | T | 34.1 | Very low | 33.7 | Very low | 147 Ų | 147 | 131.7 Ų | 131.7 | 90% | 0.902 | 81% | 0.807 | S | S | * | * | trans | -136.9 | 143.2 | 152.4 | -25.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 29 | C | 29.8 | Very low | 33.8 | Very low | 102 Ų | 102 | 139.1 Ų | 139.1 | 69% | 0.689 | 82% | 0.818 | S | S | * | * | trans | -125.5 | 144 | -172.5 | -66.1 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 30 | N | 33.5 | Very low | 33.5 | Very low | 153 Ų | 153 | 138.2 Ų | 138.2 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | 55.8 | 112.5 | 148.4 | -62.9 | -22.6 | 0 | 0 | 0 | 122.4 | ||||
| 31 | K | 33.5 | Very low | 33.7 | Very low | 183 Ų | 183 | 137.9 Ų | 137.9 | 80% | 0.796 | 80% | 0.8 | S | S | * | * | 168.4 | 153.4 | 121.5 | -102.3 | 173.5 | 173.1 | 172.3 | 0 | 109.6 | |||||
| 32 | F | 30 | Very low | 33.1 | Very low | 188 Ų | 188 | 136.1 Ų | 136.1 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | cis | -115.4 | 178.7 | 1.7 | -69.2 | -112.6 | 0 | 0 | 0 | 108.9 | ||||
| 33 | G | 30.1 | Very low | 33.3 | Very low | 68 Ų | 68 | 134.7 Ų | 134.7 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | cis | 95.3 | 128.9 | 15.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 34 | S | 33.6 | Very low | 34 | Very low | 116 Ų | 116 | 136.4 Ų | 136.4 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | cis | -177 | 136.9 | -6 | 47.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 35 | T | 32.1 | Very low | 33.7 | Very low | 145 Ų | 145 | 130.6 Ų | 130.6 | 89% | 0.89 | 79% | 0.787 | S | S | * | * | trans | -158.9 | 140.4 | 161 | 32.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 36 | S | 35.5 | Very low | 33.6 | Very low | 117 Ų | 117 | 132.2 Ų | 132.2 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -150.2 | 147.3 | 169.1 | -59.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 37 | P | 49.3 | Very low | 33.6 | Very low | 117 Ų | 117 | 132.1 Ų | 132.1 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | -133.4 | 147.6 | 117.1 | 10.4 | 12.3 | 0 | 0 | 0 | 111.7 | |||||
| 38 | I | 30.8 | Very low | 33.6 | Very low | 155 Ų | 155 | 131.2 Ų | 131.2 | 80% | 0.795 | 79% | 0.785 | S | S | * | * | 57.7 | 119.4 | 71.5 | -57.3 | 177.7 | 0 | 0 | 0 | 110.5 | |||||
| 39 | R | 33.4 | Very low | 33.3 | Very low | 210 Ų | 210 | 130.2 Ų | 130.2 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | cis | -132.7 | -171.6 | 29.4 | -120.2 | 159.6 | 78.2 | 156.5 | 10.8 | 110 | ||||
| 40 | D | 27.1 | Very low | 33.3 | Very low | 112 Ų | 112 | 130.8 Ų | 130.8 | 60% | 0.599 | 79% | 0.789 | S | S | * | * | cis | -149.7 | -167.4 | 11.1 | -144.3 | -28 | 0 | 0 | 0 | 114 | ||||
| 41 | S | 34.2 | Very low | 34.1 | Very low | 105 Ų | 105 | 129.3 Ų | 129.3 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | trans | -83 | 143.5 | -168.9 | -52.3 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 42 | A | 28.2 | Very low | 33.9 | Very low | 97 Ų | 97 | 127 Ų | 127 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | -167.2 | 121.7 | 121.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 43 | T | 35.8 | Very low | 34 | Very low | 140 Ų | 140 | 127.3 Ų | 127.3 | 86% | 0.859 | 79% | 0.79 | S | S | * | * | trans | -137.6 | 176.2 | 168.7 | 51.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 44 | P | 48 | Very low | 34 | Very low | 125 Ų | 125 | 134.1 Ų | 134.1 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | cis | -133 | -175.3 | 13.9 | 42 | -23.2 | 0 | 0 | 0 | 114.9 | ||||
| 45 | G | 29.2 | Very low | 33.6 | Very low | 64 Ų | 64 | 136.9 Ų | 136.9 | 66% | 0.66 | 80% | 0.8 | S | S | * | * | cis | 144.7 | 169.7 | -8.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 46 | K | 34.6 | Very low | 33.6 | Very low | 207 Ų | 207 | 141 Ų | 141 | 90% | 0.9 | 80% | 0.801 | S | S | * | * | trans | 66.3 | 148.8 | 177.6 | -62 | 177.8 | 179.2 | 177.6 | 0 | 114.9 | ||||
| 47 | T | 31.7 | Very low | 33.3 | Very low | 140 Ų | 140 | 141.4 Ų | 141.4 | 86% | 0.859 | 80% | 0.799 | S | S | * | * | cis | -160.4 | 160.6 | -7.8 | 19 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 48 | G | 30.1 | Very low | 32.8 | Very low | 64 Ų | 64 | 145 Ų | 145 | 66% | 0.66 | 81% | 0.808 | S | S | * | * | cis | 163.5 | 167.2 | 3.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 49 | S | 29.3 | Very low | 32.8 | Very low | 127 Ų | 127 | 144.4 Ų | 144.4 | 89% | 0.888 | 81% | 0.811 | S | S | * | * | trans | 69.7 | 159.1 | 172.5 | -61.6 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 50 | S | 30.3 | Very low | 32.8 | Very low | 114 Ų | 114 | 139 Ų | 139 | 80% | 0.797 | 81% | 0.806 | S | S | * | * | trans | -134.1 | -152.4 | -170.3 | -55.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 51 | P | 49.1 | Very low | 33.1 | Very low | 122 Ų | 122 | 140.1 Ų | 140.1 | 79% | 0.792 | 81% | 0.812 | S | S | * | * | -120.4 | 145.5 | -105.9 | 36.1 | -19.6 | 0 | 0 | 0 | 114.9 | |||||
| 52 | V | 30.3 | Very low | 33.1 | Very low | 134 Ų | 134 | 142.2 Ų | 142.2 | 81% | 0.812 | 81% | 0.814 | S | S | * | * | trans | -134 | 133.9 | 175 | -178.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 53 | K | 31.2 | Very low | 33.4 | Very low | 194 Ų | 194 | 145.3 Ų | 145.3 | 84% | 0.843 | 81% | 0.812 | S | S | * | * | trans | -8.9 | 134.7 | 159.7 | -51.6 | 167.9 | -174.7 | 175.2 | 0 | 116.5 | ||||
| 54 | K | 29.5 | Very low | 33.2 | Very low | 212 Ų | 212 | 145 Ų | 145 | 92% | 0.922 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -99.7 | 122.1 | 152.3 | -76.8 | -166.3 | 173.5 | -173.8 | 0 | 110.3 | ||
| 55 | Q | 26.3 | Very low | 32.3 | Very low | 174 Ų | 174 | 144 Ų | 144 | 81% | 0.813 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 157.2 | 176.1 | -173.2 | 171.3 | -60.1 | 0 | 0 | 109.4 | ||
| 56 | Y | 32.2 | Very low | 32.6 | Very low | 232 Ų | 232 | 150.1 Ų | 150.1 | 91% | 0.91 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 137 | 173.9 | -67.6 | -95.1 | 0 | 0 | 0 | 111 | ||
| 57 | T | 29 | Very low | 32.6 | Very low | 124 Ų | 124 | 148.3 Ų | 148.3 | 76% | 0.761 | 82% | 0.821 | S | S | * | * | trans | -142.7 | 126.3 | 166.6 | 48.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 58 | M | 38.5 | Very low | 32.4 | Very low | 194 Ų | 194 | 145 Ų | 145 | 96% | 0.956 | 82% | 0.815 | S | S | * | * | trans | -93.8 | 137.3 | 167.3 | -66.7 | -125.3 | -162.3 | 0 | 0 | 109.4 | ||||
| 59 | T | 31.4 | Very low | 32.6 | Very low | 141 Ų | 141 | 153.3 Ų | 153.3 | 87% | 0.865 | 83% | 0.826 | S | S | * | * | trans | -146.1 | 149.3 | 162.2 | 46.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 60 | S | 33.3 | Very low | 32.7 | Very low | 98 Ų | 98 | 152.6 Ų | 152.6 | 69% | 0.685 | 82% | 0.816 | S | S | * | * | trans | -101.4 | -175.3 | -171.2 | 47 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 61 | D | 31.9 | Very low | 33.1 | Very low | 134 Ų | 134 | 151.7 Ų | 151.7 | 72% | 0.717 | 81% | 0.81 | S | S | * | * | trans | 82.3 | 94.2 | 153.8 | -55 | -54 | 0 | 0 | 0 | 121.1 | ||||
| 62 | L | 34.4 | Very low | 32.1 | Very low | 150 Ų | 150 | 153.2 Ų | 153.2 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | 76.1 | 155.1 | 115.3 | -136.8 | 73.4 | 0 | 0 | 0 | 121.5 | |||||
| 63 | Q | 34.6 | Very low | 32.4 | Very low | 162 Ų | 162 | 152 Ų | 152 | 76% | 0.757 | 81% | 0.809 | S | S | * | * | trans | 78.2 | 100.3 | 162.3 | -68.3 | 175.8 | 6.9 | 0 | 0 | 120.4 | ||||
| 64 | T | 31.6 | Very low | 32.6 | Very low | 132 Ų | 132 | 148.6 Ų | 148.6 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | 62.3 | 110.6 | 117.1 | -48.5 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 65 | A | 30.1 | Very low | 32.7 | Very low | 104 Ų | 104 | 141.6 Ų | 141.6 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | -142 | 127.2 | 146.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 66 | K | 36.2 | Very low | 33.2 | Very low | 193 Ų | 193 | 141.2 Ų | 141.2 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | -92.1 | 139.4 | 167.2 | -84.6 | 177.7 | 174.3 | 174.4 | 0 | 109.7 | ||||
| 67 | N | 33.4 | Very low | 33.4 | Very low | 169 Ų | 169 | 135.5 Ų | 135.5 | 90% | 0.904 | 79% | 0.789 | S | S | * | * | trans | -152.3 | 136 | 139.2 | -80.7 | -42.7 | 0 | 0 | 0 | 104.7 | ||||
| 68 | G | 28.7 | Very low | 33.5 | Very low | 71 Ų | 71 | 136.2 Ų | 136.2 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | cis | 105.5 | 120.9 | 22.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 69 | R | 32.6 | Very low | 33.4 | Very low | 239 Ų | 239 | 131.6 Ų | 131.6 | 90% | 0.902 | 78% | 0.775 | S | S | * | * | cis | -167.7 | 167.8 | 8.1 | -164 | -170.7 | -173.6 | 171.9 | 2.3 | 110.3 | ||||
| 70 | V | 33.1 | Very low | 33.3 | Very low | 112 Ų | 112 | 135.6 Ų | 135.6 | 68% | 0.679 | 78% | 0.776 | S | S | * | * | trans | 80.3 | 102.2 | 162.3 | -163 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 71 | S | 37.6 | Very low | 33.5 | Very low | 95 Ų | 95 | 136.9 Ų | 136.9 | 66% | 0.664 | 78% | 0.78 | S | S | * | * | 28.1 | 170.4 | 107.2 | -16.3 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 72 | D | 29 | Very low | 33.4 | Very low | 154 Ų | 154 | 134.1 Ų | 134.1 | 82% | 0.824 | 78% | 0.783 | S | S | * | * | cis | -148.6 | 178.7 | 10.1 | -119 | -42.2 | 0 | 0 | 0 | 112.8 | ||||
| 73 | S | 36.8 | Very low | 33.6 | Very low | 108 Ų | 108 | 132.3 Ų | 132.3 | 76% | 0.755 | 78% | 0.783 | S | S | * | * | trans | -125.3 | 153.3 | -168.6 | 60.9 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 74 | S | 34.6 | Very low | 33.4 | Very low | 123 Ų | 123 | 134 Ų | 134 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | -150.4 | 144.2 | 161.9 | -59.6 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 75 | G | 31.5 | Very low | 33.4 | Very low | 65 Ų | 65 | 133 Ų | 133 | 67% | 0.67 | 78% | 0.782 | S | S | * | * | cis | 93.4 | 124.8 | 20.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 76 | L | 37.1 | Very low | 33.5 | Very low | 165 Ų | 165 | 134.2 Ų | 134.2 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | cis | -145.9 | 176.7 | 0.2 | -71.3 | 172.1 | 0 | 0 | 0 | 107.8 | ||||
| 77 | T | 36.4 | Very low | 33.3 | Very low | 112 Ų | 112 | 129.8 Ų | 129.8 | 69% | 0.687 | 78% | 0.778 | S | S | * | * | cis | -133.1 | -131.3 | 6.9 | -24.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 78 | D | 30.2 | Very low | 33.1 | Very low | 140 Ų | 140 | 125.7 Ų | 125.7 | 75% | 0.749 | 78% | 0.776 | S | S | * | * | cis | -150.3 | 177.4 | -4.8 | -137.5 | -53.3 | 0 | 0 | 0 | 111.7 | ||||
| 79 | S | 36.4 | Very low | 33.3 | Very low | 96 Ų | 96 | 126.3 Ų | 126.3 | 67% | 0.671 | 78% | 0.782 | S | S | * | * | trans | -140.5 | 153.1 | -164.3 | -52.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 80 | Y | 29 | Very low | 33.1 | Very low | 226 Ų | 226 | 119.1 Ų | 119.1 | 89% | 0.886 | 78% | 0.782 | S | S | * | * | trans | -158.7 | 172 | 130.4 | -131.7 | -96.1 | 0 | 0 | 0 | 112.9 | ||||
| 81 | T | 38.3 | Very low | 33 | Very low | 124 Ų | 124 | 117.5 Ų | 117.5 | 76% | 0.761 | 79% | 0.789 | S | S | * | * | trans | -132.7 | 167.9 | -162.9 | 56.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 82 | G | 30.4 | Very low | 32.8 | Very low | 76 Ų | 76 | 116.6 Ų | 116.6 | 78% | 0.784 | 79% | 0.794 | S | S | * | * | trans | 118.7 | 145.6 | 152.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 83 | S | 37.8 | Very low | 32.9 | Very low | 112 Ų | 112 | 117.1 Ų | 117.1 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -122.3 | 152.9 | 163.4 | -60.8 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 84 | F | 29.7 | Very low | 32.7 | Very low | 199 Ų | 199 | 119.4 Ų | 119.4 | 87% | 0.873 | 80% | 0.799 | S | S | * | * | trans | -178.5 | 129.4 | 143.7 | -104.4 | -66.6 | 0 | 0 | 0 | 113.8 | ||||
| 85 | T | 32.7 | Very low | 32.9 | Very low | 111 Ų | 111 | 118.7 Ų | 118.7 | 68% | 0.681 | 79% | 0.794 | S | S | * | * | trans | 42.5 | 122.8 | 143.2 | 46.6 | 0 | 0 | 0 | 0 | 125.2 | ||||
| 86 | T | 31.8 | Very low | 33.8 | Very low | 129 Ų | 129 | 121.7 Ų | 121.7 | 79% | 0.791 | 80% | 0.802 | S | S | * | * | 92.3 | 123.7 | 114.6 | -60.8 | 0 | 0 | 0 | 0 | 123.7 | |||||
| 87 | A | 32.8 | Very low | 33.7 | Very low | 99 Ų | 99 | 120.7 Ų | 120.7 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | 77.2 | 144.8 | 146.6 | 0 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 88 | G | 29.1 | Very low | 33.4 | Very low | 84 Ų | 84 | 118.9 Ų | 118.9 | 87% | 0.866 | 81% | 0.807 | S | S | * | * | trans | 99.1 | 132.5 | 165.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 89 | G | 32 | Very low | 33.5 | Very low | 83 Ų | 83 | 118 Ų | 118 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | cis | 164.7 | 136.3 | -10.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 90 | G | 29.9 | Very low | 34.9 | Very low | 88 Ų | 88 | 119 Ų | 119 | 91% | 0.907 | 82% | 0.815 | S | S | * | * | trans | 94.9 | 142.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 91 | G | 31 | Very low | 35.7 | Very low | 79 Ų | 79 | 113.9 Ų | 113.9 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | cis | -151.8 | 179.2 | -1 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 92 | G | 32.2 | Very low | 36.1 | Very low | 76 Ų | 76 | 113.9 Ų | 113.9 | 78% | 0.784 | 81% | 0.812 | S | S | * | * | trans | -78.2 | -163.1 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 93 | L | 32.2 | Very low | 36.6 | Very low | 164 Ų | 164 | 116.3 Ų | 116.3 | 86% | 0.859 | 82% | 0.817 | S | S | * | * | cis | -162.3 | 165.7 | 30.1 | -102.9 | 175.5 | 0 | 0 | 0 | 113.7 | ||||
| 94 | L | 31.9 | Very low | 36.5 | Very low | 156 Ų | 156 | 116.1 Ų | 116.1 | 82% | 0.817 | 82% | 0.823 | S | S | * | * | trans | 71.5 | 111.5 | 157.8 | -67 | 160.7 | 0 | 0 | 0 | 120.7 | ||||
| 95 | S | 38.7 | Very low | 36.4 | Very low | 109 Ų | 109 | 110.3 Ų | 110.3 | 76% | 0.762 | 82% | 0.819 | S | S | * | * | trans | -85.3 | 168.6 | 137.7 | -50.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 96 | P | 49.5 | Very low | 36.1 | Very low | 127 Ų | 127 | 108.6 Ų | 108.6 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | -146.2 | 177 | 108.6 | 38 | -22.6 | 0 | 0 | 0 | 116.3 | |||||
| 97 | T | 35.3 | Very low | 36.1 | Very low | 144 Ų | 144 | 113.4 Ų | 113.4 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | trans | -71.9 | 157.7 | -176.3 | 50.6 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 98 | G | 30 | Very low | 36 | Very low | 75 Ų | 75 | 114.4 Ų | 114.4 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | trans | -176.1 | 128.6 | 158.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 99 | S | 32.7 | Very low | 36.1 | Very low | 120 Ų | 120 | 114.8 Ų | 114.8 | 84% | 0.839 | 81% | 0.814 | S | S | * | * | trans | -130.2 | -176.8 | 174.9 | -51.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 100 | P | 65.5 | Low | 36 | Very low | 117 Ų | 117 | 118.8 Ų | 118.8 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | -82.4 | 175 | -114.5 | 43 | -33 | 0 | 0 | 0 | 114.7 | |||||
| 101 | P | 45.9 | Very low | 35.9 | Very low | 120 Ų | 120 | 124.8 Ų | 124.8 | 78% | 0.779 | 81% | 0.807 | S | S | * | * | -149.4 | -155.1 | 100.6 | 37.6 | -15.9 | 0 | 0 | 0 | 112.8 | |||||
| 102 | P | 47.6 | Very low | 36.4 | Very low | 124 Ų | 124 | 128.4 Ų | 128.4 | 81% | 0.805 | 81% | 0.808 | S | S | * | * | -125.8 | 179.5 | -82.7 | 41 | -25.6 | 0 | 0 | 0 | 114.4 | |||||
| 103 | S | 41.2 | Very low | 36.5 | Very low | 126 Ų | 126 | 128.8 Ų | 128.8 | 88% | 0.881 | 80% | 0.797 | S | S | * | * | trans | -84.1 | 145.7 | -175.8 | -45.3 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 104 | A | 34.1 | Very low | 36.4 | Very low | 109 Ų | 109 | 128.9 Ų | 128.9 | 90% | 0.901 | 79% | 0.79 | S | S | * | * | trans | -154.5 | 152.3 | 156.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 105 | G | 27.7 | Very low | 36.3 | Very low | 77 Ų | 77 | 126.7 Ų | 126.7 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | cis | 158.8 | 100.2 | -6.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 106 | G | 27.1 | Very low | 36 | Very low | 75 Ų | 75 | 128.1 Ų | 128.1 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | trans | 84.9 | 154.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 107 | Y | 31 | Very low | 34.9 | Very low | 229 Ų | 229 | 127.3 Ų | 127.3 | 90% | 0.898 | 78% | 0.78 | S | S | * | * | cis | -142.8 | -172.7 | 3.8 | 52.4 | -91.6 | 0 | 0 | 0 | 111.6 | ||||
| 108 | T | 30.7 | Very low | 34.6 | Very low | 120 Ų | 120 | 129 Ų | 129 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | trans | -113.9 | 169.3 | -153.1 | 53.6 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 109 | S | 31.2 | Very low | 34.7 | Very low | 92 Ų | 92 | 134.5 Ų | 134.5 | 64% | 0.643 | 78% | 0.781 | S | S | * | * | trans | 71.3 | 151.8 | 159.3 | -66.8 | 0 | 0 | 0 | 0 | 118 | ||||
| 110 | E | 29.9 | Very low | 34.5 | Very low | 167 Ų | 167 | 135.7 Ų | 135.7 | 78% | 0.78 | 78% | 0.783 | S | S | * | * | cis | -170.4 | 131.7 | -25 | -116.8 | 165.5 | 116.6 | 0 | 0 | 107.9 | ||||
| 111 | Y | 28.8 | Very low | 32.8 | Very low | 214 Ų | 214 | 135.2 Ų | 135.2 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | trans | -171.4 | 139.8 | 138.7 | -135.8 | -114 | 0 | 0 | 0 | 112.4 | P113 | Y111-P113 HydrophobicContact CD1-CG 4.13Å; Y111-P113 HydrophobicContact CE1-CB 4.25Å; Y111-P113 HydrophobicContact CE1-CG 4.22Å | ||
| 112 | N | 40.6 | Very low | 32 | Very low | 155 Ų | 155 | 135.8 Ų | 135.8 | 83% | 0.829 | 78% | 0.783 | S | S | * | * | trans | -154.3 | 108.2 | 168.8 | -177 | 18.3 | 0 | 0 | 0 | 110.5 | ||||
| 113 | P | 35.9 | Very low | 31.1 | Very low | 85 Ų | 85 | 134.1 Ų | 134.1 | 55% | 0.552 | 78% | 0.775 | S | S | * | * | trans | -106.9 | 115.9 | 179.5 | 34 | -24.7 | 0 | 0 | 0 | 113.9 | Y111 | Y111-P113 HydrophobicContact CD1-CG 4.13Å; Y111-P113 HydrophobicContact CE1-CB 4.25Å; Y111-P113 HydrophobicContact CE1-CG 4.22Å | ||
| 114 | F | 29.1 | Very low | 30.7 | Very low | 166 Ų | 166 | 136.5 Ų | 136.5 | 73% | 0.728 | 77% | 0.772 | S | S | * | * | trans | 61.7 | 95.7 | 149.1 | -67.6 | -74.2 | 0 | 0 | 0 | 120.8 | H116 | F114-H116 AromaticContact CD1-CD2 3.39Å; F114-H116 WeakPolarHBondContact CD1-CD2 3.49Å; F114-H116 AromaticContact CD1-NE2 3.49Å; F114-H116 WeakPolarHBondContact CD1-NE2 3.39Å; F114-H116 AromaticContact CE1-CD2 3.98Å; F114-H116 AromaticContact CE1-NE2 3.58Å | ||
| 115 | S | 29.1 | Very low | 30.6 | Very low | 109 Ų | 109 | 138.8 Ų | 138.8 | 76% | 0.762 | 77% | 0.769 | S | S | * | * | -63.9 | 141.8 | 128.5 | 50.3 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 116 | H | 32.6 | Very low | 31.6 | Very low | 139 Ų | 139 | 140.1 Ų | 140.1 | 64% | 0.644 | 76% | 0.763 | S | S | * | * | trans | -145.7 | 107.7 | 156.1 | -103 | -62.7 | 0 | 0 | 0 | 110.5 | F114 F118 | F114-H116 AromaticContact CD1-CD2 3.39Å; F114-H116 WeakPolarHBondContact CD1-CD2 3.49Å; F114-H116 AromaticContact CD1-NE2 3.49Å; F114-H116 WeakPolarHBondContact CD1-NE2 3.39Å; F114-H116 AromaticContact CE1-CD2 3.98Å; F114-H116 AromaticContact CE1-NE2 3.58Å; H116-F118 AromaticContact ND1-CE2 3.78Å | ||
| 117 | S | 27.8 | Very low | 31.7 | Very low | 110 Ų | 110 | 141.8 Ų | 141.8 | 77% | 0.769 | 76% | 0.763 | S | S | * | * | trans | -87.1 | 138 | 164.1 | -57.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 118 | F | 27.6 | Very low | 31.8 | Very low | 180 Ų | 180 | 139 Ų | 139 | 79% | 0.789 | 76% | 0.763 | S | S | * | * | trans | -131.1 | 121.2 | 161.9 | -90.7 | -80.9 | 0 | 0 | 0 | 110 | H116 | H116-F118 AromaticContact ND1-CE2 3.78Š| ||
| 119 | Q | 33.3 | Very low | 32 | Very low | 191 Ų | 191 | 140.5 Ų | 140.5 | 89% | 0.893 | 77% | 0.766 | S | S | * | * | trans | -91.8 | 138.5 | 164.1 | -65.7 | 169.7 | -57.5 | 0 | 0 | 108.2 | ||||
| 120 | T | 28.4 | Very low | 31.8 | Very low | 144 Ų | 144 | 143.3 Ų | 143.3 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | trans | -139 | 140.6 | 160.5 | 49.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 121 | S | 30.3 | Very low | 31.9 | Very low | 107 Ų | 107 | 139.7 Ų | 139.7 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | trans | -118.2 | 141.9 | -165.1 | 53.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 122 | V | 28.9 | Very low | 32 | Very low | 132 Ų | 132 | 139.7 Ų | 139.7 | 80% | 0.8 | 78% | 0.776 | S | S | * | * | trans | 76.7 | 140.2 | 141.7 | 169.1 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 123 | S | 28.7 | Very low | 31.6 | Very low | 89 Ų | 89 | 137.2 Ų | 137.2 | 62% | 0.622 | 77% | 0.767 | S | S | * | * | trans | 72.5 | 102.8 | 158.5 | -72 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 124 | Q | 31.3 | Very low | 31.3 | Very low | 176 Ų | 176 | 141.5 Ų | 141.5 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | 61.7 | 126.1 | 107.3 | -73.4 | 177.7 | -38.8 | 0 | 0 | 123.4 | |||||
| 125 | D | 32.3 | Very low | 31.3 | Very low | 158 Ų | 158 | 138.6 Ų | 138.6 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | 79.4 | 147.4 | 143.7 | -98.3 | 34.1 | 0 | 0 | 0 | 123 | ||||
| 126 | P | 49.7 | Very low | 31.5 | Very low | 104 Ų | 104 | 139.7 Ų | 139.7 | 68% | 0.675 | 79% | 0.788 | S | S | * | * | trans | -116 | 147.9 | -164 | 40.2 | -27.9 | 0 | 0 | 0 | 114.7 | ||||
| 127 | S | 29.4 | Very low | 31.8 | Very low | 110 Ų | 110 | 139.2 Ų | 139.2 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | -169.5 | 135.3 | 146.6 | -86.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 128 | L | 32.7 | Very low | 32.1 | Very low | 172 Ų | 172 | 138 Ų | 138 | 90% | 0.901 | 79% | 0.793 | S | S | * | * | 179.2 | 146.6 | 105.4 | -93 | 174.6 | 0 | 0 | 0 | 111.6 | |||||
| 129 | L | 34 | Very low | 32.3 | Very low | 151 Ų | 151 | 136.8 Ų | 136.8 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | trans | -90 | 145.3 | 172.6 | -65.9 | 156.3 | 0 | 0 | 0 | 109.9 | ||||
| 130 | V | 28.5 | Very low | 32.2 | Very low | 150 Ų | 150 | 134.1 Ų | 134.1 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | trans | -135 | 116.3 | 146.4 | 179.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 131 | S | 31.8 | Very low | 32.5 | Very low | 92 Ų | 92 | 134.9 Ų | 134.9 | 64% | 0.643 | 79% | 0.794 | S | S | * | * | trans | -85.9 | 159.3 | 176.1 | -53.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 132 | K | 30.4 | Very low | 32.7 | Very low | 214 Ų | 214 | 136.2 Ų | 136.2 | 93% | 0.93 | 80% | 0.798 | S | S | * | * | trans | -133.6 | 136.9 | 150.8 | -160.6 | 163.3 | -173.7 | 172.1 | 0 | 109.5 | ||||
| 133 | T | 32.8 | Very low | 32.9 | Very low | 103 Ų | 103 | 135 Ų | 135 | 63% | 0.632 | 80% | 0.796 | S | S | * | * | trans | -121.5 | 172.5 | -157.5 | 45.6 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 134 | H | 29.5 | Very low | 33.2 | Very low | 175 Ų | 175 | 137.5 Ų | 137.5 | 81% | 0.81 | 81% | 0.807 | S | S | * | * | trans | 73.7 | 100.5 | 170.2 | -56 | -77.2 | 0 | 0 | 0 | 118.2 | ||||
| 135 | A | 27.6 | Very low | 33.2 | Very low | 104 Ų | 104 | 138.8 Ų | 138.8 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | -149.6 | 138.5 | 102.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 136 | T | 33.4 | Very low | 33.4 | Very low | 132 Ų | 132 | 137.2 Ų | 137.2 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | trans | -127.9 | 153.8 | 164.9 | 53.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 137 | P | 39.3 | Very low | 32.7 | Very low | 130 Ų | 130 | 136.7 Ų | 136.7 | 84% | 0.844 | 80% | 0.801 | S | S | * | * | -131.4 | 177.1 | 89.8 | 38.3 | -28.7 | 0 | 0 | 0 | 113.2 | |||||
| 138 | A | 34.1 | Very low | 33 | Very low | 83 Ų | 83 | 140 Ų | 140 | 69% | 0.686 | 81% | 0.809 | S | S | * | * | trans | -97.4 | -167.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 139 | D | 31.9 | Very low | 32.9 | Very low | 155 Ų | 155 | 138.1 Ų | 138.1 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | 71.5 | 75.4 | 167.1 | -56.6 | -29.4 | 0 | 0 | 0 | 118.4 | ||||
| 140 | C | 30.3 | Very low | 32.8 | Very low | 135 Ų | 135 | 138.6 Ų | 138.6 | 91% | 0.912 | 80% | 0.8 | S | S | * | * | trans | -142.1 | 117.3 | 141.2 | -114.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 141 | L | 36.1 | Very low | 33.3 | Very low | 161 Ų | 161 | 137 Ų | 137 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -91.7 | 170.3 | -178.9 | -77.3 | 171.9 | 0 | 0 | 0 | 112.8 | ||||
| 142 | T | 34.5 | Very low | 33.5 | Very low | 134 Ų | 134 | 140.3 Ų | 140.3 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | 84.1 | 106.9 | 163.5 | 68 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 143 | S | 32 | Very low | 34.1 | Very low | 108 Ų | 108 | 135 Ų | 135 | 76% | 0.755 | 78% | 0.783 | S | S | * | * | 59.7 | 100.1 | 124.2 | -177.1 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 144 | V | 36.2 | Very low | 34.4 | Very low | 141 Ų | 141 | 139.9 Ų | 139.9 | 86% | 0.855 | 79% | 0.791 | S | S | * | * | -132.8 | 132.6 | 123.8 | -178.9 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 145 | Y | 30.5 | Very low | 34.5 | Very low | 203 Ų | 203 | 134.4 Ų | 134.4 | 80% | 0.796 | 78% | 0.782 | S | S | * | * | trans | -127.6 | 105.9 | 178.7 | -170 | -71.3 | 0 | 0 | 0 | 109.7 | ||||
| 146 | T | 35.9 | Very low | 34.9 | Very low | 125 Ų | 125 | 134.3 Ų | 134.3 | 77% | 0.767 | 78% | 0.775 | S | S | * | * | trans | -151.7 | 95.3 | 161.5 | 45.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 147 | S | 36.3 | Very low | 34.8 | Very low | 93 Ų | 93 | 138.9 Ų | 138.9 | 65% | 0.65 | 78% | 0.778 | S | S | * | * | trans | 8.8 | 127.4 | 139 | -44 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 148 | L | 35.5 | Very low | 34.6 | Very low | 180 Ų | 180 | 142.3 Ų | 142.3 | 94% | 0.942 | 78% | 0.775 | S | S | * | * | trans | -126.3 | 96.5 | 142.3 | -85.1 | 175.8 | 0 | 0 | 0 | 109 | ||||
| 149 | D | 30 | Very low | 34.4 | Very low | 132 Ų | 132 | 148.3 Ų | 148.3 | 71% | 0.706 | 79% | 0.786 | S | S | * | * | trans | -89.3 | 105.2 | 178.9 | -170.1 | -18.2 | 0 | 0 | 0 | 110.2 | T151 | D149-T151 PolarHBondContact O-N 3.45Å; D149-T151 VanDerWaalsContact O-N 3.1Å | ||
| 150 | M | 32.3 | Very low | 34.4 | Very low | 160 Ų | 160 | 145 Ų | 145 | 79% | 0.788 | 78% | 0.78 | S | S | * | * | trans | -83.9 | 77.8 | 178.9 | -95.7 | -75.1 | 167.7 | 0 | 0 | 111 | H152 | M150-H152 PolarHBondContact O-N 2.86Š| ||
| 151 | T | 37.9 | Very low | 34.4 | Very low | 118 Ų | 118 | 142.2 Ų | 142.2 | 72% | 0.724 | 78% | 0.775 | S | S | * | * | trans | -68 | 94.6 | 176.2 | 42.3 | 0 | 0 | 0 | 0 | 112.1 | D149 | D149-T151 PolarHBondContact O-N 3.45Å; D149-T151 VanDerWaalsContact O-N 3.1Å | ||
| 152 | H | 37.3 | Very low | 34.4 | Very low | 160 Ų | 160 | 142 Ų | 142 | 74% | 0.741 | 77% | 0.772 | S | S | * | * | trans | -71.1 | 146.4 | 169.9 | -78.8 | -58.7 | 0 | 0 | 0 | 112.1 | M150 | M150-H152 PolarHBondContact O-N 2.86Š| ||
| 153 | P | 42.8 | Very low | 34.1 | Very low | 103 Ų | 103 | 144.2 Ų | 144.2 | 67% | 0.669 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -71 | 161.8 | -177.2 | 29.8 | -36 | 0 | 0 | 0 | 113 | ||
| 154 | Y | 38.4 | Very low | 34.3 | Very low | 205 Ų | 205 | 145.1 Ų | 145.1 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | 79.8 | 39.7 | -176.7 | -54.2 | -74.7 | 0 | 0 | 0 | 117 | ||||
| 155 | G | 32.1 | Very low | 34 | Very low | 60 Ų | 60 | 141.5 Ų | 141.5 | 62% | 0.619 | 77% | 0.768 | S | S | * | * | trans | -72.8 | 155.6 | 154.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 156 | S | 36.2 | Very low | 34.2 | Very low | 103 Ų | 103 | 140.4 Ų | 140.4 | 72% | 0.72 | 77% | 0.774 | S | S | * | * | trans | 56.2 | 87.8 | 160.4 | -60 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 157 | W | 31 | Very low | 34.1 | Very low | 227 Ų | 227 | 141 Ų | 141 | 86% | 0.86 | 78% | 0.778 | S | S | * | * | trans | -125.8 | 68.5 | 147.6 | 11.4 | -73.6 | 0 | 0 | 0 | 111.8 | ||||
| 158 | Y | 34.9 | Very low | 33.9 | Very low | 203 Ų | 203 | 141.4 Ų | 141.4 | 80% | 0.796 | 79% | 0.787 | S | S | * | * | trans | -132.7 | 111 | 153.7 | 62.5 | -82.3 | 0 | 0 | 0 | 108.4 | ||||
| 159 | K | 30.2 | Very low | 33.6 | Very low | 208 Ų | 208 | 137.2 Ų | 137.2 | 90% | 0.904 | 78% | 0.778 | S | S | * | * | trans | -102.1 | 101.4 | 174.9 | -174.5 | 176.4 | -178.5 | 178.2 | 0 | 108.2 | G161 | K159-G161 PolarHBondContact O-N 3.08Š| ||
| 160 | A | 32.1 | Very low | 34.2 | Very low | 85 Ų | 85 | 137.2 Ų | 137.2 | 70% | 0.702 | 79% | 0.785 | S | S | * | * | trans | -62.9 | 124.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 161 | G | 30.9 | Very low | 34.4 | Very low | 78 Ų | 78 | 134.6 Ų | 134.6 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | trans | -87.1 | 115.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | K159 | K159-G161 PolarHBondContact O-N 3.08Š| ||
| 162 | I | 34.3 | Very low | 34.2 | Very low | 155 Ų | 155 | 136.4 Ų | 136.4 | 80% | 0.795 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 128.9 | 179.8 | -66 | 172.9 | 0 | 0 | 0 | 109.8 | ||
| 163 | H | 28.8 | Very low | 33.9 | Very low | 181 Ų | 181 | 133.6 Ų | 133.6 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 128.5 | 159 | -96.7 | -110.4 | 0 | 0 | 0 | 109 | ||
| 164 | P | 36.5 | Very low | 33.5 | Very low | 128 Ų | 128 | 134.7 Ų | 134.7 | 83% | 0.831 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 125.9 | 177.4 | 31.6 | -32.5 | 0 | 0 | 0 | 111.3 | ||
| 165 | G | 30 | Very low | 33.2 | Very low | 65 Ų | 65 | 130.1 Ų | 130.1 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | trans | 164.3 | 146.2 | 168.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 166 | I | 35.2 | Very low | 33.2 | Very low | 179 Ų | 179 | 132.6 Ų | 132.6 | 92% | 0.918 | 81% | 0.809 | S | S | * | * | trans | 78.9 | 140.5 | 172.8 | -50.2 | 172.7 | 0 | 0 | 0 | 115.1 | ||||
| 167 | T | 33 | Very low | 32.8 | Very low | 138 Ų | 138 | 139.1 Ų | 139.1 | 85% | 0.847 | 82% | 0.818 | S | S | * | * | trans | -92.7 | 157.7 | -164.1 | -45.5 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 168 | A | 31.4 | Very low | 32.9 | Very low | 102 Ų | 102 | 139.9 Ų | 139.9 | 84% | 0.843 | 82% | 0.821 | S | S | * | * | trans | -72.5 | 145.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 169 | A | 30.7 | Very low | 32.9 | Very low | 92 Ų | 92 | 137.6 Ų | 137.6 | 76% | 0.76 | 82% | 0.823 | S | S | * | * | trans | -145.3 | 158.9 | 163.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 170 | P | 41.7 | Very low | 32.9 | Very low | 131 Ų | 131 | 134 Ų | 134 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | trans | -85.2 | 167.7 | -155.6 | 33.2 | -37.1 | 0 | 0 | 0 | 115.8 | ||||
| 171 | A | 36 | Very low | 33 | Very low | 105 Ų | 105 | 138.5 Ų | 138.5 | 87% | 0.868 | 82% | 0.824 | S | S | * | * | trans | -76.5 | 133.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 172 | N | 34 | Very low | 33.3 | Very low | 157 Ų | 157 | 140.7 Ų | 140.7 | 84% | 0.84 | 82% | 0.824 | S | S | * | * | -166.3 | 107 | 129.6 | -170 | 11.6 | 0 | 0 | 0 | 110.4 | |||||
| 173 | A | 31.4 | Very low | 33.1 | Very low | 100 Ų | 100 | 140.8 Ų | 140.8 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | trans | -160.7 | 129.7 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 174 | T | 34.8 | Very low | 33.3 | Very low | 127 Ų | 127 | 137 Ų | 137 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -100.9 | 155.6 | 174.2 | 45.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 175 | S | 32.3 | Very low | 33.1 | Very low | 108 Ų | 108 | 138.1 Ų | 138.1 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | S | Bend | trans | 77.8 | 147.1 | 158.7 | 78.2 | 0 | 0 | 0 | 0 | 120.4 | ||
| 176 | S | 31 | Very low | 33.1 | Very low | 112 Ų | 112 | 146.7 Ų | 146.7 | 78% | 0.783 | 83% | 0.831 | S | S | * | * | trans | 56.6 | 90.6 | 148.1 | -55.9 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 177 | W | 28 | Very low | 33 | Very low | 241 Ų | 241 | 145.7 Ų | 145.7 | 91% | 0.913 | 83% | 0.827 | S | S | * | * | trans | -114.4 | 64.3 | 169.3 | -164.4 | -1.2 | 0 | 0 | 0 | 113.6 | ||||
| 178 | W | 32.8 | Very low | 32.9 | Very low | 242 Ų | 242 | 145 Ų | 145 | 92% | 0.917 | 83% | 0.828 | S | S | * | * | trans | -150.6 | 88.1 | 155.8 | 4.1 | 72.2 | 0 | 0 | 0 | 110.7 | ||||
| 179 | D | 35.4 | Very low | 32.8 | Very low | 156 Ų | 156 | 144.3 Ų | 144.3 | 83% | 0.834 | 82% | 0.822 | S | S | * | * | trans | -162.3 | 123.8 | 150.6 | -107.7 | -40 | 0 | 0 | 0 | 109.6 | ||||
| 180 | V | 31.7 | Very low | 32.8 | Very low | 131 Ų | 131 | 146.4 Ų | 146.4 | 79% | 0.794 | 83% | 0.826 | S | S | * | * | trans | 166.2 | 111.4 | 153.9 | 156.3 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 181 | H | 33.2 | Very low | 32.5 | Very low | 181 Ų | 181 | 148 Ų | 148 | 84% | 0.838 | 82% | 0.822 | S | S | * | * | trans | -86.7 | 130.3 | 164.2 | -87 | -109 | 0 | 0 | 0 | 109.6 | N183 | H181-N183 PolarHBondContact O-N 3.33Š| ||
| 182 | P | 37.8 | Very low | 33 | Very low | 124 Ų | 124 | 148.9 Ų | 148.9 | 81% | 0.805 | 82% | 0.819 | S | S | * | * | trans | -89.9 | 91.7 | 179.2 | 33.9 | -32.9 | 0 | 0 | 0 | 111.6 | ||||
| 183 | N | 30.2 | Very low | 33 | Very low | 157 Ų | 157 | 149.7 Ų | 149.7 | 84% | 0.84 | 82% | 0.817 | S | S | * | * | trans | -156.6 | 92.3 | 163.5 | -159.2 | 17.9 | 0 | 0 | 0 | 114.9 | H181 | H181-N183 PolarHBondContact O-N 3.33Š| ||
| 184 | S | 32 | Very low | 33.1 | Very low | 101 Ų | 101 | 149.6 Ų | 149.6 | 71% | 0.706 | 82% | 0.817 | S | S | * | * | trans | -158.2 | 126.4 | 159.6 | 55.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 185 | N | 33.4 | Very low | 33.1 | Very low | 152 Ų | 152 | 151.7 Ų | 151.7 | 81% | 0.813 | 82% | 0.823 | S | S | * | * | trans | -64.7 | 136 | 176.1 | -85.6 | -44.6 | 0 | 0 | 0 | 111.4 | ||||
| 186 | W | 28.8 | Very low | 33.1 | Very low | 245 Ų | 245 | 150.5 Ų | 150.5 | 93% | 0.928 | 83% | 0.827 | S | S | * | * | trans | -89.7 | 114.2 | 157.3 | -89.8 | 76.3 | 0 | 0 | 0 | 109.2 | ||||
| 187 | L | 32.6 | Very low | 33.1 | Very low | 157 Ų | 157 | 150.5 Ų | 150.5 | 82% | 0.822 | 83% | 0.827 | S | S | * | * | trans | -112.4 | 137.1 | 164 | -86.4 | 166.1 | 0 | 0 | 0 | 108.6 | ||||
| 188 | S | 31.5 | Very low | 33.5 | Very low | 124 Ų | 124 | 147.2 Ų | 147.2 | 87% | 0.867 | 83% | 0.827 | S | S | * | * | trans | -80.1 | 141.5 | -167.4 | -44.7 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 189 | A | 29.3 | Very low | 33.5 | Very low | 87 Ų | 87 | 144.6 Ų | 144.6 | 72% | 0.719 | 83% | 0.825 | S | S | * | * | trans | -157.3 | 126 | 150.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 190 | T | 32 | Very low | 33.3 | Very low | 137 Ų | 137 | 141.9 Ų | 141.9 | 84% | 0.84 | 82% | 0.824 | S | S | * | * | trans | 35.7 | 121.6 | 145 | 53.6 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 191 | Q | 33.9 | Very low | 33.4 | Very low | 164 Ų | 164 | 140.9 Ų | 140.9 | 77% | 0.766 | 82% | 0.823 | S | S | * | * | trans | -62.3 | 160.7 | 149 | -143.3 | 178.9 | -4.8 | 0 | 0 | 111 | ||||
| 192 | P | 46.2 | Very low | 33.3 | Very low | 124 Ų | 124 | 139.4 Ų | 139.4 | 81% | 0.805 | 82% | 0.82 | S | S | * | * | -140.6 | -175.8 | 92.3 | 38.5 | -24.1 | 0 | 0 | 0 | 114.2 | |||||
| 193 | Q | 35.8 | Very low | 33.4 | Very low | 174 Ų | 174 | 141.8 Ų | 141.8 | 81% | 0.813 | 82% | 0.821 | S | S | * | * | trans | -92.8 | 165 | -176.9 | -60.3 | -172.7 | -91.2 | 0 | 0 | 114.1 | ||||
| 194 | A | 33.5 | Very low | 34.2 | Very low | 98 Ų | 98 | 139.7 Ų | 139.7 | 81% | 0.81 | 82% | 0.816 | S | S | * | * | trans | -146.5 | 149.1 | 151.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 195 | D | 33.6 | Very low | 34.2 | Very low | 171 Ų | 171 | 142 Ų | 142 | 91% | 0.914 | 83% | 0.826 | S | S | * | * | trans | -79.1 | 165.1 | 178.1 | -66.5 | -80 | 0 | 0 | 0 | 113.5 | ||||
| 196 | G | 31.8 | Very low | 34.4 | Very low | 82 Ų | 82 | 138.8 Ų | 138.8 | 85% | 0.845 | 82% | 0.82 | S | S | * | * | trans | 162.7 | 104.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 197 | S | 31.5 | Very low | 35.2 | Very low | 112 Ų | 112 | 133.1 Ų | 133.1 | 78% | 0.783 | 81% | 0.814 | S | S | * | * | trans | -98.9 | 152.2 | 174.9 | 55.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 198 | L | 35.7 | Very low | 35.2 | Very low | 172 Ų | 172 | 134.4 Ų | 134.4 | 90% | 0.901 | 82% | 0.816 | S | S | * | * | 174.4 | 163 | 124.5 | -91.4 | 169.6 | 0 | 0 | 0 | 112 | |||||
| 199 | Q | 33.7 | Very low | 35.2 | Very low | 187 Ų | 187 | 133 Ų | 133 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -108.4 | 148.8 | -176.7 | -63.8 | 157.7 | -115 | 0 | 0 | 111.9 | ||||
| 200 | A | 31.6 | Very low | 35.4 | Very low | 100 Ų | 100 | 134.9 Ų | 134.9 | 83% | 0.826 | 82% | 0.82 | S | S | * | * | trans | -167 | 121.7 | 143.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 201 | S | 32.3 | Very low | 35.4 | Very low | 109 Ų | 109 | 136.6 Ų | 136.6 | 76% | 0.762 | 82% | 0.823 | S | S | * | * | trans | 31.7 | 110.9 | 139.2 | -54.6 | 0 | 0 | 0 | 0 | 125.2 | ||||
| 202 | L | 32.6 | Very low | 35.4 | Very low | 150 Ų | 150 | 134.2 Ų | 134.2 | 79% | 0.785 | 83% | 0.825 | S | S | * | * | 58.3 | 102 | 114 | -63.3 | 169.8 | 0 | 0 | 0 | 123.8 | |||||
| 203 | Q | 39.6 | Very low | 35.5 | Very low | 174 Ų | 174 | 134.4 Ų | 134.4 | 81% | 0.813 | 83% | 0.826 | S | S | * | * | 60.8 | -176.4 | 129.4 | -52.6 | -165 | -34.3 | 0 | 0 | 119.6 | |||||
| 204 | P | 45.9 | Very low | 35.3 | Very low | 114 Ų | 114 | 134.7 Ų | 134.7 | 74% | 0.74 | 83% | 0.827 | S | S | * | * | -130.5 | 168.5 | -89.3 | 40.7 | -23.8 | 0 | 0 | 0 | 115.4 | |||||
| 205 | V | 33.6 | Very low | 35.3 | Very low | 150 Ų | 150 | 137.7 Ų | 137.7 | 91% | 0.909 | 83% | 0.829 | S | S | * | * | trans | -130.6 | 140.6 | 171.7 | 178.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 206 | A | 37.9 | Very low | 35.9 | Very low | 83 Ų | 83 | 135.5 Ų | 135.5 | 69% | 0.686 | 82% | 0.824 | S | S | * | * | trans | -96.2 | 164.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 207 | P | 43.7 | Very low | 35.8 | Very low | 126 Ų | 126 | 137.2 Ų | 137.2 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | -81.7 | 157.8 | -162.5 | 33 | -36.2 | 0 | 0 | 0 | 114.6 | ||||
| 208 | Q | 34.4 | Very low | 35.8 | Very low | 184 Ų | 184 | 142.3 Ų | 142.3 | 86% | 0.86 | 83% | 0.826 | S | S | * | * | trans | -105.5 | 144.2 | 166.1 | -74.3 | -64.2 | -36.1 | 0 | 0 | 110.4 | ||||
| 209 | A | 31.7 | Very low | 35.6 | Very low | 95 Ų | 95 | 138.6 Ų | 138.6 | 79% | 0.785 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -89.2 | 136.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 210 | S | 32.1 | Very low | 35.8 | Very low | 126 Ų | 126 | 133.8 Ų | 133.8 | 88% | 0.881 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 136.2 | 173.9 | -64.4 | 0 | 0 | 0 | 0 | 111.5 | ||
| 211 | L | 32 | Very low | 35.8 | Very low | 173 Ų | 173 | 135.3 Ų | 135.3 | 91% | 0.906 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 140.8 | -178.8 | -68.4 | 161.2 | 0 | 0 | 0 | 112 | ||
| 212 | S | 34.7 | Very low | 35.9 | Very low | 114 Ų | 114 | 139.9 Ų | 139.9 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 138 | 170.8 | -54.5 | 0 | 0 | 0 | 0 | 111.9 | ||
| 213 | P | 48.1 | Very low | 36.1 | Very low | 128 Ų | 128 | 138.8 Ų | 138.8 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 136.8 | 157.9 | -5.7 | 24.8 | 0 | 0 | 0 | 110.9 | ||
| 214 | Q | 32.3 | Very low | 36.2 | Very low | 181 Ų | 181 | 136.3 Ų | 136.3 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 157.8 | 168.1 | -73 | -74.9 | 2.6 | 0 | 0 | 110.8 | ||
| 215 | L | 33.5 | Very low | 35.5 | Very low | 161 Ų | 161 | 139.3 Ų | 139.3 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | trans | -110.7 | 147.7 | 167.1 | -77.4 | 172.2 | 0 | 0 | 0 | 110.6 | ||||
| 216 | P | 45.2 | Very low | 35.5 | Very low | 124 Ų | 124 | 139.3 Ų | 139.3 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | trans | -81.6 | 154.9 | -165.7 | 32.1 | -36.6 | 0 | 0 | 0 | 114.5 | ||||
| 217 | S | 30.9 | Very low | 36.5 | Very low | 118 Ų | 118 | 140.4 Ų | 140.4 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -87 | 156.5 | 176.1 | 49.7 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 218 | Y | 30.9 | Very low | 35.9 | Very low | 219 Ų | 219 | 138.8 Ų | 138.8 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -142.2 | 145.9 | 162.3 | -171.7 | -101.7 | 0 | 0 | 0 | 111.6 | ||||
| 219 | S | 31.3 | Very low | 36.4 | Very low | 94 Ų | 94 | 134.9 Ų | 134.9 | 66% | 0.657 | 79% | 0.793 | S | S | * | * | trans | -150.7 | 151.7 | -178.8 | -75.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 220 | S | 38.5 | Very low | 36.2 | Very low | 86 Ų | 86 | 140.8 Ų | 140.8 | 60% | 0.601 | 80% | 0.796 | S | S | * | * | cis | -162.4 | -149.7 | -3.2 | 43 | 0 | 0 | 0 | 0 | 109 | ||||
| 221 | D | 31.5 | Very low | 37 | Very low | 132 Ų | 132 | 140.8 Ų | 140.8 | 71% | 0.706 | 79% | 0.793 | S | S | * | * | trans | 96.2 | 113 | 155.1 | -50.7 | -9.3 | 0 | 0 | 0 | 117.8 | ||||
| 222 | F | 33.2 | Very low | 37.2 | Very low | 206 Ų | 206 | 137.5 Ų | 137.5 | 90% | 0.904 | 79% | 0.785 | S | S | * | * | -165.6 | 151 | 101.3 | -111.2 | -79.2 | 0 | 0 | 0 | 111.3 | |||||
| 223 | T | 37.2 | Very low | 37.4 | Very low | 126 Ų | 126 | 139.3 Ų | 139.3 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | trans | -106.4 | 153 | -178 | 39.7 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 224 | P | 40.9 | Very low | 36.6 | Very low | 122 Ų | 122 | 136.4 Ų | 136.4 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | trans | -89.5 | 156.6 | -176.3 | 35.6 | -35.8 | 0 | 0 | 0 | 114.2 | ||||
| 225 | L | 32.2 | Very low | 36.7 | Very low | 178 Ų | 178 | 136.7 Ų | 136.7 | 93% | 0.932 | 79% | 0.791 | S | S | * | * | trans | -110.4 | 162.9 | 169.8 | -70.6 | 173.1 | 0 | 0 | 0 | 111.6 | ||||
| 226 | N | 32.7 | Very low | 36.5 | Very low | 150 Ų | 150 | 132.6 Ų | 132.6 | 80% | 0.802 | 79% | 0.787 | S | S | * | * | trans | -158.9 | -177 | -168.6 | -159.3 | 26.2 | 0 | 0 | 0 | 109.7 | ||||
| 227 | P | 59.5 | Low | 35.9 | Very low | 106 Ų | 106 | 132.5 Ų | 132.5 | 69% | 0.688 | 79% | 0.79 | S | S | * | * | -103.1 | -177.8 | -78.3 | 34.8 | -21.9 | 0 | 0 | 0 | 113.7 | |||||
| 228 | A | 30.7 | Very low | 35.9 | Very low | 91 Ų | 91 | 132.7 Ų | 132.7 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | trans | 155.6 | 168.3 | 141 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 229 | P | 46.2 | Very low | 36.1 | Very low | 103 Ų | 103 | 127.8 Ų | 127.8 | 67% | 0.669 | 79% | 0.789 | S | S | * | * | -142.7 | 151.8 | -56.4 | 40.9 | -25 | 0 | 0 | 0 | 116.6 | |||||
| 230 | Y | 27.6 | Very low | 36.4 | Very low | 218 Ų | 218 | 131.5 Ų | 131.5 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | trans | 60.6 | 172.7 | 151.4 | -72.8 | -52.4 | 0 | 0 | 0 | 119.8 | ||||
| 231 | P | 48.3 | Very low | 36.2 | Very low | 126 Ų | 126 | 134.5 Ų | 134.5 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | cis | -120.9 | -179.8 | 1.1 | 42.8 | -29 | 0 | 0 | 0 | 116.1 | ||||
| 232 | S | 36.8 | Very low | 36.3 | Very low | 105 Ų | 105 | 136.5 Ų | 136.5 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | trans | -103.6 | 158.1 | -178.2 | -46.3 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 233 | V | 37.5 | Very low | 36.4 | Very low | 152 Ų | 152 | 135.3 Ų | 135.3 | 92% | 0.921 | 81% | 0.811 | S | S | * | * | trans | -127.1 | 156.5 | 152.6 | -70.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 234 | G | 32.7 | Very low | 36.3 | Very low | 66 Ų | 66 | 135 Ų | 135 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | trans | -142.2 | -151.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 235 | L | 34 | Very low | 35.9 | Very low | 188 Ų | 188 | 135.1 Ų | 135.1 | 98% | 0.984 | 82% | 0.815 | S | S | * | * | trans | 75 | 138.1 | -164.4 | -46.9 | 175.5 | 0 | 0 | 0 | 112.7 | ||||
| 236 | G | 27.7 | Very low | 36.2 | Very low | 75 Ų | 75 | 134.9 Ų | 134.9 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | cis | -162.7 | 160.2 | -4.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 237 | S | 33.7 | Very low | 36.3 | Very low | 122 Ų | 122 | 136.3 Ų | 136.3 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | trans | -80.6 | 139.3 | -176.4 | -49.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 238 | S | 30.4 | Very low | 35 | Very low | 122 Ų | 122 | 138.4 Ų | 138.4 | 85% | 0.853 | 81% | 0.813 | S | S | * | * | trans | -156.9 | 115.1 | 155.1 | -83.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 239 | S | 36.5 | Very low | 35.4 | Very low | 116 Ų | 116 | 141.4 Ų | 141.4 | 81% | 0.811 | 82% | 0.815 | S | S | * | * | trans | -99.2 | 116.8 | 178.8 | -57.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 240 | H | 36.4 | Very low | 35.1 | Very low | 172 Ų | 172 | 142.5 Ų | 142.5 | 80% | 0.796 | 82% | 0.822 | S | S | * | * | trans | -141.7 | 114.5 | 166.5 | -103.1 | -88.4 | 0 | 0 | 0 | 112.5 | ||||
| 241 | L | 33.9 | Very low | 35.5 | Very low | 149 Ų | 149 | 141 Ų | 141 | 78% | 0.78 | 82% | 0.823 | S | S | * | * | trans | 41.7 | 112.9 | 144.7 | -52.4 | 176.6 | 0 | 0 | 0 | 119.2 | ||||
| 242 | L | 34 | Very low | 34.8 | Very low | 174 Ų | 174 | 141.8 Ų | 141.8 | 91% | 0.911 | 82% | 0.82 | S | S | * | * | -175.1 | 125 | 112.8 | -96.7 | 156.1 | 0 | 0 | 0 | 110.5 | |||||
| 243 | Q | 35.2 | Very low | 34.8 | Very low | 180 Ų | 180 | 145 Ų | 145 | 84% | 0.841 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 153.9 | 169 | -82.9 | -178.7 | -87.6 | 0 | 0 | 110.9 | ||
| 244 | P | 35.8 | Very low | 34.8 | Very low | 119 Ų | 119 | 148.9 Ų | 148.9 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 130.4 | 179.6 | -9.2 | 26.6 | 0 | 0 | 0 | 112 | Q246 | P244-Q246 PolarHBondContact O-N 2.78Š|
| 245 | S | 33.1 | Very low | 34.7 | Very low | 126 Ų | 126 | 154.7 Ų | 154.7 | 88% | 0.881 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 126.1 | 171.8 | -62.1 | 0 | 0 | 0 | 0 | 111.5 | ||
| 246 | Q | 37.7 | Very low | 34.8 | Very low | 172 Ų | 172 | 151.6 Ų | 151.6 | 80% | 0.804 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 133.2 | 175.3 | -66.8 | 179.1 | -18.3 | 0 | 0 | 111.1 | P244 M248 | P244-Q246 PolarHBondContact O-N 2.78Å; Q246-M248 PolarHBondContact O-N 3.35Å |
| 247 | H | 34.6 | Very low | 35.1 | Very low | 180 Ų | 180 | 157 Ų | 157 | 83% | 0.833 | 83% | 0.825 | S | S | * | * | trans | -92.5 | 98.5 | 178.5 | -150.2 | -82.6 | 0 | 0 | 0 | 110.3 | ||||
| 248 | M | 33 | Very low | 35.1 | Very low | 151 Ų | 151 | 157 Ų | 157 | 74% | 0.744 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -85.6 | 128.5 | 179 | -77.9 | -76.2 | 104.3 | 0 | 0 | 112 | Q246 | Q246-M248 PolarHBondContact O-N 3.35Š|
| 249 | L | 37.9 | Very low | 35.3 | Very low | 153 Ų | 153 | 157.9 Ų | 157.9 | 80% | 0.801 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 125.7 | 170.4 | -93.7 | 134 | 0 | 0 | 0 | 110.2 | Q251 | L249-Q251 PolarHBondContact O-N 2.75Š|
| 250 | P | 40.9 | Very low | 34.8 | Very low | 126 Ų | 126 | 158 Ų | 158 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 120.2 | 170.2 | -17.4 | 32 | 0 | 0 | 0 | 111.7 | ||
| 251 | Q | 34.9 | Very low | 34.6 | Very low | 188 Ų | 188 | 155.6 Ų | 155.6 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | trans | -126.4 | 98.2 | 157.6 | -77.8 | -154.8 | 20.8 | 0 | 0 | 109.4 | L249 | L249-Q251 PolarHBondContact O-N 2.75Š| ||
| 252 | D | 33.2 | Very low | 34.5 | Very low | 141 Ų | 141 | 153.6 Ų | 153.6 | 75% | 0.754 | 83% | 0.831 | S | S | * | * | trans | -159 | 88.1 | 170.4 | -133.3 | -28.6 | 0 | 0 | 0 | 111 | ||||
| 253 | M | 38.6 | Very low | 34.2 | Very low | 174 Ų | 174 | 149.2 Ų | 149.2 | 86% | 0.857 | 83% | 0.828 | S | S | * | * | trans | -145.9 | 28.3 | -178.2 | -101.6 | -58.2 | 107.9 | 0 | 0 | 115.3 | ||||
| 254 | Y | 37.3 | Very low | 34 | Very low | 232 Ų | 232 | 147.9 Ų | 147.9 | 91% | 0.91 | 83% | 0.826 | S | S | * | * | trans | -141.6 | 99.4 | 163.4 | -90.6 | -73.3 | 0 | 0 | 0 | 112.1 | ||||
| 255 | K | 30.5 | Very low | 34.2 | Very low | 189 Ų | 189 | 150 Ų | 150 | 82% | 0.822 | 83% | 0.828 | S | S | * | * | trans | -136 | 109.1 | 168.6 | -166.7 | 166.4 | -173.1 | 169.8 | 0 | 110 | ||||
| 256 | P | 34.8 | Very low | 34 | Very low | 122 Ų | 122 | 151.1 Ų | 151.1 | 79% | 0.792 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 141.7 | 177.9 | 28.2 | -33.4 | 0 | 0 | 0 | 110.5 | ||
| 257 | K | 34.2 | Very low | 33.7 | Very low | 189 Ų | 189 | 150.6 Ų | 150.6 | 82% | 0.822 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 137 | 176 | -63 | 177.8 | -177.9 | 177.2 | 0 | 109.7 | ||
| 258 | P | 33.3 | Very low | 33.8 | Very low | 122 Ų | 122 | 146.5 Ų | 146.5 | 79% | 0.792 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 146.8 | 166.6 | 31 | -33.7 | 0 | 0 | 0 | 110 | ||
| 259 | V | 34.8 | Very low | 34 | Very low | 141 Ų | 141 | 148.6 Ų | 148.6 | 86% | 0.855 | 82% | 0.824 | S | S | * | * | trans | -120.3 | 117.4 | 171.3 | -175.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 260 | S | 27.5 | Very low | 33.7 | Very low | 117 Ų | 117 | 144.8 Ų | 144.8 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -87.4 | 150 | -178.9 | -62.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 261 | S | 31.8 | Very low | 33.3 | Very low | 122 Ų | 122 | 147.1 Ų | 147.1 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | trans | -84.1 | 129.9 | -177.5 | 53.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 262 | A | 31 | Very low | 33.5 | Very low | 107 Ų | 107 | 148 Ų | 148 | 88% | 0.884 | 83% | 0.828 | S | S | * | * | trans | -165.9 | 141.6 | 147.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 263 | G | 28.9 | Very low | 33.6 | Very low | 82 Ų | 82 | 147 Ų | 147 | 85% | 0.845 | 83% | 0.829 | S | S | * | * | trans | 159.5 | 59.5 | -178 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 264 | L | 31.2 | Very low | 33.3 | Very low | 153 Ų | 153 | 143.4 Ų | 143.4 | 80% | 0.801 | 83% | 0.827 | S | S | * | * | trans | -86.2 | 116.7 | -176.3 | -165.9 | 172.9 | 0 | 0 | 0 | 110.1 | E266 | L264-E266 HydrophobicContact CD2-CB 4.41Š| ||
| 265 | I | 38.9 | Very low | 33.3 | Very low | 162 Ų | 162 | 144.9 Ų | 144.9 | 83% | 0.831 | 83% | 0.831 | S | S | * | * | trans | -131.4 | 122.8 | 158.4 | -55.6 | -178.3 | 0 | 0 | 0 | 108.4 | ||||
| 266 | E | 28.6 | Very low | 33.3 | Very low | 151 Ų | 151 | 139.5 Ų | 139.5 | 71% | 0.706 | 83% | 0.829 | S | S | * | * | trans | -88.3 | 143 | -179.8 | -175.3 | 179.6 | 134 | 0 | 0 | 110.7 | L264 | L264-E266 HydrophobicContact CD2-CB 4.41Š| ||
| 267 | N | 32.1 | Very low | 33.4 | Very low | 160 Ų | 160 | 139.8 Ų | 139.8 | 86% | 0.856 | 83% | 0.834 | S | S | * | * | trans | -162.9 | 109.2 | 157.2 | -106.1 | -45.9 | 0 | 0 | 0 | 110.5 | ||||
| 268 | S | 36.6 | Very low | 33.5 | Very low | 94 Ų | 94 | 134.9 Ų | 134.9 | 66% | 0.657 | 84% | 0.837 | S | S | * | * | trans | -98.2 | 126.5 | -179 | 59.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 269 | M | 36.7 | Very low | 33.4 | Very low | 195 Ų | 195 | 132.5 Ų | 132.5 | 96% | 0.961 | 83% | 0.834 | S | S | * | * | trans | -160.9 | 125.9 | 151.8 | -111.6 | 173.4 | -72.2 | 0 | 0 | 108.9 | ||||
| 270 | G | 31 | Very low | 33.9 | Very low | 73 Ų | 73 | 136.8 Ų | 136.8 | 75% | 0.753 | 84% | 0.837 | S | S | * | * | trans | -124.7 | 134.2 | -173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 271 | L | 34.4 | Very low | 34.3 | Very low | 175 Ų | 175 | 136.8 Ų | 136.8 | 92% | 0.916 | 84% | 0.837 | S | S | * | * | trans | -138.2 | 141.1 | 165.5 | -72.3 | 177.3 | 0 | 0 | 0 | 109.8 | ||||
| 272 | K | 37.4 | Very low | 34.5 | Very low | 207 Ų | 207 | 134.7 Ų | 134.7 | 90% | 0.9 | 83% | 0.834 | S | S | * | * | trans | -98.3 | 137.9 | 169.4 | -68.6 | 175.3 | 178.1 | 173.6 | 0 | 109.2 | ||||
| 273 | P | 35.2 | Very low | 34.6 | Very low | 121 Ų | 121 | 133.3 Ų | 133.3 | 79% | 0.786 | 83% | 0.831 | S | S | * | * | -121.8 | 134 | 122 | -1.9 | 22.8 | 0 | 0 | 0 | 109.8 | |||||
| 274 | A | 32.5 | Very low | 34.7 | Very low | 97 Ų | 97 | 134.3 Ų | 134.3 | 80% | 0.802 | 83% | 0.831 | S | S | * | * | 88.1 | 135.4 | 65 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 275 | R | 37.7 | Very low | 35 | Very low | 263 Ų | 263 | 133.1 Ų | 133.1 | 99% | 0.992 | 83% | 0.83 | S | S | * | * | trans | -52.4 | 134.9 | -174.5 | -89.9 | 172.3 | 162 | 174 | -6.9 | 113.2 | ||||
| 276 | G | 31.8 | Very low | 35.3 | Very low | 76 Ų | 76 | 131.1 Ų | 131.1 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | trans | -133.8 | 138.6 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 277 | S | 36.7 | Very low | 35.9 | Very low | 129 Ų | 129 | 129.7 Ų | 129.7 | 90% | 0.902 | 83% | 0.834 | S | S | * | * | trans | -91.5 | 148.9 | -167.2 | -55.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 278 | G | 36.2 | Very low | 36.8 | Very low | 86 Ų | 86 | 132.3 Ų | 132.3 | 89% | 0.887 | 83% | 0.832 | S | S | * | * | trans | 83.3 | 111 | 146 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 279 | G | 31.2 | Very low | 37.3 | Very low | 71 Ų | 71 | 133.1 Ų | 133.1 | 73% | 0.732 | 84% | 0.838 | S | S | * | * | trans | -177.5 | 93 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 280 | Y | 44.2 | Very low | 37.8 | Very low | 232 Ų | 232 | 127.8 Ų | 127.8 | 91% | 0.91 | 82% | 0.82 | S | S | * | * | trans | -83.1 | 123.1 | 167.7 | 54.6 | -87.1 | 0 | 0 | 0 | 108.7 | ||||
| 281 | S | 36.6 | Very low | 39.2 | Very low | 117 Ų | 117 | 127.4 Ų | 127.4 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -151.4 | 149.8 | 173.4 | 52.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 282 | G | 36.5 | Very low | 40.1 | Very low | 77 Ų | 77 | 126.7 Ų | 126.7 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 149.5 | -160.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | A284 | G282-A284 PolarHBondContact O-N 3.46Š|
| 283 | G | 31.9 | Very low | 41.5 | Very low | 79 Ų | 79 | 119.5 Ų | 119.5 | 81% | 0.814 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 132.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | T285 | G283-T285 PolarHBondContact O-N 3.35Š|
| 284 | A | 31.9 | Very low | 42.9 | Very low | 103 Ų | 103 | 118.8 Ų | 118.8 | 85% | 0.851 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 131.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | G282 | G282-A284 PolarHBondContact O-N 3.46Š|
| 285 | T | 37.2 | Very low | 43.9 | Very low | 127 Ų | 127 | 118.9 Ų | 118.9 | 78% | 0.779 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 148.5 | 167.8 | 48.1 | 0 | 0 | 0 | 0 | 110 | G283 | G283-T285 PolarHBondContact O-N 3.35Š|
| 286 | P | 44.9 | Very low | 45 | Very low | 121 Ų | 121 | 107.8 Ų | 107.8 | 79% | 0.786 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 145.8 | -177.4 | 25.5 | -34.5 | 0 | 0 | 0 | 111.4 | R288 | P286-R288 PolarHBondContact O-N 3.01Š|
| 287 | S | 42.3 | Very low | 46.6 | Very low | 120 Ų | 120 | 110 Ų | 110 | 84% | 0.839 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 126.1 | -175.7 | 37.6 | 0 | 0 | 0 | 0 | 112.2 | ||
| 288 | R | 50.1 | Low | 47.7 | Very low | 216 Ų | 216 | 109 Ų | 109 | 82% | 0.815 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 136.2 | 161.8 | -74.9 | 174.2 | 167.2 | -110.7 | -1.7 | 108 | P286 S290 | P286-R288 PolarHBondContact O-N 3.01Å; R288-S290 PolarHBondContact O-N 3.25Å |
| 289 | S | 47.4 | Very low | 48.9 | Very low | 110 Ų | 110 | 106.1 Ų | 106.1 | 77% | 0.769 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 123.3 | 168 | 52.7 | 0 | 0 | 0 | 0 | 109.6 | C291 | S289-C291 PolarHBondContact O-N 2.79Š|
| 290 | S | 47.6 | Very low | 50.7 | Low | 84 Ų | 84 | 109.8 Ų | 109.8 | 59% | 0.587 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 138.3 | 172.8 | -169.7 | 0 | 0 | 0 | 0 | 109.6 | R288 D292 | R288-S290 PolarHBondContact O-N 3.25Å; S290-D292 PolarHBondContact OG-OD1 3.46Å |
| 291 | C | 58.8 | Low | 51.7 | Low | 65 Ų | 65 | 108.4 Ų | 108.4 | 44% | 0.439 | 65% | 0.648 | S | S | . | * | trans | -117.5 | 101 | 169 | 38.4 | 0 | 0 | 0 | 0 | 107.7 | S289 C293 C296 | S289-C291 PolarHBondContact O-N 2.79Å; C291-C293 PolarHBondContact O-N 3.21Å; C291-C296 HydrophobicContact CB-CB 3.99Å; C291-C296 WeakPolarHBondContact CB-SG 3.38Å; C291-C296 WeakPolarHBondContact O-CB 3.48Å; C291-C296 WeakPolarHBondContact SG-CB 3.38Å; C291-C296 CovalentContact SG-SG 2.05Å; C291-C296 PolarHBondContact SG-SG 3.36Å | ||
| 292 | D | 53.2 | Low | 53.1 | Low | 160 Ų | 160 | 106.4 Ų | 106.4 | 86% | 0.856 | 63% | 0.628 | S | S | * | * | trans | -76 | 54.1 | 178.7 | -53.5 | -61.7 | 0 | 0 | 0 | 111.4 | S290 | S290-D292 PolarHBondContact OG-OD1 3.46Š| ||
| 293 | C | 66.9 | Low | 54.8 | Low | 55 Ų | 55 | 104.4 Ų | 104.4 | 37% | 0.372 | 61% | 0.608 | S | S | . | * | S | Bend | trans | -113.7 | 146 | 170.3 | 84.3 | 0 | 0 | 0 | 0 | 109.9 | C291 N295 C296 Q297 | C291-C293 PolarHBondContact O-N 3.21Å; C293-N295 PolarHBondContact O-N 3.36Å; C293-N295 VanDerWaalsContact O-N 3.08Å; C293-C296 PolarHBondContact O-N 3.38Å; C293-C296 VanDerWaalsContact SG-SG 3.61Å; C293-Q297 PolarHBondContact O-N 2.81Å |
| 294 | P | 64.3 | Low | 56.3 | Low | 107 Ų | 107 | 105 Ų | 105 | 70% | 0.695 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -55 | -37.1 | -172.5 | -28.5 | 35.3 | 0 | 0 | 0 | 113.6 | C296 Q297 E298 | P294-C296 PolarHBondContact O-N 3.37Å; P294-Q297 PolarHBondContact O-N 3.46Å; P294-E298 WeakPolarHBondContact O-CB 3.33Å; P294-E298 PolarHBondContact O-N 3.11Å |
| 295 | N | 54.1 | Low | 57.8 | Low | 98 Ų | 98 | 105.5 Ų | 105.5 | 52% | 0.524 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -69.5 | -27.2 | 179.4 | -172 | 52.8 | 0 | 0 | 0 | 113.4 | C293 L299 | C293-N295 PolarHBondContact O-N 3.36Å; C293-N295 VanDerWaalsContact O-N 3.08Å; N295-L299 WeakPolarHBondContact O-CB 3.34Å; N295-L299 WeakPolarHBondContact O-CD1 3.49Å; N295-L299 PolarHBondContact O-N 3.13Å |
| 296 | C | 62.2 | Low | 58.9 | Low | 31 Ų | 31 | 99.5 Ų | 99.5 | 21% | 0.209 | 57% | 0.565 | C | S | . | * | H | α-helix | trans | -74.4 | -44.8 | 170.3 | -77.9 | 0 | 0 | 0 | 0 | 110.9 | C291 C293 P294 E298 L299 E300 | C291-C296 HydrophobicContact CB-CB 3.99Å; C291-C296 WeakPolarHBondContact CB-SG 3.38Å; C291-C296 WeakPolarHBondContact O-CB 3.48Å; C291-C296 WeakPolarHBondContact SG-CB 3.38Å; C291-C296 CovalentContact SG-SG 2.05Å; C291-C296 PolarHBondContact SG-SG 3.36Å; C293-C296 PolarHBondContact O-N 3.38Å; C293-C296 VanDerWaalsContact SG-SG 3.61Å; P294-C296 PolarHBondContact O-N 3.37Å; C296-E298 PolarHBondContact O-N 2.87Å; C296-L299 CarbonylContact O-C 3.34Å; C296-L299 WeakPolarHBondContact O-CA 3.48Å; C296-L299 WeakPolarHBondContact O-CB 3.41Å; C296-L299 PolarHBondContact O-N 2.78Å; C296-L299 VanDerWaalsContact O-N 3.1Å; C296-E300 PolarHBondContact O-N 3.08Å |
| 297 | Q | 65 | Low | 59.6 | Low | 123 Ų | 123 | 97 Ų | 97 | 58% | 0.575 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.2 | -40.1 | -179.1 | -163 | 176.7 | 29.8 | 0 | 0 | 112.4 | C293 P294 L299 E300 R301 | C293-Q297 PolarHBondContact O-N 2.81Å; P294-Q297 PolarHBondContact O-N 3.46Å; Q297-L299 VanDerWaalsContact C-N 3.33Å; Q297-L299 PolarHBondContact O-N 2.95Å; Q297-E300 PolarHBondContact O-N 3.21Å; Q297-R301 WeakPolarHBondContact O-CG 3.38Å; Q297-R301 PolarHBondContact O-N 2.98Å; Q297-R301 VanDerWaalsContact O-N 3.07Å |
| 298 | E | 60.1 | Low | 60.4 | Low | 108 Ų | 108 | 97.1 Ų | 97.1 | 51% | 0.505 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.1 | -42.9 | 171.9 | -161.5 | 67.3 | -139 | 0 | 0 | 111.5 | P294 C296 E300 R301 L302 | P294-E298 WeakPolarHBondContact O-CB 3.33Å; P294-E298 PolarHBondContact O-N 3.11Å; C296-E298 PolarHBondContact O-N 2.87Å; E298-E300 VanDerWaalsContact C-N 3.26Å; E298-E300 PolarHBondContact O-N 3.13Å; E298-R301 PolarHBondContact O-N 3.15Å; E298-L302 HydrophobicContact CG-CD1 4.11Å; E298-L302 WeakPolarHBondContact O-CB 3.25Å; E298-L302 VanDerWaalsContact O-CG 3.31Å; E298-L302 WeakPolarHBondContact O-CG 3.41Å; E298-L302 PolarHBondContact O-N 3.33Å |
| 299 | L | 61.3 | Low | 60.8 | Low | 25 Ų | 25 | 92.3 Ų | 92.3 | 13% | 0.131 | 55% | 0.545 | C | S | . | . | H | α-helix | trans | -67.1 | -22.6 | 178 | -105.2 | 152.6 | 0 | 0 | 0 | 113.8 | N295 C296 Q297 A306 R310 | N295-L299 WeakPolarHBondContact O-CB 3.34Å; N295-L299 WeakPolarHBondContact O-CD1 3.49Å; N295-L299 PolarHBondContact O-N 3.13Å; C296-L299 CarbonylContact O-C 3.34Å; C296-L299 WeakPolarHBondContact O-CA 3.48Å; C296-L299 WeakPolarHBondContact O-CB 3.41Å; C296-L299 PolarHBondContact O-N 2.78Å; C296-L299 VanDerWaalsContact O-N 3.1Å; Q297-L299 VanDerWaalsContact C-N 3.33Å; Q297-L299 PolarHBondContact O-N 2.95Å; L299-A306 HydrophobicContact CD2-CB 3.61Å; L299-A306 HydrophobicContact CG-CB 4.42Å; L299-R310 HydrophobicContact CD2-CG 3.98Å |
| 300 | E | 67.6 | Low | 61.4 | Low | 148 Ų | 148 | 93.4 Ų | 93.4 | 69% | 0.692 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -82.7 | -41.8 | 171.6 | -69.2 | -172.9 | 154.7 | 0 | 0 | 111.8 | C296 Q297 E298 L302 G303 | C296-E300 PolarHBondContact O-N 3.08Å; Q297-E300 PolarHBondContact O-N 3.21Å; E298-E300 VanDerWaalsContact C-N 3.26Å; E298-E300 PolarHBondContact O-N 3.13Å; E300-L302 PolarHBondContact O-N 3.46Å; E300-G303 PolarHBondContact O-N 3.29Å |
| 301 | R | 66 | Low | 62 | Low | 202 Ų | 202 | 97.6 Ų | 97.6 | 76% | 0.762 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59 | -34.4 | 173.4 | -66.4 | -176 | 100.5 | 89.4 | -0 | 112.7 | Q297 E298 | Q297-R301 WeakPolarHBondContact O-CG 3.38Å; Q297-R301 PolarHBondContact O-N 2.98Å; Q297-R301 VanDerWaalsContact O-N 3.07Å; E298-R301 PolarHBondContact O-N 3.15Å |
| 302 | L | 66.4 | Low | 62.3 | Low | 76 Ų | 76 | 102.7 Ų | 102.7 | 40% | 0.398 | 56% | 0.555 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.4 | -1.9 | -178.9 | -63.9 | 171.7 | 0 | 0 | 0 | 114.3 | E298 E300 S305 A306 | E298-L302 HydrophobicContact CG-CD1 4.11Å; E298-L302 WeakPolarHBondContact O-CB 3.25Å; E298-L302 VanDerWaalsContact O-CG 3.31Å; E298-L302 WeakPolarHBondContact O-CG 3.41Å; E298-L302 PolarHBondContact O-N 3.33Å; E300-L302 PolarHBondContact O-N 3.46Å; L302-S305 WeakPolarHBondContact O-CB 3.45Å; L302-S305 PolarHBondContact O-N 3.21Å; L302-A306 HydrophobicContact CB-CB 3.69Å; L302-A306 PolarHBondContact O-N 2.84Å |
| 303 | G | 72.4 | Confident | 63 | Low | 35 Ų | 35 | 99.5 Ų | 99.5 | 36% | 0.361 | 54% | 0.543 | S | S | . | . | G | 310 helix | trans | 52.1 | -137.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | E300 S305 A306 | E300-G303 PolarHBondContact O-N 3.29Å; G303-S305 VanDerWaalsContact C-N 3.29Å; G303-S305 PolarHBondContact O-N 2.82Å; G303-A306 PolarHBondContact O-N 3.1Å |
| 304 | A | 62 | Low | 63.5 | Low | 92 Ų | 92 | 101.7 Ų | 101.7 | 76% | 0.76 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -65.4 | -31 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | A306 A307 | A304-A306 PolarHBondContact O-N 2.76Å; A304-A307 WeakPolarHBondContact O-CB 3.49Å; A304-A307 PolarHBondContact O-N 2.83Å; A304-A307 VanDerWaalsContact O-N 3.1Å |
| 305 | S | 63.8 | Low | 64.2 | Low | 113 Ų | 113 | 99 Ų | 99 | 79% | 0.79 | 53% | 0.532 | S | S | * | . | G | 310 helix | trans | -60.1 | -29.8 | -179.9 | -45.5 | 0 | 0 | 0 | 0 | 112.7 | L302 G303 A307 | L302-S305 WeakPolarHBondContact O-CB 3.45Å; L302-S305 PolarHBondContact O-N 3.21Å; G303-S305 VanDerWaalsContact C-N 3.29Å; G303-S305 PolarHBondContact O-N 2.82Å; S305-A307 PolarHBondContact O-N 3.37Å |
| 306 | A | 59.8 | Low | 65.6 | Low | 0 Ų | 0 | 97.8 Ų | 97.8 | 0% | 0 | 53% | 0.531 | C | S | . | . | G | 310 helix | trans | -76.4 | 5.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115 | L299 L302 G303 A304 S308 L309 R310 | L299-A306 HydrophobicContact CD2-CB 3.61Å; L299-A306 HydrophobicContact CG-CB 4.42Å; L302-A306 HydrophobicContact CB-CB 3.69Å; L302-A306 PolarHBondContact O-N 2.84Å; G303-A306 PolarHBondContact O-N 3.1Å; A304-A306 PolarHBondContact O-N 2.76Å; A306-S308 VanDerWaalsContact C-N 3.28Å; A306-S308 PolarHBondContact O-N 2.86Å; A306-L309 HydrophobicContact CB-CB 4.43Å; A306-L309 CarbonylContact O-C 3.51Å; A306-L309 WeakPolarHBondContact O-CA 3.43Å; A306-L309 PolarHBondContact O-N 3.34Å; A306-R310 WeakPolarHBondContact O-CG 3.33Å; A306-R310 PolarHBondContact O-N 3.4Å; A306-R310 VanDerWaalsContact O-N 3.14Å |
| 307 | A | 59.5 | Low | 66.7 | Low | 69 Ų | 69 | 96.8 Ų | 96.8 | 57% | 0.57 | 53% | 0.525 | S | S | * | . | G | 310 helix | trans | -52.6 | -42.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | A304 S305 R310 | A304-A307 WeakPolarHBondContact O-CB 3.49Å; A304-A307 PolarHBondContact O-N 2.83Å; A304-A307 VanDerWaalsContact O-N 3.1Å; S305-A307 PolarHBondContact O-N 3.37Å; A307-R310 WeakPolarHBondContact O-CB 3.45Å; A307-R310 VanDerWaalsContact O-CG 3.29Å; A307-R310 WeakPolarHBondContact O-CG 3.45Å |
| 308 | S | 59.1 | Low | 67.4 | Low | 123 Ų | 123 | 99.7 Ų | 99.7 | 86% | 0.86 | 54% | 0.538 | S | S | * | . | G | 310 helix | trans | -75.6 | -21.1 | 175.6 | -60.6 | 0 | 0 | 0 | 0 | 113.9 | A306 R310 | A306-S308 VanDerWaalsContact C-N 3.28Å; A306-S308 PolarHBondContact O-N 2.86Å; S308-R310 VanDerWaalsContact C-N 3.33Å |
| 309 | L | 58.5 | Low | 68.4 | Low | 114 Ų | 114 | 97.1 Ų | 97.1 | 60% | 0.597 | 53% | 0.527 | S | S | * | . | G | 310 helix | trans | -87.3 | -0.2 | 177.2 | -63.6 | 177.4 | 0 | 0 | 0 | 113.1 | A306 K311 | A306-L309 HydrophobicContact CB-CB 4.43Å; A306-L309 CarbonylContact O-C 3.51Å; A306-L309 WeakPolarHBondContact O-CA 3.43Å; A306-L309 PolarHBondContact O-N 3.34Å; L309-K311 PolarHBondContact O-N 3.33Å |
| 310 | R | 61.6 | Low | 68.7 | Low | 133 Ų | 133 | 101.8 Ų | 101.8 | 50% | 0.502 | 56% | 0.559 | S | S | . | * | trans | -65.4 | 74.9 | 170.9 | -63 | -98.6 | -179 | -173.5 | -4.9 | 110.5 | L299 A306 A307 S308 K312 | L299-R310 HydrophobicContact CD2-CG 3.98Å; A306-R310 WeakPolarHBondContact O-CG 3.33Å; A306-R310 PolarHBondContact O-N 3.4Å; A306-R310 VanDerWaalsContact O-N 3.14Å; A307-R310 WeakPolarHBondContact O-CB 3.45Å; A307-R310 VanDerWaalsContact O-CG 3.29Å; A307-R310 WeakPolarHBondContact O-CG 3.45Å; S308-R310 VanDerWaalsContact C-N 3.33Å; R310-K312 PolarHBondContact O-N 3.13Å | ||
| 311 | K | 60.1 | Low | 68.9 | Low | 173 Ų | 173 | 99.2 Ų | 99.2 | 75% | 0.752 | 57% | 0.572 | S | S | * | * | trans | -48.2 | 114.7 | 165.9 | -70 | 176.2 | -178.6 | 171.9 | 0 | 107.3 | L309 | L309-K311 PolarHBondContact O-N 3.33Š| ||
| 312 | K | 64.4 | Low | 69.6 | Low | 172 Ų | 172 | 90.5 Ų | 90.5 | 75% | 0.748 | 54% | 0.542 | S | S | * | . | trans | -52.6 | 133.1 | -175.2 | -67.2 | 171.5 | -177 | 168.1 | 0 | 108.5 | R310 V314 | R310-K312 PolarHBondContact O-N 3.13Å; K312-V314 VanDerWaalsContact O-CG2 3.26Å; K312-V314 WeakPolarHBondContact O-CG2 3.3Å; K312-V314 PolarHBondContact O-N 3.2Å; K312-V314 VanDerWaalsContact O-N 3.09Å | ||
| 313 | P | 67.4 | Low | 70.2 | Confident | 92 Ų | 92 | 89.9 Ų | 89.9 | 60% | 0.597 | 55% | 0.554 | S | S | * | * | trans | -55.4 | 121.5 | -172.2 | 21.6 | -33 | 0 | 0 | 0 | 110.3 | H315 | P313-H315 PolarHBondContact O-CD2 2.86Å; P313-H315 PolarHBondContact O-NE2 3.4Å | ||
| 314 | V | 77.4 | Confident | 70.6 | Confident | 101 Ų | 101 | 93.1 Ų | 93.1 | 61% | 0.612 | 56% | 0.558 | S | S | * | * | trans | -94.6 | 114.3 | -173.6 | -179.4 | 0 | 0 | 0 | 0 | 107.7 | K312 V325 | K312-V314 VanDerWaalsContact O-CG2 3.26Å; K312-V314 WeakPolarHBondContact O-CG2 3.3Å; K312-V314 PolarHBondContact O-N 3.2Å; K312-V314 VanDerWaalsContact O-N 3.09Å; V314-V325 HydrophobicContact CG1-CG1 3.2Å | ||
| 315 | H | 80.4 | Confident | 71.7 | Confident | 51 Ų | 51 | 93.1 Ų | 93.1 | 24% | 0.236 | 55% | 0.549 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 96.2 | -174.9 | -58.6 | -82.6 | 0 | 0 | 0 | 109.6 | P313 Y326 K328 A329 L332 | P313-H315 PolarHBondContact O-CD2 2.86Å; P313-H315 PolarHBondContact O-NE2 3.4Å; H315-Y326 WeakPolarHBondContact CB-O 3.18Å; H315-Y326 PolarHBondContact N-O 2.87Å; H315-Y326 PolarHBondContact O-N 3.49Å; H315-K328 VanDerWaalsContact CD2-C 3.4Å; H315-A329 PolarHBondContact CD2-N 3.16Å; H315-A329 PolarHBondContact NE2-N 3.12Å; H315-L332 HydrophobicContact CB-CB 3.86Å; H315-L332 HydrophobicContact CB-CD2 3.74Å; H315-L332 HydrophobicContact CB-CG 4.4Å |
| 316 | S | 82.9 | Confident | 72.7 | Confident | 72 Ų | 72 | 90.3 Ų | 90.3 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.8 | 150.9 | 175.5 | 47.1 | 0 | 0 | 0 | 0 | 112.3 | K324 L332 | S316-K324 CarbonylContact C-O 3.6Å; S316-L332 VanDerWaalsContact O-CD2 3.3Å; S316-L332 WeakPolarHBondContact O-CD2 3.16Å |
| 317 | C | 84.9 | Confident | 73.7 | Confident | 10 Ų | 10 | 93 Ų | 93 | 7% | 0.068 | 55% | 0.549 | C | S | . | . | trans | -78.5 | 122.2 | 166.6 | -166.7 | 0 | 0 | 0 | 0 | 109.5 | I319 C322 K324 L332 H335 H339 | C317-I319 VanDerWaalsContact C-N 3.27Å; C317-I319 PolarHBondContact O-N 2.87Å; C317-C322 HydrophobicContact CB-CB 4.38Å; C317-K324 PolarHBondContact N-O 3Å; C317-L332 HydrophobicContact CB-CD1 4.08Å; C317-H335 PolarHBondContact SG-NE2 2.86Å; C317-H339 PolarHBondContact SG-NE2 3.39Å | ||
| 318 | H | 80.4 | Confident | 74.8 | Confident | 184 Ų | 184 | 95.6 Ų | 95.6 | 85% | 0.852 | 55% | 0.547 | S | S | * | . | trans | -77 | -12.5 | 179.2 | -177.9 | 61 | 0 | 0 | 0 | 113.3 | ||||
| 319 | I | 80.3 | Confident | 75.8 | Confident | 55 Ų | 55 | 92.3 Ų | 92.3 | 28% | 0.282 | 53% | 0.528 | S | S | . | . | S | Bend | trans | -72.4 | 125.9 | -173.8 | -63.1 | 174.6 | 0 | 0 | 0 | 109.6 | C317 C322 L336 H339 | C317-I319 VanDerWaalsContact C-N 3.27Å; C317-I319 PolarHBondContact O-N 2.87Å; I319-C322 VanDerWaalsContact O-CB 3.29Å; I319-C322 WeakPolarHBondContact O-CB 3.49Å; I319-C322 PolarHBondContact O-N 3.23Å; I319-C322 VanDerWaalsContact O-N 3.15Å; I319-L336 HydrophobicContact CD1-CD2 3.83Å; I319-L336 HydrophobicContact CG1-CD2 4.39Å; I319-H339 HydrophobicContact CD1-CB 3.43Å; I319-H339 VanDerWaalsContact CD1-CB 3.43Å; I319-H339 VanDerWaalsContact CD1-CG 3.45Å |
| 320 | P | 68.1 | Low | 76.9 | Confident | 122 Ų | 122 | 90.5 Ų | 90.5 | 79% | 0.792 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | 145.4 | -175.9 | 23.5 | -34 | 0 | 0 | 0 | 111.7 | C322 | P320-C322 PolarHBondContact O-N 2.87Š|
| 321 | G | 71.7 | Confident | 77.9 | Confident | 94 Ų | 94 | 88.4 Ų | 88.4 | 97% | 0.969 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.3 | -10 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 322 | C | 80.1 | Confident | 79 | Confident | 19 Ų | 19 | 81.3 Ų | 81.3 | 13% | 0.128 | 49% | 0.491 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | -51.4 | -178.4 | -167.5 | 0 | 0 | 0 | 0 | 114.1 | C317 I319 P320 K324 H335 H339 | C317-C322 HydrophobicContact CB-CB 4.38Å; I319-C322 VanDerWaalsContact O-CB 3.29Å; I319-C322 WeakPolarHBondContact O-CB 3.49Å; I319-C322 PolarHBondContact O-N 3.23Å; I319-C322 VanDerWaalsContact O-N 3.15Å; P320-C322 PolarHBondContact O-N 2.87Å; C322-K324 PolarHBondContact O-N 3.38Å; C322-H335 PolarHBondContact SG-CE1 2.77Å; C322-H335 PolarHBondContact SG-NE2 3.42Å; C322-H339 WeakPolarHBondContact CB-CE1 3.2Å; C322-H339 WeakPolarHBondContact CB-NE2 3.32Å; C322-H339 PolarHBondContact SG-CE1 3.31Å; C322-H339 PolarHBondContact SG-NE2 3.21Å |
| 323 | G | 79.4 | Confident | 79.7 | Confident | 64 Ų | 64 | 79.9 Ų | 79.9 | 66% | 0.66 | 48% | 0.484 | S | S | * | . | trans | 62.4 | -0.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 324 | K | 81.3 | Confident | 80.3 | Confident | 103 Ų | 103 | 76.5 Ų | 76.5 | 45% | 0.448 | 46% | 0.464 | S | S | . | . | trans | -72.3 | 141.6 | -173 | -68.4 | 175.8 | -171.7 | 174.6 | 0 | 112.5 | S316 C317 C322 Y326 | S316-K324 CarbonylContact C-O 3.6Å; C317-K324 PolarHBondContact N-O 3Å; C322-K324 PolarHBondContact O-N 3.38Å; K324-Y326 HydrophobicContact CB-CE2 3.71Å | ||
| 325 | V | 84.6 | Confident | 80.5 | Confident | 91 Ų | 91 | 72.6 Ų | 72.6 | 55% | 0.552 | 44% | 0.439 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -127.7 | 134.5 | -171.4 | 178.1 | 0 | 0 | 0 | 0 | 111.2 | V314 | V314-V325 HydrophobicContact CG1-CG1 3.2Å |
| 326 | Y | 84.6 | Confident | 80.5 | Confident | 54 Ų | 54 | 72.9 Ų | 72.9 | 21% | 0.212 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.2 | 129 | -172.3 | -60.1 | -84.4 | 0 | 0 | 0 | 112.5 | H315 K324 K328 H331 L332 H335 | H315-Y326 WeakPolarHBondContact CB-O 3.18Å; H315-Y326 PolarHBondContact N-O 2.87Å; H315-Y326 PolarHBondContact O-N 3.49Å; K324-Y326 HydrophobicContact CB-CE2 3.71Å; Y326-K328 PolarHBondContact O-N 3.49Å; Y326-K328 VanDerWaalsContact O-N 3.11Å; Y326-H331 HydrophobicContact CD1-CB 3.7Å; Y326-H331 HydrophobicContact CG-CB 4.11Å; Y326-L332 HydrophobicContact CD2-CB 4.12Å; Y326-L332 HydrophobicContact CD2-CD1 4.03Å; Y326-L332 HydrophobicContact CE2-CD1 4.36Å; Y326-L332 HydrophobicContact CG-CB 4.46Å; Y326-H335 HydrophobicContact CE1-CB 4.37Å; Y326-H335 HydrophobicContact CE2-CB 3.79Å; Y326-H335 AromaticContact CE2-CD2 3.42Å; Y326-H335 VanDerWaalsContact CE2-CD2 3.42Å; Y326-H335 WeakPolarHBondContact CE2-CD2 3.47Å; Y326-H335 AromaticContact CE2-CG 3.67Å; Y326-H335 AromaticContact CZ-CD2 3.86Å; Y326-H335 AromaticContact CZ-CG 3.66Å |
| 327 | G | 81.8 | Confident | 80.3 | Confident | 57 Ų | 57 | 71.8 Ų | 71.8 | 59% | 0.588 | 43% | 0.427 | S | S | * | . | S | Bend | trans | -75.9 | 14 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 328 | K | 82.4 | Confident | 79.6 | Confident | 123 Ų | 123 | 77.2 Ų | 77.2 | 54% | 0.535 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -150.9 | 131.8 | 176.8 | -66.5 | -171.4 | -177.2 | -179.9 | 0 | 110.9 | H315 Y326 S330 H331 L332 | H315-K328 VanDerWaalsContact CD2-C 3.4Å; Y326-K328 PolarHBondContact O-N 3.49Å; Y326-K328 VanDerWaalsContact O-N 3.11Å; K328-S330 VanDerWaalsContact C-N 3.25Å; K328-S330 PolarHBondContact O-N 3.36Å; K328-H331 HydrophobicContact CB-CB 4.4Å; K328-H331 PolarHBondContact O-N 3.46Å; K328-L332 PolarHBondContact O-N 2.91Å |
| 329 | A | 80.2 | Confident | 79.4 | Confident | 54 Ų | 54 | 71.7 Ų | 71.7 | 45% | 0.446 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -56.1 | -36.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | H315 H331 L332 K333 | H315-A329 PolarHBondContact CD2-N 3.16Å; H315-A329 PolarHBondContact NE2-N 3.12Å; A329-H331 VanDerWaalsContact C-N 3.3Å; A329-H331 PolarHBondContact O-N 3.22Å; A329-L332 PolarHBondContact O-N 3.11Å; A329-K333 WeakPolarHBondContact O-CB 3.31Å; A329-K333 PolarHBondContact O-N 3.1Å |
| 330 | S | 80.3 | Confident | 79 | Confident | 77 Ų | 77 | 73.2 Ų | 73.2 | 54% | 0.538 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64 | -33 | 177.1 | 54.7 | 0 | 0 | 0 | 0 | 113.1 | K328 A334 | K328-S330 VanDerWaalsContact C-N 3.25Å; K328-S330 PolarHBondContact O-N 3.36Å; S330-A334 WeakPolarHBondContact O-CB 3.41Å; S330-A334 PolarHBondContact O-N 3Å |
| 331 | H | 82.2 | Confident | 79 | Confident | 88 Ų | 88 | 70 Ų | 70 | 41% | 0.407 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -75 | -39.6 | 176.7 | -66 | -168.3 | 0 | 0 | 0 | 111 | Y326 K328 A329 A334 H335 | Y326-H331 HydrophobicContact CD1-CB 3.7Å; Y326-H331 HydrophobicContact CG-CB 4.11Å; K328-H331 HydrophobicContact CB-CB 4.4Å; K328-H331 PolarHBondContact O-N 3.46Å; A329-H331 VanDerWaalsContact C-N 3.3Å; A329-H331 PolarHBondContact O-N 3.22Å; H331-A334 PolarHBondContact O-N 3.4Å; H331-H335 WeakPolarHBondContact O-CB 3.49Å; H331-H335 PolarHBondContact O-N 3.21Å |
| 332 | L | 83.8 | Confident | 78.8 | Confident | 25 Ų | 25 | 70.3 Ų | 70.3 | 13% | 0.131 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 170.9 | 175.8 | 62.5 | 0 | 0 | 0 | 111 | H315 S316 C317 Y326 K328 A329 A334 H335 L336 | H315-L332 HydrophobicContact CB-CB 3.86Å; H315-L332 HydrophobicContact CB-CD2 3.74Å; H315-L332 HydrophobicContact CB-CG 4.4Å; S316-L332 VanDerWaalsContact O-CD2 3.3Å; S316-L332 WeakPolarHBondContact O-CD2 3.16Å; C317-L332 HydrophobicContact CB-CD1 4.08Å; Y326-L332 HydrophobicContact CD2-CB 4.12Å; Y326-L332 HydrophobicContact CD2-CD1 4.03Å; Y326-L332 HydrophobicContact CE2-CD1 4.36Å; Y326-L332 HydrophobicContact CG-CB 4.46Å; K328-L332 PolarHBondContact O-N 2.91Å; A329-L332 PolarHBondContact O-N 3.11Å; L332-A334 VanDerWaalsContact C-N 3.31Å; L332-A334 PolarHBondContact O-N 2.68Å; L332-H335 CarbonylContact O-C 3.59Å; L332-H335 WeakPolarHBondContact O-CA 3.49Å; L332-H335 WeakPolarHBondContact O-CB 3.11Å; L332-H335 PolarHBondContact O-N 2.97Å; L332-L336 HydrophobicContact CD1-CD1 4.19Å; L332-L336 HydrophobicContact CD1-CD2 4.37Å; L332-L336 HydrophobicContact CD1-CG 3.98Å; L332-L336 HydrophobicContact CD2-CD1 4.48Å; L332-L336 HydrophobicContact CG-CD1 3.97Å; L332-L336 HydrophobicContact CG-CG 4.24Å; L332-L336 WeakPolarHBondContact O-CG 3.3Å; L332-L336 PolarHBondContact O-N 3.18Å |
| 333 | K | 80.5 | Confident | 78.4 | Confident | 141 Ų | 141 | 74 Ų | 74 | 61% | 0.613 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -61.6 | -38.4 | 178.6 | -170.1 | 168 | -175 | 170.6 | 0 | 112.2 | A329 | A329-K333 WeakPolarHBondContact O-CB 3.31Å; A329-K333 PolarHBondContact O-N 3.1Å |
| 334 | A | 79.2 | Confident | 78.1 | Confident | 22 Ų | 22 | 74 Ų | 74 | 18% | 0.182 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -68 | -32.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S330 H331 L332 R358 | S330-A334 WeakPolarHBondContact O-CB 3.41Å; S330-A334 PolarHBondContact O-N 3Å; H331-A334 PolarHBondContact O-N 3.4Å; L332-A334 VanDerWaalsContact C-N 3.31Å; L332-A334 PolarHBondContact O-N 2.68Å; A334-R358 HydrophobicContact CB-CG 3.91Å |
| 335 | H | 81.4 | Confident | 77.8 | Confident | 18 Ų | 18 | 72.1 Ų | 72.1 | 8% | 0.083 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -73.2 | -41.5 | 175.2 | 166.9 | 49 | 0 | 0 | 0 | 112.8 | C317 C322 Y326 H331 L332 R337 W338 H339 | C317-H335 PolarHBondContact SG-NE2 2.86Å; C322-H335 PolarHBondContact SG-CE1 2.77Å; C322-H335 PolarHBondContact SG-NE2 3.42Å; Y326-H335 HydrophobicContact CE1-CB 4.37Å; Y326-H335 HydrophobicContact CE2-CB 3.79Å; Y326-H335 AromaticContact CE2-CD2 3.42Å; Y326-H335 VanDerWaalsContact CE2-CD2 3.42Å; Y326-H335 WeakPolarHBondContact CE2-CD2 3.47Å; Y326-H335 AromaticContact CE2-CG 3.67Å; Y326-H335 AromaticContact CZ-CD2 3.86Å; Y326-H335 AromaticContact CZ-CG 3.66Å; H331-H335 WeakPolarHBondContact O-CB 3.49Å; H331-H335 PolarHBondContact O-N 3.21Å; L332-H335 CarbonylContact O-C 3.59Å; L332-H335 WeakPolarHBondContact O-CA 3.49Å; L332-H335 WeakPolarHBondContact O-CB 3.11Å; L332-H335 PolarHBondContact O-N 2.97Å; H335-R337 PolarHBondContact O-N 3.2Å; H335-W338 VanDerWaalsContact O-CB 3.3Å; H335-W338 WeakPolarHBondContact O-CB 3.26Å; H335-W338 PolarHBondContact O-N 3.06Å; H335-H339 AromaticContact CD2-NE2 3.79Å; H335-H339 AromaticContact CE1-CD2 3.53Å; H335-H339 AromaticContact CE1-NE2 2.66Å; H335-H339 PolarHBondContact CE1-NE2 2.89Å; H335-H339 AromaticContact ND1-NE2 3.9Å; H335-H339 AromaticContact NE2-CD2 3.65Å; H335-H339 AromaticContact NE2-NE2 2.52Å; H335-H339 PolarHBondContact NE2-NE2 3.26Å |
| 336 | L | 79.6 | Confident | 77.3 | Confident | 57 Ų | 57 | 70.7 Ų | 70.7 | 30% | 0.298 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -58.6 | -30.3 | 178.1 | -71.6 | 169.9 | 0 | 0 | 0 | 112.1 | I319 L332 W338 H339 T340 | I319-L336 HydrophobicContact CD1-CD2 3.83Å; I319-L336 HydrophobicContact CG1-CD2 4.39Å; L332-L336 HydrophobicContact CD1-CD1 4.19Å; L332-L336 HydrophobicContact CD1-CD2 4.37Å; L332-L336 HydrophobicContact CD1-CG 3.98Å; L332-L336 HydrophobicContact CD2-CD1 4.48Å; L332-L336 HydrophobicContact CG-CD1 3.97Å; L332-L336 HydrophobicContact CG-CG 4.24Å; L332-L336 WeakPolarHBondContact O-CG 3.3Å; L332-L336 PolarHBondContact O-N 3.18Å; L336-W338 PolarHBondContact O-N 3.5Å; L336-H339 WeakPolarHBondContact O-CB 3.44Å; L336-H339 PolarHBondContact O-N 3.43Å; L336-T340 PolarHBondContact O-N 3.11Å; L336-T340 PolarHBondContact O-OG1 3.42Å |
| 337 | R | 78.8 | Confident | 77.2 | Confident | 50 Ų | 50 | 68.3 Ų | 68.3 | 19% | 0.189 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -61.5 | -23.2 | 172.1 | -70.6 | -174.7 | 169.2 | 160.1 | -1 | 115.4 | H335 H339 T340 G341 E342 T357 | H335-R337 PolarHBondContact O-N 3.2Å; R337-H339 VanDerWaalsContact C-N 3.35Å; R337-T340 WeakPolarHBondContact CA-OG1 3.38Å; R337-G341 CarbonylContact O-C 3.58Å; R337-G341 WeakPolarHBondContact O-CA 3.38Å; R337-G341 PolarHBondContact O-N 2.66Å; R337-E342 HydrophobicContact CB-CB 4.09Å; R337-E342 HydrophobicContact CG-CB 3.81Å; R337-E342 IonicContact NE-OE2 3.29Å; R337-E342 PolarHBondContact NE-OE2 3.33Å; R337-E342 PolarHBondContact O-N 3.26Å; R337-T357 HydrophobicContact CB-CG2 4.39Å; R337-T357 PolarHBondContact NH1-O 2.8Å; R337-T357 VanDerWaalsContact NH1-O 3.08Å |
| 338 | W | 71.6 | Confident | 76.9 | Confident | 123 Ų | 123 | 73.4 Ų | 73.4 | 47% | 0.466 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -70.7 | -35 | 171.5 | -179.7 | 73.6 | 0 | 0 | 0 | 111.2 | H335 L336 S425 | H335-W338 VanDerWaalsContact O-CB 3.3Å; H335-W338 WeakPolarHBondContact O-CB 3.26Å; H335-W338 PolarHBondContact O-N 3.06Å; L336-W338 PolarHBondContact O-N 3.5Å; W338-S425 PolarHBondContact NE1-O 3.1Å |
| 339 | H | 75.1 | Confident | 76.6 | Confident | 68 Ų | 68 | 73.5 Ų | 73.5 | 32% | 0.315 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -78.7 | -35 | 175.8 | -67.1 | -83 | 0 | 0 | 0 | 113.2 | C317 I319 C322 H335 L336 R337 | C317-H339 PolarHBondContact SG-NE2 3.39Å; I319-H339 HydrophobicContact CD1-CB 3.43Å; I319-H339 VanDerWaalsContact CD1-CB 3.43Å; I319-H339 VanDerWaalsContact CD1-CG 3.45Å; C322-H339 WeakPolarHBondContact CB-CE1 3.2Å; C322-H339 WeakPolarHBondContact CB-NE2 3.32Å; C322-H339 PolarHBondContact SG-CE1 3.31Å; C322-H339 PolarHBondContact SG-NE2 3.21Å; H335-H339 AromaticContact CD2-NE2 3.79Å; H335-H339 AromaticContact CE1-CD2 3.53Å; H335-H339 AromaticContact CE1-NE2 2.66Å; H335-H339 PolarHBondContact CE1-NE2 2.89Å; H335-H339 AromaticContact ND1-NE2 3.9Å; H335-H339 AromaticContact NE2-CD2 3.65Å; H335-H339 AromaticContact NE2-NE2 2.52Å; H335-H339 PolarHBondContact NE2-NE2 3.26Å; L336-H339 WeakPolarHBondContact O-CB 3.44Å; L336-H339 PolarHBondContact O-N 3.43Å; R337-H339 VanDerWaalsContact C-N 3.35Å |
| 340 | T | 72.5 | Confident | 76 | Confident | 88 Ų | 88 | 78.3 Ų | 78.3 | 54% | 0.54 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -86.7 | -4.6 | 177.9 | 64.2 | 0 | 0 | 0 | 0 | 114.1 | L336 R337 E342 | L336-T340 PolarHBondContact O-N 3.11Å; L336-T340 PolarHBondContact O-OG1 3.42Å; R337-T340 WeakPolarHBondContact CA-OG1 3.38Å; T340-E342 PolarHBondContact O-N 2.92Å |
| 341 | G | 67.9 | Low | 75.5 | Confident | 53 Ų | 53 | 83.4 Ų | 83.4 | 55% | 0.546 | 41% | 0.413 | S | S | . | . | trans | 69.1 | 4.2 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | R337 R343 | R337-G341 CarbonylContact O-C 3.58Å; R337-G341 WeakPolarHBondContact O-CA 3.38Å; R337-G341 PolarHBondContact O-N 2.66Å; G341-R343 PolarHBondContact O-N 2.99Å; G341-R343 VanDerWaalsContact O-N 3.1Å | ||
| 342 | E | 68.3 | Low | 75.4 | Confident | 102 Ų | 102 | 80.6 Ų | 80.6 | 48% | 0.477 | 40% | 0.403 | S | S | . | . | trans | -63.4 | 108.7 | -178.3 | -86.2 | -176.4 | -155.1 | 0 | 0 | 112.5 | R337 T340 P344 | R337-E342 HydrophobicContact CB-CB 4.09Å; R337-E342 HydrophobicContact CG-CB 3.81Å; R337-E342 IonicContact NE-OE2 3.29Å; R337-E342 PolarHBondContact NE-OE2 3.33Å; R337-E342 PolarHBondContact O-N 3.26Å; T340-E342 PolarHBondContact O-N 2.92Å; E342-P344 WeakPolarHBondContact O-CD 3.35Å | ||
| 343 | R | 70.3 | Confident | 74.6 | Confident | 96 Ų | 96 | 81.5 Ų | 81.5 | 36% | 0.362 | 42% | 0.418 | S | S | . | . | trans | -115.8 | 71.8 | 175.4 | -61.8 | 171 | 81.7 | 134.9 | 2.2 | 110.8 | G341 F345 R355 F356 T357 | G341-R343 PolarHBondContact O-N 2.99Å; G341-R343 VanDerWaalsContact O-N 3.1Å; R343-F345 VanDerWaalsContact C-N 3.35Å; R343-F345 PolarHBondContact O-N 3.03Å; R343-R355 HydrophobicContact CB-CB 3.6Å; R343-R355 VanDerWaalsContact CZ-O 3.26Å; R343-R355 PolarHBondContact NE-O 3.39Å; R343-R355 PolarHBondContact NH2-O 3.41Å; R343-R355 PolarHBondContact O-NE 3.03Å; R343-F356 CarbonylContact C-O 3.59Å; R343-F356 VanDerWaalsContact C-O 3.3Å; R343-F356 VanDerWaalsContact CA-O 3.31Å; R343-F356 WeakPolarHBondContact CA-O 3.49Å; R343-T357 HydrophobicContact CG-CG2 4.14Å | ||
| 344 | P | 73.2 | Confident | 74.4 | Confident | 64 Ų | 64 | 80.2 Ų | 80.2 | 42% | 0.416 | 41% | 0.412 | S | S | . | . | trans | -76.4 | -16.8 | -171.2 | 30.8 | -36.4 | 0 | 0 | 0 | 114.2 | E342 | E342-P344 WeakPolarHBondContact O-CD 3.35Š| ||
| 345 | F | 75.1 | Confident | 74.5 | Confident | 63 Ų | 63 | 86 Ų | 86 | 28% | 0.276 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | 107.6 | -179.6 | -60.4 | -74.3 | 0 | 0 | 0 | 109.9 | R343 R355 F356 T357 R358 L362 | R343-F345 VanDerWaalsContact C-N 3.35Å; R343-F345 PolarHBondContact O-N 3.03Å; F345-R355 CarbonylContact O-C 3.39Å; F345-R355 WeakPolarHBondContact O-CA 3.41Å; F345-F356 HydrophobicContact CB-CB 4.23Å; F345-F356 PolarHBondContact N-O 3.35Å; F345-F356 PolarHBondContact O-N 3.22Å; F345-T357 WeakPolarHBondContact CE2-O 3.46Å; F345-R358 VanDerWaalsContact CE2-C 3.44Å; F345-L362 HydrophobicContact CB-CB 4Å; F345-L362 HydrophobicContact CB-CD2 3.87Å |
| 346 | V | 75.1 | Confident | 74.4 | Confident | 62 Ų | 62 | 86.2 Ų | 86.2 | 38% | 0.376 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 139.1 | -176.1 | -173 | 0 | 0 | 0 | 0 | 110.7 | N348 R355 L362 | V346-N348 PolarHBondContact O-N 3.41Å; V346-R355 HydrophobicContact CG1-CG 4.35Å; V346-R355 HydrophobicContact CG2-CG 4.08Å; V346-L362 WeakPolarHBondContact O-CD2 3.34Å |
| 347 | C | 82.5 | Confident | 74.1 | Confident | 4 Ų | 4 | 84.9 Ų | 84.9 | 3% | 0.027 | 42% | 0.424 | C | S | . | . | trans | -71.3 | 108.1 | 169 | -169.9 | 0 | 0 | 0 | 0 | 110.1 | W349 C352 K354 F356 L362 H365 H369 | C347-W349 PolarHBondContact O-N 2.72Å; C347-C352 HydrophobicContact CB-CB 4.46Å; C347-K354 HydrophobicContact CB-CB 4.49Å; C347-K354 WeakPolarHBondContact CB-O 3.46Å; C347-K354 PolarHBondContact N-O 3.41Å; C347-F356 HydrophobicContact CB-CE2 4.46Å; C347-L362 HydrophobicContact CB-CD1 4.03Å; C347-H365 PolarHBondContact SG-NE2 3.42Å; C347-H365 VanDerWaalsContact SG-NE2 3.37Å; C347-H369 PolarHBondContact SG-NE2 3.48Å; C347-H369 VanDerWaalsContact SG-NE2 3.36Å | ||
| 348 | N | 75.9 | Confident | 74 | Confident | 163 Ų | 163 | 87.7 Ų | 87.7 | 87% | 0.872 | 44% | 0.435 | S | S | * | . | trans | -75 | 19.9 | 178.5 | -153.1 | 68.9 | 0 | 0 | 0 | 113.7 | V346 | V346-N348 PolarHBondContact O-N 3.41Š| ||
| 349 | W | 75.1 | Confident | 74.3 | Confident | 125 Ų | 125 | 85.3 Ų | 85.3 | 47% | 0.473 | 44% | 0.437 | S | S | . | . | trans | -86.6 | 122.3 | 172.7 | -164.8 | -79.4 | 0 | 0 | 0 | 108.4 | C347 F351 C352 H369 | C347-W349 PolarHBondContact O-N 2.72Å; W349-F351 VanDerWaalsContact C-N 3.27Å; W349-F351 PolarHBondContact O-N 2.85Å; W349-F351 VanDerWaalsContact O-N 3.08Å; W349-C352 HydrophobicContact CB-CB 3.94Å; W349-C352 HydrophobicContact CG-CB 4.48Å; W349-C352 WeakPolarHBondContact O-CB 3.35Å; W349-C352 PolarHBondContact O-N 2.98Å; W349-H369 HydrophobicContact CD2-CB 3.9Å; W349-H369 AromaticContact CD2-CD2 3.91Å; W349-H369 AromaticContact CD2-CG 3.74Å; W349-H369 HydrophobicContact CE3-CB 3.67Å; W349-H369 AromaticContact CE3-CD2 3.96Å; W349-H369 AromaticContact CE3-CG 3.89Å; W349-H369 AromaticContact CG-CD2 3.89Å; W349-H369 HydrophobicContact CH2-CB 3.91Å; W349-H369 HydrophobicContact CZ2-CB 4.12Å; W349-H369 HydrophobicContact CZ3-CB 3.68Å | ||
| 350 | L | 68 | Low | 74.5 | Confident | 155 Ų | 155 | 84.9 Ų | 84.9 | 81% | 0.812 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.2 | -41.6 | -163.2 | -171.3 | 64.9 | 0 | 0 | 0 | 114.2 | ||
| 351 | F | 70.4 | Confident | 74.9 | Confident | 185 Ų | 185 | 82.9 Ų | 82.9 | 81% | 0.811 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92 | 7.3 | -178.6 | -54.8 | -74.1 | 0 | 0 | 0 | 114.6 | W349 | W349-F351 VanDerWaalsContact C-N 3.27Å; W349-F351 PolarHBondContact O-N 2.85Å; W349-F351 VanDerWaalsContact O-N 3.08Å |
| 352 | C | 79.1 | Confident | 75.6 | Confident | 29 Ų | 29 | 81.9 Ų | 81.9 | 20% | 0.196 | 40% | 0.404 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.8 | -52.5 | -171.1 | -162.2 | 0 | 0 | 0 | 0 | 114.3 | C347 W349 K354 H365 H369 | C347-C352 HydrophobicContact CB-CB 4.46Å; W349-C352 HydrophobicContact CB-CB 3.94Å; W349-C352 HydrophobicContact CG-CB 4.48Å; W349-C352 WeakPolarHBondContact O-CB 3.35Å; W349-C352 PolarHBondContact O-N 2.98Å; C352-K354 PolarHBondContact O-N 3.2Å; C352-H365 VanDerWaalsContact SG-CE1 3.58Å; C352-H365 PolarHBondContact SG-NE2 3.21Å; C352-H369 PolarHBondContact SG-CE1 2.74Å |
| 353 | G | 68.1 | Low | 76.2 | Confident | 43 Ų | 43 | 82.3 Ų | 82.3 | 44% | 0.443 | 41% | 0.405 | S | S | . | . | trans | 59.1 | -3.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | R355 | G353-R355 WeakPolarHBondContact O-CG 3.38Å; G353-R355 PolarHBondContact O-N 3.21Å | ||
| 354 | K | 76.1 | Confident | 76.6 | Confident | 114 Ų | 114 | 81.8 Ų | 81.8 | 50% | 0.496 | 40% | 0.404 | S | S | . | . | trans | -59.6 | 129.2 | -171.8 | -69.8 | -171.5 | -179.7 | -165.6 | 0 | 111.3 | C347 C352 F356 | C347-K354 HydrophobicContact CB-CB 4.49Å; C347-K354 WeakPolarHBondContact CB-O 3.46Å; C347-K354 PolarHBondContact N-O 3.41Å; C352-K354 PolarHBondContact O-N 3.2Å; K354-F356 HydrophobicContact CB-CE2 3.8Å; K354-F356 HydrophobicContact CB-CZ 3.7Å; K354-F356 VanDerWaalsContact O-CE2 3.25Å; K354-F356 WeakPolarHBondContact O-CE2 3.29Å | ||
| 355 | R | 79.8 | Confident | 77.1 | Confident | 144 Ų | 144 | 80 Ų | 80 | 54% | 0.543 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 142.9 | -176.3 | -45.8 | -175.7 | 75.4 | 160.3 | 9.6 | 110.8 | R343 F345 V346 G353 | R343-R355 HydrophobicContact CB-CB 3.6Å; R343-R355 VanDerWaalsContact CZ-O 3.26Å; R343-R355 PolarHBondContact NE-O 3.39Å; R343-R355 PolarHBondContact NH2-O 3.41Å; R343-R355 PolarHBondContact O-NE 3.03Å; F345-R355 CarbonylContact O-C 3.39Å; F345-R355 WeakPolarHBondContact O-CA 3.41Å; V346-R355 HydrophobicContact CG1-CG 4.35Å; V346-R355 HydrophobicContact CG2-CG 4.08Å; G353-R355 WeakPolarHBondContact O-CG 3.38Å; G353-R355 PolarHBondContact O-N 3.21Å |
| 356 | F | 79.3 | Confident | 77.3 | Confident | 23 Ų | 23 | 79.8 Ų | 79.8 | 10% | 0.101 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 154.9 | -172.4 | -59.1 | -76.7 | 0 | 0 | 0 | 112 | R343 F345 C347 K354 E361 L362 H365 | R343-F356 CarbonylContact C-O 3.59Å; R343-F356 VanDerWaalsContact C-O 3.3Å; R343-F356 VanDerWaalsContact CA-O 3.31Å; R343-F356 WeakPolarHBondContact CA-O 3.49Å; F345-F356 HydrophobicContact CB-CB 4.23Å; F345-F356 PolarHBondContact N-O 3.35Å; F345-F356 PolarHBondContact O-N 3.22Å; C347-F356 HydrophobicContact CB-CE2 4.46Å; K354-F356 HydrophobicContact CB-CE2 3.8Å; K354-F356 HydrophobicContact CB-CZ 3.7Å; K354-F356 VanDerWaalsContact O-CE2 3.25Å; K354-F356 WeakPolarHBondContact O-CE2 3.29Å; F356-E361 HydrophobicContact CB-CB 4.16Å; F356-E361 HydrophobicContact CB-CG 4.18Å; F356-E361 WeakPolarHBondContact CB-OE2 3.41Å; F356-E361 HydrophobicContact CD1-CB 4.31Å; F356-E361 HydrophobicContact CD1-CG 3.52Å; F356-E361 HydrophobicContact CE1-CG 4.26Å; F356-E361 HydrophobicContact CG-CB 4.42Å; F356-E361 HydrophobicContact CG-CG 4.1Å; F356-L362 HydrophobicContact CB-CB 4.45Å; F356-L362 HydrophobicContact CD2-CB 3.94Å; F356-L362 HydrophobicContact CD2-CD1 3.98Å; F356-L362 HydrophobicContact CE2-CD1 4.15Å; F356-L362 HydrophobicContact CG-CB 4.44Å; F356-H365 HydrophobicContact CE1-CB 4.31Å; F356-H365 HydrophobicContact CE2-CB 3.98Å; F356-H365 AromaticContact CE2-CD2 3.34Å; F356-H365 WeakPolarHBondContact CE2-CD2 3.42Å; F356-H365 AromaticContact CE2-CG 3.8Å; F356-H365 HydrophobicContact CZ-CB 3.64Å; F356-H365 AromaticContact CZ-CD2 3.41Å; F356-H365 VanDerWaalsContact CZ-CD2 3.41Å; F356-H365 WeakPolarHBondContact CZ-CD2 3.39Å; F356-H365 AromaticContact CZ-CG 3.45Å; F356-H365 VanDerWaalsContact CZ-CG 3.45Å |
| 357 | T | 74.3 | Confident | 77.4 | Confident | 29 Ų | 29 | 81.7 Ų | 81.7 | 18% | 0.178 | 39% | 0.394 | C | S | . | . | S | Bend | trans | -83.5 | -22.5 | -179.3 | 62 | 0 | 0 | 0 | 0 | 112.2 | R337 R343 F345 E361 | R337-T357 HydrophobicContact CB-CG2 4.39Å; R337-T357 PolarHBondContact NH1-O 2.8Å; R337-T357 VanDerWaalsContact NH1-O 3.08Å; R343-T357 HydrophobicContact CG-CG2 4.14Å; F345-T357 WeakPolarHBondContact CE2-O 3.46Å; T357-E361 PolarHBondContact N-OE2 2.94Å; T357-E361 PolarHBondContact OG1-OE2 3.46Å |
| 358 | R | 76.9 | Confident | 77.1 | Confident | 109 Ų | 109 | 85 Ų | 85 | 41% | 0.411 | 41% | 0.414 | S | S | . | . | S | Bend | trans | -131.4 | 152.1 | -172.9 | -69.1 | 167.5 | 54.8 | 155.6 | -8.6 | 112.8 | A334 F345 D360 E361 L362 | A334-R358 HydrophobicContact CB-CG 3.91Å; F345-R358 VanDerWaalsContact CE2-C 3.44Å; R358-D360 WeakPolarHBondContact CB-OD1 3.39Å; R358-D360 IonicContact CZ-OD1 3.34Å; R358-D360 VanDerWaalsContact CZ-OD1 3.29Å; R358-D360 IonicContact CZ-OD2 3.21Å; R358-D360 IonicContact NE-OD1 3.77Å; R358-D360 PolarHBondContact NE-OD1 2.89Å; R358-D360 IonicContact NE-OD2 2.65Å; R358-D360 IonicContact NH2-OD1 3.58Å; R358-D360 PolarHBondContact NH2-OD1 2.78Å; R358-D360 IonicContact NH2-OD2 3.4Å; R358-D360 PolarHBondContact NH2-OD2 3.33Å; R358-E361 HydrophobicContact CB-CB 4.02Å; R358-E361 WeakPolarHBondContact O-CB 3.49Å; R358-E361 PolarHBondContact O-N 3.42Å; R358-L362 PolarHBondContact O-N 3.32Å |
| 359 | S | 78.4 | Confident | 77 | Confident | 72 Ų | 72 | 79.5 Ų | 79.5 | 50% | 0.503 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -72.5 | -40.2 | 178.9 | 46.6 | 0 | 0 | 0 | 0 | 113.2 | E361 L362 E363 | S359-E361 PolarHBondContact O-N 3.09Å; S359-L362 PolarHBondContact O-N 3.32Å; S359-E363 PolarHBondContact O-N 3.02Å |
| 360 | D | 79.3 | Confident | 76.8 | Confident | 60 Ų | 60 | 76.7 Ų | 76.7 | 32% | 0.321 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -66 | -17 | 175.5 | 70.2 | -78.2 | 0 | 0 | 0 | 113.1 | R358 R364 | R358-D360 WeakPolarHBondContact CB-OD1 3.39Å; R358-D360 IonicContact CZ-OD1 3.34Å; R358-D360 VanDerWaalsContact CZ-OD1 3.29Å; R358-D360 IonicContact CZ-OD2 3.21Å; R358-D360 IonicContact NE-OD1 3.77Å; R358-D360 PolarHBondContact NE-OD1 2.89Å; R358-D360 IonicContact NE-OD2 2.65Å; R358-D360 IonicContact NH2-OD1 3.58Å; R358-D360 PolarHBondContact NH2-OD1 2.78Å; R358-D360 IonicContact NH2-OD2 3.4Å; R358-D360 PolarHBondContact NH2-OD2 3.33Å; D360-R364 VanDerWaalsContact O-CB 3.26Å; D360-R364 WeakPolarHBondContact O-CB 3.34Å; D360-R364 PolarHBondContact O-N 2.83Å; D360-R364 PolarHBondContact O-NH2 3.26Å; D360-R364 IonicContact OD2-NH2 3.33Å; D360-R364 PolarHBondContact OD2-NH2 3.5Å |
| 361 | E | 79.8 | Confident | 76.6 | Confident | 46 Ų | 46 | 79.3 Ų | 79.3 | 22% | 0.215 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -81.5 | -47.1 | 174.9 | -164.7 | -177.9 | -156.2 | 0 | 0 | 111.1 | F356 T357 R358 S359 H365 | F356-E361 HydrophobicContact CB-CB 4.16Å; F356-E361 HydrophobicContact CB-CG 4.18Å; F356-E361 WeakPolarHBondContact CB-OE2 3.41Å; F356-E361 HydrophobicContact CD1-CB 4.31Å; F356-E361 HydrophobicContact CD1-CG 3.52Å; F356-E361 HydrophobicContact CE1-CG 4.26Å; F356-E361 HydrophobicContact CG-CB 4.42Å; F356-E361 HydrophobicContact CG-CG 4.1Å; T357-E361 PolarHBondContact N-OE2 2.94Å; T357-E361 PolarHBondContact OG1-OE2 3.46Å; R358-E361 HydrophobicContact CB-CB 4.02Å; R358-E361 WeakPolarHBondContact O-CB 3.49Å; R358-E361 PolarHBondContact O-N 3.42Å; S359-E361 PolarHBondContact O-N 3.09Å; E361-H365 WeakPolarHBondContact O-CB 3.12Å; E361-H365 PolarHBondContact O-N 3.42Å |
| 362 | L | 82.6 | Confident | 76.2 | Confident | 32 Ų | 32 | 74.5 Ų | 74.5 | 17% | 0.168 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59.6 | -47.6 | 170.6 | 171.3 | 60 | 0 | 0 | 0 | 111.8 | F345 V346 C347 F356 R358 S359 R364 H365 V366 | F345-L362 HydrophobicContact CB-CB 4Å; F345-L362 HydrophobicContact CB-CD2 3.87Å; V346-L362 WeakPolarHBondContact O-CD2 3.34Å; C347-L362 HydrophobicContact CB-CD1 4.03Å; F356-L362 HydrophobicContact CB-CB 4.45Å; F356-L362 HydrophobicContact CD2-CB 3.94Å; F356-L362 HydrophobicContact CD2-CD1 3.98Å; F356-L362 HydrophobicContact CE2-CD1 4.15Å; F356-L362 HydrophobicContact CG-CB 4.44Å; R358-L362 PolarHBondContact O-N 3.32Å; S359-L362 PolarHBondContact O-N 3.32Å; L362-R364 PolarHBondContact O-N 3.22Å; L362-H365 CarbonylContact O-C 3.55Å; L362-H365 WeakPolarHBondContact O-CB 3.41Å; L362-H365 PolarHBondContact O-N 3.1Å; L362-H365 VanDerWaalsContact O-N 3.11Å; L362-V366 HydrophobicContact CD1-CG2 3.92Å; L362-V366 HydrophobicContact CG-CG2 4.45Å; L362-V366 WeakPolarHBondContact O-CG2 3.36Å; L362-V366 PolarHBondContact O-N 3.39Å |
| 363 | E | 80.3 | Confident | 75.6 | Confident | 110 Ų | 110 | 76.5 Ų | 76.5 | 51% | 0.514 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | -178.1 | -161.7 | -153.2 | 163.1 | 0 | 0 | 111.7 | S359 H365 V366 R367 | S359-E363 PolarHBondContact O-N 3.02Å; E363-H365 VanDerWaalsContact C-N 3.28Å; E363-H365 PolarHBondContact O-N 3.03Å; E363-V366 PolarHBondContact O-N 3.17Å; E363-R367 WeakPolarHBondContact O-CG 3.29Å; E363-R367 PolarHBondContact O-N 3.34Å; E363-R367 IonicContact OE1-CZ 2.92Å; E363-R367 IonicContact OE1-NE 2.8Å; E363-R367 IonicContact OE1-NH2 3.66Å; E363-R367 PolarHBondContact OE1-NH2 3.07Å; E363-R367 IonicContact OE2-NH2 2.82Å; E363-R367 PolarHBondContact OE2-NH2 2.89Å |
| 364 | R | 79.1 | Confident | 75.9 | Confident | 86 Ų | 86 | 80.8 Ų | 80.8 | 33% | 0.325 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.9 | -37.3 | 174.6 | -167 | -163.2 | -33.9 | 112.7 | 4.8 | 111.9 | D360 L362 | D360-R364 VanDerWaalsContact O-CB 3.26Å; D360-R364 WeakPolarHBondContact O-CB 3.34Å; D360-R364 PolarHBondContact O-N 2.83Å; D360-R364 PolarHBondContact O-NH2 3.26Å; D360-R364 IonicContact OD2-NH2 3.33Å; D360-R364 PolarHBondContact OD2-NH2 3.5Å; L362-R364 PolarHBondContact O-N 3.22Å |
| 365 | H | 83.3 | Confident | 75.9 | Confident | 25 Ų | 25 | 78.8 Ų | 78.8 | 12% | 0.116 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -71.4 | -40.1 | 176.4 | 169.3 | 52.1 | 0 | 0 | 0 | 112.7 | C347 C352 F356 E361 L362 E363 R367 T368 H369 | C347-H365 PolarHBondContact SG-NE2 3.42Å; C347-H365 VanDerWaalsContact SG-NE2 3.37Å; C352-H365 VanDerWaalsContact SG-CE1 3.58Å; C352-H365 PolarHBondContact SG-NE2 3.21Å; F356-H365 HydrophobicContact CE1-CB 4.31Å; F356-H365 HydrophobicContact CE2-CB 3.98Å; F356-H365 AromaticContact CE2-CD2 3.34Å; F356-H365 WeakPolarHBondContact CE2-CD2 3.42Å; F356-H365 AromaticContact CE2-CG 3.8Å; F356-H365 HydrophobicContact CZ-CB 3.64Å; F356-H365 AromaticContact CZ-CD2 3.41Å; F356-H365 VanDerWaalsContact CZ-CD2 3.41Å; F356-H365 WeakPolarHBondContact CZ-CD2 3.39Å; F356-H365 AromaticContact CZ-CG 3.45Å; F356-H365 VanDerWaalsContact CZ-CG 3.45Å; E361-H365 WeakPolarHBondContact O-CB 3.12Å; E361-H365 PolarHBondContact O-N 3.42Å; L362-H365 CarbonylContact O-C 3.55Å; L362-H365 WeakPolarHBondContact O-CB 3.41Å; L362-H365 PolarHBondContact O-N 3.1Å; L362-H365 VanDerWaalsContact O-N 3.11Å; E363-H365 VanDerWaalsContact C-N 3.28Å; E363-H365 PolarHBondContact O-N 3.03Å; H365-R367 PolarHBondContact O-N 3.34Å; H365-R367 VanDerWaalsContact O-N 3.16Å; H365-T368 PolarHBondContact ND1-OG1 3.4Å; H365-T368 WeakPolarHBondContact O-CB 3.39Å; H365-T368 PolarHBondContact O-N 3.18Å; H365-T368 PolarHBondContact O-OG1 3.2Å; H365-H369 AromaticContact CE1-CE1 3.73Å; H365-H369 AromaticContact CE1-NE2 3.36Å; H365-H369 PolarHBondContact CE1-NE2 3.25Å; H365-H369 AromaticContact NE2-CE1 3.93Å; H365-H369 AromaticContact NE2-NE2 3.21Å; H365-H369 PolarHBondContact NE2-NE2 3.3Å |
| 366 | V | 79.1 | Confident | 75.9 | Confident | 59 Ų | 59 | 74.6 Ų | 74.6 | 36% | 0.358 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -58.3 | -33.2 | 177.4 | 169.9 | 0 | 0 | 0 | 0 | 111.5 | L362 E363 T368 H369 | L362-V366 HydrophobicContact CD1-CG2 3.92Å; L362-V366 HydrophobicContact CG-CG2 4.45Å; L362-V366 WeakPolarHBondContact O-CG2 3.36Å; L362-V366 PolarHBondContact O-N 3.39Å; E363-V366 PolarHBondContact O-N 3.17Å; V366-T368 PolarHBondContact O-N 3.36Å; V366-H369 PolarHBondContact O-N 2.94Å; V366-H369 VanDerWaalsContact O-N 3.13Å |
| 367 | R | 77.4 | Confident | 76.2 | Confident | 102 Ų | 102 | 73.5 Ų | 73.5 | 39% | 0.385 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.7 | -11.8 | 173.5 | -59.8 | 169.8 | -167.7 | 171.4 | 1.4 | 114.6 | E363 H365 T370 | E363-R367 WeakPolarHBondContact O-CG 3.29Å; E363-R367 PolarHBondContact O-N 3.34Å; E363-R367 IonicContact OE1-CZ 2.92Å; E363-R367 IonicContact OE1-NE 2.8Å; E363-R367 IonicContact OE1-NH2 3.66Å; E363-R367 PolarHBondContact OE1-NH2 3.07Å; E363-R367 IonicContact OE2-NH2 2.82Å; E363-R367 PolarHBondContact OE2-NH2 2.89Å; H365-R367 PolarHBondContact O-N 3.34Å; H365-R367 VanDerWaalsContact O-N 3.16Å; R367-T370 PolarHBondContact O-OG1 2.84Å |
| 368 | T | 76.1 | Confident | 76.6 | Confident | 73 Ų | 73 | 79.2 Ų | 79.2 | 45% | 0.448 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -77.8 | -31.3 | 171.6 | 68.9 | 0 | 0 | 0 | 0 | 111.7 | H365 V366 R371 | H365-T368 PolarHBondContact ND1-OG1 3.4Å; H365-T368 WeakPolarHBondContact O-CB 3.39Å; H365-T368 PolarHBondContact O-N 3.18Å; H365-T368 PolarHBondContact O-OG1 3.2Å; V366-T368 PolarHBondContact O-N 3.36Å; T368-R371 PolarHBondContact O-N 3.08Å |
| 369 | H | 75.1 | Confident | 76.8 | Confident | 49 Ų | 49 | 80 Ų | 80 | 23% | 0.227 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -69.9 | -38.7 | 176.7 | -61.3 | -51.1 | 0 | 0 | 0 | 112 | C347 W349 C352 H365 V366 R371 | C347-H369 PolarHBondContact SG-NE2 3.48Å; C347-H369 VanDerWaalsContact SG-NE2 3.36Å; W349-H369 HydrophobicContact CD2-CB 3.9Å; W349-H369 AromaticContact CD2-CD2 3.91Å; W349-H369 AromaticContact CD2-CG 3.74Å; W349-H369 HydrophobicContact CE3-CB 3.67Å; W349-H369 AromaticContact CE3-CD2 3.96Å; W349-H369 AromaticContact CE3-CG 3.89Å; W349-H369 AromaticContact CG-CD2 3.89Å; W349-H369 HydrophobicContact CH2-CB 3.91Å; W349-H369 HydrophobicContact CZ2-CB 4.12Å; W349-H369 HydrophobicContact CZ3-CB 3.68Å; C352-H369 PolarHBondContact SG-CE1 2.74Å; H365-H369 AromaticContact CE1-CE1 3.73Å; H365-H369 AromaticContact CE1-NE2 3.36Å; H365-H369 PolarHBondContact CE1-NE2 3.25Å; H365-H369 AromaticContact NE2-CE1 3.93Å; H365-H369 AromaticContact NE2-NE2 3.21Å; H365-H369 PolarHBondContact NE2-NE2 3.3Å; V366-H369 PolarHBondContact O-N 2.94Å; V366-H369 VanDerWaalsContact O-N 3.13Å; H369-R371 VanDerWaalsContact C-N 3.27Å; H369-R371 PolarHBondContact O-N 2.65Å |
| 370 | T | 70.4 | Confident | 77.1 | Confident | 66 Ų | 66 | 78.7 Ų | 78.7 | 41% | 0.405 | 38% | 0.379 | S | S | . | . | S | Bend | trans | -76.9 | -9 | 178.4 | 64.7 | 0 | 0 | 0 | 0 | 114.1 | R367 E372 | R367-T370 PolarHBondContact O-OG1 2.84Å; T370-E372 PolarHBondContact O-N 2.82Å; T370-E372 WeakPolarHBondContact OG1-CG 3.46Å; T370-E372 PolarHBondContact OG1-OE2 2.91Å |
| 371 | R | 64.3 | Low | 77.2 | Confident | 210 Ų | 210 | 81.5 Ų | 81.5 | 79% | 0.792 | 39% | 0.393 | S | S | * | . | trans | 52.7 | 17.6 | -178 | -63 | -172.5 | 172.3 | -148.5 | -1.1 | 115.7 | T368 H369 K373 | T368-R371 PolarHBondContact O-N 3.08Å; H369-R371 VanDerWaalsContact C-N 3.27Å; H369-R371 PolarHBondContact O-N 2.65Å; R371-K373 PolarHBondContact O-N 3.04Å | ||
| 372 | E | 60.5 | Low | 77.2 | Confident | 83 Ų | 83 | 85.5 Ų | 85.5 | 39% | 0.388 | 41% | 0.41 | S | S | . | . | trans | -70 | 89.2 | -171.4 | -70 | -178.5 | 114.8 | 0 | 0 | 113.3 | T370 K374 | T370-E372 PolarHBondContact O-N 2.82Å; T370-E372 WeakPolarHBondContact OG1-CG 3.46Å; T370-E372 PolarHBondContact OG1-OE2 2.91Å; E372-K374 VanDerWaalsContact C-N 3.27Å; E372-K374 HydrophobicContact CB-CD 4.17Å; E372-K374 HydrophobicContact CB-CG 4.22Å; E372-K374 VanDerWaalsContact CD-CE 3.43Å; E372-K374 PolarHBondContact O-N 2.92Å; E372-K374 WeakPolarHBondContact OE1-CE 3.48Å; E372-K374 IonicContact OE1-NZ 3.61Å; E372-K374 PolarHBondContact OE1-NZ 2.8Å; E372-K374 IonicContact OE2-NZ 2.66Å; E372-K374 PolarHBondContact OE2-NZ 3.15Å | ||
| 373 | K | 67.3 | Low | 77.1 | Confident | 71 Ų | 71 | 91.2 Ų | 91.2 | 31% | 0.309 | 43% | 0.43 | S | S | . | . | trans | -72.2 | 78.3 | 171.3 | -66.3 | 174.8 | 177.4 | 173.2 | 0 | 110.9 | R371 R383 F384 T385 | R371-K373 PolarHBondContact O-N 3.04Å; K373-R383 HydrophobicContact CB-CB 3.82Å; K373-R383 HydrophobicContact CD-CB 4.24Å; K373-R383 PolarHBondContact O-NE 3.33Å; K373-R383 PolarHBondContact O-NH2 3.19Å; K373-F384 CarbonylContact C-O 3.49Å; K373-F384 WeakPolarHBondContact CA-O 3.3Å; K373-T385 HydrophobicContact CG-CG2 3.88Å | ||
| 374 | K | 74.4 | Confident | 77.1 | Confident | 134 Ų | 134 | 88.1 Ų | 88.1 | 58% | 0.583 | 41% | 0.414 | S | S | * | . | trans | -82.3 | -14.3 | -176 | -80.3 | 169.5 | 172.9 | 162.2 | 0 | 115.4 | E372 F384 | E372-K374 VanDerWaalsContact C-N 3.27Å; E372-K374 HydrophobicContact CB-CD 4.17Å; E372-K374 HydrophobicContact CB-CG 4.22Å; E372-K374 VanDerWaalsContact CD-CE 3.43Å; E372-K374 PolarHBondContact O-N 2.92Å; E372-K374 WeakPolarHBondContact OE1-CE 3.48Å; E372-K374 IonicContact OE1-NZ 3.61Å; E372-K374 PolarHBondContact OE1-NZ 2.8Å; E372-K374 IonicContact OE2-NZ 2.66Å; E372-K374 PolarHBondContact OE2-NZ 3.15Å; K374-F384 PolarHBondContact N-O 3.37Å | ||
| 375 | F | 75.3 | Confident | 77 | Confident | 71 Ų | 71 | 86.2 Ų | 86.2 | 31% | 0.311 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 106.8 | -173.4 | -59.7 | -79.7 | 0 | 0 | 0 | 111.3 | F384 R386 L390 | F375-F384 HydrophobicContact CB-CB 4.3Å; F375-F384 PolarHBondContact N-O 3.42Å; F375-F384 PolarHBondContact O-N 2.87Å; F375-R386 VanDerWaalsContact CD2-C 3.46Å; F375-L390 HydrophobicContact CB-CB 4.18Å; F375-L390 HydrophobicContact CB-CD2 3.85Å |
| 376 | T | 81.2 | Confident | 76.7 | Confident | 56 Ų | 56 | 88.7 Ų | 88.7 | 34% | 0.344 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 136.4 | -177.9 | -53.2 | 0 | 0 | 0 | 0 | 111.6 | R383 | T376-R383 HydrophobicContact CG2-CG 4.17Å |
| 377 | C | 85.2 | Confident | 76.8 | Confident | 0 Ų | 0 | 89.3 Ų | 89.3 | 0% | 0 | 43% | 0.427 | C | S | . | . | trans | -82.6 | 115.4 | 172 | -170.3 | 0 | 0 | 0 | 0 | 111.1 | L379 C380 N381 K382 F384 L390 | C377-L379 PolarHBondContact O-N 2.38Å; C377-L379 VanDerWaalsContact O-N 3.09Å; C377-C380 PolarHBondContact O-N 2.52Å; C377-N381 WeakPolarHBondContact O-CA 3.34Å; C377-N381 PolarHBondContact O-N 2.91Å; C377-K382 PolarHBondContact N-O 2.91Å; C377-F384 HydrophobicContact CB-CE2 4.29Å; C377-L390 HydrophobicContact CB-CD1 3.53Å | ||
| 378 | L | 81.5 | Confident | 77.1 | Confident | 150 Ų | 150 | 87.5 Ų | 87.5 | 79% | 0.785 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -12.8 | -176.8 | -57.1 | 179.3 | 0 | 0 | 0 | 114.6 | ||
| 379 | L | 82.1 | Confident | 77.5 | Confident | 125 Ų | 125 | 87.7 Ų | 87.7 | 65% | 0.654 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.9 | -21.8 | -178.4 | -62.1 | 173.8 | 0 | 0 | 0 | 113.8 | C377 H397 | C377-L379 PolarHBondContact O-N 2.38Å; C377-L379 VanDerWaalsContact O-N 3.09Å; L379-H397 HydrophobicContact CD1-CB 3.57Å |
| 380 | C | 85.4 | Confident | 78 | Confident | 45 Ų | 45 | 86.3 Ų | 86.3 | 30% | 0.304 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -150.7 | 13.4 | -178.3 | 67.9 | 0 | 0 | 0 | 0 | 114.2 | C377 K382 H393 H397 | C377-C380 PolarHBondContact O-N 2.52Å; C380-K382 PolarHBondContact O-N 2.87Å; C380-H393 PolarHBondContact SG-NE2 2.66Å; C380-H397 PolarHBondContact SG-CE1 3.19Å; C380-H397 PolarHBondContact SG-NE2 3.48Å; C380-H397 VanDerWaalsContact SG-NE2 3.36Å |
| 381 | N | 81 | Confident | 78.7 | Confident | 118 Ų | 118 | 86 Ų | 86 | 63% | 0.631 | 42% | 0.416 | S | S | * | . | trans | 52.7 | 7.7 | -179 | -65.4 | -41.6 | 0 | 0 | 0 | 117.7 | C377 R383 | C377-N381 WeakPolarHBondContact O-CA 3.34Å; C377-N381 PolarHBondContact O-N 2.91Å; N381-R383 WeakPolarHBondContact O-CG 3.26Å; N381-R383 PolarHBondContact O-N 2.82Å | ||
| 382 | K | 79.1 | Confident | 79.8 | Confident | 130 Ų | 130 | 82.3 Ų | 82.3 | 57% | 0.565 | 41% | 0.405 | S | S | * | . | trans | -60.6 | 133.2 | 173.9 | -68.5 | -174.6 | -171.6 | -67 | 0 | 110.8 | C377 C380 F384 | C377-K382 PolarHBondContact N-O 2.91Å; C380-K382 PolarHBondContact O-N 2.87Å; K382-F384 HydrophobicContact CB-CE2 3.99Å; K382-F384 HydrophobicContact CB-CZ 4.18Å; K382-F384 WeakPolarHBondContact O-CE2 3.06Å | ||
| 383 | R | 80.4 | Confident | 81 | Confident | 153 Ų | 153 | 79.8 Ų | 79.8 | 58% | 0.577 | 39% | 0.394 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.1 | 132.1 | -171.9 | -56.8 | 179.3 | 58.3 | -178.7 | -1.8 | 112 | K373 T376 N381 | K373-R383 HydrophobicContact CB-CB 3.82Å; K373-R383 HydrophobicContact CD-CB 4.24Å; K373-R383 PolarHBondContact O-NE 3.33Å; K373-R383 PolarHBondContact O-NH2 3.19Å; T376-R383 HydrophobicContact CG2-CG 4.17Å; N381-R383 WeakPolarHBondContact O-CG 3.26Å; N381-R383 PolarHBondContact O-N 2.82Å |
| 384 | F | 80.3 | Confident | 81.8 | Confident | 44 Ų | 44 | 80.6 Ų | 80.6 | 19% | 0.193 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 149.3 | -175.3 | -58.4 | -91.3 | 0 | 0 | 0 | 111.3 | K373 K374 F375 C377 K382 R386 H389 L390 H393 | K373-F384 CarbonylContact C-O 3.49Å; K373-F384 WeakPolarHBondContact CA-O 3.3Å; K374-F384 PolarHBondContact N-O 3.37Å; F375-F384 HydrophobicContact CB-CB 4.3Å; F375-F384 PolarHBondContact N-O 3.42Å; F375-F384 PolarHBondContact O-N 2.87Å; C377-F384 HydrophobicContact CB-CE2 4.29Å; K382-F384 HydrophobicContact CB-CE2 3.99Å; K382-F384 HydrophobicContact CB-CZ 4.18Å; K382-F384 WeakPolarHBondContact O-CE2 3.06Å; F384-R386 VanDerWaalsContact C-N 3.3Å; F384-H389 HydrophobicContact CD1-CB 3.92Å; F384-H389 HydrophobicContact CG-CB 4.49Å; F384-L390 HydrophobicContact CB-CB 4.49Å; F384-L390 HydrophobicContact CD2-CB 4.11Å; F384-L390 HydrophobicContact CD2-CD1 4.02Å; F384-L390 HydrophobicContact CE2-CD1 4.17Å; F384-L390 HydrophobicContact CG-CB 4.39Å; F384-H393 HydrophobicContact CE1-CB 4.2Å; F384-H393 HydrophobicContact CE2-CB 4.26Å; F384-H393 AromaticContact CE2-CD2 3.34Å; F384-H393 WeakPolarHBondContact CE2-CD2 3.29Å; F384-H393 AromaticContact CE2-CG 3.93Å; F384-H393 HydrophobicContact CZ-CB 3.7Å; F384-H393 AromaticContact CZ-CD2 3.3Å; F384-H393 WeakPolarHBondContact CZ-CD2 3.13Å; F384-H393 AromaticContact CZ-CG 3.43Å; F384-H393 VanDerWaalsContact CZ-CG 3.43Å; F384-H393 AromaticContact CZ-NE2 3.94Å |
| 385 | T | 78.1 | Confident | 82.4 | Confident | 46 Ų | 46 | 80.7 Ų | 80.7 | 28% | 0.282 | 40% | 0.399 | S | S | . | . | S | Bend | trans | -78.9 | -13.1 | 171.9 | 51.4 | 0 | 0 | 0 | 0 | 113.1 | K373 | K373-T385 HydrophobicContact CG-CG2 3.88Š|
| 386 | R | 76.2 | Confident | 82.8 | Confident | 78 Ų | 78 | 80.4 Ų | 80.4 | 29% | 0.294 | 40% | 0.403 | S | S | . | . | trans | -138.2 | 141.5 | -172.9 | -68.5 | 165 | 52.8 | 173.2 | -2.7 | 112.5 | F375 F384 D388 H389 L390 | F375-R386 VanDerWaalsContact CD2-C 3.46Å; F384-R386 VanDerWaalsContact C-N 3.3Å; R386-D388 WeakPolarHBondContact CB-OD1 3.07Å; R386-D388 IonicContact CZ-OD1 3.66Å; R386-D388 IonicContact CZ-OD2 2.72Å; R386-D388 IonicContact NE-OD1 3.83Å; R386-D388 PolarHBondContact NE-OD1 2.99Å; R386-D388 IonicContact NE-OD2 3.45Å; R386-D388 IonicContact NH2-OD1 2.74Å; R386-D388 PolarHBondContact NH2-OD1 3.33Å; R386-D388 IonicContact NH2-OD2 2.85Å; R386-D388 PolarHBondContact NH2-OD2 3.24Å; R386-H389 HydrophobicContact CB-CB 4.36Å; R386-H389 PolarHBondContact NH2-NE2 3.17Å; R386-L390 PolarHBondContact O-N 3.24Å | ||
| 387 | S | 81.6 | Confident | 82.7 | Confident | 71 Ų | 71 | 80 Ų | 80 | 50% | 0.497 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -70.5 | -31 | 177.4 | 50 | 0 | 0 | 0 | 0 | 113.7 | L390 S391 | S387-L390 PolarHBondContact O-N 3.3Å; S387-S391 WeakPolarHBondContact O-CB 3.4Å; S387-S391 PolarHBondContact O-N 3.4Å |
| 388 | D | 82.8 | Confident | 82.3 | Confident | 64 Ų | 64 | 83.1 Ų | 83.1 | 34% | 0.342 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -70.9 | -33.5 | 177.1 | 72.5 | -62.1 | 0 | 0 | 0 | 112.1 | R386 K392 | R386-D388 WeakPolarHBondContact CB-OD1 3.07Å; R386-D388 IonicContact CZ-OD1 3.66Å; R386-D388 IonicContact CZ-OD2 2.72Å; R386-D388 IonicContact NE-OD1 3.83Å; R386-D388 PolarHBondContact NE-OD1 2.99Å; R386-D388 IonicContact NE-OD2 3.45Å; R386-D388 IonicContact NH2-OD1 2.74Å; R386-D388 PolarHBondContact NH2-OD1 3.33Å; R386-D388 IonicContact NH2-OD2 2.85Å; R386-D388 PolarHBondContact NH2-OD2 3.24Å; D388-K392 WeakPolarHBondContact O-CG 3.43Å; D388-K392 PolarHBondContact O-N 3.03Å |
| 389 | H | 84.4 | Confident | 81.5 | Confident | 78 Ų | 78 | 81 Ų | 81 | 36% | 0.361 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -67.8 | -45 | 170.1 | -66 | -28.1 | 0 | 0 | 0 | 111.9 | F384 R386 S391 K392 H393 | F384-H389 HydrophobicContact CD1-CB 3.92Å; F384-H389 HydrophobicContact CG-CB 4.49Å; R386-H389 HydrophobicContact CB-CB 4.36Å; R386-H389 PolarHBondContact NH2-NE2 3.17Å; H389-S391 VanDerWaalsContact C-N 3.33Å; H389-S391 PolarHBondContact O-N 2.81Å; H389-K392 PolarHBondContact O-N 3.12Å; H389-H393 WeakPolarHBondContact O-CB 3.44Å; H389-H393 PolarHBondContact O-N 3.45Å |
| 390 | L | 87 | Confident | 80.4 | Confident | 19 Ų | 19 | 78.3 Ų | 78.3 | 10% | 0.099 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -57.6 | -45.4 | 172.8 | 173.3 | 60 | 0 | 0 | 0 | 111.4 | F375 C377 F384 R386 S387 K392 H393 Q394 | F375-L390 HydrophobicContact CB-CB 4.18Å; F375-L390 HydrophobicContact CB-CD2 3.85Å; C377-L390 HydrophobicContact CB-CD1 3.53Å; F384-L390 HydrophobicContact CB-CB 4.49Å; F384-L390 HydrophobicContact CD2-CB 4.11Å; F384-L390 HydrophobicContact CD2-CD1 4.02Å; F384-L390 HydrophobicContact CE2-CD1 4.17Å; F384-L390 HydrophobicContact CG-CB 4.39Å; R386-L390 PolarHBondContact O-N 3.24Å; S387-L390 PolarHBondContact O-N 3.3Å; L390-K392 PolarHBondContact O-N 2.85Å; L390-H393 CarbonylContact O-C 3.3Å; L390-H393 PolarHBondContact O-N 3.09Å; L390-Q394 HydrophobicContact CD1-CG 3.94Å; L390-Q394 HydrophobicContact CG-CG 4.34Å; L390-Q394 WeakPolarHBondContact O-CB 3.35Å; L390-Q394 WeakPolarHBondContact O-CG 3.42Å; L390-Q394 PolarHBondContact O-N 3.11Å |
| 391 | S | 84.9 | Confident | 79 | Confident | 60 Ų | 60 | 80.1 Ų | 80.1 | 42% | 0.42 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.6 | -35.9 | -179.6 | -176.9 | 0 | 0 | 0 | 0 | 113.1 | S387 H389 | S387-S391 WeakPolarHBondContact O-CB 3.4Å; S387-S391 PolarHBondContact O-N 3.4Å; H389-S391 VanDerWaalsContact C-N 3.33Å; H389-S391 PolarHBondContact O-N 2.81Å |
| 392 | K | 86.2 | Confident | 77.6 | Confident | 132 Ų | 132 | 82.6 Ų | 82.6 | 57% | 0.574 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -64.6 | -47.1 | 170.2 | -74.8 | 178.4 | 178.5 | -172.1 | 0 | 111.5 | D388 H389 L390 Q394 K395 T396 | D388-K392 WeakPolarHBondContact O-CG 3.43Å; D388-K392 PolarHBondContact O-N 3.03Å; H389-K392 PolarHBondContact O-N 3.12Å; L390-K392 PolarHBondContact O-N 2.85Å; K392-Q394 VanDerWaalsContact C-N 3.33Å; K392-Q394 PolarHBondContact O-N 3.32Å; K392-K395 WeakPolarHBondContact O-CB 3.48Å; K392-K395 PolarHBondContact O-N 2.86Å; K392-K395 VanDerWaalsContact O-N 3.1Å; K392-T396 PolarHBondContact O-N 3.31Å |
| 393 | H | 87.1 | Confident | 76.2 | Confident | 31 Ų | 31 | 83.8 Ų | 83.8 | 14% | 0.144 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -66.1 | -30.6 | 179 | 171.9 | 61.1 | 0 | 0 | 0 | 113.5 | C380 F384 H389 L390 K395 T396 H397 | C380-H393 PolarHBondContact SG-NE2 2.66Å; F384-H393 HydrophobicContact CE1-CB 4.2Å; F384-H393 HydrophobicContact CE2-CB 4.26Å; F384-H393 AromaticContact CE2-CD2 3.34Å; F384-H393 WeakPolarHBondContact CE2-CD2 3.29Å; F384-H393 AromaticContact CE2-CG 3.93Å; F384-H393 HydrophobicContact CZ-CB 3.7Å; F384-H393 AromaticContact CZ-CD2 3.3Å; F384-H393 WeakPolarHBondContact CZ-CD2 3.13Å; F384-H393 AromaticContact CZ-CG 3.43Å; F384-H393 VanDerWaalsContact CZ-CG 3.43Å; F384-H393 AromaticContact CZ-NE2 3.94Å; H389-H393 WeakPolarHBondContact O-CB 3.44Å; H389-H393 PolarHBondContact O-N 3.45Å; L390-H393 CarbonylContact O-C 3.3Å; L390-H393 PolarHBondContact O-N 3.09Å; H393-K395 PolarHBondContact O-N 3.45Å; H393-T396 PolarHBondContact ND1-OG1 2.75Å; H393-T396 PolarHBondContact O-N 3.26Å; H393-T396 PolarHBondContact O-OG1 2.92Å; H393-H397 AromaticContact CD2-NE2 3.85Å; H393-H397 AromaticContact CE1-CD2 3.91Å; H393-H397 AromaticContact CE1-CE1 3.93Å; H393-H397 AromaticContact CE1-NE2 3.12Å; H393-H397 PolarHBondContact CE1-NE2 3.01Å; H393-H397 AromaticContact ND1-NE2 3.95Å; H393-H397 AromaticContact NE2-CD2 3.84Å; H393-H397 AromaticContact NE2-NE2 3.02Å; H393-H397 PolarHBondContact NE2-NE2 3.08Å; H393-H397 PolarHBondContact O-CD2 2.05Å; H393-H397 VanDerWaalsContact O-CD2 3.22Å |
| 394 | Q | 84.5 | Confident | 74.6 | Confident | 88 Ų | 88 | 80.8 Ų | 80.8 | 41% | 0.411 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.9 | -26.9 | 172.4 | -78.7 | 171.7 | -40.6 | 0 | 0 | 112.5 | L390 K392 | L390-Q394 HydrophobicContact CD1-CG 3.94Å; L390-Q394 HydrophobicContact CG-CG 4.34Å; L390-Q394 WeakPolarHBondContact O-CB 3.35Å; L390-Q394 WeakPolarHBondContact O-CG 3.42Å; L390-Q394 PolarHBondContact O-N 3.11Å; K392-Q394 VanDerWaalsContact C-N 3.33Å; K392-Q394 PolarHBondContact O-N 3.32Å |
| 395 | K | 86.1 | Confident | 72.8 | Confident | 135 Ų | 135 | 87.5 Ų | 87.5 | 59% | 0.587 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -72.3 | -40 | 174 | -62.3 | 178.6 | -177.9 | -168.8 | 0 | 111.9 | K392 H393 H397 A398 D399 | K392-K395 WeakPolarHBondContact O-CB 3.48Å; K392-K395 PolarHBondContact O-N 2.86Å; K392-K395 VanDerWaalsContact O-N 3.1Å; H393-K395 PolarHBondContact O-N 3.45Å; K395-H397 PolarHBondContact O-N 3.3Å; K395-A398 WeakPolarHBondContact O-CA 3.38Å; K395-A398 WeakPolarHBondContact O-CB 3.48Å; K395-A398 PolarHBondContact O-N 3.18Å; K395-D399 VanDerWaalsContact C-OD2 3.29Å; K395-D399 VanDerWaalsContact O-CG 3.25Å; K395-D399 PolarHBondContact O-N 2.92Å |
| 396 | T | 83.4 | Confident | 71 | Confident | 66 Ų | 66 | 91.9 Ų | 91.9 | 41% | 0.405 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.6 | -26.5 | 178.5 | 64.2 | 0 | 0 | 0 | 0 | 112.7 | K392 H393 D399 S400 | K392-T396 PolarHBondContact O-N 3.31Å; H393-T396 PolarHBondContact ND1-OG1 2.75Å; H393-T396 PolarHBondContact O-N 3.26Å; H393-T396 PolarHBondContact O-OG1 2.92Å; T396-D399 WeakPolarHBondContact CA-OD2 3.47Å; T396-S400 VanDerWaalsContact O-CB 3.29Å; T396-S400 WeakPolarHBondContact O-CB 3.47Å; T396-S400 PolarHBondContact O-N 2.78Å; T396-S400 PolarHBondContact O-OG 3.46Å |
| 397 | H | 79.6 | Confident | 69.6 | Low | 48 Ų | 48 | 94.5 Ų | 94.5 | 22% | 0.222 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -71.3 | -36.3 | 170.6 | -68.7 | -73.2 | 0 | 0 | 0 | 113.7 | L379 C380 H393 K395 A401 | L379-H397 HydrophobicContact CD1-CB 3.57Å; C380-H397 PolarHBondContact SG-CE1 3.19Å; C380-H397 PolarHBondContact SG-NE2 3.48Å; C380-H397 VanDerWaalsContact SG-NE2 3.36Å; H393-H397 AromaticContact CD2-NE2 3.85Å; H393-H397 AromaticContact CE1-CD2 3.91Å; H393-H397 AromaticContact CE1-CE1 3.93Å; H393-H397 AromaticContact CE1-NE2 3.12Å; H393-H397 PolarHBondContact CE1-NE2 3.01Å; H393-H397 AromaticContact ND1-NE2 3.95Å; H393-H397 AromaticContact NE2-CD2 3.84Å; H393-H397 AromaticContact NE2-NE2 3.02Å; H393-H397 PolarHBondContact NE2-NE2 3.08Å; H393-H397 PolarHBondContact O-CD2 2.05Å; H393-H397 VanDerWaalsContact O-CD2 3.22Å; K395-H397 PolarHBondContact O-N 3.3Å; H397-A401 PolarHBondContact O-N 3.44Å |
| 398 | A | 75.9 | Confident | 67.4 | Low | 64 Ų | 64 | 94.7 Ų | 94.7 | 53% | 0.529 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69 | -37.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | K395 A401 | K395-A398 WeakPolarHBondContact O-CA 3.38Å; K395-A398 WeakPolarHBondContact O-CB 3.48Å; K395-A398 PolarHBondContact O-N 3.18Å; A398-A401 WeakPolarHBondContact O-CB 3.31Å; A398-A401 PolarHBondContact O-N 3.14Å |
| 399 | D | 65.3 | Low | 65.9 | Low | 105 Ų | 105 | 98.8 Ų | 98.8 | 56% | 0.561 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -66.8 | -43.1 | 174.7 | -52.4 | -42.9 | 0 | 0 | 0 | 110.8 | K395 T396 A401 M402 | K395-D399 VanDerWaalsContact C-OD2 3.29Å; K395-D399 VanDerWaalsContact O-CG 3.25Å; K395-D399 PolarHBondContact O-N 2.92Å; T396-D399 WeakPolarHBondContact CA-OD2 3.47Å; D399-A401 VanDerWaalsContact C-N 3.29Å; D399-A401 PolarHBondContact O-N 3.06Å; D399-M402 PolarHBondContact O-N 3.1Å |
| 400 | S | 58.8 | Low | 63.5 | Low | 70 Ų | 70 | 103.5 Ų | 103.5 | 49% | 0.49 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.6 | -22.2 | 174.6 | -64.4 | 0 | 0 | 0 | 0 | 114.1 | T396 M402 Q403 | T396-S400 VanDerWaalsContact O-CB 3.29Å; T396-S400 WeakPolarHBondContact O-CB 3.47Å; T396-S400 PolarHBondContact O-N 2.78Å; T396-S400 PolarHBondContact O-OG 3.46Å; S400-M402 PolarHBondContact O-N 2.91Å; S400-M402 VanDerWaalsContact O-N 3.17Å; S400-Q403 CarbonylContact O-C 3.59Å; S400-Q403 PolarHBondContact O-N 3.46Å |
| 401 | A | 56.5 | Low | 61.2 | Low | 82 Ų | 82 | 105 Ų | 105 | 68% | 0.678 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.5 | -18.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | H397 A398 D399 Q403 | H397-A401 PolarHBondContact O-N 3.44Å; A398-A401 WeakPolarHBondContact O-CB 3.31Å; A398-A401 PolarHBondContact O-N 3.14Å; D399-A401 VanDerWaalsContact C-N 3.29Å; D399-A401 PolarHBondContact O-N 3.06Å; A401-Q403 VanDerWaalsContact C-N 3.34Å |
| 402 | M | 51.1 | Low | 59.1 | Low | 171 Ų | 171 | 110.6 Ų | 110.6 | 84% | 0.842 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -8.9 | 172 | -70.2 | -67.7 | 178.8 | 0 | 0 | 113.7 | D399 S400 | D399-M402 PolarHBondContact O-N 3.1Å; S400-M402 PolarHBondContact O-N 2.91Å; S400-M402 VanDerWaalsContact O-N 3.17Å |
| 403 | Q | 50.1 | Low | 56.8 | Low | 155 Ų | 155 | 110.2 Ų | 110.2 | 72% | 0.724 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -130.4 | 85.9 | -176.8 | -66.3 | 175.2 | 13.1 | 0 | 0 | 108.3 | S400 A401 K405 | S400-Q403 CarbonylContact O-C 3.59Å; S400-Q403 PolarHBondContact O-N 3.46Å; A401-Q403 VanDerWaalsContact C-N 3.34Å; Q403-K405 PolarHBondContact O-N 3.47Å |
| 404 | G | 47.2 | Very low | 54.5 | Low | 90 Ų | 90 | 115.2 Ų | 115.2 | 93% | 0.928 | 67% | 0.674 | S | S | * | * | trans | -64.1 | 66.9 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 405 | K | 41.2 | Very low | 52.3 | Low | 185 Ų | 185 | 116 Ų | 116 | 80% | 0.804 | 69% | 0.686 | S | S | * | * | trans | -105 | 114.2 | 175.7 | -168.5 | 169.3 | -174.4 | 176.4 | 0 | 108.7 | Q403 V407 | Q403-K405 PolarHBondContact O-N 3.47Å; K405-V407 PolarHBondContact O-N 3.45Å; K405-V407 VanDerWaalsContact O-N 3.11Å | ||
| 406 | T | 41.8 | Very low | 50.3 | Low | 138 Ų | 138 | 119.7 Ų | 119.7 | 85% | 0.847 | 70% | 0.697 | S | S | * | * | trans | -60.3 | 111.9 | 175.9 | 37.1 | 0 | 0 | 0 | 0 | 110.1 | A408 | T406-A408 PolarHBondContact O-N 3.07Å; T406-A408 VanDerWaalsContact O-N 3.15Å | ||
| 407 | V | 45.6 | Very low | 48.3 | Very low | 133 Ų | 133 | 122.1 Ų | 122.1 | 81% | 0.806 | 71% | 0.711 | S | S | * | * | trans | -75.5 | 103.9 | 172.5 | -179.5 | 0 | 0 | 0 | 0 | 107.7 | K405 | K405-V407 PolarHBondContact O-N 3.45Å; K405-V407 VanDerWaalsContact O-N 3.11Å | ||
| 408 | A | 36.9 | Very low | 46.2 | Very low | 74 Ų | 74 | 128.8 Ų | 128.8 | 61% | 0.612 | 74% | 0.743 | S | S | * | * | trans | -58.4 | 142.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | T406 E410 | T406-A408 PolarHBondContact O-N 3.07Å; T406-A408 VanDerWaalsContact O-N 3.15Å; A408-E410 VanDerWaalsContact C-N 3.27Å; A408-E410 PolarHBondContact O-N 3.29Å | ||
| 409 | V | 49.6 | Very low | 44.4 | Very low | 150 Ų | 150 | 131.8 Ų | 131.8 | 91% | 0.909 | 75% | 0.75 | S | S | * | * | trans | -79.6 | 81.4 | 174.5 | -177.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 410 | E | 34.6 | Very low | 43.3 | Very low | 177 Ų | 177 | 133.3 Ų | 133.3 | 83% | 0.827 | 76% | 0.763 | S | S | * | * | trans | -79.6 | 136.2 | 165 | -62.6 | -161.7 | 139 | 0 | 0 | 109.8 | A408 | A408-E410 VanDerWaalsContact C-N 3.27Å; A408-E410 PolarHBondContact O-N 3.29Å | ||
| 411 | G | 39.7 | Very low | 42.2 | Very low | 52 Ų | 52 | 134.1 Ų | 134.1 | 54% | 0.536 | 77% | 0.769 | S | S | . | * | trans | -83.1 | -157.1 | -162.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | T413 | G411-T413 VanDerWaalsContact C-N 3.32Å; G411-T413 PolarHBondContact O-N 3.25Å; G411-T413 PolarHBondContact O-OG1 3.34Å | ||
| 412 | D | 40 | Very low | 41 | Very low | 177 Ų | 177 | 138.1 Ų | 138.1 | 95% | 0.947 | 77% | 0.774 | S | S | * | * | trans | -58.7 | 79.3 | -169.2 | -63.1 | -94.8 | 0 | 0 | 0 | 115.3 | ||||
| 413 | T | 37.6 | Very low | 40.2 | Very low | 123 Ų | 123 | 137.5 Ų | 137.5 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | trans | -93.2 | 103.8 | 159.5 | 36.8 | 0 | 0 | 0 | 0 | 108.7 | G411 P415 | G411-T413 VanDerWaalsContact C-N 3.32Å; G411-T413 PolarHBondContact O-N 3.25Å; G411-T413 PolarHBondContact O-OG1 3.34Å; T413-P415 WeakPolarHBondContact O-CD 3.34Å | ||
| 414 | D | 38.8 | Very low | 39.4 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 73% | 0.733 | 77% | 0.765 | S | S | * | * | trans | -65.3 | 118.9 | 177.3 | -150.5 | -7.7 | 0 | 0 | 0 | 109.1 | R416 | D414-R416 PolarHBondContact O-N 3.49Š| ||
| 415 | P | 39.7 | Very low | 38.8 | Very low | 103 Ų | 103 | 133.7 Ų | 133.7 | 67% | 0.669 | 74% | 0.74 | S | S | * | * | trans | -75.4 | 81.4 | -177.4 | 30.4 | -34.7 | 0 | 0 | 0 | 109.9 | T413 | T413-P415 WeakPolarHBondContact O-CD 3.34Š| ||
| 416 | R | 42.2 | Very low | 38.7 | Very low | 214 Ų | 214 | 130.9 Ų | 130.9 | 81% | 0.808 | 73% | 0.734 | S | S | * | * | trans | -87.6 | 147.6 | 169.8 | -165.9 | 174.1 | 177 | 134.4 | -2.5 | 108.9 | D414 | D414-R416 PolarHBondContact O-N 3.49Š| ||
| 417 | T | 41.4 | Very low | 38.1 | Very low | 116 Ų | 116 | 127.9 Ų | 127.9 | 71% | 0.712 | 72% | 0.723 | S | S | * | * | S | Bend | trans | 56.9 | 55.4 | 171.1 | 45.1 | 0 | 0 | 0 | 0 | 117.5 | ||
| 418 | E | 36.6 | Very low | 37.7 | Very low | 188 Ų | 188 | 127.6 Ų | 127.6 | 88% | 0.879 | 72% | 0.722 | S | S | * | * | trans | -140.2 | 45.1 | 155.5 | -78.3 | -58.4 | 164.7 | 0 | 0 | 111.6 | ||||
| 419 | D | 37.3 | Very low | 37.5 | Very low | 128 Ų | 128 | 129.3 Ų | 129.3 | 68% | 0.684 | 73% | 0.727 | S | S | * | * | trans | -151.2 | 56.4 | 162.6 | -160.1 | 8 | 0 | 0 | 0 | 112.4 | S421 | D419-S421 PolarHBondContact OD1-OG 3.45Š| ||
| 420 | T | 41.9 | Very low | 36.7 | Very low | 137 Ų | 137 | 128.1 Ų | 128.1 | 84% | 0.84 | 72% | 0.72 | S | S | * | * | trans | -107.5 | 39.2 | 154 | 48.1 | 0 | 0 | 0 | 0 | 110 | E422 | T420-E422 PolarHBondContact O-N 3.43Š| ||
| 421 | S | 35.8 | Very low | 36.6 | Very low | 87 Ų | 87 | 126.7 Ų | 126.7 | 61% | 0.608 | 72% | 0.718 | S | S | * | * | trans | -80.6 | 91.2 | 166.9 | 69.9 | 0 | 0 | 0 | 0 | 108.7 | D419 L423 | D419-S421 PolarHBondContact OD1-OG 3.45Å; S421-L423 PolarHBondContact O-N 3.34Å | ||
| 422 | E | 31.5 | Very low | 36.3 | Very low | 166 Ų | 166 | 130.3 Ų | 130.3 | 78% | 0.776 | 73% | 0.732 | S | S | * | * | trans | -65.4 | 104.2 | 174.2 | -68.5 | -144.2 | 116.1 | 0 | 0 | 109.8 | T420 N424 | T420-E422 PolarHBondContact O-N 3.43Å; E422-N424 PolarHBondContact O-N 3.24Å | ||
| 423 | L | 35.7 | Very low | 35.8 | Very low | 158 Ų | 158 | 128.4 Ų | 128.4 | 83% | 0.827 | 73% | 0.726 | S | S | * | * | trans | -70.4 | 68.6 | 159.9 | -71.4 | 179.4 | 0 | 0 | 0 | 109.5 | S421 S425 | S421-L423 PolarHBondContact O-N 3.34Å; L423-S425 VanDerWaalsContact C-N 3.33Å; L423-S425 PolarHBondContact O-N 3.24Å; L423-S425 PolarHBondContact O-OG 3.23Å; L423-S425 VanDerWaalsContact O-OG 3.08Å | ||
| 424 | N | 32.7 | Very low | 35.5 | Very low | 106 Ų | 106 | 126.7 Ų | 126.7 | 57% | 0.567 | 73% | 0.725 | S | S | * | * | trans | -58.3 | 97.1 | 168 | 177.3 | 9.6 | 0 | 0 | 0 | 108.3 | E422 N426 | E422-N424 PolarHBondContact O-N 3.24Å; N424-N426 PolarHBondContact O-N 3.29Å; N424-N426 VanDerWaalsContact O-N 3.13Å; N424-N426 WeakPolarHBondContact OD1-CB 3.38Å; N424-N426 PolarHBondContact OD1-N 3.04Å; N424-N426 VanDerWaalsContact OD1-N 3.11Å | ||
| 425 | S | 35 | Very low | 35 | Very low | 58 Ų | 58 | 127 Ų | 127 | 41% | 0.406 | 73% | 0.727 | S | S | . | * | trans | -79.8 | 14.2 | -176.9 | -55.3 | 0 | 0 | 0 | 0 | 113.2 | W338 L423 | W338-S425 PolarHBondContact NE1-O 3.1Å; L423-S425 VanDerWaalsContact C-N 3.33Å; L423-S425 PolarHBondContact O-N 3.24Å; L423-S425 PolarHBondContact O-OG 3.23Å; L423-S425 VanDerWaalsContact O-OG 3.08Å | ||
| 426 | N | 38 | Very low | 34.6 | Very low | 126 Ų | 126 | 130.3 Ų | 130.3 | 67% | 0.674 | 73% | 0.733 | S | S | * | * | trans | -109.4 | 54.5 | 174.6 | -60.9 | -0.9 | 0 | 0 | 0 | 110.6 | N424 | N424-N426 PolarHBondContact O-N 3.29Å; N424-N426 VanDerWaalsContact O-N 3.13Å; N424-N426 WeakPolarHBondContact OD1-CB 3.38Å; N424-N426 PolarHBondContact OD1-N 3.04Å; N424-N426 VanDerWaalsContact OD1-N 3.11Å | ||
| 427 | A | 30.2 | Very low | 34.1 | Very low | 75 Ų | 75 | 127.3 Ų | 127.3 | 62% | 0.62 | 73% | 0.731 | S | S | * | * | trans | -107.1 | 116.5 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 428 | V | 36.1 | Very low | 33.5 | Very low | 128 Ų | 128 | 125.1 Ų | 125.1 | 78% | 0.776 | 73% | 0.726 | S | S | * | * | trans | -78.1 | 126.4 | 172 | 175.8 | 0 | 0 | 0 | 0 | 108.4 | T430 | V428-T430 PolarHBondContact O-N 3.18Å; V428-T430 VanDerWaalsContact O-N 3.13Å | ||
| 429 | P | 32.6 | Very low | 33.1 | Very low | 110 Ų | 110 | 124 Ų | 124 | 71% | 0.714 | 73% | 0.725 | S | S | * | * | trans | -77.9 | 98.7 | 177.3 | 31 | -33.2 | 0 | 0 | 0 | 110.7 | ||||
| 430 | T | 34.1 | Very low | 32.7 | Very low | 124 Ų | 124 | 121.6 Ų | 121.6 | 76% | 0.761 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 129.3 | 164.8 | 47.2 | 0 | 0 | 0 | 0 | 110.1 | V428 | V428-T430 PolarHBondContact O-N 3.18Å; V428-T430 VanDerWaalsContact O-N 3.13Å |
| 431 | N | 31 | Very low | 32.1 | Very low | 147 Ų | 147 | 122.5 Ų | 122.5 | 79% | 0.786 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 139.4 | 175.2 | -69.2 | -36.6 | 0 | 0 | 0 | 111.2 | V433 | N431-V433 PolarHBondContact O-N 3.31Š|
| 432 | P | 34.4 | Very low | 31.9 | Very low | 128 Ų | 128 | 125.6 Ų | 125.6 | 83% | 0.831 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 119.3 | 159.8 | 31.2 | -30.1 | 0 | 0 | 0 | 109.5 | ||
| 433 | V | 29.6 | Very low | 32 | Very low | 137 Ų | 137 | 125.4 Ų | 125.4 | 83% | 0.83 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 141.7 | 156.8 | 175.1 | 0 | 0 | 0 | 0 | 106.6 | N431 | N431-V433 PolarHBondContact O-N 3.31Š|
| 434 | A | 31.8 | Very low | 31.7 | Very low | 88 Ų | 88 | 123.9 Ų | 123.9 | 73% | 0.727 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 151.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 435 | D | 28.4 | Very low | 31.5 | Very low | 144 Ų | 144 | 125.2 Ų | 125.2 | 77% | 0.77 | 74% | 0.742 | S | S | * | * | -149.8 | 170.8 | 127.1 | -135.5 | -39.6 | 0 | 0 | 0 | 111.4 | |||||
| 436 | Q | 30.3 | Very low | 31.5 | Very low | 172 Ų | 172 | 127.7 Ų | 127.7 | 80% | 0.804 | 76% | 0.755 | S | S | * | * | trans | -91.4 | -179.1 | -179.1 | -64.5 | 164.4 | 89.8 | 0 | 0 | 110.2 | ||||
| 437 | I | 31.6 | Very low | 31.6 | Very low | 150 Ų | 150 | 127.4 Ų | 127.4 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | -179.8 | 150.2 | 82.6 | -85.8 | 164.3 | 0 | 0 | 0 | 109.7 | |||||
| 438 | A | 29.9 | Very low | 31.6 | Very low | 71 Ų | 71 | 131.7 Ų | 131.7 | 59% | 0.587 | 77% | 0.772 | S | S | * | * | trans | 73.4 | 103.4 | 157.5 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 439 | N | 27.8 | Very low | 31.2 | Very low | 164 Ų | 164 | 129.1 Ų | 129.1 | 88% | 0.877 | 77% | 0.772 | S | S | * | * | 64.4 | 134.2 | 112.8 | -52.8 | -7.4 | 0 | 0 | 0 | 122 | |||||
| 440 | G | 28.8 | Very low | 31.1 | Very low | 78 Ų | 78 | 130.4 Ų | 130.4 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | 170.4 | 90.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 441 | D | 29.9 | Very low | 31.1 | Very low | 156 Ų | 156 | 133.4 Ų | 133.4 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | trans | -82.4 | 172 | -173.8 | -82.2 | -84.8 | 0 | 0 | 0 | 115 | ||||
| 442 | E | 31.3 | Very low | 31 | Very low | 152 Ų | 152 | 133.5 Ų | 133.5 | 71% | 0.71 | 78% | 0.783 | S | S | * | * | trans | 80.2 | 112 | 162.7 | -73.3 | -140.8 | 81.8 | 0 | 0 | 121.6 | ||||
| 443 | K | 32.8 | Very low | 31 | Very low | 161 Ų | 161 | 132.7 Ų | 132.7 | 70% | 0.7 | 78% | 0.781 | S | S | * | * | 84.4 | 93.8 | 115.8 | -168.8 | -175.6 | -98.3 | 146.2 | 0 | 119.6 | |||||
| 444 | T | 28.8 | Very low | 31.3 | Very low | 126 Ų | 126 | 132 Ų | 132 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | 25.8 | 117.1 | 119.5 | -46.2 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 445 | T | 30.1 | Very low | 31.4 | Very low | 134 Ų | 134 | 131.8 Ų | 131.8 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | trans | -165.1 | 155.8 | 132.2 | -79.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 446 | T | 34.6 | Very low | 31.8 | Very low | 111 Ų | 111 | 132.3 Ų | 132.3 | 68% | 0.681 | 79% | 0.79 | S | S | * | * | trans | -78.3 | 154.5 | -175.3 | 49.3 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 447 | P | 39.6 | Very low | 32.1 | Very low | 120 Ų | 120 | 130.3 Ų | 130.3 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | trans | -76 | 139.9 | 170.4 | 33.3 | -34.6 | 0 | 0 | 0 | 111.9 | ||||
| 448 | N | 31.1 | Very low | 32.3 | Very low | 165 Ų | 165 | 130.9 Ų | 130.9 | 88% | 0.882 | 78% | 0.783 | S | S | * | * | trans | -168.1 | 164.2 | 168 | -110.2 | -30.4 | 0 | 0 | 0 | 110 | ||||
| 449 | G | 27 | Very low | 33.1 | Very low | 74 Ų | 74 | 138.8 Ų | 138.8 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | trans | 92.3 | 86.5 | 160.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 450 | V | 31.1 | Very low | 33.4 | Very low | 136 Ų | 136 | 137.5 Ų | 137.5 | 82% | 0.824 | 81% | 0.81 | S | S | * | * | trans | -61.8 | 138.3 | 154.3 | 172.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 451 | E | 32.9 | Very low | 33.6 | Very low | 188 Ų | 188 | 140.6 Ų | 140.6 | 88% | 0.879 | 81% | 0.81 | S | S | * | * | trans | -160.6 | 161.6 | 139.3 | -119.3 | 167.7 | -168.8 | 0 | 0 | 114.2 | ||||
| 452 | N | 29.4 | Very low | 33.8 | Very low | 148 Ų | 148 | 139.8 Ų | 139.8 | 79% | 0.791 | 81% | 0.809 | S | S | * | * | trans | -88.5 | 154.5 | -175.6 | -64.4 | -55.8 | 0 | 0 | 0 | 111.8 | ||||
| 453 | S | 35.4 | Very low | 34 | Very low | 112 Ų | 112 | 139.1 Ų | 139.1 | 78% | 0.783 | 82% | 0.815 | S | S | * | * | 175.3 | 142.8 | 104.5 | 44 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 454 | S | 35.8 | Very low | 34 | Very low | 123 Ų | 123 | 137.7 Ų | 137.7 | 86% | 0.86 | 82% | 0.822 | S | S | * | * | trans | 23.8 | 113.9 | 143 | -49.2 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 455 | G | 33.8 | Very low | 34.4 | Very low | 82 Ų | 82 | 138.5 Ų | 138.5 | 85% | 0.845 | 83% | 0.825 | S | S | * | * | trans | -141.4 | 113 | 163.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 456 | L | 35.7 | Very low | 34.7 | Very low | 155 Ų | 155 | 138.8 Ų | 138.8 | 81% | 0.812 | 83% | 0.825 | S | S | * | * | trans | -87.1 | 147 | -167.7 | -130.2 | 72.7 | 0 | 0 | 0 | 113.6 | ||||
| 457 | L | 37 | Very low | 34.7 | Very low | 130 Ų | 130 | 140.9 Ų | 140.9 | 68% | 0.681 | 84% | 0.836 | S | S | * | * | trans | 52.5 | 141.3 | 146 | -74.8 | 170.9 | 0 | 0 | 0 | 123.2 | ||||
| 458 | E | 35.6 | Very low | 34.3 | Very low | 163 Ų | 163 | 142.7 Ų | 142.7 | 76% | 0.762 | 84% | 0.841 | S | S | * | * | trans | 64.3 | 147.7 | 149.8 | -68.3 | 166.4 | 102.3 | 0 | 0 | 117.7 | ||||
| 459 | I | 46.8 | Very low | 34.6 | Very low | 236 Ų | 236 | 140.6 Ų | 140.6 | 100% | 1.21 | 84% | 0.837 | S | S | * | * | cis | -123.4 | 0 | 13.6 | -51.6 | 165.9 | 0 | 0 | 0 | 110.1 |
Retrieved 459 of 459 residues in 552.9 ms
(Link to these results)