| 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 | 34.3 | Very low | 40.9 | Very low | 219 Ų | 219 | 140.5 Ų | 140.5 | 100% | 1.079 | 80% | 0.799 | S | S | * | * | 0 | 59.4 | 0 | -53.7 | 177.2 | -165.8 | 0 | 0 | 108.1 | |||||
| 2 | E | 37.9 | Very low | 40.6 | Very low | 172 Ų | 172 | 138.8 Ų | 138.8 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | 85.7 | 136.1 | 65.2 | -73 | 148 | 95.5 | 0 | 0 | 111.6 | |||||
| 3 | S | 41 | Very low | 40.9 | Very low | 85 Ų | 85 | 134.4 Ų | 134.4 | 59% | 0.594 | 79% | 0.792 | S | S | * | * | cis | -160.5 | 168.6 | -16.6 | 61.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 4 | E | 47.3 | Very low | 41.7 | Very low | 176 Ų | 176 | 133.1 Ų | 133.1 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | trans | 60 | 130.9 | 143.9 | -74.2 | 160.5 | 118.1 | 0 | 0 | 123.3 | ||||
| 5 | Q | 47.3 | Very low | 41.3 | Very low | 177 Ų | 177 | 134.3 Ų | 134.3 | 83% | 0.827 | 79% | 0.788 | S | S | * | * | trans | -79.6 | 175.7 | 147.7 | -59 | 177.6 | -10.6 | 0 | 0 | 109.8 | ||||
| 6 | P | 60.6 | Low | 41.3 | Very low | 129 Ų | 129 | 137.8 Ų | 137.8 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | -148.1 | 172 | 101.4 | 37.9 | -22.5 | 0 | 0 | 0 | 116.1 | |||||
| 7 | A | 39.3 | Very low | 40.8 | Very low | 91 Ų | 91 | 139.5 Ų | 139.5 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | -88.8 | -171.4 | 166.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 8 | A | 36.5 | Very low | 41.5 | Very low | 85 Ų | 85 | 137.8 Ų | 137.8 | 70% | 0.702 | 79% | 0.789 | S | S | * | * | cis | -164.2 | 159.5 | 12.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 9 | V | 37.5 | Very low | 41.1 | Very low | 128 Ų | 128 | 139.7 Ų | 139.7 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | 55.2 | 125.3 | 136.6 | 171.4 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 10 | K | 34.5 | Very low | 40.6 | Very low | 193 Ų | 193 | 138.9 Ų | 138.9 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | 177.9 | 134.4 | 104.5 | -134.6 | 154.7 | -172.7 | 171.8 | 0 | 116.9 | |||||
| 11 | A | 34.4 | Very low | 40.7 | Very low | 91 Ų | 91 | 138.4 Ų | 138.4 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | 47.4 | 148.9 | 148.8 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 12 | S | 36.8 | Very low | 40.6 | Very low | 119 Ų | 119 | 137.6 Ų | 137.6 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | cis | -154.9 | 170 | 31.6 | -66 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 13 | A | 45 | Very low | 40.4 | Very low | 82 Ų | 82 | 135.9 Ų | 135.9 | 68% | 0.678 | 79% | 0.789 | S | S | * | * | trans | -91.1 | 176.9 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 14 | P | 51.6 | Low | 40 | Very low | 117 Ų | 117 | 136.6 Ų | 136.6 | 76% | 0.76 | 80% | 0.799 | S | S | * | * | -120.7 | 161.9 | 76.6 | 4.4 | 19.3 | 0 | 0 | 0 | 113.4 | |||||
| 15 | I | 36.4 | Very low | 39.2 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | 68.5 | 124.4 | 56.5 | -51.9 | 164.9 | 0 | 0 | 0 | 109.8 | |||||
| 16 | E | 40.1 | Very low | 38.4 | Very low | 190 Ų | 190 | 133.5 Ų | 133.5 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | -149.6 | -173.8 | 54.1 | -153.8 | 156.3 | -149 | 0 | 0 | 115.2 | |||||
| 17 | E | 33.3 | Very low | 37.1 | Very low | 168 Ų | 168 | 134 Ų | 134 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -122.5 | -164.4 | -161.7 | -124.3 | -174.8 | -171.4 | 0 | 0 | 111.2 | ||||
| 18 | P | 53.2 | Low | 36.5 | Very low | 109 Ų | 109 | 132.7 Ų | 132.7 | 71% | 0.708 | 78% | 0.784 | S | S | * | * | cis | -135.8 | -167.8 | -14.9 | 32.9 | -9.1 | 0 | 0 | 0 | 116.1 | ||||
| 19 | Q | 33.7 | Very low | 36.5 | Very low | 174 Ų | 174 | 137.1 Ų | 137.1 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | trans | -57 | 166.2 | 175 | -47.8 | 165.4 | 5.9 | 0 | 0 | 117.3 | ||||
| 20 | S | 30.6 | Very low | 36.4 | Very low | 122 Ų | 122 | 139.6 Ų | 139.6 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | trans | -160.4 | 129 | 134.3 | 62.8 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 21 | T | 42.7 | Very low | 36.2 | Very low | 130 Ų | 130 | 135 Ų | 135 | 80% | 0.798 | 78% | 0.782 | S | S | * | * | trans | -104.2 | 140.6 | 167 | 51 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 22 | E | 32.8 | Very low | 36.2 | Very low | 202 Ų | 202 | 135.5 Ų | 135.5 | 94% | 0.944 | 78% | 0.776 | S | S | * | * | trans | -158.6 | 162 | 163.7 | -130.2 | 167.2 | -142.4 | 0 | 0 | 114.8 | ||||
| 23 | T | 34 | Very low | 36.2 | Very low | 136 Ų | 136 | 137.1 Ų | 137.1 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | trans | -130.4 | 128.2 | -171.6 | 50.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 24 | A | 32.1 | Very low | 35.9 | Very low | 99 Ų | 99 | 141.1 Ų | 141.1 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -159.3 | 140.3 | 163.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 25 | V | 31.3 | Very low | 35.2 | Very low | 129 Ų | 129 | 139.6 Ų | 139.6 | 78% | 0.782 | 77% | 0.774 | S | S | * | * | cis | 113.5 | 119.8 | 23.7 | 163.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 26 | E | 31 | Very low | 35.2 | Very low | 159 Ų | 159 | 137.9 Ų | 137.9 | 74% | 0.743 | 77% | 0.766 | S | S | * | * | trans | 75.1 | 151.1 | 157.8 | -97.2 | -168.8 | 103.7 | 0 | 0 | 124.5 | ||||
| 27 | L | 31.7 | Very low | 35.2 | Very low | 140 Ų | 140 | 135.3 Ų | 135.3 | 73% | 0.733 | 76% | 0.758 | S | S | * | * | trans | 55.3 | 117.7 | 155.7 | -60.2 | 159.9 | 0 | 0 | 0 | 118.3 | ||||
| 28 | G | 27.7 | Very low | 35.4 | Very low | 63 Ų | 63 | 132 Ų | 132 | 65% | 0.649 | 75% | 0.753 | S | S | * | * | cis | 92.9 | 116.2 | 10.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 29 | K | 35.5 | Very low | 34.6 | Very low | 178 Ų | 178 | 133.2 Ų | 133.2 | 77% | 0.774 | 75% | 0.753 | S | S | * | * | trans | -177.3 | 112.2 | 164.4 | -104.1 | 149.8 | -176.7 | 172.7 | 0 | 114.8 | ||||
| 30 | H | 35.4 | Very low | 34.4 | Very low | 180 Ų | 180 | 130.7 Ų | 130.7 | 83% | 0.833 | 74% | 0.744 | S | S | * | * | trans | 55.4 | 155.7 | 147.7 | -45.8 | -49.6 | 0 | 0 | 0 | 120.8 | ||||
| 31 | S | 31.8 | Very low | 34.5 | Very low | 97 Ų | 97 | 132.3 Ų | 132.3 | 68% | 0.678 | 74% | 0.736 | S | S | * | * | cis | -149.5 | 148.2 | 5.5 | 105.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 32 | T | 33.2 | Very low | 34.1 | Very low | 102 Ų | 102 | 133.5 Ų | 133.5 | 63% | 0.626 | 74% | 0.737 | S | S | * | * | trans | 11 | 147.9 | 140.2 | 37.2 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 33 | L | 36.8 | Very low | 34 | Very low | 152 Ų | 152 | 131.9 Ų | 131.9 | 80% | 0.796 | 73% | 0.729 | S | S | * | * | cis | -134.1 | 146.8 | 40.6 | -66.9 | 159.7 | 0 | 0 | 0 | 111.3 | ||||
| 34 | K | 38.3 | Very low | 33.7 | Very low | 167 Ų | 167 | 131.8 Ų | 131.8 | 73% | 0.726 | 73% | 0.729 | S | S | * | * | 60.8 | 135.5 | 64.3 | -69.5 | -160.2 | 171 | -157 | 0 | 113.3 | |||||
| 35 | A | 38.8 | Very low | 33.5 | Very low | 85 Ų | 85 | 131.8 Ų | 131.8 | 70% | 0.702 | 73% | 0.729 | S | S | * | * | cis | -160.5 | 170.7 | 27.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 36 | D | 35.1 | Very low | 33.5 | Very low | 113 Ų | 113 | 132.3 Ų | 132.3 | 60% | 0.604 | 73% | 0.732 | S | S | * | * | cis | -168.3 | 145.9 | -13.3 | -99.2 | -12.2 | 0 | 0 | 0 | 111.7 | ||||
| 37 | L | 40.2 | Very low | 33.3 | Very low | 136 Ų | 136 | 131.5 Ų | 131.5 | 71% | 0.712 | 74% | 0.739 | S | S | * | * | trans | 57 | 157.2 | 135.8 | -50.4 | 171.5 | 0 | 0 | 0 | 121.1 | I39 | L37-I39 HydrophobicContact CD2-CD1 3.89Š| ||
| 38 | S | 37.1 | Very low | 33.3 | Very low | 99 Ų | 99 | 128.6 Ų | 128.6 | 69% | 0.692 | 73% | 0.734 | S | S | * | * | cis | -144.3 | 144 | 17.4 | -77.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 39 | I | 36.5 | Very low | 33.4 | Very low | 135 Ų | 135 | 131.5 Ų | 131.5 | 69% | 0.692 | 74% | 0.74 | S | S | * | * | 64.7 | 133.6 | 71.1 | -53.4 | 160.6 | 0 | 0 | 0 | 111.6 | L37 | L37-I39 HydrophobicContact CD2-CD1 3.89Š| |||
| 40 | D | 30 | Very low | 33.2 | Very low | 120 Ų | 120 | 129.8 Ų | 129.8 | 64% | 0.642 | 74% | 0.739 | S | S | * | * | cis | -135.8 | -175.1 | 28.8 | -142.3 | -15.1 | 0 | 0 | 0 | 109.1 | ||||
| 41 | K | 33.1 | Very low | 33.2 | Very low | 156 Ų | 156 | 125.1 Ų | 125.1 | 68% | 0.678 | 73% | 0.732 | S | S | * | * | cis | -152.6 | -158.5 | 4.8 | -159.4 | 146.8 | -153.3 | 68.5 | 0 | 112 | ||||
| 42 | L | 34.9 | Very low | 33 | Very low | 155 Ų | 155 | 126.6 Ų | 126.6 | 81% | 0.812 | 74% | 0.736 | S | S | * | * | trans | -148.1 | -174.9 | -174 | -84.6 | 169.2 | 0 | 0 | 0 | 111.5 | ||||
| 43 | E | 28.9 | Very low | 32.9 | Very low | 169 Ų | 169 | 128.2 Ų | 128.2 | 79% | 0.79 | 75% | 0.746 | S | S | * | * | trans | 94.5 | 121.3 | 168.8 | -54.8 | -178.9 | 141.3 | 0 | 0 | 115.4 | ||||
| 44 | T | 28.7 | Very low | 32.7 | Very low | 133 Ų | 133 | 129.5 Ų | 129.5 | 82% | 0.816 | 75% | 0.748 | S | S | * | * | cis | 74.5 | 96.1 | 31 | 76.7 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 45 | A | 27 | Very low | 33.3 | Very low | 100 Ų | 100 | 126.2 Ų | 126.2 | 83% | 0.826 | 74% | 0.744 | S | S | * | * | trans | -176.9 | 145 | 133.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 46 | T | 32.2 | Very low | 32.8 | Very low | 139 Ų | 139 | 127.8 Ų | 127.8 | 85% | 0.853 | 74% | 0.744 | S | S | * | * | trans | -118.6 | 156.8 | 163.4 | 46.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 47 | T | 26.3 | Very low | 32.6 | Very low | 143 Ų | 143 | 131.3 Ų | 131.3 | 88% | 0.877 | 76% | 0.757 | S | S | * | * | trans | -152.8 | 148.5 | 173.5 | -69.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 48 | A | 32 | Very low | 32.2 | Very low | 78 Ų | 78 | 133.1 Ų | 133.1 | 65% | 0.645 | 76% | 0.764 | S | S | * | * | trans | -70.6 | 176.3 | -172.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 49 | T | 29.9 | Very low | 31.9 | Very low | 125 Ų | 125 | 137.5 Ų | 137.5 | 77% | 0.767 | 77% | 0.774 | S | S | * | * | cis | -160 | 162.4 | 38 | 53 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 50 | N | 32 | Very low | 31.8 | Very low | 142 Ų | 142 | 140 Ų | 140 | 76% | 0.759 | 78% | 0.782 | S | S | * | * | cis | -169.9 | 164.7 | -4.6 | -106.4 | 14.9 | 0 | 0 | 0 | 107.7 | ||||
| 51 | A | 34.3 | Very low | 31.6 | Very low | 81 Ų | 81 | 143.6 Ų | 143.6 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | cis | -135 | -118.6 | -10.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 52 | V | 27.3 | Very low | 31.5 | Very low | 128 Ų | 128 | 142 Ų | 142 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | cis | -141.5 | 129.6 | 8.9 | 172.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 53 | V | 31.8 | Very low | 31.2 | Very low | 137 Ų | 137 | 143.5 Ų | 143.5 | 83% | 0.83 | 80% | 0.801 | S | S | * | * | trans | 27.1 | 114 | 162.4 | -171.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 54 | E | 31.9 | Very low | 31.3 | Very low | 178 Ų | 178 | 142.5 Ų | 142.5 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -123.3 | -175.9 | 151.6 | -119.5 | -160.5 | -148.3 | 0 | 0 | 107.1 | ||||
| 55 | P | 50.6 | Low | 31.3 | Very low | 99 Ų | 99 | 144.7 Ų | 144.7 | 64% | 0.643 | 80% | 0.802 | S | S | * | * | cis | -128.4 | -166.8 | -2.5 | 42 | -25.4 | 0 | 0 | 0 | 112.9 | ||||
| 56 | V | 29.1 | Very low | 31.6 | Very low | 117 Ų | 117 | 147 Ų | 147 | 71% | 0.709 | 80% | 0.8 | S | S | * | * | -179.9 | 132.7 | 121 | 148.1 | 0 | 0 | 0 | 0 | 110.1 | M58 | V56-M58 HydrophobicContact CG1-CE 3.73Š| |||
| 57 | E | 31.7 | Very low | 31.6 | Very low | 187 Ų | 187 | 146.7 Ų | 146.7 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -79.8 | 154.1 | 170.4 | -58.2 | 170 | 124.1 | 0 | 0 | 111.2 | ||||
| 58 | M | 31 | Very low | 31.8 | Very low | 174 Ų | 174 | 146.2 Ų | 146.2 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | trans | -157.1 | 141.8 | 150.7 | -125.9 | 162.6 | -70.9 | 0 | 0 | 113 | V56 | V56-M58 HydrophobicContact CG1-CE 3.73Š| ||
| 59 | E | 31.6 | Very low | 31.8 | Very low | 192 Ų | 192 | 150.6 Ų | 150.6 | 90% | 0.897 | 80% | 0.797 | S | S | * | * | trans | -78.7 | 170.4 | 176.7 | -69.8 | -174.7 | 112.9 | 0 | 0 | 113 | ||||
| 60 | Q | 32.6 | Very low | 31.9 | Very low | 188 Ų | 188 | 149.5 Ų | 149.5 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | trans | -76.9 | 123.5 | -177.5 | -174.9 | 176.2 | 37.1 | 0 | 0 | 112.4 | ||||
| 61 | Q | 27 | Very low | 32 | Very low | 194 Ų | 194 | 147.5 Ų | 147.5 | 91% | 0.907 | 79% | 0.787 | S | S | * | * | trans | -150.8 | 160.8 | 159.6 | -132.9 | 152.9 | 109 | 0 | 0 | 113.5 | ||||
| 62 | V | 31.2 | Very low | 32 | Very low | 124 Ų | 124 | 152.1 Ų | 152.1 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | trans | -93.3 | 135.3 | -168.5 | 174.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 63 | E | 28.2 | Very low | 32.1 | Very low | 185 Ų | 185 | 150 Ų | 150 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -150.7 | 140.9 | 150.5 | -128.3 | 162.6 | -148.4 | 0 | 0 | 112 | ||||
| 64 | N | 30.2 | Very low | 32 | Very low | 148 Ų | 148 | 151.8 Ų | 151.8 | 79% | 0.791 | 79% | 0.792 | S | S | * | * | trans | -108.1 | 143.7 | 167.8 | -62.5 | -70.1 | 0 | 0 | 0 | 107.4 | ||||
| 65 | E | 30.1 | Very low | 31.9 | Very low | 180 Ų | 180 | 149.7 Ų | 149.7 | 84% | 0.841 | 79% | 0.792 | S | S | * | * | trans | -143.3 | 154.5 | 163.7 | -103.2 | -89.5 | 79.8 | 0 | 0 | 110.4 | ||||
| 66 | L | 33.6 | Very low | 31.1 | Very low | 147 Ų | 147 | 149.3 Ų | 149.3 | 77% | 0.77 | 79% | 0.792 | S | S | * | * | trans | -111.7 | 165.3 | -169.1 | -70 | 138.9 | 0 | 0 | 0 | 111.4 | ||||
| 67 | V | 30.3 | Very low | 31.1 | Very low | 133 Ų | 133 | 149.9 Ų | 149.9 | 81% | 0.806 | 80% | 0.796 | S | S | * | * | trans | -135.6 | 92.1 | 155.4 | -175.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 68 | N | 32.2 | Very low | 30.9 | Very low | 134 Ų | 134 | 147 Ų | 147 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | trans | 60.9 | 160.3 | 141.4 | -61.9 | -5.1 | 0 | 0 | 0 | 119.7 | ||||
| 69 | E | 32.3 | Very low | 30.8 | Very low | 169 Ų | 169 | 143.9 Ų | 143.9 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | cis | -150.4 | 171 | 17.4 | -155.2 | 161.9 | -118.9 | 0 | 0 | 114 | ||||
| 70 | S | 31.6 | Very low | 30.8 | Very low | 102 Ų | 102 | 143.4 Ų | 143.4 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | trans | 80.5 | 144.3 | 168.7 | -77.4 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 71 | T | 32.5 | Very low | 30.7 | Very low | 101 Ų | 101 | 143.5 Ų | 143.5 | 62% | 0.62 | 78% | 0.78 | S | S | * | * | cis | -167.9 | 146.9 | -13.1 | -100.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 72 | Q | 35 | Very low | 30.9 | Very low | 178 Ų | 178 | 142.7 Ų | 142.7 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | 66.1 | 134.9 | 173.6 | -72.4 | 157.2 | 51 | 0 | 0 | 116.2 | ||||
| 73 | A | 29.9 | Very low | 30.8 | Very low | 83 Ų | 83 | 143.3 Ų | 143.3 | 69% | 0.686 | 78% | 0.777 | S | S | * | * | cis | 76.2 | 127 | 35.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 74 | M | 29.6 | Very low | 30.9 | Very low | 175 Ų | 175 | 140.7 Ų | 140.7 | 86% | 0.862 | 77% | 0.773 | S | S | * | * | cis | -140.4 | -172.1 | 8.1 | -59.3 | -176.6 | -166.6 | 0 | 0 | 109 | ||||
| 75 | T | 30.3 | Very low | 30.8 | Very low | 134 Ų | 134 | 136.5 Ų | 136.5 | 82% | 0.822 | 77% | 0.766 | S | S | * | * | cis | -151.1 | -133.2 | 19.1 | -31.1 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 76 | S | 32.3 | Very low | 30.8 | Very low | 91 Ų | 91 | 133.3 Ų | 133.3 | 64% | 0.636 | 76% | 0.763 | S | S | * | * | trans | -140 | 163.2 | -160.4 | 60.5 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 77 | T | 29.3 | Very low | 30.8 | Very low | 129 Ų | 129 | 131.9 Ų | 131.9 | 79% | 0.791 | 76% | 0.76 | S | S | * | * | trans | 79 | 121.7 | 144.4 | 41.3 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 78 | T | 27.7 | Very low | 30.9 | Very low | 126 Ų | 126 | 132 Ų | 132 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | trans | -42.9 | 149.3 | 152.1 | -24.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 79 | T | 29.7 | Very low | 30.7 | Very low | 109 Ų | 109 | 132.3 Ų | 132.3 | 67% | 0.669 | 76% | 0.758 | S | S | * | * | -176.9 | 155.7 | 51.6 | -32.4 | 0 | 0 | 0 | 0 | 112 | |||||
| 80 | Q | 31.7 | Very low | 30.7 | Very low | 182 Ų | 182 | 131.4 Ų | 131.4 | 85% | 0.85 | 76% | 0.758 | S | S | * | * | trans | 67.9 | 148.1 | 168.8 | -47.1 | -168.3 | 21.5 | 0 | 0 | 114.6 | ||||
| 81 | E | 29.6 | Very low | 30.7 | Very low | 190 Ų | 190 | 131.2 Ų | 131.2 | 89% | 0.888 | 75% | 0.752 | S | S | * | * | cis | -139.1 | -152.2 | 39.2 | -148 | -172.5 | 137.5 | 0 | 0 | 114.1 | ||||
| 82 | K | 32.2 | Very low | 30.6 | Very low | 176 Ų | 176 | 134.1 Ų | 134.1 | 77% | 0.765 | 76% | 0.758 | S | S | * | * | trans | -139 | 139 | -162 | 157.5 | -166 | 173.6 | -172.3 | 0 | 110.3 | ||||
| 83 | V | 29.5 | Very low | 30.4 | Very low | 137 Ų | 137 | 132.8 Ų | 132.8 | 83% | 0.83 | 75% | 0.752 | S | S | * | * | trans | -169.4 | 139.1 | 141.8 | 135.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 84 | V | 29.8 | Very low | 30.6 | Very low | 130 Ų | 130 | 136 Ų | 136 | 79% | 0.788 | 75% | 0.753 | S | S | * | * | trans | -28.8 | 145.6 | 167 | -173.2 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 85 | G | 27.9 | Very low | 30.6 | Very low | 61 Ų | 61 | 135.5 Ų | 135.5 | 63% | 0.629 | 75% | 0.749 | S | S | * | * | trans | 133.1 | 109.5 | 147.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 86 | S | 30.5 | Very low | 30.3 | Very low | 112 Ų | 112 | 134.5 Ų | 134.5 | 78% | 0.783 | 75% | 0.746 | S | S | * | * | 73.3 | 126.6 | 78.5 | -68.4 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 87 | V | 32.8 | Very low | 30.2 | Very low | 117 Ų | 117 | 135.8 Ų | 135.8 | 71% | 0.709 | 75% | 0.75 | S | S | * | * | cis | -156.2 | 158.1 | -0.5 | -100.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 88 | N | 31.8 | Very low | 30.1 | Very low | 136 Ų | 136 | 137.6 Ų | 137.6 | 73% | 0.727 | 75% | 0.749 | S | S | * | * | trans | 23.4 | 136.4 | 139.8 | -43.1 | -0.9 | 0 | 0 | 0 | 118.5 | ||||
| 89 | N | 29.3 | Very low | 30.2 | Very low | 141 Ų | 141 | 138.4 Ų | 138.4 | 75% | 0.754 | 75% | 0.746 | S | S | * | * | -174 | 147.8 | 65 | -121.3 | 2.4 | 0 | 0 | 0 | 107.3 | |||||
| 90 | L | 30.8 | Very low | 30.2 | Very low | 149 Ų | 149 | 141.4 Ų | 141.4 | 78% | 0.78 | 75% | 0.752 | S | S | * | * | cis | 56.6 | 130.4 | 40.9 | -99.7 | 76 | 0 | 0 | 0 | 113.1 | ||||
| 91 | V | 31.7 | Very low | 30 | Very low | 98 Ų | 98 | 140.3 Ų | 140.3 | 59% | 0.594 | 75% | 0.745 | S | S | * | * | cis | -166.2 | 167.9 | 16.7 | 69.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 92 | E | 31.8 | Very low | 29.9 | Very low | 162 Ų | 162 | 138 Ų | 138 | 76% | 0.757 | 73% | 0.734 | S | S | * | * | trans | 63.2 | 166.9 | 161.6 | -78 | 137.2 | -148.5 | 0 | 0 | 117.9 | ||||
| 93 | E | 31.3 | Very low | 29.6 | Very low | 150 Ų | 150 | 134.4 Ų | 134.4 | 70% | 0.701 | 73% | 0.727 | S | S | * | * | cis | -147.6 | -177.7 | 7.1 | -142.2 | 172 | 173.2 | 0 | 0 | 113.9 | ||||
| 94 | Q | 32.9 | Very low | 29.7 | Very low | 150 Ų | 150 | 133.6 Ų | 133.6 | 70% | 0.701 | 73% | 0.727 | S | S | * | * | trans | -31.9 | 169.3 | 166.3 | -69.9 | 149.2 | 53.2 | 0 | 0 | 117.9 | ||||
| 95 | Q | 29.9 | Very low | 29.7 | Very low | 165 Ų | 165 | 133.1 Ų | 133.1 | 77% | 0.771 | 73% | 0.73 | S | S | * | * | cis | 156.3 | 130 | -19.9 | 171.5 | 174.3 | -9.6 | 0 | 0 | 107.2 | ||||
| 96 | C | 23.7 | Very low | 29.8 | Very low | 113 Ų | 113 | 136.8 Ų | 136.8 | 76% | 0.764 | 74% | 0.735 | S | S | * | * | trans | 61.6 | 164 | 177.2 | -60.3 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 97 | V | 30.3 | Very low | 29.8 | Very low | 118 Ų | 118 | 139.3 Ų | 139.3 | 72% | 0.715 | 74% | 0.739 | S | S | * | * | cis | -139.9 | 126.5 | 17.5 | 171.1 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 98 | E | 26.9 | Very low | 29.6 | Very low | 167 Ų | 167 | 139.1 Ų | 139.1 | 78% | 0.78 | 74% | 0.738 | S | S | * | * | 67.3 | 148 | 91.7 | -142.4 | 177.8 | -133.4 | 0 | 0 | 117.5 | |||||
| 99 | M | 30.6 | Very low | 29.6 | Very low | 143 Ų | 143 | 138.1 Ų | 138.1 | 70% | 0.704 | 74% | 0.737 | S | S | * | * | trans | 74.3 | 92.6 | 171.4 | -78.7 | 171.3 | -82.1 | 0 | 0 | 121.6 | ||||
| 100 | E | 29.7 | Very low | 29.6 | Very low | 173 Ų | 173 | 140.6 Ų | 140.6 | 81% | 0.808 | 74% | 0.743 | S | S | * | * | 56.3 | 140.6 | 115.2 | -65.8 | -174.5 | -166.7 | 0 | 0 | 125.5 | |||||
| 101 | F | 26.3 | Very low | 29.4 | Very low | 158 Ų | 158 | 136.5 Ų | 136.5 | 69% | 0.693 | 74% | 0.738 | S | S | * | * | trans | 112.2 | 110.9 | 130.8 | -132.3 | -107.9 | 0 | 0 | 0 | 120.1 | ||||
| 102 | E | 28.9 | Very low | 29.2 | Very low | 141 Ų | 141 | 137.6 Ų | 137.6 | 66% | 0.659 | 75% | 0.75 | S | S | * | * | trans | 47.8 | 163 | 144.2 | -67.4 | -156.5 | 176.9 | 0 | 0 | 122.6 | ||||
| 103 | T | 25.1 | Very low | 29.7 | Very low | 102 Ų | 102 | 135.6 Ų | 135.6 | 63% | 0.626 | 75% | 0.751 | S | S | * | * | cis | -159.6 | 176.7 | -22.6 | 30.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 104 | S | 31 | Very low | 29.6 | Very low | 119 Ų | 119 | 133 Ų | 133 | 83% | 0.832 | 75% | 0.749 | S | S | * | * | trans | 77.7 | 156.5 | 168.6 | -46.6 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 105 | S | 31.3 | Very low | 29.6 | Very low | 120 Ų | 120 | 133.8 Ų | 133.8 | 84% | 0.839 | 75% | 0.753 | S | S | * | * | cis | -146.7 | 158.3 | 16.2 | 54.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 106 | D | 29 | Very low | 29.5 | Very low | 138 Ų | 138 | 131.8 Ų | 131.8 | 74% | 0.738 | 74% | 0.743 | S | S | * | * | trans | -92 | 156.8 | 175.6 | 178.1 | 29.8 | 0 | 0 | 0 | 112.7 | ||||
| 107 | L | 31.3 | Very low | 29.9 | Very low | 165 Ų | 165 | 130.1 Ų | 130.1 | 86% | 0.864 | 73% | 0.733 | S | S | * | * | trans | 177.5 | 167.2 | 145.4 | -100.1 | 168.2 | 0 | 0 | 0 | 114.3 | ||||
| 108 | V | 28.4 | Very low | 30 | Very low | 113 Ų | 113 | 132.1 Ų | 132.1 | 69% | 0.685 | 73% | 0.732 | S | S | * | * | trans | -133.7 | 159 | -156.5 | -175 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 109 | V | 30.8 | Very low | 30.2 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 70% | 0.703 | 73% | 0.734 | S | S | * | * | trans | 145.1 | 123.8 | 137.9 | 168.5 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 110 | Q | 29.6 | Very low | 30.2 | Very low | 192 Ų | 192 | 132.7 Ų | 132.7 | 90% | 0.897 | 74% | 0.739 | S | S | * | * | trans | 20 | 149.4 | 146 | -52.7 | 169.4 | -7.1 | 0 | 0 | 122.5 | ||||
| 111 | G | 26.2 | Very low | 30.2 | Very low | 64 Ų | 64 | 128.5 Ų | 128.5 | 66% | 0.66 | 73% | 0.734 | S | S | * | * | cis | 148.3 | 152.4 | -10.2 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 112 | S | 27.9 | Very low | 30.4 | Very low | 121 Ų | 121 | 127 Ų | 127 | 85% | 0.846 | 74% | 0.743 | S | S | * | * | trans | 66.3 | 169.4 | 158.5 | 79.1 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 113 | P | 42.8 | Very low | 30.4 | Very low | 120 Ų | 120 | 127.8 Ų | 127.8 | 78% | 0.779 | 75% | 0.751 | S | S | * | * | cis | -116.6 | -154 | -10.2 | 46.1 | -33.5 | 0 | 0 | 0 | 110.4 | ||||
| 114 | S | 29.6 | Very low | 30.7 | Very low | 94 Ų | 94 | 126.4 Ų | 126.4 | 66% | 0.657 | 75% | 0.751 | S | S | * | * | cis | -146.9 | -163.3 | -7.4 | 57.1 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 115 | E | 32.4 | Very low | 30.7 | Very low | 168 Ų | 168 | 126.7 Ų | 126.7 | 79% | 0.785 | 75% | 0.753 | S | S | * | * | cis | -167.4 | 179 | -2.3 | -131.2 | 157 | 124.8 | 0 | 0 | 106.4 | ||||
| 116 | E | 28.4 | Very low | 30.5 | Very low | 123 Ų | 123 | 125.4 Ų | 125.4 | 58% | 0.575 | 75% | 0.749 | S | S | * | * | cis | -152.8 | 137.4 | -1.6 | -161.2 | -111.6 | 155.4 | 0 | 0 | 109.1 | K118 | E116-K118 IonicContact OE1-NZ 2.94Å; E116-K118 PolarHBondContact OE1-NZ 3.4Å; E116-K118 IonicContact OE2-NZ 2.64Å; E116-K118 PolarHBondContact OE2-NZ 3.26Å | ||
| 117 | S | 31.4 | Very low | 30.4 | Very low | 78 Ų | 78 | 125 Ų | 125 | 55% | 0.545 | 75% | 0.752 | S | S | . | * | trans | 65.2 | 160.5 | 152.7 | -84.3 | 0 | 0 | 0 | 0 | 123 | ||||
| 118 | K | 31.8 | Very low | 30.3 | Very low | 160 Ų | 160 | 123.4 Ų | 123.4 | 70% | 0.696 | 75% | 0.749 | S | S | * | * | cis | -159.4 | 157.7 | 0.8 | -108.6 | 138.5 | -153.1 | 129.2 | 0 | 107 | E116 | E116-K118 IonicContact OE1-NZ 2.94Å; E116-K118 PolarHBondContact OE1-NZ 3.4Å; E116-K118 IonicContact OE2-NZ 2.64Å; E116-K118 PolarHBondContact OE2-NZ 3.26Å | ||
| 119 | K | 32.4 | Very low | 30.2 | Very low | 189 Ų | 189 | 124.5 Ų | 124.5 | 82% | 0.822 | 76% | 0.756 | S | S | * | * | cis | -174.2 | 173.2 | -29.8 | -163.1 | 174.9 | 179.9 | -179.2 | 0 | 107.6 | ||||
| 120 | V | 30.7 | Very low | 30.1 | Very low | 132 Ų | 132 | 123.1 Ų | 123.1 | 80% | 0.8 | 76% | 0.756 | S | S | * | * | trans | 82.1 | 137.6 | 171.1 | -179.6 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 121 | A | 29.4 | Very low | 30.6 | Very low | 85 Ų | 85 | 119.3 Ų | 119.3 | 70% | 0.702 | 75% | 0.749 | S | S | * | * | cis | 111.6 | 145.1 | 3.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 122 | S | 30.8 | Very low | 30.7 | Very low | 128 Ų | 128 | 124.9 Ų | 124.9 | 90% | 0.895 | 76% | 0.757 | S | S | * | * | cis | -166.5 | -164.7 | -11.5 | 48.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 123 | D | 27.3 | Very low | 30.8 | Very low | 156 Ų | 156 | 125 Ų | 125 | 83% | 0.834 | 75% | 0.753 | S | S | * | * | trans | -126.4 | 169.5 | -151.8 | -175.9 | 34.5 | 0 | 0 | 0 | 117.3 | ||||
| 124 | A | 31.9 | Very low | 30.4 | Very low | 74 Ų | 74 | 127.7 Ų | 127.7 | 61% | 0.612 | 76% | 0.755 | S | S | * | * | trans | 73.3 | 111.5 | 151.7 | 0 | 0 | 0 | 0 | 0 | 125.6 | ||||
| 125 | S | 30.7 | Very low | 30.9 | Very low | 125 Ų | 125 | 128.8 Ų | 128.8 | 87% | 0.874 | 76% | 0.76 | S | S | * | * | 59 | 128.5 | 123.7 | -159.7 | 0 | 0 | 0 | 0 | 125.1 | |||||
| 126 | A | 28 | Very low | 30.8 | Very low | 93 Ų | 93 | 124.9 Ų | 124.9 | 77% | 0.769 | 76% | 0.757 | S | S | * | * | trans | -162 | 111.7 | 153.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 127 | T | 26.9 | Very low | 31.8 | Very low | 129 Ų | 129 | 123.8 Ų | 123.8 | 79% | 0.791 | 76% | 0.76 | S | S | * | * | trans | 43.9 | 109.9 | 132.3 | -43.2 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 128 | V | 28.6 | Very low | 31.7 | Very low | 131 Ų | 131 | 128.4 Ų | 128.4 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | trans | 56.7 | 125.9 | 138.8 | -180 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 129 | T | 26.7 | Very low | 32.1 | Very low | 137 Ų | 137 | 127.1 Ų | 127.1 | 84% | 0.84 | 78% | 0.778 | S | S | * | * | -170.8 | 150.4 | 129 | -75.8 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 130 | A | 28.2 | Very low | 32 | Very low | 86 Ų | 86 | 125.5 Ų | 125.5 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | trans | -141.2 | 160.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 131 | P | 40.8 | Very low | 32.2 | Very low | 113 Ų | 113 | 124.3 Ų | 124.3 | 73% | 0.734 | 78% | 0.776 | S | S | * | * | -159.7 | -176.3 | 66.5 | 45.6 | -24.8 | 0 | 0 | 0 | 118.4 | |||||
| 132 | Q | 27.7 | Very low | 32.5 | Very low | 180 Ų | 180 | 125.5 Ų | 125.5 | 84% | 0.841 | 78% | 0.779 | S | S | * | * | trans | 69.5 | 150.7 | 157.1 | -64.3 | -149.2 | -11.1 | 0 | 0 | 118.8 | ||||
| 133 | V | 29.5 | Very low | 33.1 | Very low | 125 Ų | 125 | 125.3 Ų | 125.3 | 76% | 0.758 | 77% | 0.774 | S | S | * | * | cis | -149.1 | 167 | 2.5 | 101 | 0 | 0 | 0 | 0 | 113 | ||||
| 134 | Q | 35.6 | Very low | 34 | Very low | 175 Ų | 175 | 127.2 Ų | 127.2 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -92.4 | -176.6 | 179.6 | -90 | -174.5 | 10.3 | 0 | 0 | 112.1 | ||||
| 135 | P | 40.5 | Very low | 34.7 | Very low | 118 Ų | 118 | 128.3 Ų | 128.3 | 77% | 0.766 | 79% | 0.788 | S | S | * | * | cis | -147.3 | -173.7 | 22 | 45.2 | -23.7 | 0 | 0 | 0 | 118.6 | ||||
| 136 | A | 29.7 | Very low | 35.7 | Very low | 86 Ų | 86 | 126.9 Ų | 126.9 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | trans | -88.3 | -166.6 | 158.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 137 | P | 49.8 | Very low | 36.6 | Very low | 99 Ų | 99 | 126 Ų | 126 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | cis | -134.5 | -167.2 | 2.3 | 43.7 | -25.3 | 0 | 0 | 0 | 114.1 | ||||
| 138 | H | 29.3 | Very low | 38 | Very low | 175 Ų | 175 | 126.8 Ų | 126.8 | 81% | 0.81 | 78% | 0.776 | S | S | * | * | 179.2 | 166.5 | 117.4 | -98.6 | -73.3 | 0 | 0 | 0 | 112.3 | |||||
| 139 | V | 40.2 | Very low | 39.3 | Very low | 133 Ų | 133 | 125.1 Ų | 125.1 | 81% | 0.806 | 77% | 0.77 | S | S | * | * | trans | -139.9 | 130.2 | -175.8 | -179 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 140 | D | 30.2 | Very low | 40.6 | Very low | 156 Ų | 156 | 124.8 Ų | 124.8 | 83% | 0.834 | 76% | 0.763 | S | S | * | * | trans | -176.2 | 158.7 | 169.4 | -96.1 | -38.1 | 0 | 0 | 0 | 107.6 | ||||
| 141 | S | 33.9 | Very low | 41.8 | Very low | 107 Ų | 107 | 127.4 Ų | 127.4 | 75% | 0.748 | 76% | 0.764 | S | S | * | * | cis | -160.4 | 170.3 | -29 | 49.3 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 142 | S | 35.9 | Very low | 42.3 | Very low | 109 Ų | 109 | 126.3 Ų | 126.3 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | trans | -88.8 | 155.6 | -168.7 | 58.5 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 143 | P | 44.7 | Very low | 43.4 | Very low | 124 Ų | 124 | 121.4 Ų | 121.4 | 81% | 0.805 | 75% | 0.754 | S | S | * | * | trans | -115.5 | 146.2 | 142.1 | 35.4 | -28.6 | 0 | 0 | 0 | 111.3 | ||||
| 144 | Q | 45 | Very low | 44.5 | Very low | 197 Ų | 197 | 125 Ų | 125 | 92% | 0.921 | 76% | 0.755 | S | S | * | * | trans | -84.5 | 140.1 | 175.6 | -68.1 | -172.4 | -20.1 | 0 | 0 | 111.6 | ||||
| 145 | A | 46.8 | Very low | 45.5 | Very low | 97 Ų | 97 | 122 Ų | 122 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | trans | -110.6 | 138.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 146 | S | 51.8 | Low | 45.7 | Very low | 95 Ų | 95 | 121.2 Ų | 121.2 | 66% | 0.664 | 75% | 0.751 | S | S | * | * | trans | -84.6 | 147.9 | -176.9 | 50.2 | 0 | 0 | 0 | 0 | 112.4 | L148 S149 | S146-L148 PolarHBondContact O-N 3.11Å; S146-S149 PolarHBondContact O-N 3.22Å | ||
| 147 | G | 47.3 | Very low | 46 | Very low | 74 Ų | 74 | 124.3 Ų | 124.3 | 76% | 0.763 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | 24.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 148 | L | 55.1 | Low | 45.4 | Very low | 145 Ų | 145 | 127.2 Ų | 127.2 | 76% | 0.759 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | -14.5 | 174.7 | -66.7 | 174 | 0 | 0 | 0 | 113 | S146 L150 | S146-L148 PolarHBondContact O-N 3.11Å; L148-L150 VanDerWaalsContact C-N 3.26Å; L148-L150 PolarHBondContact O-N 3.5Å |
| 149 | S | 57.4 | Low | 46.2 | Very low | 96 Ų | 96 | 124.3 Ų | 124.3 | 67% | 0.671 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -10.7 | -175.5 | -163.6 | 0 | 0 | 0 | 0 | 115.1 | S146 | S146-S149 PolarHBondContact O-N 3.22Š|
| 150 | L | 53.3 | Low | 46.1 | Very low | 131 Ų | 131 | 126 Ų | 126 | 69% | 0.686 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.6 | -26.5 | -176.8 | -86.2 | 161.1 | 0 | 0 | 0 | 114.1 | L148 A152 | L148-L150 VanDerWaalsContact C-N 3.26Å; L148-L150 PolarHBondContact O-N 3.5Å; L150-A152 VanDerWaalsContact C-N 3.31Å; L150-A152 PolarHBondContact O-N 3.45Å |
| 151 | L | 53.7 | Low | 46.7 | Very low | 141 Ų | 141 | 126.5 Ų | 126.5 | 74% | 0.738 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -73.3 | -23 | 179.4 | -94.5 | 68.7 | 0 | 0 | 0 | 113 | A153 | L151-A153 PolarHBondContact O-N 2.96Š|
| 152 | A | 51.9 | Low | 46.8 | Very low | 89 Ų | 89 | 130.1 Ų | 130.1 | 74% | 0.736 | 78% | 0.778 | S | S | * | * | G | 310 helix | trans | -75.3 | -7.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | L150 | L150-A152 VanDerWaalsContact C-N 3.31Å; L150-A152 PolarHBondContact O-N 3.45Å |
| 153 | A | 50.6 | Low | 46.7 | Very low | 77 Ų | 77 | 133 Ų | 133 | 64% | 0.636 | 78% | 0.776 | S | S | * | * | G | 310 helix | trans | -95.9 | -2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | L151 | L151-A153 PolarHBondContact O-N 2.96Š|
| 154 | Y | 52.9 | Low | 46.2 | Very low | 200 Ų | 200 | 133.8 Ų | 133.8 | 78% | 0.784 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -122.2 | 35 | -173.1 | -71 | -83.8 | 0 | 0 | 0 | 112.7 | ||
| 155 | S | 55.3 | Low | 45.5 | Very low | 112 Ų | 112 | 129.9 Ų | 129.9 | 78% | 0.783 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -153.6 | 55.6 | 177.8 | -68.7 | 0 | 0 | 0 | 0 | 113.2 | ||
| 156 | S | 44.5 | Very low | 45.1 | Very low | 102 Ų | 102 | 131.1 Ų | 131.1 | 71% | 0.713 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -152.5 | 153.6 | 155.5 | -158.1 | 0 | 0 | 0 | 0 | 109 | ||
| 157 | D | 36.6 | Very low | 44.2 | Very low | 151 Ų | 151 | 132.4 Ų | 132.4 | 81% | 0.807 | 77% | 0.772 | S | S | * | * | trans | 57.9 | 90.1 | 168.6 | -66.5 | 41.4 | 0 | 0 | 0 | 116.2 | ||||
| 158 | D | 36.9 | Very low | 43.5 | Very low | 160 Ų | 160 | 137.6 Ų | 137.6 | 86% | 0.856 | 78% | 0.776 | S | S | * | * | trans | -132.8 | 103.3 | 145.2 | -176.7 | 57.6 | 0 | 0 | 0 | 106.9 | ||||
| 159 | S | 45.6 | Very low | 42.6 | Very low | 115 Ų | 115 | 138.4 Ų | 138.4 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | -170.5 | 74.3 | -175.4 | -74.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 160 | D | 38.7 | Very low | 41.4 | Very low | 167 Ų | 167 | 137.3 Ų | 137.3 | 89% | 0.893 | 79% | 0.785 | S | S | * | * | trans | -130.4 | 128.2 | 168 | -92.7 | -54.4 | 0 | 0 | 0 | 110.9 | E162 | D160-E162 PolarHBondContact O-N 3.33Š| ||
| 161 | D | 42.4 | Very low | 41 | Very low | 168 Ų | 168 | 138.1 Ų | 138.1 | 90% | 0.898 | 79% | 0.79 | S | S | * | * | trans | -78.9 | 100 | 177.9 | -76.8 | -81.6 | 0 | 0 | 0 | 111 | ||||
| 162 | E | 37.2 | Very low | 40.5 | Very low | 183 Ų | 183 | 139 Ų | 139 | 86% | 0.855 | 80% | 0.796 | S | S | * | * | trans | -79.2 | 139.7 | 168.8 | -104.3 | -57.4 | 157.9 | 0 | 0 | 112.7 | D160 | D160-E162 PolarHBondContact O-N 3.33Š| ||
| 163 | K | 33.4 | Very low | 40.1 | Very low | 168 Ų | 168 | 143 Ų | 143 | 73% | 0.73 | 81% | 0.805 | S | S | * | * | trans | -121.5 | 103.3 | -158.8 | 180 | -172.4 | 170.7 | -171 | 0 | 110.9 | T165 | K163-T165 PolarHBondContact O-N 2.88Š| ||
| 164 | V | 33.4 | Very low | 39.7 | Very low | 141 Ų | 141 | 145.3 Ų | 145.3 | 86% | 0.855 | 81% | 0.811 | S | S | * | * | trans | -43.8 | 120.5 | 179.6 | -174.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 165 | T | 30.8 | Very low | 39.1 | Very low | 115 Ų | 115 | 142 Ų | 142 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | -120.7 | 130.6 | 165.8 | 53.4 | 0 | 0 | 0 | 0 | 109.2 | K163 | K163-T165 PolarHBondContact O-N 2.88Š| ||
| 166 | P | 39.3 | Very low | 38.5 | Very low | 123 Ų | 123 | 145.5 Ų | 145.5 | 80% | 0.799 | 81% | 0.809 | S | S | * | * | trans | -97 | 116.7 | -176.4 | 33.7 | -30.4 | 0 | 0 | 0 | 111.9 | ||||
| 167 | V | 31.9 | Very low | 38.2 | Very low | 123 Ų | 123 | 145.9 Ų | 145.9 | 75% | 0.745 | 81% | 0.807 | S | S | * | * | trans | -136.5 | 105.9 | 169.4 | -176.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 168 | Q | 33.4 | Very low | 38.7 | Very low | 182 Ų | 182 | 144.3 Ų | 144.3 | 85% | 0.85 | 81% | 0.805 | S | S | * | * | trans | 34.4 | 135.9 | 139.3 | -61.6 | 176 | -18.9 | 0 | 0 | 121.3 | ||||
| 169 | N | 35.5 | Very low | 38.9 | Very low | 163 Ų | 163 | 143 Ų | 143 | 87% | 0.872 | 80% | 0.802 | S | S | * | * | trans | -46.1 | 149.2 | 176.9 | -48.1 | 10.3 | 0 | 0 | 0 | 115.2 | ||||
| 170 | G | 31.8 | Very low | 38.5 | Very low | 72 Ų | 72 | 143.6 Ų | 143.6 | 74% | 0.742 | 80% | 0.802 | S | S | * | * | trans | -168.5 | 95.8 | 161.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | N172 | G170-N172 PolarHBondContact O-N 3.29Š| ||
| 171 | D | 44.7 | Very low | 38.3 | Very low | 148 Ų | 148 | 143 Ų | 143 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | trans | -65.3 | 126.7 | 176 | -47.5 | -88.1 | 0 | 0 | 0 | 110 | ||||
| 172 | N | 43.8 | Very low | 38.5 | Very low | 161 Ų | 161 | 141 Ų | 141 | 86% | 0.861 | 80% | 0.795 | S | S | * | * | trans | 174.4 | 86 | 163.1 | -101.4 | -75.1 | 0 | 0 | 0 | 108.5 | G170 | G170-N172 PolarHBondContact O-N 3.29Š| ||
| 173 | D | 44.2 | Very low | 38.8 | Very low | 171 Ų | 171 | 136.6 Ų | 136.6 | 91% | 0.914 | 79% | 0.789 | S | S | * | * | trans | -103.3 | 144.9 | 171.1 | -110.6 | -38.1 | 0 | 0 | 0 | 111.3 | ||||
| 174 | V | 40.5 | Very low | 39.2 | Very low | 127 Ų | 127 | 134.5 Ų | 134.5 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -97.9 | 138 | -157.8 | 175.9 | 0 | 0 | 0 | 0 | 113.1 | E176 | V174-E176 PolarHBondContact O-N 3.24Š| ||
| 175 | I | 40.3 | Very low | 39.5 | Very low | 130 Ų | 130 | 133.5 Ų | 133.5 | 67% | 0.667 | 80% | 0.795 | S | S | * | * | trans | -73.7 | 104.6 | 174.1 | -54.8 | 172.7 | 0 | 0 | 0 | 110 | V177 | I175-V177 HydrophobicContact CG2-CG2 4.09Š| ||
| 176 | E | 43.1 | Very low | 40.1 | Very low | 185 Ų | 185 | 135 Ų | 135 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -83.8 | 116.4 | 167 | -70.1 | -159 | 148.9 | 0 | 0 | 111.3 | V174 | V174-E176 PolarHBondContact O-N 3.24Š| ||
| 177 | V | 39 | Very low | 40 | Very low | 111 Ų | 111 | 135.3 Ų | 135.3 | 67% | 0.673 | 80% | 0.804 | S | S | * | * | trans | -98.9 | 115.8 | 173.1 | -179.6 | 0 | 0 | 0 | 0 | 109.5 | I175 V179 | I175-V177 HydrophobicContact CG2-CG2 4.09Å; V177-V179 PolarHBondContact O-N 3.26Å | ||
| 178 | P | 47.9 | Very low | 40.7 | Very low | 118 Ų | 118 | 134 Ų | 134 | 77% | 0.766 | 81% | 0.806 | S | S | * | * | trans | -76.8 | 93 | -179.5 | 30.2 | -34.2 | 0 | 0 | 0 | 111.4 | T180 | P178-T180 PolarHBondContact O-N 2.9Š| ||
| 179 | V | 39.1 | Very low | 41.1 | Very low | 131 Ų | 131 | 136.2 Ų | 136.2 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | trans | -71.1 | 123 | 165.4 | 178.8 | 0 | 0 | 0 | 0 | 108.9 | V177 | V177-V179 PolarHBondContact O-N 3.26Š| ||
| 180 | T | 37.2 | Very low | 41.4 | Very low | 128 Ų | 128 | 139.7 Ų | 139.7 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | -83.8 | 123.1 | -175.9 | 55.2 | 0 | 0 | 0 | 0 | 112.5 | P178 | P178-T180 PolarHBondContact O-N 2.9Š| ||
| 181 | D | 35.5 | Very low | 41.8 | Very low | 154 Ų | 154 | 142.4 Ų | 142.4 | 82% | 0.824 | 81% | 0.814 | S | S | * | * | trans | -122.4 | 120 | 164.4 | -115.1 | -33.8 | 0 | 0 | 0 | 110.3 | A183 | D181-A183 PolarHBondContact O-N 3.07Å; D181-A183 VanDerWaalsContact O-N 3.08Å | ||
| 182 | P | 46.9 | Very low | 41.6 | Very low | 128 Ų | 128 | 142 Ų | 142 | 83% | 0.831 | 82% | 0.817 | S | S | * | * | trans | -91.6 | 64.5 | -158.8 | 36.2 | -38.6 | 0 | 0 | 0 | 114.4 | ||||
| 183 | A | 43 | Very low | 41.4 | Very low | 89 Ų | 89 | 141 Ų | 141 | 74% | 0.736 | 82% | 0.816 | S | S | * | * | trans | -151.7 | 53.1 | -175 | 0 | 0 | 0 | 0 | 0 | 118.6 | D181 | D181-A183 PolarHBondContact O-N 3.07Å; D181-A183 VanDerWaalsContact O-N 3.08Å | ||
| 184 | S | 41 | Very low | 40.8 | Very low | 125 Ų | 125 | 137.2 Ų | 137.2 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | trans | 158.1 | 112.9 | 139.4 | -76.4 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 185 | S | 39.7 | Very low | 40.6 | Very low | 120 Ų | 120 | 137.5 Ų | 137.5 | 84% | 0.839 | 81% | 0.81 | S | S | * | * | trans | -170.1 | 63.6 | 158.4 | 56.7 | 0 | 0 | 0 | 0 | 113.5 | T187 | S185-T187 PolarHBondContact O-N 3.08Š| ||
| 186 | T | 44 | Very low | 40.3 | Very low | 146 Ų | 146 | 136.5 Ų | 136.5 | 90% | 0.896 | 82% | 0.815 | S | S | * | * | trans | -76.7 | 99.9 | 171.3 | 45.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 187 | T | 37.8 | Very low | 39.7 | Very low | 129 Ų | 129 | 133.5 Ų | 133.5 | 79% | 0.791 | 81% | 0.814 | S | S | * | * | trans | -138.5 | 144.4 | 161 | -73.5 | 0 | 0 | 0 | 0 | 109.7 | S185 | S185-T187 PolarHBondContact O-N 3.08Š| ||
| 188 | A | 46.1 | Very low | 39.7 | Very low | 96 Ų | 96 | 135.9 Ų | 135.9 | 79% | 0.793 | 82% | 0.823 | S | S | * | * | trans | -71.1 | 133.4 | -159 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 189 | Y | 42.5 | Very low | 39.5 | Very low | 228 Ų | 228 | 137.5 Ų | 137.5 | 89% | 0.894 | 83% | 0.825 | S | S | * | * | trans | -114.9 | 152.3 | 158 | -78.9 | -88 | 0 | 0 | 0 | 110.3 | ||||
| 190 | R | 42.3 | Very low | 39.6 | Very low | 236 Ų | 236 | 139.5 Ų | 139.5 | 89% | 0.891 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 145.7 | 175.9 | -74.9 | -179.4 | 171.8 | -178 | -1.7 | 110.7 | V192 | R190-V192 PolarHBondContact O-N 3.29Š|
| 191 | P | 39.7 | Very low | 39.8 | Very low | 129 Ų | 129 | 137.7 Ų | 137.7 | 84% | 0.838 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 125.1 | 174.1 | 29.6 | -33.5 | 0 | 0 | 0 | 111 | ||
| 192 | V | 40.3 | Very low | 39.9 | Very low | 140 Ų | 140 | 134 Ų | 134 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 145.2 | 158.4 | -70.8 | 0 | 0 | 0 | 0 | 109 | R190 | R190-V192 PolarHBondContact O-N 3.29Š|
| 193 | V | 38.8 | Very low | 39.3 | Very low | 139 Ų | 139 | 136.2 Ų | 136.2 | 84% | 0.842 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 126.3 | -179.3 | -72.4 | 0 | 0 | 0 | 0 | 110.7 | ||
| 194 | A | 32.5 | Very low | 39.3 | Very low | 92 Ų | 92 | 137.6 Ų | 137.6 | 76% | 0.76 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 126.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 195 | V | 36.7 | Very low | 39.1 | Very low | 134 Ų | 134 | 137.8 Ų | 137.8 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | trans | -103 | 89.3 | 167.7 | -76.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 196 | S | 32.3 | Very low | 39.4 | Very low | 108 Ų | 108 | 137.9 Ų | 137.9 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | trans | -71.2 | 125.9 | 172.1 | -60.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 197 | S | 32.1 | Very low | 39.1 | Very low | 122 Ų | 122 | 137 Ų | 137 | 85% | 0.853 | 81% | 0.808 | S | S | * | * | trans | -106.7 | 105.9 | 166.3 | -65.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 198 | D | 37.6 | Very low | 39.4 | Very low | 162 Ų | 162 | 135.7 Ų | 135.7 | 87% | 0.866 | 80% | 0.803 | S | S | * | * | trans | -108.1 | 125 | 169.9 | -114 | -94.5 | 0 | 0 | 0 | 107.4 | ||||
| 199 | D | 43.8 | Very low | 39.1 | Very low | 151 Ų | 151 | 137 Ų | 137 | 81% | 0.807 | 81% | 0.807 | S | S | * | * | trans | -111.7 | 116.8 | 178.3 | -169.8 | -73.8 | 0 | 0 | 0 | 109.2 | ||||
| 200 | E | 41 | Very low | 39.3 | Very low | 173 Ų | 173 | 132.5 Ų | 132.5 | 81% | 0.808 | 80% | 0.798 | S | S | * | * | trans | -149.1 | 150 | 161.4 | -103.3 | -55.8 | 172.7 | 0 | 0 | 111.2 | ||||
| 201 | S | 42.8 | Very low | 39.1 | Very low | 90 Ų | 90 | 126.9 Ų | 126.9 | 63% | 0.629 | 80% | 0.796 | S | S | * | * | trans | -99.8 | 151.1 | -157.3 | 72.1 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 202 | S | 36.5 | Very low | 39.5 | Very low | 77 Ų | 77 | 127.6 Ų | 127.6 | 54% | 0.538 | 79% | 0.792 | S | S | . | * | 158.5 | 155.5 | 106.8 | 54.6 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 203 | K | 35.8 | Very low | 39.7 | Very low | 175 Ų | 175 | 126.1 Ų | 126.1 | 76% | 0.761 | 79% | 0.788 | S | S | * | * | trans | 57.9 | 80.7 | 147.5 | 71.7 | -147.1 | 168.3 | -132.7 | 0 | 121.6 | ||||
| 204 | S | 41.3 | Very low | 40.5 | Very low | 118 Ų | 118 | 127 Ų | 127 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | 44.7 | 119.5 | 118.4 | 65.1 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 205 | S | 37.8 | Very low | 41.7 | Very low | 129 Ų | 129 | 127.2 Ų | 127.2 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | trans | -149.8 | 156.1 | 135 | 67.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 206 | S | 44.9 | Very low | 42.4 | Very low | 121 Ų | 121 | 126.2 Ų | 126.2 | 85% | 0.846 | 77% | 0.77 | S | S | * | * | trans | -98 | 140.9 | -165.7 | 55.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 207 | S | 37.7 | Very low | 43.4 | Very low | 128 Ų | 128 | 123 Ų | 123 | 90% | 0.895 | 76% | 0.755 | S | S | * | * | trans | -144.6 | 134.9 | 146.2 | 49.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 208 | S | 45.1 | Very low | 44.6 | Very low | 101 Ų | 101 | 125 Ų | 125 | 71% | 0.706 | 75% | 0.751 | S | S | * | * | trans | -103.6 | 139.8 | -175.4 | 50.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 209 | S | 38.7 | Very low | 45.5 | Very low | 125 Ų | 125 | 123.4 Ų | 123.4 | 87% | 0.874 | 73% | 0.733 | S | S | * | * | trans | -146.1 | 104.1 | 163.1 | -77.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 210 | D | 47.5 | Very low | 46.7 | Very low | 132 Ų | 132 | 121 Ų | 121 | 71% | 0.706 | 72% | 0.72 | S | S | * | * | trans | -79.5 | 146.6 | 178.1 | -44.2 | -84.3 | 0 | 0 | 0 | 110.9 | ||||
| 211 | S | 37.3 | Very low | 48 | Very low | 119 Ų | 119 | 116.3 Ų | 116.3 | 83% | 0.832 | 70% | 0.704 | S | S | * | * | trans | -163.6 | 90.4 | 169.7 | -77.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 212 | D | 48.6 | Very low | 49.4 | Very low | 143 Ų | 143 | 116.3 Ų | 116.3 | 77% | 0.765 | 70% | 0.699 | S | S | * | * | trans | -73.3 | 143.8 | -174.6 | -46.5 | -78.5 | 0 | 0 | 0 | 112.6 | ||||
| 213 | S | 45.5 | Very low | 51 | Low | 109 Ų | 109 | 116.9 Ų | 116.9 | 76% | 0.762 | 70% | 0.696 | S | S | * | * | trans | -146.5 | 64.9 | 172.9 | -176.9 | 0 | 0 | 0 | 0 | 110 | S215 | S213-S215 PolarHBondContact O-N 3.19Å; S213-S215 VanDerWaalsContact O-N 3.08Å | ||
| 214 | D | 55.3 | Low | 53.1 | Low | 157 Ų | 157 | 117.3 Ų | 117.3 | 84% | 0.84 | 69% | 0.693 | S | S | * | * | trans | -65.7 | 101.5 | -179.7 | -84.2 | -49.8 | 0 | 0 | 0 | 113.1 | ||||
| 215 | S | 56.5 | Low | 54.7 | Low | 97 Ų | 97 | 118.9 Ų | 118.9 | 68% | 0.678 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -151.7 | -5.8 | 153.8 | -165.7 | 0 | 0 | 0 | 0 | 114.5 | S213 | S213-S215 PolarHBondContact O-N 3.19Å; S213-S215 VanDerWaalsContact O-N 3.08Å |
| 216 | E | 52.1 | Low | 56.4 | Low | 113 Ų | 113 | 119 Ų | 119 | 53% | 0.528 | 67% | 0.669 | S | S | . | * | S | Bend | trans | -106.2 | -21.3 | -169.5 | -44.5 | -52.7 | 134.1 | 0 | 0 | 114.4 | Y219 | E216-Y219 HydrophobicContact CB-CE1 4.18Å; E216-Y219 WeakPolarHBondContact O-CD1 3.11Å; E216-Y219 WeakPolarHBondContact O-CE1 3.23Å |
| 217 | G | 53.5 | Low | 57.8 | Low | 42 Ų | 42 | 117 Ų | 117 | 43% | 0.433 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -73.6 | -33.2 | -167.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | T221 | G217-T221 WeakPolarHBondContact O-CG2 3.08Å; G217-T221 PolarHBondContact O-N 3.4Å; G217-T221 VanDerWaalsContact O-N 3.14Å; G217-T221 PolarHBondContact O-OG1 2.83Å |
| 218 | E | 56.8 | Low | 59.5 | Low | 164 Ų | 164 | 114.8 Ų | 114.8 | 77% | 0.766 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -72.4 | -42.6 | -174 | -63.8 | -158.4 | 142.3 | 0 | 0 | 112.6 | L220 T221 V222 | E218-L220 PolarHBondContact O-N 2.79Å; E218-T221 PolarHBondContact O-N 2.95Å; E218-T221 PolarHBondContact O-OG1 2.88Å; E218-V222 VanDerWaalsContact O-CB 3.3Å; E218-V222 WeakPolarHBondContact O-CB 3.26Å; E218-V222 VanDerWaalsContact O-CG2 3.25Å; E218-V222 WeakPolarHBondContact O-CG2 3.33Å; E218-V222 PolarHBondContact O-N 3.08Å |
| 219 | Y | 57.7 | Low | 60.6 | Low | 127 Ų | 127 | 117.3 Ų | 117.3 | 50% | 0.498 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -65.3 | -40.7 | -178.8 | 85.5 | -97.3 | 0 | 0 | 0 | 111.5 | E216 L223 | E216-Y219 HydrophobicContact CB-CE1 4.18Å; E216-Y219 WeakPolarHBondContact O-CD1 3.11Å; E216-Y219 WeakPolarHBondContact O-CE1 3.23Å; Y219-L223 HydrophobicContact CD2-CD1 3.93Å; Y219-L223 HydrophobicContact CE2-CD1 4.42Å; Y219-L223 VanDerWaalsContact O-CB 3.31Å; Y219-L223 WeakPolarHBondContact O-CB 3.37Å; Y219-L223 VanDerWaalsContact O-CG 3.26Å; Y219-L223 WeakPolarHBondContact O-CG 3.38Å; Y219-L223 PolarHBondContact O-N 3.37Å |
| 220 | L | 67.5 | Low | 61.8 | Low | 100 Ų | 100 | 119.1 Ų | 119.1 | 52% | 0.524 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -66.1 | -42.6 | 177.6 | -102.1 | 165.2 | 0 | 0 | 0 | 112.1 | E218 L223 R224 | E218-L220 PolarHBondContact O-N 2.79Å; L220-L223 PolarHBondContact O-N 2.69Å; L220-R224 WeakPolarHBondContact O-CB 3.44Å; L220-R224 PolarHBondContact O-N 3.15Å |
| 221 | T | 69.7 | Low | 62.6 | Low | 76 Ų | 76 | 118.2 Ų | 118.2 | 47% | 0.466 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -73.4 | -32.5 | 178.6 | 53.8 | 0 | 0 | 0 | 0 | 113 | G217 E218 K225 | G217-T221 WeakPolarHBondContact O-CG2 3.08Å; G217-T221 PolarHBondContact O-N 3.4Å; G217-T221 VanDerWaalsContact O-N 3.14Å; G217-T221 PolarHBondContact O-OG1 2.83Å; E218-T221 PolarHBondContact O-N 2.95Å; E218-T221 PolarHBondContact O-OG1 2.88Å; T221-K225 WeakPolarHBondContact O-CB 3.44Å; T221-K225 WeakPolarHBondContact O-CG 3.29Å; T221-K225 PolarHBondContact O-N 2.79Å |
| 222 | V | 72.1 | Confident | 63.3 | Low | 89 Ų | 89 | 119.3 Ų | 119.3 | 54% | 0.539 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -68.4 | -42.6 | 170.6 | 169.2 | 0 | 0 | 0 | 0 | 111.2 | E218 K226 | E218-V222 VanDerWaalsContact O-CB 3.3Å; E218-V222 WeakPolarHBondContact O-CB 3.26Å; E218-V222 VanDerWaalsContact O-CG2 3.25Å; E218-V222 WeakPolarHBondContact O-CG2 3.33Å; E218-V222 PolarHBondContact O-N 3.08Å; V222-K226 WeakPolarHBondContact O-CB 3.15Å; V222-K226 PolarHBondContact O-N 3.2Å |
| 223 | L | 70.3 | Confident | 63.3 | Low | 90 Ų | 90 | 116.5 Ų | 116.5 | 47% | 0.471 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -61.6 | -46.2 | 174.1 | -78.3 | 174.3 | 0 | 0 | 0 | 111.5 | Y219 L220 K226 I227 | Y219-L223 HydrophobicContact CD2-CD1 3.93Å; Y219-L223 HydrophobicContact CE2-CD1 4.42Å; Y219-L223 VanDerWaalsContact O-CB 3.31Å; Y219-L223 WeakPolarHBondContact O-CB 3.37Å; Y219-L223 VanDerWaalsContact O-CG 3.26Å; Y219-L223 WeakPolarHBondContact O-CG 3.38Å; Y219-L223 PolarHBondContact O-N 3.37Å; L220-L223 PolarHBondContact O-N 2.69Å; L223-K226 CarbonylContact O-C 3.59Å; L223-K226 PolarHBondContact O-N 3.43Å; L223-K226 VanDerWaalsContact O-N 3.16Å; L223-I227 VanDerWaalsContact O-CG1 3.31Å; L223-I227 WeakPolarHBondContact O-CG1 3.49Å; L223-I227 PolarHBondContact O-N 2.91Å |
| 224 | R | 79.1 | Confident | 63.5 | Low | 184 Ų | 184 | 117.2 Ų | 117.2 | 69% | 0.694 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -59.5 | -53.7 | 177.4 | -151.4 | 173.9 | -164.4 | 165 | 5.4 | 110.6 | L220 K226 I227 D228 | L220-R224 WeakPolarHBondContact O-CB 3.44Å; L220-R224 PolarHBondContact O-N 3.15Å; R224-K226 PolarHBondContact O-N 2.94Å; R224-K226 VanDerWaalsContact O-N 3.16Å; R224-I227 CarbonylContact O-C 3.51Å; R224-I227 WeakPolarHBondContact O-CA 3.45Å; R224-I227 WeakPolarHBondContact O-CB 3.44Å; R224-I227 PolarHBondContact O-N 2.91Å; R224-D228 VanDerWaalsContact C-OD2 3.31Å; R224-D228 WeakPolarHBondContact O-CB 3.44Å; R224-D228 PolarHBondContact O-N 3.42Å; R224-D228 VanDerWaalsContact O-OD2 3.08Å |
| 225 | K | 73.9 | Confident | 63.3 | Low | 150 Ų | 150 | 116.7 Ų | 116.7 | 65% | 0.652 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -56.4 | -33.7 | 173.7 | -74.7 | 174 | 177.8 | 173.1 | 0 | 113.6 | T221 K229 | T221-K225 WeakPolarHBondContact O-CB 3.44Å; T221-K225 WeakPolarHBondContact O-CG 3.29Å; T221-K225 PolarHBondContact O-N 2.79Å; K225-K229 WeakPolarHBondContact O-CB 3.45Å; K225-K229 PolarHBondContact O-N 2.85Å |
| 226 | K | 73.6 | Confident | 62.4 | Low | 132 Ų | 132 | 118 Ų | 118 | 57% | 0.574 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -80.1 | -15.5 | 176.5 | -172.6 | 168.7 | -178.4 | 173.9 | 0 | 113.4 | V222 L223 R224 R230 | V222-K226 WeakPolarHBondContact O-CB 3.15Å; V222-K226 PolarHBondContact O-N 3.2Å; L223-K226 CarbonylContact O-C 3.59Å; L223-K226 PolarHBondContact O-N 3.43Å; L223-K226 VanDerWaalsContact O-N 3.16Å; R224-K226 PolarHBondContact O-N 2.94Å; R224-K226 VanDerWaalsContact O-N 3.16Å; K226-R230 WeakPolarHBondContact O-CG 3.31Å; K226-R230 PolarHBondContact O-NE 2.88Å |
| 227 | I | 76.1 | Confident | 62.2 | Low | 78 Ų | 78 | 120.4 Ų | 120.4 | 40% | 0.4 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -86.2 | -54.4 | 168.7 | -70 | 162.2 | 0 | 0 | 0 | 108.4 | L223 R224 K229 R230 I231 | L223-I227 VanDerWaalsContact O-CG1 3.31Å; L223-I227 WeakPolarHBondContact O-CG1 3.49Å; L223-I227 PolarHBondContact O-N 2.91Å; R224-I227 CarbonylContact O-C 3.51Å; R224-I227 WeakPolarHBondContact O-CA 3.45Å; R224-I227 WeakPolarHBondContact O-CB 3.44Å; R224-I227 PolarHBondContact O-N 2.91Å; I227-K229 VanDerWaalsContact C-N 3.35Å; I227-K229 PolarHBondContact O-N 3.16Å; I227-R230 CarbonylContact O-C 3.56Å; I227-R230 WeakPolarHBondContact O-CA 3.37Å; I227-R230 PolarHBondContact O-N 3.16Å; I227-I231 HydrophobicContact CG2-CD1 3.63Å; I227-I231 HydrophobicContact CG2-CG1 4.41Å; I227-I231 WeakPolarHBondContact O-CG1 3.37Å; I227-I231 PolarHBondContact O-N 2.8Å |
| 228 | D | 72.5 | Confident | 61.7 | Low | 82 Ų | 82 | 127.4 Ų | 127.4 | 44% | 0.439 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -53.8 | -48.3 | 177.8 | -53.8 | -29.3 | 0 | 0 | 0 | 111.3 | R224 R230 I231 N232 | R224-D228 VanDerWaalsContact C-OD2 3.31Å; R224-D228 WeakPolarHBondContact O-CB 3.44Å; R224-D228 PolarHBondContact O-N 3.42Å; R224-D228 VanDerWaalsContact O-OD2 3.08Å; D228-R230 VanDerWaalsContact C-N 3.27Å; D228-R230 PolarHBondContact O-N 2.82Å; D228-I231 PolarHBondContact O-N 2.95Å; D228-N232 VanDerWaalsContact O-CB 3.26Å; D228-N232 WeakPolarHBondContact O-CB 3.48Å; D228-N232 PolarHBondContact O-N 2.66Å |
| 229 | K | 68.3 | Low | 61.4 | Low | 155 Ų | 155 | 126.5 Ų | 126.5 | 67% | 0.674 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -67 | -21.2 | 177.1 | -166.1 | 180 | -179.2 | -166.5 | 0 | 113.4 | K225 I227 T233 | K225-K229 WeakPolarHBondContact O-CB 3.45Å; K225-K229 PolarHBondContact O-N 2.85Å; I227-K229 VanDerWaalsContact C-N 3.35Å; I227-K229 PolarHBondContact O-N 3.16Å; K229-T233 HydrophobicContact CG-CG2 4.29Å; K229-T233 WeakPolarHBondContact O-CG2 3.47Å; K229-T233 PolarHBondContact O-OG1 2.79Å |
| 230 | R | 63.9 | Low | 60.7 | Low | 162 Ų | 162 | 128.2 Ų | 128.2 | 61% | 0.611 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -88.5 | -25.8 | 173.4 | -79.8 | -174.6 | -65.2 | 156.2 | 5.3 | 113.3 | K226 I227 D228 | K226-R230 WeakPolarHBondContact O-CG 3.31Å; K226-R230 PolarHBondContact O-NE 2.88Å; I227-R230 CarbonylContact O-C 3.56Å; I227-R230 WeakPolarHBondContact O-CA 3.37Å; I227-R230 PolarHBondContact O-N 3.16Å; D228-R230 VanDerWaalsContact C-N 3.27Å; D228-R230 PolarHBondContact O-N 2.82Å |
| 231 | I | 64.1 | Low | 59.9 | Low | 114 Ų | 114 | 132.1 Ų | 132.1 | 59% | 0.585 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -77.3 | -33.7 | 173.6 | -66.8 | 172 | 0 | 0 | 0 | 110.1 | I227 D228 | I227-I231 HydrophobicContact CG2-CD1 3.63Å; I227-I231 HydrophobicContact CG2-CG1 4.41Å; I227-I231 WeakPolarHBondContact O-CG1 3.37Å; I227-I231 PolarHBondContact O-N 2.8Å; D228-I231 PolarHBondContact O-N 2.95Å |
| 232 | N | 51.5 | Low | 58.8 | Low | 141 Ų | 141 | 135.8 Ų | 135.8 | 75% | 0.754 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -97.8 | 15.4 | -175.5 | -153.7 | 72.3 | 0 | 0 | 0 | 114.4 | D228 | D228-N232 VanDerWaalsContact O-CB 3.26Å; D228-N232 WeakPolarHBondContact O-CB 3.48Å; D228-N232 PolarHBondContact O-N 2.66Å |
| 233 | T | 48.8 | Very low | 57.5 | Low | 85 Ų | 85 | 139.8 Ų | 139.8 | 52% | 0.521 | 69% | 0.694 | S | S | . | * | trans | -124.2 | 49.9 | 171.8 | 61.6 | 0 | 0 | 0 | 0 | 110.7 | K229 | K229-T233 HydrophobicContact CG-CG2 4.29Å; K229-T233 WeakPolarHBondContact O-CG2 3.47Å; K229-T233 PolarHBondContact O-OG1 2.79Å | ||
| 234 | V | 50.5 | Low | 56.3 | Low | 124 Ų | 124 | 143.4 Ų | 143.4 | 75% | 0.752 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -103 | 10.8 | 171.1 | -69.1 | 0 | 0 | 0 | 0 | 112.7 | ||
| 235 | D | 50.7 | Low | 55.1 | Low | 146 Ų | 146 | 142.7 Ų | 142.7 | 78% | 0.781 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -133.3 | 147.1 | 167 | -101 | -50.4 | 0 | 0 | 0 | 109.7 | ||
| 236 | C | 37 | Very low | 53.6 | Low | 125 Ų | 125 | 143.3 Ų | 143.3 | 85% | 0.845 | 73% | 0.729 | S | S | * | * | trans | 68.7 | 108.9 | -177.8 | -55.2 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 237 | D | 47.6 | Very low | 52.3 | Low | 163 Ų | 163 | 140.6 Ų | 140.6 | 87% | 0.872 | 74% | 0.738 | S | S | * | * | trans | -64.8 | 146.2 | 154.8 | -61.6 | -84.7 | 0 | 0 | 0 | 111 | ||||
| 238 | E | 44.4 | Very low | 50.6 | Low | 189 Ų | 189 | 141.6 Ų | 141.6 | 88% | 0.883 | 76% | 0.758 | S | S | * | * | trans | -164.9 | 130.5 | 142.4 | -112.9 | 168.1 | -159.5 | 0 | 0 | 110.3 | ||||
| 239 | D | 49.1 | Very low | 49.4 | Very low | 144 Ų | 144 | 144.9 Ų | 144.9 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | trans | -5.9 | 114.4 | 179.3 | -54.2 | -31.7 | 0 | 0 | 0 | 121.4 | ||||
| 240 | D | 44.9 | Very low | 48.2 | Very low | 164 Ų | 164 | 140.8 Ų | 140.8 | 88% | 0.877 | 78% | 0.783 | S | S | * | * | trans | -114.2 | 100.5 | 145.3 | -91.3 | -41.7 | 0 | 0 | 0 | 107.9 | D242 | D240-D242 VanDerWaalsContact C-N 3.33Å; D240-D242 PolarHBondContact O-N 2.91Å | ||
| 241 | E | 50.4 | Low | 47.3 | Very low | 182 Ų | 182 | 137.6 Ų | 137.6 | 85% | 0.85 | 78% | 0.778 | S | S | * | * | trans | -79.6 | 66.3 | 178.4 | -70.4 | -166.3 | 142.2 | 0 | 0 | 112.8 | ||||
| 242 | D | 45.3 | Very low | 46.5 | Very low | 153 Ų | 153 | 144.9 Ų | 144.9 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -82.6 | 121.4 | 168.2 | -95.5 | -31.7 | 0 | 0 | 0 | 111.3 | D240 D244 | D240-D242 VanDerWaalsContact C-N 3.33Å; D240-D242 PolarHBondContact O-N 2.91Å; D242-D244 PolarHBondContact O-N 2.87Å | ||
| 243 | F | 45.6 | Very low | 46.5 | Very low | 173 Ų | 173 | 142.7 Ų | 142.7 | 76% | 0.759 | 79% | 0.794 | S | S | * | * | trans | -95.3 | 71.6 | -160.1 | -158.2 | -82.3 | 0 | 0 | 0 | 113.2 | E245 | F243-E245 HydrophobicContact CD1-CB 4.46Å; F243-E245 HydrophobicContact CE1-CB 4.13Å | ||
| 244 | D | 45.7 | Very low | 46.9 | Very low | 165 Ų | 165 | 148.2 Ų | 148.2 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | -94.1 | 90.8 | 170.9 | -87.9 | -40.1 | 0 | 0 | 0 | 111.5 | D242 D246 | D242-D244 PolarHBondContact O-N 2.87Å; D244-D246 PolarHBondContact O-N 2.98Å | ||
| 245 | E | 53.2 | Low | 47.3 | Very low | 170 Ų | 170 | 152.6 Ų | 152.6 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -87 | 91.4 | 177 | -171.9 | 179.7 | 174.1 | 0 | 0 | 112.2 | F243 | F243-E245 HydrophobicContact CD1-CB 4.46Å; F243-E245 HydrophobicContact CE1-CB 4.13Å | ||
| 246 | D | 43.4 | Very low | 48 | Very low | 163 Ų | 163 | 157.4 Ų | 157.4 | 87% | 0.872 | 82% | 0.816 | S | S | * | * | trans | -145.5 | 145.2 | 145.8 | -160.7 | 3.1 | 0 | 0 | 0 | 111.1 | D244 | D244-D246 PolarHBondContact O-N 2.98Š| ||
| 247 | G | 44.3 | Very low | 49.6 | Very low | 74 Ų | 74 | 157.5 Ų | 157.5 | 76% | 0.763 | 80% | 0.804 | S | S | * | * | trans | -102.7 | 104.1 | -158.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 248 | A | 42.4 | Very low | 50.9 | Low | 100 Ų | 100 | 154.1 Ų | 154.1 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | trans | -136.3 | 111.8 | 164.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 249 | T | 45.6 | Very low | 52.3 | Low | 151 Ų | 151 | 151.3 Ų | 151.3 | 93% | 0.926 | 79% | 0.789 | S | S | * | * | trans | -58.9 | 133.4 | -179.3 | 51.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 250 | G | 43.5 | Very low | 53.6 | Low | 68 Ų | 68 | 149.6 Ų | 149.6 | 70% | 0.701 | 78% | 0.775 | S | S | * | * | trans | 147.3 | 114.9 | 151.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 251 | D | 45.6 | Very low | 55.1 | Low | 96 Ų | 96 | 144.8 Ų | 144.8 | 51% | 0.513 | 75% | 0.751 | S | S | . | * | trans | 60.2 | 88.2 | 152.5 | -174.3 | 27.7 | 0 | 0 | 0 | 118.5 | S253 R254 | D251-S253 PolarHBondContact O-N 3.47Å; D251-S253 VanDerWaalsContact OD1-CA 3.28Å; D251-S253 WeakPolarHBondContact OD1-CA 3.03Å; D251-S253 WeakPolarHBondContact OD1-CB 3.18Å; D251-S253 PolarHBondContact OD1-N 2.86Å; D251-R254 WeakPolarHBondContact OD2-CG 3.47Å; D251-R254 IonicContact OD2-NE 3.62Å | ||
| 252 | R | 48.1 | Very low | 56.1 | Low | 266 Ų | 266 | 146.1 Ų | 146.1 | 100% | 1.004 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | 1.6 | 164.7 | -72.1 | -173 | 174.9 | -172.9 | -2.1 | 113.8 | ||
| 253 | S | 51.6 | Low | 57.4 | Low | 95 Ų | 95 | 142.5 Ų | 142.5 | 66% | 0.664 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.4 | 10.7 | -172.8 | -151 | 0 | 0 | 0 | 0 | 114.4 | D251 R255 | D251-S253 PolarHBondContact O-N 3.47Å; D251-S253 VanDerWaalsContact OD1-CA 3.28Å; D251-S253 WeakPolarHBondContact OD1-CA 3.03Å; D251-S253 WeakPolarHBondContact OD1-CB 3.18Å; D251-S253 PolarHBondContact OD1-N 2.86Å; S253-R255 PolarHBondContact O-N 2.86Å |
| 254 | R | 56.1 | Low | 58.9 | Low | 201 Ų | 201 | 137.6 Ų | 137.6 | 76% | 0.758 | 73% | 0.727 | S | S | * | * | trans | -68.7 | 76.8 | 167.6 | -59.9 | -165.4 | -169.5 | 178.4 | 8.3 | 110.9 | D251 R256 | D251-R254 WeakPolarHBondContact OD2-CG 3.47Å; D251-R254 IonicContact OD2-NE 3.62Å; R254-R256 PolarHBondContact O-N 3.37Å | ||
| 255 | R | 59.7 | Low | 60.4 | Low | 217 Ų | 217 | 135.7 Ų | 135.7 | 82% | 0.819 | 71% | 0.714 | S | S | * | * | trans | -43.4 | 126.9 | 160.4 | -71 | -173.3 | 174.5 | -157.1 | -3.2 | 107.4 | S253 Q257 | S253-R255 PolarHBondContact O-N 2.86Å; R255-Q257 PolarHBondContact O-N 3.14Å | ||
| 256 | R | 64.9 | Low | 61.7 | Low | 247 Ų | 247 | 130.6 Ų | 130.6 | 93% | 0.932 | 69% | 0.692 | S | S | * | * | trans | -56.9 | 105.6 | -179.3 | -65.4 | -175.7 | -177.1 | -146.9 | -0.1 | 107.9 | R254 | R254-R256 PolarHBondContact O-N 3.37Š| ||
| 257 | Q | 70 | Confident | 63.4 | Low | 127 Ų | 127 | 125.5 Ų | 125.5 | 59% | 0.593 | 66% | 0.664 | S | S | * | * | trans | -57.3 | 148.4 | 173.8 | -69.6 | -72.5 | -57.4 | 0 | 0 | 108.2 | R255 | R255-Q257 PolarHBondContact O-N 3.14Š| ||
| 258 | P | 75.2 | Confident | 64.9 | Low | 92 Ų | 92 | 128.1 Ų | 128.1 | 60% | 0.597 | 66% | 0.661 | S | S | * | * | trans | -47.7 | 143 | 166.6 | -26.6 | 35.5 | 0 | 0 | 0 | 110.1 | K260 | P258-K260 WeakPolarHBondContact O-CG 3.31Å; P258-K260 PolarHBondContact O-N 2.91Å | ||
| 259 | P | 74.8 | Confident | 66.8 | Low | 130 Ų | 130 | 128.2 Ų | 128.2 | 84% | 0.844 | 65% | 0.648 | S | S | * | * | trans | -59.2 | 112.3 | 179.6 | -23 | 33.9 | 0 | 0 | 0 | 110.4 | ||||
| 260 | K | 76 | Confident | 68.6 | Low | 108 Ų | 108 | 122.8 Ų | 122.8 | 47% | 0.47 | 61% | 0.613 | S | S | . | * | trans | -91.6 | 127.3 | -172.7 | -57.8 | -154.8 | 158.9 | 178.7 | 0 | 112.1 | P258 E264 L266 | P258-K260 WeakPolarHBondContact O-CG 3.31Å; P258-K260 PolarHBondContact O-N 2.91Å; K260-E264 WeakPolarHBondContact CA-OE2 3.44Å; K260-E264 VanDerWaalsContact CB-OE1 3.27Å; K260-E264 WeakPolarHBondContact CB-OE1 3.28Å; K260-E264 WeakPolarHBondContact CD-OE1 3.3Å; K260-E264 WeakPolarHBondContact CE-OE1 3.39Å; K260-E264 WeakPolarHBondContact CG-OE1 3.25Å; K260-L266 VanDerWaalsContact NZ-CD1 3.31Å | ||
| 261 | V | 75 | Confident | 70.6 | Confident | 63 Ų | 63 | 124 Ų | 124 | 38% | 0.382 | 61% | 0.608 | S | S | . | * | trans | -81.4 | 143 | 171.9 | -178 | 0 | 0 | 0 | 0 | 109.3 | G263 E264 H390 | V261-G263 PolarHBondContact O-N 3.43Å; V261-E264 PolarHBondContact N-OE2 2.85Å; V261-E264 WeakPolarHBondContact O-CG 3.15Å; V261-E264 PolarHBondContact O-N 3.18Å; V261-E264 VanDerWaalsContact O-N 3.15Å; V261-H390 HydrophobicContact CG1-CB 3.86Å | ||
| 262 | R | 71.6 | Confident | 72.4 | Confident | 209 Ų | 209 | 124 Ų | 124 | 79% | 0.789 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | 95.5 | -176.5 | -175.4 | -170.8 | 175.4 | -171.5 | -1.8 | 110.8 | ||
| 263 | G | 72.3 | Confident | 74.2 | Confident | 78 Ų | 78 | 113.7 Ų | 113.7 | 80% | 0.804 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 116.1 | 5.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | V261 | V261-G263 PolarHBondContact O-N 3.43Š|
| 264 | E | 78.6 | Confident | 75.5 | Confident | 70 Ų | 70 | 116.7 Ų | 116.7 | 33% | 0.327 | 58% | 0.581 | S | S | . | * | trans | -57.6 | 145.1 | 163.7 | 76.4 | -174.1 | -153.1 | 0 | 0 | 110.4 | K260 V261 L266 | K260-E264 WeakPolarHBondContact CA-OE2 3.44Å; K260-E264 VanDerWaalsContact CB-OE1 3.27Å; K260-E264 WeakPolarHBondContact CB-OE1 3.28Å; K260-E264 WeakPolarHBondContact CD-OE1 3.3Å; K260-E264 WeakPolarHBondContact CE-OE1 3.39Å; K260-E264 WeakPolarHBondContact CG-OE1 3.25Å; V261-E264 PolarHBondContact N-OE2 2.85Å; V261-E264 WeakPolarHBondContact O-CG 3.15Å; V261-E264 PolarHBondContact O-N 3.18Å; V261-E264 VanDerWaalsContact O-N 3.15Å; E264-L266 HydrophobicContact CG-CD2 4.48Å | ||
| 265 | M | 76.4 | Confident | 76.4 | Confident | 125 Ų | 125 | 111.3 Ų | 111.3 | 62% | 0.616 | 56% | 0.564 | S | S | * | * | trans | -118.9 | 122.3 | 176.1 | -176.9 | 172.3 | 53.6 | 0 | 0 | 107.8 | D269 L270 | M265-D269 HydrophobicContact CG-CB 3.75Å; M265-L270 HydrophobicContact CE-CD2 3.5Å; M265-L270 VanDerWaalsContact CE-CD2 3.5Å; M265-L270 HydrophobicContact CE-CG 4.11Å; M265-L270 HydrophobicContact CG-CG 4.33Å; M265-L270 HydrophobicContact SD-CD2 3.96Å; M265-L270 HydrophobicContact SD-CG 4.26Å | ||
| 266 | L | 81.3 | Confident | 77.3 | Confident | 63 Ų | 63 | 103.4 Ų | 103.4 | 33% | 0.33 | 54% | 0.538 | S | S | . | . | trans | -86.2 | 165.4 | -174.7 | -57 | 168.1 | 0 | 0 | 0 | 111 | K260 E264 D268 D269 L270 | K260-L266 VanDerWaalsContact NZ-CD1 3.31Å; E264-L266 HydrophobicContact CG-CD2 4.48Å; L266-D268 PolarHBondContact O-N 2.76Å; L266-D269 VanDerWaalsContact CB-OD2 3.26Å; L266-D269 WeakPolarHBondContact CB-OD2 3.28Å; L266-D269 WeakPolarHBondContact CG-OD2 3.32Å; L266-D269 PolarHBondContact N-OD2 3.45Å; L266-D269 PolarHBondContact O-N 3.38Å; L266-L270 PolarHBondContact O-N 3.09Å | ||
| 267 | L | 78.3 | Confident | 77.8 | Confident | 56 Ų | 56 | 99.1 Ų | 99.1 | 29% | 0.293 | 53% | 0.528 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59 | -18.6 | 175.1 | -61.2 | 176.7 | 0 | 0 | 0 | 113.4 | L270 L298 F329 R343 | L267-L270 HydrophobicContact CD2-CD1 4.42Å; L267-L298 HydrophobicContact CD1-CD1 3.92Å; L267-L298 HydrophobicContact CD1-CD2 4.2Å; L267-L298 HydrophobicContact CD1-CG 3.96Å; L267-L298 HydrophobicContact CD2-CD2 4.36Å; L267-F329 HydrophobicContact CD2-CE1 3.83Å; L267-F329 HydrophobicContact CD2-CZ 4.08Å; L267-R343 PolarHBondContact O-NE 3.38Å; L267-R343 PolarHBondContact O-NH2 2.99Å |
| 268 | D | 75.6 | Confident | 78.4 | Confident | 129 Ų | 129 | 95.1 Ų | 95.1 | 69% | 0.69 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.7 | -19.8 | 177.4 | -58.7 | -24.1 | 0 | 0 | 0 | 113.3 | L266 Q297 | L266-D268 PolarHBondContact O-N 2.76Å; D268-Q297 PolarHBondContact OD1-NE2 2.81Å |
| 269 | D | 81.8 | Confident | 78.7 | Confident | 102 Ų | 102 | 95.9 Ų | 95.9 | 55% | 0.545 | 51% | 0.514 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | -25.4 | 175.4 | -60.4 | -51.4 | 0 | 0 | 0 | 111.5 | M265 L266 | M265-D269 HydrophobicContact CG-CB 3.75Å; L266-D269 VanDerWaalsContact CB-OD2 3.26Å; L266-D269 WeakPolarHBondContact CB-OD2 3.28Å; L266-D269 WeakPolarHBondContact CG-OD2 3.32Å; L266-D269 PolarHBondContact N-OD2 3.45Å; L266-D269 PolarHBondContact O-N 3.38Å |
| 270 | L | 83.7 | Confident | 79.2 | Confident | 37 Ų | 37 | 90.3 Ų | 90.3 | 19% | 0.194 | 48% | 0.477 | C | S | . | . | S | Bend | trans | -67.2 | 142.8 | 175.1 | -82.1 | 168 | 0 | 0 | 0 | 112.2 | M265 L266 L267 F329 R343 | M265-L270 HydrophobicContact CE-CD2 3.5Å; M265-L270 VanDerWaalsContact CE-CD2 3.5Å; M265-L270 HydrophobicContact CE-CG 4.11Å; M265-L270 HydrophobicContact CG-CG 4.33Å; M265-L270 HydrophobicContact SD-CD2 3.96Å; M265-L270 HydrophobicContact SD-CG 4.26Å; L266-L270 PolarHBondContact O-N 3.09Å; L267-L270 HydrophobicContact CD2-CD1 4.42Å; L270-F329 HydrophobicContact CD1-CE2 3.69Å; L270-F329 HydrophobicContact CD1-CZ 3.5Å; L270-F329 VanDerWaalsContact CD1-CZ 3.5Å; L270-R343 VanDerWaalsContact CB-NH2 3.34Å; L270-R343 PolarHBondContact O-NH2 3.04Å |
| 271 | P | 85.8 | Confident | 79.5 | Confident | 94 Ų | 94 | 88.5 Ų | 88.5 | 61% | 0.61 | 48% | 0.477 | S | S | * | . | P | Polyproline II helix | trans | -58.5 | 152.5 | -178.4 | 25.5 | -35.1 | 0 | 0 | 0 | 112.9 | R343 | P271-R343 PolarHBondContact O-NH1 2.8Å; P271-R343 PolarHBondContact O-NH2 2.76Å |
| 272 | P | 84.4 | Confident | 80 | Confident | 96 Ų | 96 | 89.3 Ų | 89.3 | 62% | 0.623 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -68.4 | 136 | 177.2 | 28.8 | -34.5 | 0 | 0 | 0 | 111.1 | N345 | P272-N345 WeakPolarHBondContact CA-OD1 3.48Š|
| 273 | I | 84.8 | Confident | 80.4 | Confident | 48 Ų | 48 | 86.3 Ų | 86.3 | 25% | 0.246 | 48% | 0.476 | C | S | . | . | P | Polyproline II helix | trans | -79.6 | 145.6 | 178.8 | -62.6 | 171.9 | 0 | 0 | 0 | 109.5 | R343 N345 | I273-R343 HydrophobicContact CD1-CB 3.58Å; I273-R343 HydrophobicContact CD1-CG 3.59Å; I273-R343 WeakPolarHBondContact CD1-O 3.46Å; I273-N345 PolarHBondContact N-OD1 3.41Å; I273-N345 PolarHBondContact O-ND2 3.3Å |
| 274 | H | 79.4 | Confident | 81.1 | Confident | 159 Ų | 159 | 85.7 Ų | 85.7 | 74% | 0.736 | 45% | 0.452 | S | S | * | . | P | Polyproline II helix | trans | -80.9 | 143.2 | 178 | -70.4 | 77.1 | 0 | 0 | 0 | 111.3 | L276 | H274-L276 PolarHBondContact O-N 3.38Š|
| 275 | Q | 74.8 | Confident | 81.5 | Confident | 88 Ų | 88 | 83.3 Ų | 83.3 | 41% | 0.411 | 44% | 0.443 | S | S | . | . | trans | -71.9 | 97.7 | 175.6 | 172.1 | 69.6 | 17.1 | 0 | 0 | 109.1 | E277 R353 | Q275-E277 HydrophobicContact CG-CG 4.13Å; Q275-E277 PolarHBondContact NE2-OE1 3Å; Q275-E277 VanDerWaalsContact NE2-OE1 3.1Å; Q275-R353 VanDerWaalsContact OE1-CZ 3.29Å | ||
| 276 | L | 77.9 | Confident | 82.2 | Confident | 50 Ų | 50 | 80.4 Ų | 80.4 | 26% | 0.262 | 43% | 0.432 | S | S | . | . | trans | -75.3 | 128.6 | 175.1 | -63.6 | 176.3 | 0 | 0 | 0 | 111 | H274 I278 V315 V324 | H274-L276 PolarHBondContact O-N 3.38Å; L276-I278 HydrophobicContact CD2-CD1 4.43Å; L276-V315 HydrophobicContact CD1-CG2 4.19Å; L276-V324 HydrophobicContact CB-CG1 4Å; L276-V324 HydrophobicContact CB-CG2 4.39Å; L276-V324 WeakPolarHBondContact O-CB 3.5Å | ||
| 277 | E | 76.7 | Confident | 82.7 | Confident | 157 Ų | 157 | 81.1 Ų | 81.1 | 73% | 0.734 | 43% | 0.434 | S | S | * | . | trans | -126.9 | 55.1 | 178.1 | -60.3 | -166.2 | 166 | 0 | 0 | 110.8 | Q275 | Q275-E277 HydrophobicContact CG-CG 4.13Å; Q275-E277 PolarHBondContact NE2-OE1 3Å; Q275-E277 VanDerWaalsContact NE2-OE1 3.1Å | ||
| 278 | I | 81.4 | Confident | 83.3 | Confident | 43 Ų | 43 | 78.5 Ų | 78.5 | 22% | 0.221 | 42% | 0.42 | C | S | . | . | trans | -88.7 | 131 | 178.2 | -56.4 | 167.9 | 0 | 0 | 0 | 109.1 | L276 V280 F317 V324 | L276-I278 HydrophobicContact CD2-CD1 4.43Å; I278-V280 HydrophobicContact CG2-CG2 4.39Å; I278-F317 HydrophobicContact CB-CE1 4.33Å; I278-F317 HydrophobicContact CG2-CE1 4.22Å; I278-F317 HydrophobicContact CG2-CZ 4.37Å; I278-V324 HydrophobicContact CB-CG2 3.9Å; I278-V324 VanDerWaalsContact N-CG2 3.28Å; I278-V324 WeakPolarHBondContact O-CG2 3.41Å | ||
| 279 | T | 82.7 | Confident | 84.2 | Confident | 109 Ų | 109 | 72.4 Ų | 72.4 | 67% | 0.669 | 39% | 0.388 | S | S | * | . | trans | -114.8 | 125.4 | 174 | 56.6 | 0 | 0 | 0 | 0 | 111.1 | G321 | T279-G321 WeakPolarHBondContact CA-O 3.37Š| ||
| 280 | V | 84.3 | Confident | 84.8 | Confident | 12 Ų | 12 | 72 Ų | 72 | 7% | 0.073 | 38% | 0.381 | C | S | . | . | trans | -109 | 141.7 | 179.5 | 176.5 | 0 | 0 | 0 | 0 | 109.5 | I278 E284 F317 G321 A364 T367 | I278-V280 HydrophobicContact CG2-CG2 4.39Å; V280-E284 HydrophobicContact CG1-CB 4.1Å; V280-F317 HydrophobicContact CB-CE1 4.42Å; V280-F317 HydrophobicContact CG2-CD1 4.37Å; V280-F317 HydrophobicContact CG2-CE1 3.63Å; V280-F317 HydrophobicContact CG2-CE2 4.07Å; V280-F317 HydrophobicContact CG2-CZ 3.46Å; V280-F317 VanDerWaalsContact CG2-CZ 3.46Å; V280-G321 PolarHBondContact N-O 3.21Å; V280-G321 CarbonylContact O-C 3.58Å; V280-G321 WeakPolarHBondContact O-CA 3.18Å; V280-A364 HydrophobicContact CB-CB 4.4Å; V280-A364 HydrophobicContact CG1-CB 3.81Å; V280-A364 HydrophobicContact CG2-CB 4.06Å; V280-T367 HydrophobicContact CG1-CG2 4.25Å; V280-T367 HydrophobicContact CG2-CG2 4.34Å | ||
| 281 | P | 83.6 | Confident | 85.4 | Confident | 71 Ų | 71 | 70.3 Ų | 70.3 | 46% | 0.461 | 37% | 0.372 | S | S | . | . | trans | -61.6 | 147.1 | 174.4 | 25.1 | -35.5 | 0 | 0 | 0 | 113.3 | D283 E284 C285 | P281-D283 PolarHBondContact O-N 3.06Å; P281-E284 HydrophobicContact CG-CB 4.33Å; P281-E284 HydrophobicContact CG-CG 3.91Å; P281-E284 PolarHBondContact O-N 2.9Å; P281-C285 PolarHBondContact O-SG 2.84Å | ||
| 282 | E | 84 | Confident | 85.8 | Confident | 79 Ų | 79 | 70.9 Ų | 70.9 | 37% | 0.369 | 37% | 0.367 | S | S | . | . | G | 310 helix | trans | -59.6 | -31.3 | -178.3 | -62.5 | -157.9 | 177 | 0 | 0 | 112.9 | E284 C285 K320 R322 | E282-E284 PolarHBondContact O-N 2.91Å; E282-E284 VanDerWaalsContact O-N 3.17Å; E282-C285 PolarHBondContact O-N 2.79Å; E282-K320 HydrophobicContact CB-CB 4.27Å; E282-K320 HydrophobicContact CB-CD 4.18Å; E282-K320 HydrophobicContact CG-CB 3.89Å; E282-K320 HydrophobicContact CG-CD 3.97Å; E282-K320 WeakPolarHBondContact OE2-CD 3.13Å; E282-K320 WeakPolarHBondContact OE2-CE 3.08Å; E282-K320 IonicContact OE2-NZ 2.66Å; E282-K320 PolarHBondContact OE2-NZ 3.31Å; E282-R322 IonicContact OE1-CZ 3.71Å; E282-R322 IonicContact OE1-NE 3.56Å; E282-R322 IonicContact OE1-NH2 3.64Å |
| 283 | D | 81.5 | Confident | 86.3 | Confident | 146 Ų | 146 | 68.2 Ų | 68.2 | 78% | 0.781 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -70.5 | -5.3 | -178.3 | -56.6 | -49.5 | 0 | 0 | 0 | 114.5 | P281 K366 | P281-D283 PolarHBondContact O-N 3.06Å; D283-K366 PolarHBondContact O-NZ 3.47Å |
| 284 | E | 85.1 | Confident | 86.7 | Confident | 65 Ų | 65 | 68.1 Ų | 68.1 | 30% | 0.304 | 35% | 0.35 | S | S | . | . | G | 310 helix | trans | -116 | -3.8 | 177.6 | -54.5 | -161 | 140.1 | 0 | 0 | 112.7 | V280 P281 E282 K366 | V280-E284 HydrophobicContact CG1-CB 4.1Å; P281-E284 HydrophobicContact CG-CB 4.33Å; P281-E284 HydrophobicContact CG-CG 3.91Å; P281-E284 PolarHBondContact O-N 2.9Å; E282-E284 PolarHBondContact O-N 2.91Å; E282-E284 VanDerWaalsContact O-N 3.17Å; E284-K366 HydrophobicContact CB-CD 4.01Å; E284-K366 HydrophobicContact CG-CD 3.76Å; E284-K366 WeakPolarHBondContact OE1-CD 3.47Å |
| 285 | C | 87.7 | Confident | 87.2 | Confident | 21 Ų | 21 | 63.9 Ų | 63.9 | 14% | 0.142 | 34% | 0.335 | C | S | . | . | P | Polyproline II helix | trans | -89.7 | 118 | -178.6 | -66.8 | 0 | 0 | 0 | 0 | 111.8 | P281 E282 K320 G321 Y362 C363 | P281-C285 PolarHBondContact O-SG 2.84Å; E282-C285 PolarHBondContact O-N 2.79Å; C285-K320 HydrophobicContact CB-CB 4.21Å; C285-G321 WeakPolarHBondContact SG-CA 3.46Å; C285-G321 PolarHBondContact SG-N 3.1Å; C285-G321 VanDerWaalsContact SG-N 3.43Å; C285-Y362 HydrophobicContact CB-CD1 4.38Å; C285-C363 WeakPolarHBondContact CA-O 3.33Å |
| 286 | V | 90.8 | Very high | 87.9 | Confident | 64 Ų | 64 | 65.9 Ų | 65.9 | 39% | 0.388 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.5 | 137.1 | 173.6 | 177.1 | 0 | 0 | 0 | 0 | 109.5 | L288 Y362 C363 P365 | V286-L288 PolarHBondContact O-N 3.25Å; V286-Y362 CarbonylContact O-C 3.53Å; V286-Y362 VanDerWaalsContact O-CA 3.24Å; V286-Y362 WeakPolarHBondContact O-CA 3.46Å; V286-C363 PolarHBondContact N-O 3.03Å; V286-C363 PolarHBondContact O-N 3.48Å; V286-P365 HydrophobicContact CB-CG 4.17Å; V286-P365 HydrophobicContact CG2-CG 3.6Å |
| 287 | E | 92.2 | Very high | 88.5 | Confident | 77 Ų | 77 | 64.8 Ų | 64.8 | 36% | 0.36 | 34% | 0.342 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 118.6 | 175.3 | -173.8 | 170.4 | 159.9 | 0 | 0 | 109.9 | L304 V360 Y362 | E287-L304 HydrophobicContact CG-CD1 3.93Å; E287-V360 HydrophobicContact CG-CG1 3.62Å; E287-Y362 HydrophobicContact CB-CD1 4.16Å; E287-Y362 HydrophobicContact CB-CE1 3.89Å; E287-Y362 HydrophobicContact CG-CE1 4.29Å |
| 288 | L | 91.4 | Very high | 89.3 | Confident | 1 Ų | 1 | 58.6 Ų | 58.6 | 1% | 0.005 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | -46.2 | -179.4 | 173.6 | 61.6 | 0 | 0 | 0 | 111.4 | V286 V303 L304 F310 L316 Y340 V361 C363 | V286-L288 PolarHBondContact O-N 3.25Å; L288-V303 HydrophobicContact CD1-CG1 3.94Å; L288-V303 HydrophobicContact CD1-CG2 4Å; L288-V303 HydrophobicContact CG-CG2 4.24Å; L288-L304 PolarHBondContact O-N 2.89Å; L288-F310 HydrophobicContact CD1-CD2 3.79Å; L288-F310 HydrophobicContact CD1-CE2 3.73Å; L288-L316 HydrophobicContact CD2-CD1 4.02Å; L288-L316 HydrophobicContact CD2-CD2 3.48Å; L288-L316 VanDerWaalsContact CD2-CD2 3.48Å; L288-L316 HydrophobicContact CD2-CG 4.39Å; L288-Y340 HydrophobicContact CD1-CE2 4.28Å; L288-Y340 HydrophobicContact CD2-CD2 4.1Å; L288-Y340 HydrophobicContact CD2-CE2 4.36Å; L288-V361 HydrophobicContact CD2-CG1 4.48Å; L288-V361 PolarHBondContact N-O 3.1Å; L288-C363 HydrophobicContact CB-CB 4.3Å; L288-C363 HydrophobicContact CD2-CB 4.48Å |
| 289 | G | 93.8 | Very high | 89.9 | Confident | 1 Ų | 1 | 56.6 Ų | 56.6 | 1% | 0.01 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 172.5 | -162.2 | -160.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | S302 V361 | G289-S302 CarbonylContact C-O 3.58Å; G289-S302 WeakPolarHBondContact CA-O 3.45Å; G289-V361 PolarHBondContact N-O 3Å; G289-V361 PolarHBondContact O-N 2.79Å |
| 290 | K | 95.1 | Very high | 90.5 | Very high | 93 Ų | 93 | 52.5 Ų | 52.5 | 40% | 0.404 | 28% | 0.278 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.3 | 149.9 | -177.9 | -61.1 | 179.9 | -175 | 172.9 | 0 | 110.7 | Q292 V301 S302 D359 V360 | K290-Q292 PolarHBondContact O-N 3.18Å; K290-Q292 VanDerWaalsContact O-N 3.12Å; K290-V301 CarbonylContact O-C 3.53Å; K290-V301 WeakPolarHBondContact O-CA 3.29Å; K290-S302 PolarHBondContact N-O 3.31Å; K290-S302 PolarHBondContact O-N 2.9Å; K290-S302 PolarHBondContact O-OG 2.88Å; K290-D359 VanDerWaalsContact CA-O 3.31Å; K290-D359 WeakPolarHBondContact CA-O 3.48Å; K290-V360 HydrophobicContact CG-CG2 4.37Å |
| 291 | V | 95.5 | Very high | 91 | Very high | 2 Ų | 2 | 52 Ų | 52 | 1% | 0.012 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.3 | 112.5 | 172 | 179.6 | 0 | 0 | 0 | 0 | 108.9 | I294 V299 L300 I355 K356 G358 D359 V361 | V291-I294 HydrophobicContact CG1-CG1 4.2Å; V291-V299 HydrophobicContact CB-CG1 4.47Å; V291-V299 HydrophobicContact CG1-CG1 3.64Å; V291-V299 HydrophobicContact CG2-CG1 4.07Å; V291-L300 CarbonylContact C-O 3.49Å; V291-I355 HydrophobicContact CG2-CG2 4.19Å; V291-K356 WeakPolarHBondContact CB-O 3.44Å; V291-G358 PolarHBondContact O-N 2.82Å; V291-D359 HydrophobicContact CG2-CB 4.35Å; V291-D359 PolarHBondContact N-O 3.15Å; V291-V361 HydrophobicContact CG2-CG2 3.85Å |
| 292 | Q | 94.3 | Very high | 91.5 | Very high | 107 Ų | 107 | 50.4 Ų | 50.4 | 50% | 0.5 | 27% | 0.265 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.2 | -42 | -179.4 | -168.7 | -168.1 | 59.2 | 0 | 0 | 111.6 | K290 L300 L339 I357 | K290-Q292 PolarHBondContact O-N 3.18Å; K290-Q292 VanDerWaalsContact O-N 3.12Å; Q292-L300 PolarHBondContact N-O 2.89Å; Q292-L339 HydrophobicContact CB-CD1 4.3Å; Q292-I357 WeakPolarHBondContact O-CG2 3.39Å |
| 293 | S | 94.4 | Very high | 92 | Very high | 40 Ų | 40 | 47.7 Ų | 47.7 | 28% | 0.28 | 25% | 0.254 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -160.5 | 166.1 | -175.7 | -169.9 | 0 | 0 | 0 | 0 | 111.1 | L300 | S293-L300 PolarHBondContact N-O 3.43Å; S293-L300 PolarHBondContact O-N 3.12Å |
| 294 | I | 93.3 | Very high | 92.4 | Very high | 45 Ų | 45 | 44 Ų | 44 | 23% | 0.231 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.7 | 121.3 | 175.9 | -53 | 178.7 | 0 | 0 | 0 | 106.5 | V291 V299 I350 I357 | V291-I294 HydrophobicContact CG1-CG1 4.2Å; I294-V299 HydrophobicContact CG1-CG2 4.43Å; I294-V299 HydrophobicContact CG2-CG2 4.32Å; I294-I350 HydrophobicContact CD1-CG2 3.95Å; I294-I350 HydrophobicContact CG2-CD1 3.84Å; I294-I350 HydrophobicContact CG2-CG2 4.13Å; I294-I357 HydrophobicContact CD1-CG1 4.32Å; I294-I357 HydrophobicContact CG1-CG1 4.12Å |
| 295 | V | 91.2 | Very high | 92.4 | Very high | 70 Ų | 70 | 45 Ų | 45 | 42% | 0.424 | 25% | 0.246 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.8 | 110.6 | -173.3 | -177.1 | 0 | 0 | 0 | 0 | 108.3 | Q297 L298 L300 | V295-Q297 PolarHBondContact O-N 2.84Å; V295-L298 PolarHBondContact N-O 3.05Å; V295-L298 PolarHBondContact O-N 3.08Å; V295-L300 HydrophobicContact CG2-CD1 3.87Å |
| 296 | D | 88.9 | Confident | 92.1 | Very high | 130 Ų | 130 | 52.1 Ų | 52.1 | 70% | 0.695 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.9 | -97.2 | -173 | -60.7 | -38.1 | 0 | 0 | 0 | 113.1 | N347 | D296-N347 VanDerWaalsContact O-CB 3.28Å; D296-N347 WeakPolarHBondContact O-CB 3.13Å; D296-N347 PolarHBondContact O-ND2 2.83Å |
| 297 | Q | 90.6 | Very high | 91.8 | Very high | 27 Ų | 27 | 50.6 Ų | 50.6 | 13% | 0.126 | 28% | 0.275 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -118.3 | 17.1 | 178.4 | 67.2 | -161.6 | -9.1 | 0 | 0 | 114 | D268 V295 F344 | D268-Q297 PolarHBondContact OD1-NE2 2.81Å; V295-Q297 PolarHBondContact O-N 2.84Å; Q297-F344 PolarHBondContact O-N 2.95Å |
| 298 | L | 93.1 | Very high | 91.5 | Very high | 28 Ų | 28 | 50.6 Ų | 50.6 | 15% | 0.147 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 140.4 | 171.3 | -56.2 | -176.4 | 0 | 0 | 0 | 110.7 | L267 V295 F329 V342 R343 | L267-L298 HydrophobicContact CD1-CD1 3.92Å; L267-L298 HydrophobicContact CD1-CD2 4.2Å; L267-L298 HydrophobicContact CD1-CG 3.96Å; L267-L298 HydrophobicContact CD2-CD2 4.36Å; V295-L298 PolarHBondContact N-O 3.05Å; V295-L298 PolarHBondContact O-N 3.08Å; L298-F329 HydrophobicContact CD2-CD1 4.37Å; L298-V342 CarbonylContact C-O 3.43Å; L298-V342 WeakPolarHBondContact CA-O 3.11Å; L298-R343 HydrophobicContact CD2-CB 3.63Å; L298-R343 HydrophobicContact CD2-CG 3.85Å |
| 299 | V | 94.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108 | 127.5 | 167.3 | 179.4 | 0 | 0 | 0 | 0 | 108.3 | V291 I294 V301 L325 V342 F344 I350 I355 | V291-V299 HydrophobicContact CB-CG1 4.47Å; V291-V299 HydrophobicContact CG1-CG1 3.64Å; V291-V299 HydrophobicContact CG2-CG1 4.07Å; I294-V299 HydrophobicContact CG1-CG2 4.43Å; I294-V299 HydrophobicContact CG2-CG2 4.32Å; V299-V301 HydrophobicContact CG1-CG2 4.45Å; V299-L325 HydrophobicContact CG1-CD1 4.48Å; V299-V342 PolarHBondContact N-O 2.78Å; V299-V342 PolarHBondContact O-N 3.45Å; V299-F344 HydrophobicContact CB-CE2 3.96Å; V299-F344 HydrophobicContact CG2-CD2 3.96Å; V299-F344 HydrophobicContact CG2-CE2 3.36Å; V299-F344 HydrophobicContact CG2-CZ 4.14Å; V299-I350 HydrophobicContact CG2-CD1 3.85Å; V299-I350 HydrophobicContact CG2-CG1 4.21Å; V299-I350 HydrophobicContact CG2-CG2 3.8Å; V299-I355 HydrophobicContact CG1-CG2 4.43Å |
| 300 | L | 95.3 | Very high | 91.2 | Very high | 24 Ų | 24 | 53.5 Ų | 53.5 | 13% | 0.126 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.5 | 121.3 | -178 | -58.2 | 179.1 | 0 | 0 | 0 | 109.6 | V291 Q292 S293 V295 L339 Y340 C341 | V291-L300 CarbonylContact C-O 3.49Å; Q292-L300 PolarHBondContact N-O 2.89Å; S293-L300 PolarHBondContact N-O 3.43Å; S293-L300 PolarHBondContact O-N 3.12Å; V295-L300 HydrophobicContact CG2-CD1 3.87Å; L300-L339 HydrophobicContact CB-CD1 4.16Å; L300-L339 HydrophobicContact CB-CD2 4.36Å; L300-L339 HydrophobicContact CB-CG 4.27Å; L300-L339 HydrophobicContact CD1-CD2 4.28Å; L300-L339 HydrophobicContact CD2-CD2 4.48Å; L300-Y340 WeakPolarHBondContact CA-O 3.25Å; L300-C341 HydrophobicContact CD2-CB 4.18Å; L300-C341 WeakPolarHBondContact CD2-SG 3.27Å |
| 301 | V | 95.5 | Very high | 91 | Very high | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 112.3 | -177.2 | -178.4 | 0 | 0 | 0 | 0 | 109.8 | K290 V299 L316 L325 Y340 V361 | K290-V301 CarbonylContact O-C 3.53Å; K290-V301 WeakPolarHBondContact O-CA 3.29Å; V299-V301 HydrophobicContact CG1-CG2 4.45Å; V301-L316 HydrophobicContact CG2-CD1 4.5Å; V301-L325 HydrophobicContact CG2-CD2 3.73Å; V301-Y340 PolarHBondContact N-O 3.2Å; V301-Y340 PolarHBondContact O-N 3.4Å; V301-V361 HydrophobicContact CG1-CB 3.86Å; V301-V361 HydrophobicContact CG1-CG1 4.08Å; V301-V361 HydrophobicContact CG1-CG2 3.76Å; V301-V361 HydrophobicContact CG2-CG2 4.02Å |
| 302 | S | 94 | Very high | 90.8 | Very high | 38 Ų | 38 | 54.5 Ų | 54.5 | 27% | 0.266 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.1 | 127.7 | 174.2 | 56 | 0 | 0 | 0 | 0 | 110.4 | G289 K290 | G289-S302 CarbonylContact C-O 3.58Å; G289-S302 WeakPolarHBondContact CA-O 3.45Å; K290-S302 PolarHBondContact N-O 3.31Å; K290-S302 PolarHBondContact O-N 2.9Å; K290-S302 PolarHBondContact O-OG 2.88Å |
| 303 | V | 93.1 | Very high | 90.5 | Very high | 22 Ų | 22 | 54 Ų | 54 | 13% | 0.133 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.2 | 153.9 | -175 | 176.7 | 0 | 0 | 0 | 0 | 111.9 | L288 P338 Y340 | L288-V303 HydrophobicContact CD1-CG1 3.94Å; L288-V303 HydrophobicContact CD1-CG2 4Å; L288-V303 HydrophobicContact CG-CG2 4.24Å; V303-P338 HydrophobicContact CB-CG 4.14Å; V303-P338 HydrophobicContact CG1-CG 4.4Å; V303-P338 HydrophobicContact CG2-CG 4Å; V303-P338 WeakPolarHBondContact CG2-O 3.36Å; V303-Y340 HydrophobicContact CG2-CD2 3.41Å; V303-Y340 VanDerWaalsContact CG2-CD2 3.41Å; V303-Y340 HydrophobicContact CG2-CE2 3.44Å; V303-Y340 VanDerWaalsContact CG2-CE2 3.44Å |
| 304 | L | 90.9 | Very high | 90.4 | Very high | 68 Ų | 68 | 52 Ų | 52 | 36% | 0.356 | 29% | 0.287 | S | S | . | . | P | Polyproline II helix | trans | -77.3 | 138.1 | 171.4 | -67.6 | 174.6 | 0 | 0 | 0 | 110.9 | E287 L288 N306 S307 | E287-L304 HydrophobicContact CG-CD1 3.93Å; L288-L304 PolarHBondContact O-N 2.89Å; L304-N306 PolarHBondContact O-N 2.89Å; L304-S307 WeakPolarHBondContact O-CB 3.48Å; L304-S307 PolarHBondContact O-N 2.86Å |
| 305 | P | 85.4 | Confident | 90.3 | Very high | 87 Ų | 87 | 50.2 Ų | 50.2 | 57% | 0.565 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | 137.7 | -179.8 | 26.3 | -34.8 | 0 | 0 | 0 | 111 | S307 | P305-S307 VanDerWaalsContact C-N 3.3Š|
| 306 | N | 81.2 | Confident | 90.3 | Very high | 170 Ų | 170 | 46.9 Ų | 46.9 | 91% | 0.909 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.1 | 15.2 | -170.9 | -37.9 | -89.7 | 0 | 0 | 0 | 115.4 | L304 | L304-N306 PolarHBondContact O-N 2.89Š|
| 307 | S | 83.4 | Confident | 90.5 | Very high | 32 Ų | 32 | 40.7 Ų | 40.7 | 22% | 0.224 | 23% | 0.225 | C | C | . | . | trans | -72.4 | 168.9 | 165.9 | -161.6 | 0 | 0 | 0 | 0 | 111.8 | L304 P305 | L304-S307 WeakPolarHBondContact O-CB 3.48Å; L304-S307 PolarHBondContact O-N 2.86Å; P305-S307 VanDerWaalsContact C-N 3.3Å | ||
| 308 | M | 86 | Confident | 90.6 | Very high | 78 Ų | 78 | 39.8 Ų | 39.8 | 38% | 0.384 | 22% | 0.221 | S | C | . | . | trans | -74.3 | 144.8 | 177.4 | -66.5 | -178.6 | -71.9 | 0 | 0 | 111.2 | F310 P365 F372 | M308-F310 HydrophobicContact CB-CE2 3.88Å; M308-F310 HydrophobicContact CB-CZ 3.92Å; M308-F310 HydrophobicContact CE-CZ 4.15Å; M308-F310 VanDerWaalsContact O-CD2 3.24Å; M308-F310 WeakPolarHBondContact O-CD2 3.49Å; M308-F310 VanDerWaalsContact O-CE2 3.28Å; M308-F310 WeakPolarHBondContact O-CE2 3.47Å; M308-P365 HydrophobicContact CE-CB 3.79Å; M308-P365 HydrophobicContact CE-CG 3.93Å; M308-F372 HydrophobicContact CB-CD1 4.46Å; M308-F372 HydrophobicContact CB-CE1 4.24Å; M308-F372 HydrophobicContact CE-CE1 4.29Å; M308-F372 HydrophobicContact SD-CE1 3.8Å | ||
| 309 | L | 88.5 | Confident | 90.4 | Very high | 58 Ų | 58 | 43.4 Ų | 43.4 | 30% | 0.304 | 24% | 0.237 | S | C | . | . | trans | -88.6 | 113 | 175.9 | -61.1 | -178.9 | 0 | 0 | 0 | 110.1 | V335 P338 V373 | L309-V335 HydrophobicContact CD1-CG1 4.03Å; L309-P338 HydrophobicContact CD2-CG 3.78Å; L309-V373 HydrophobicContact CB-CB 3.98Å; L309-V373 HydrophobicContact CB-CG2 4.35Å; L309-V373 PolarHBondContact O-N 3.33Å | ||
| 310 | F | 90.3 | Very high | 90.1 | Very high | 4 Ų | 4 | 47.5 Ų | 47.5 | 2% | 0.018 | 26% | 0.255 | C | S | . | . | B | Isolated β-bridge | trans | -91.2 | 144.2 | 174.3 | -61.9 | -80 | 0 | 0 | 0 | 110.9 | L288 M308 T314 Y340 C363 Q371 F372 V373 | L288-F310 HydrophobicContact CD1-CD2 3.79Å; L288-F310 HydrophobicContact CD1-CE2 3.73Å; M308-F310 HydrophobicContact CB-CE2 3.88Å; M308-F310 HydrophobicContact CB-CZ 3.92Å; M308-F310 HydrophobicContact CE-CZ 4.15Å; M308-F310 VanDerWaalsContact O-CD2 3.24Å; M308-F310 WeakPolarHBondContact O-CD2 3.49Å; M308-F310 VanDerWaalsContact O-CE2 3.28Å; M308-F310 WeakPolarHBondContact O-CE2 3.47Å; F310-T314 HydrophobicContact CB-CG2 3.9Å; F310-T314 HydrophobicContact CD1-CG2 4.32Å; F310-Y340 WeakPolarHBondContact CA-OH 3.48Å; F310-Y340 PolarHBondContact N-OH 2.99Å; F310-Y340 WeakPolarHBondContact O-CE1 3.19Å; F310-Y340 PolarHBondContact O-OH 3.03Å; F310-C363 HydrophobicContact CE1-CB 4.27Å; F310-C363 WeakPolarHBondContact CE1-SG 3.28Å; F310-C363 HydrophobicContact CE2-CB 4.04Å; F310-C363 HydrophobicContact CZ-CB 3.82Å; F310-C363 WeakPolarHBondContact CZ-SG 3.24Å; F310-Q371 WeakPolarHBondContact CA-O 3.14Å; F310-F372 HydrophobicContact CD1-CD1 4.19Å; F310-F372 HydrophobicContact CD1-CE1 4.11Å; F310-F372 AromaticContact CE1-CD1 3.94Å; F310-F372 HydrophobicContact CE1-CD1 3.94Å; F310-F372 AromaticContact CE1-CE1 3.41Å; F310-F372 HydrophobicContact CE1-CE1 3.41Å; F310-F372 VanDerWaalsContact CE1-CE1 3.41Å; F310-F372 HydrophobicContact CE1-CZ 4.01Å; F310-F372 AromaticContact CZ-CE1 3.95Å; F310-F372 HydrophobicContact CZ-CE1 3.95Å; F310-V373 WeakPolarHBondContact O-CG2 3.47Å |
| 311 | D | 90.9 | Very high | 89.5 | Confident | 46 Ų | 46 | 46.3 Ų | 46.3 | 25% | 0.246 | 25% | 0.249 | C | C | . | . | trans | -83.7 | -175.4 | 179.3 | -147.6 | -23.9 | 0 | 0 | 0 | 110.7 | T314 Q371 V373 | D311-T314 WeakPolarHBondContact O-CG2 3.44Å; D311-T314 PolarHBondContact O-OG1 2.91Å; D311-Q371 HydrophobicContact CB-CB 3.98Å; D311-Q371 PolarHBondContact N-O 3.2Å; D311-V373 HydrophobicContact CB-CG2 3.97Å | ||
| 312 | L | 90.8 | Very high | 89.1 | Confident | 70 Ų | 70 | 53.2 Ų | 53.2 | 37% | 0.366 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | 166.7 | 163.8 | -60.5 | 178.7 | 0 | 0 | 0 | 111.4 | T314 V328 V331 | L312-T314 PolarHBondContact O-N 3.17Å; L312-T314 VanDerWaalsContact O-N 3.1Å; L312-V328 HydrophobicContact CD2-CG1 4.3Å; L312-V331 HydrophobicContact CD2-CG2 3.93Å |
| 313 | D | 89 | Confident | 88.8 | Confident | 96 Ų | 96 | 54.7 Ų | 54.7 | 51% | 0.513 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58 | 24.9 | 177.9 | -49.5 | -19.7 | 0 | 0 | 0 | 113.5 | V328 | D313-V328 PolarHBondContact N-O 2.87Å; D313-V328 VanDerWaalsContact N-O 3.16Å |
| 314 | T | 91.3 | Very high | 88.7 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.272 | C | S | . | . | P | Polyproline II helix | trans | -93.4 | 132.6 | 176.5 | 48.7 | 0 | 0 | 0 | 0 | 111.8 | F310 D311 L312 E327 V328 Q371 | F310-T314 HydrophobicContact CB-CG2 3.9Å; F310-T314 HydrophobicContact CD1-CG2 4.32Å; D311-T314 WeakPolarHBondContact O-CG2 3.44Å; D311-T314 PolarHBondContact O-OG1 2.91Å; L312-T314 PolarHBondContact O-N 3.17Å; L312-T314 VanDerWaalsContact O-N 3.1Å; T314-E327 CarbonylContact O-C 3.54Å; T314-E327 WeakPolarHBondContact O-CA 3.35Å; T314-V328 PolarHBondContact O-N 3.18Å; T314-V328 WeakPolarHBondContact OG1-CB 3.39Å; T314-V328 WeakPolarHBondContact OG1-CG2 3.45Å; T314-Q371 HydrophobicContact CG2-CB 3.97Å; T314-Q371 WeakPolarHBondContact CG2-O 3.4Å |
| 315 | V | 91.8 | Very high | 88.7 | Confident | 6 Ų | 6 | 50.8 Ų | 50.8 | 4% | 0.036 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | 122 | -178.9 | -176 | 0 | 0 | 0 | 0 | 110.9 | L276 F317 V324 H369 | L276-V315 HydrophobicContact CD1-CG2 4.19Å; V315-F317 HydrophobicContact CB-CE2 4.19Å; V315-F317 HydrophobicContact CB-CZ 4.19Å; V315-F317 HydrophobicContact CG1-CE1 4.1Å; V315-F317 HydrophobicContact CG1-CE2 3.9Å; V315-F317 HydrophobicContact CG1-CZ 3.6Å; V315-F317 WeakPolarHBondContact O-CD2 3.17Å; V315-F317 WeakPolarHBondContact O-CE2 3.26Å; V315-V324 HydrophobicContact CG1-CG1 3.79Å; V315-H369 HydrophobicContact CB-CB 3.98Å; V315-H369 HydrophobicContact CG2-CB 3.86Å; V315-H369 PolarHBondContact N-O 3.08Å |
| 316 | L | 92.4 | Very high | 89 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 149.2 | 176.7 | -58 | -172.4 | 0 | 0 | 0 | 111.5 | L288 V301 L325 G326 V328 V342 V361 C363 | L288-L316 HydrophobicContact CD2-CD1 4.02Å; L288-L316 HydrophobicContact CD2-CD2 3.48Å; L288-L316 VanDerWaalsContact CD2-CD2 3.48Å; L288-L316 HydrophobicContact CD2-CG 4.39Å; V301-L316 HydrophobicContact CG2-CD1 4.5Å; L316-L325 HydrophobicContact CB-CB 4.13Å; L316-L325 HydrophobicContact CB-CD2 4.09Å; L316-L325 HydrophobicContact CD1-CD2 4.38Å; L316-L325 WeakPolarHBondContact O-CA 3.5Å; L316-L325 WeakPolarHBondContact O-CB 3.07Å; L316-L325 PolarHBondContact O-N 2.83Å; L316-G326 PolarHBondContact N-O 3.18Å; L316-G326 PolarHBondContact O-N 3.3Å; L316-V328 HydrophobicContact CD1-CG2 3.77Å; L316-V328 HydrophobicContact CD2-CG2 4.38Å; L316-V328 HydrophobicContact CG-CG2 3.9Å; L316-V342 HydrophobicContact CD1-CG2 3.99Å; L316-V361 HydrophobicContact CB-CG1 3.96Å; L316-V361 HydrophobicContact CD1-CG1 4.18Å; L316-C363 HydrophobicContact CD2-CB 4.35Å |
| 317 | F | 92.7 | Very high | 89.5 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 21% | 0.205 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 157.6 | -172.7 | -59.3 | -91 | 0 | 0 | 0 | 112.6 | I278 V280 V315 K323 V324 V361 Y362 A364 | I278-F317 HydrophobicContact CB-CE1 4.33Å; I278-F317 HydrophobicContact CG2-CE1 4.22Å; I278-F317 HydrophobicContact CG2-CZ 4.37Å; V280-F317 HydrophobicContact CB-CE1 4.42Å; V280-F317 HydrophobicContact CG2-CD1 4.37Å; V280-F317 HydrophobicContact CG2-CE1 3.63Å; V280-F317 HydrophobicContact CG2-CE2 4.07Å; V280-F317 HydrophobicContact CG2-CZ 3.46Å; V280-F317 VanDerWaalsContact CG2-CZ 3.46Å; V315-F317 HydrophobicContact CB-CE2 4.19Å; V315-F317 HydrophobicContact CB-CZ 4.19Å; V315-F317 HydrophobicContact CG1-CE1 4.1Å; V315-F317 HydrophobicContact CG1-CE2 3.9Å; V315-F317 HydrophobicContact CG1-CZ 3.6Å; V315-F317 WeakPolarHBondContact O-CD2 3.17Å; V315-F317 WeakPolarHBondContact O-CE2 3.26Å; F317-K323 CarbonylContact C-O 3.6Å; F317-K323 VanDerWaalsContact CA-O 3.29Å; F317-K323 WeakPolarHBondContact CA-O 3.16Å; F317-V324 HydrophobicContact CD1-CG2 4.3Å; F317-V324 HydrophobicContact CE1-CG2 4.05Å; F317-V361 WeakPolarHBondContact O-CA 3.24Å; F317-Y362 PolarHBondContact N-O 2.92Å; F317-Y362 PolarHBondContact O-N 3.28Å; F317-A364 HydrophobicContact CD2-CB 4.08Å; F317-A364 HydrophobicContact CE2-CB 3.61Å; F317-A364 HydrophobicContact CZ-CB 4.38Å |
| 318 | L | 91.9 | Very high | 90 | Very high | 8 Ų | 8 | 41 Ų | 41 | 4% | 0.042 | 20% | 0.195 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 165 | 170.2 | -67.2 | 172.2 | 0 | 0 | 0 | 109.8 | K320 G321 K323 L325 I355 D359 V360 V361 | L318-K320 PolarHBondContact O-N 3.08Å; L318-G321 PolarHBondContact O-N 2.84Å; L318-K323 HydrophobicContact CB-CB 4.31Å; L318-K323 PolarHBondContact N-O 2.96Å; L318-K323 PolarHBondContact O-N 3.33Å; L318-L325 HydrophobicContact CD1-CD1 3.96Å; L318-L325 HydrophobicContact CD2-CD1 4.47Å; L318-L325 HydrophobicContact CG-CB 4.25Å; L318-L325 HydrophobicContact CG-CD1 4.24Å; L318-I355 HydrophobicContact CD1-CG1 3.95Å; L318-D359 HydrophobicContact CD2-CB 4.31Å; L318-V360 WeakPolarHBondContact CD2-O 3.31Å; L318-V361 HydrophobicContact CD2-CG2 4.07Å |
| 319 | E | 89.8 | Confident | 90.3 | Very high | 105 Ų | 105 | 40.7 Ų | 40.7 | 49% | 0.491 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 54.7 | 28.4 | 173.8 | -60.1 | -177.8 | -147.8 | 0 | 0 | 114.4 | R322 | E319-R322 HydrophobicContact CB-CB 4.28Å; E319-R322 PolarHBondContact O-NE 2.87Å; E319-R322 PolarHBondContact O-NH2 2.74Å |
| 320 | K | 87.4 | Confident | 90.5 | Very high | 85 Ų | 85 | 41.2 Ų | 41.2 | 37% | 0.37 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 58.2 | 66.2 | -169.8 | -53.7 | 167 | 166.9 | -177 | 0 | 113.4 | E282 C285 L318 R322 Y362 | E282-K320 HydrophobicContact CB-CB 4.27Å; E282-K320 HydrophobicContact CB-CD 4.18Å; E282-K320 HydrophobicContact CG-CB 3.89Å; E282-K320 HydrophobicContact CG-CD 3.97Å; E282-K320 WeakPolarHBondContact OE2-CD 3.13Å; E282-K320 WeakPolarHBondContact OE2-CE 3.08Å; E282-K320 IonicContact OE2-NZ 2.66Å; E282-K320 PolarHBondContact OE2-NZ 3.31Å; C285-K320 HydrophobicContact CB-CB 4.21Å; L318-K320 PolarHBondContact O-N 3.08Å; K320-R322 PolarHBondContact O-N 2.8Å; K320-R322 VanDerWaalsContact O-N 3.08Å; K320-Y362 HydrophobicContact CG-CD1 4.23Å; K320-Y362 HydrophobicContact CG-CD2 4.42Å; K320-Y362 HydrophobicContact CG-CE1 3.85Å; K320-Y362 HydrophobicContact CG-CE2 4.02Å |
| 321 | G | 83.9 | Confident | 90.7 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 79.7 | -12.7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | T279 V280 C285 L318 K323 | T279-G321 WeakPolarHBondContact CA-O 3.37Å; V280-G321 PolarHBondContact N-O 3.21Å; V280-G321 CarbonylContact O-C 3.58Å; V280-G321 WeakPolarHBondContact O-CA 3.18Å; C285-G321 WeakPolarHBondContact SG-CA 3.46Å; C285-G321 PolarHBondContact SG-N 3.1Å; C285-G321 VanDerWaalsContact SG-N 3.43Å; L318-G321 PolarHBondContact O-N 2.84Å; G321-K323 PolarHBondContact O-N 2.81Å |
| 322 | R | 85.8 | Confident | 90.7 | Very high | 144 Ų | 144 | 45.3 Ų | 45.3 | 54% | 0.543 | 22% | 0.218 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -14.8 | 176.3 | -75.8 | 179.5 | -72.4 | 169 | -5.6 | 114.5 | E282 E319 K320 | E282-R322 IonicContact OE1-CZ 3.71Å; E282-R322 IonicContact OE1-NE 3.56Å; E282-R322 IonicContact OE1-NH2 3.64Å; E319-R322 HydrophobicContact CB-CB 4.28Å; E319-R322 PolarHBondContact O-NE 2.87Å; E319-R322 PolarHBondContact O-NH2 2.74Å; K320-R322 PolarHBondContact O-N 2.8Å; K320-R322 VanDerWaalsContact O-N 3.08Å |
| 323 | K | 88.8 | Confident | 90.8 | Very high | 70 Ų | 70 | 45.3 Ų | 45.3 | 30% | 0.304 | 24% | 0.235 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -148.2 | 134.9 | -178.2 | -170.8 | 175.5 | -153.1 | 166.9 | 0 | 111.3 | F317 L318 G321 R353 | F317-K323 CarbonylContact C-O 3.6Å; F317-K323 VanDerWaalsContact CA-O 3.29Å; F317-K323 WeakPolarHBondContact CA-O 3.16Å; L318-K323 HydrophobicContact CB-CB 4.31Å; L318-K323 PolarHBondContact N-O 2.96Å; L318-K323 PolarHBondContact O-N 3.33Å; G321-K323 PolarHBondContact O-N 2.81Å; K323-R353 WeakPolarHBondContact CE-O 3.47Å; K323-R353 PolarHBondContact NZ-O 2.78Å |
| 324 | V | 90.8 | Very high | 90.8 | Very high | 7 Ų | 7 | 47.3 Ų | 47.3 | 4% | 0.042 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -76.4 | 129.7 | 171.8 | -174.8 | 0 | 0 | 0 | 0 | 110.5 | L276 I278 V315 F317 R353 | L276-V324 HydrophobicContact CB-CG1 4Å; L276-V324 HydrophobicContact CB-CG2 4.39Å; L276-V324 WeakPolarHBondContact O-CB 3.5Å; I278-V324 HydrophobicContact CB-CG2 3.9Å; I278-V324 VanDerWaalsContact N-CG2 3.28Å; I278-V324 WeakPolarHBondContact O-CG2 3.41Å; V315-V324 HydrophobicContact CG1-CG1 3.79Å; F317-V324 HydrophobicContact CD1-CG2 4.3Å; F317-V324 HydrophobicContact CE1-CG2 4.05Å; V324-R353 PolarHBondContact O-NH1 2.91Å |
| 325 | L | 90.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76 | -57.7 | 162.5 | -177 | 67.4 | 0 | 0 | 0 | 108.9 | V299 V301 L316 L318 V342 F344 R353 I355 V361 | V299-L325 HydrophobicContact CG1-CD1 4.48Å; V301-L325 HydrophobicContact CG2-CD2 3.73Å; L316-L325 HydrophobicContact CB-CB 4.13Å; L316-L325 HydrophobicContact CB-CD2 4.09Å; L316-L325 HydrophobicContact CD1-CD2 4.38Å; L316-L325 WeakPolarHBondContact O-CA 3.5Å; L316-L325 WeakPolarHBondContact O-CB 3.07Å; L316-L325 PolarHBondContact O-N 2.83Å; L318-L325 HydrophobicContact CD1-CD1 3.96Å; L318-L325 HydrophobicContact CD2-CD1 4.47Å; L318-L325 HydrophobicContact CG-CB 4.25Å; L318-L325 HydrophobicContact CG-CD1 4.24Å; L325-V342 HydrophobicContact CD2-CG2 4.05Å; L325-V342 HydrophobicContact CG-CG1 4.44Å; L325-V342 HydrophobicContact CG-CG2 4.36Å; L325-F344 HydrophobicContact CD1-CZ 4.4Å; L325-F344 WeakPolarHBondContact O-CE1 3.48Å; L325-F344 WeakPolarHBondContact O-CZ 3.16Å; L325-R353 PolarHBondContact O-NH1 2.83Å; L325-I355 HydrophobicContact CD1-CD1 3.69Å; L325-I355 HydrophobicContact CD1-CG1 4.18Å; L325-I355 HydrophobicContact CD1-CG2 3.99Å; L325-V361 HydrophobicContact CD2-CG1 3.91Å; L325-V361 HydrophobicContact CD2-CG2 4.02Å |
| 326 | G | 91.4 | Very high | 90.3 | Very high | 7 Ų | 7 | 56.1 Ų | 56.1 | 7% | 0.072 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 157 | -171 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | L316 | L316-G326 PolarHBondContact N-O 3.18Å; L316-G326 PolarHBondContact O-N 3.3Å |
| 327 | E | 92.2 | Very high | 90.2 | Very high | 76 Ų | 76 | 60.2 Ų | 60.2 | 36% | 0.355 | 32% | 0.32 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.8 | 140.7 | 178.5 | -172.3 | 167.3 | -139.8 | 0 | 0 | 110.4 | T314 F329 | T314-E327 CarbonylContact O-C 3.54Å; T314-E327 WeakPolarHBondContact O-CA 3.35Å; E327-F329 PolarHBondContact O-N 3Å |
| 328 | V | 93.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.8 | 112.5 | 173.9 | 173 | 0 | 0 | 0 | 0 | 109.4 | L312 D313 T314 L316 V331 Y340 | L312-V328 HydrophobicContact CD2-CG1 4.3Å; D313-V328 PolarHBondContact N-O 2.87Å; D313-V328 VanDerWaalsContact N-O 3.16Å; T314-V328 PolarHBondContact O-N 3.18Å; T314-V328 WeakPolarHBondContact OG1-CB 3.39Å; T314-V328 WeakPolarHBondContact OG1-CG2 3.45Å; L316-V328 HydrophobicContact CD1-CG2 3.77Å; L316-V328 HydrophobicContact CD2-CG2 4.38Å; L316-V328 HydrophobicContact CG-CG2 3.9Å; V328-V331 HydrophobicContact CG1-CG2 4.05Å; V328-Y340 HydrophobicContact CB-CD1 4.49Å; V328-Y340 HydrophobicContact CG1-CD1 3.6Å; V328-Y340 HydrophobicContact CG1-CE1 4.26Å; V328-Y340 HydrophobicContact CG1-CG 4.44Å; V328-Y340 HydrophobicContact CG2-CD1 4.01Å; V328-Y340 HydrophobicContact CG2-CG 4.21Å |
| 329 | F | 93.6 | Very high | 90.3 | Very high | 73 Ų | 73 | 61.8 Ų | 61.8 | 32% | 0.32 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.6 | -32.1 | -179.7 | 169.1 | -101.6 | 0 | 0 | 0 | 112.8 | L267 L270 L298 E327 C341 R343 | L267-F329 HydrophobicContact CD2-CE1 3.83Å; L267-F329 HydrophobicContact CD2-CZ 4.08Å; L270-F329 HydrophobicContact CD1-CE2 3.69Å; L270-F329 HydrophobicContact CD1-CZ 3.5Å; L270-F329 VanDerWaalsContact CD1-CZ 3.5Å; L298-F329 HydrophobicContact CD2-CD1 4.37Å; E327-F329 PolarHBondContact O-N 3Å; F329-C341 PolarHBondContact N-O 2.72Å; F329-R343 HydrophobicContact CB-CB 3.79Å; F329-R343 HydrophobicContact CD1-CB 4.07Å; F329-R343 HydrophobicContact CD2-CB 4.26Å; F329-R343 HydrophobicContact CG-CB 3.75Å |
| 330 | D | 92.9 | Very high | 90.6 | Very high | 69 Ų | 69 | 56.9 Ų | 56.9 | 37% | 0.369 | 31% | 0.306 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -156 | 158 | -179.4 | -167.5 | 10.8 | 0 | 0 | 0 | 111.1 | C341 | D330-C341 HydrophobicContact CB-CB 3.97Å; D330-C341 PolarHBondContact N-O 2.74Å; D330-C341 WeakPolarHBondContact O-CB 3.37Å; D330-C341 PolarHBondContact O-N 3.46Å |
| 331 | V | 92.8 | Very high | 90.9 | Very high | 54 Ų | 54 | 52.9 Ų | 52.9 | 33% | 0.327 | 29% | 0.288 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.4 | 109.9 | -179.2 | -165.2 | 0 | 0 | 0 | 0 | 110.1 | L312 V328 P338 Y340 | L312-V331 HydrophobicContact CD2-CG2 3.93Å; V328-V331 HydrophobicContact CG1-CG2 4.05Å; V331-P338 HydrophobicContact CG1-CB 3.97Å; V331-Y340 HydrophobicContact CB-CD1 4.34Å; V331-Y340 HydrophobicContact CB-CE1 4.28Å; V331-Y340 HydrophobicContact CG1-CD1 3.91Å; V331-Y340 HydrophobicContact CG1-CE1 3.63Å; V331-Y340 HydrophobicContact CG2-CD1 3.83Å; V331-Y340 HydrophobicContact CG2-CE1 3.69Å |
| 332 | L | 92.6 | Very high | 91.4 | Very high | 82 Ų | 82 | 52.9 Ų | 52.9 | 43% | 0.429 | 29% | 0.288 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 169.2 | -179.7 | -57.4 | 179.4 | 0 | 0 | 0 | 111.3 | L339 | L332-L339 HydrophobicContact CB-CB 4.36Å; L332-L339 PolarHBondContact N-O 2.78Å; L332-L339 PolarHBondContact O-N 3.06Å |
| 333 | G | 91.9 | Very high | 91.7 | Very high | 70 Ų | 70 | 47 Ų | 47 | 72% | 0.722 | 27% | 0.266 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 96.4 | -149.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 334 | Q | 89.8 | Confident | 91.8 | Very high | 138 Ų | 138 | 43.9 Ų | 43.9 | 65% | 0.645 | 25% | 0.253 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 155.3 | -179.1 | -69 | -175.8 | 81.2 | 0 | 0 | 110.5 | S336 D337 P338 | Q334-S336 PolarHBondContact O-N 2.97Å; Q334-S336 VanDerWaalsContact O-N 3.17Å; Q334-D337 PolarHBondContact N-O 2.87Å; Q334-D337 CarbonylContact O-C 3.06Å; Q334-D337 PolarHBondContact O-N 2.86Å; Q334-P338 VanDerWaalsContact O-N 3.11Å |
| 335 | V | 85.2 | Confident | 91.8 | Very high | 115 Ų | 115 | 46.1 Ų | 46.1 | 70% | 0.697 | 27% | 0.265 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -23.9 | 179.1 | -175.1 | 0 | 0 | 0 | 0 | 112.5 | L309 | L309-V335 HydrophobicContact CD1-CG1 4.03Š|
| 336 | S | 87.1 | Confident | 91.7 | Very high | 75 Ų | 75 | 48.3 Ų | 48.3 | 52% | 0.524 | 28% | 0.28 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.4 | -32.9 | 171.9 | 55.2 | 0 | 0 | 0 | 0 | 113.7 | Q334 | Q334-S336 PolarHBondContact O-N 2.97Å; Q334-S336 VanDerWaalsContact O-N 3.17Å |
| 337 | D | 90.4 | Very high | 91.5 | Very high | 87 Ų | 87 | 51.2 Ų | 51.2 | 47% | 0.465 | 29% | 0.294 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.9 | 71.1 | -168.9 | -57.1 | -84.4 | 0 | 0 | 0 | 109.2 | Q334 | Q334-D337 PolarHBondContact N-O 2.87Å; Q334-D337 CarbonylContact O-C 3.06Å; Q334-D337 PolarHBondContact O-N 2.86Å |
| 338 | P | 92.3 | Very high | 91.3 | Very high | 10 Ų | 10 | 54.7 Ų | 54.7 | 7% | 0.065 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.9 | 153.4 | 180 | 30.6 | -36.3 | 0 | 0 | 0 | 111.8 | V303 L309 V331 Q334 Y340 | V303-P338 HydrophobicContact CB-CG 4.14Å; V303-P338 HydrophobicContact CG1-CG 4.4Å; V303-P338 HydrophobicContact CG2-CG 4Å; V303-P338 WeakPolarHBondContact CG2-O 3.36Å; L309-P338 HydrophobicContact CD2-CG 3.78Å; V331-P338 HydrophobicContact CG1-CB 3.97Å; Q334-P338 VanDerWaalsContact O-N 3.11Å; P338-Y340 HydrophobicContact CG-CE2 4.36Å |
| 339 | L | 94.4 | Very high | 91.1 | Very high | 31 Ų | 31 | 57.2 Ų | 57.2 | 16% | 0.162 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.8 | 101.5 | 177.7 | -173.3 | 71.4 | 0 | 0 | 0 | 108.5 | Q292 L300 L332 | Q292-L339 HydrophobicContact CB-CD1 4.3Å; L300-L339 HydrophobicContact CB-CD1 4.16Å; L300-L339 HydrophobicContact CB-CD2 4.36Å; L300-L339 HydrophobicContact CB-CG 4.27Å; L300-L339 HydrophobicContact CD1-CD2 4.28Å; L300-L339 HydrophobicContact CD2-CD2 4.48Å; L332-L339 HydrophobicContact CB-CB 4.36Å; L332-L339 PolarHBondContact N-O 2.78Å; L332-L339 PolarHBondContact O-N 3.06Å |
| 340 | Y | 95 | Very high | 90.8 | Very high | 2 Ų | 2 | 53.8 Ų | 53.8 | 1% | 0.008 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.9 | 132.4 | -178 | -70.9 | -61 | 0 | 0 | 0 | 111.4 | L288 L300 V301 V303 F310 V328 V331 P338 | L288-Y340 HydrophobicContact CD1-CE2 4.28Å; L288-Y340 HydrophobicContact CD2-CD2 4.1Å; L288-Y340 HydrophobicContact CD2-CE2 4.36Å; L300-Y340 WeakPolarHBondContact CA-O 3.25Å; V301-Y340 PolarHBondContact N-O 3.2Å; V301-Y340 PolarHBondContact O-N 3.4Å; V303-Y340 HydrophobicContact CG2-CD2 3.41Å; V303-Y340 VanDerWaalsContact CG2-CD2 3.41Å; V303-Y340 HydrophobicContact CG2-CE2 3.44Å; V303-Y340 VanDerWaalsContact CG2-CE2 3.44Å; F310-Y340 WeakPolarHBondContact CA-OH 3.48Å; F310-Y340 PolarHBondContact N-OH 2.99Å; F310-Y340 WeakPolarHBondContact O-CE1 3.19Å; F310-Y340 PolarHBondContact O-OH 3.03Å; V328-Y340 HydrophobicContact CB-CD1 4.49Å; V328-Y340 HydrophobicContact CG1-CD1 3.6Å; V328-Y340 HydrophobicContact CG1-CE1 4.26Å; V328-Y340 HydrophobicContact CG1-CG 4.44Å; V328-Y340 HydrophobicContact CG2-CD1 4.01Å; V328-Y340 HydrophobicContact CG2-CG 4.21Å; V331-Y340 HydrophobicContact CB-CD1 4.34Å; V331-Y340 HydrophobicContact CB-CE1 4.28Å; V331-Y340 HydrophobicContact CG1-CD1 3.91Å; V331-Y340 HydrophobicContact CG1-CE1 3.63Å; V331-Y340 HydrophobicContact CG2-CD1 3.83Å; V331-Y340 HydrophobicContact CG2-CE1 3.69Å; P338-Y340 HydrophobicContact CG-CE2 4.36Å |
| 341 | C | 94.7 | Very high | 90.6 | Very high | 1 Ų | 1 | 55.9 Ų | 55.9 | 1% | 0.007 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.4 | 118.6 | 178.2 | -56.6 | 0 | 0 | 0 | 0 | 109.8 | L300 F329 D330 | L300-C341 HydrophobicContact CD2-CB 4.18Å; L300-C341 WeakPolarHBondContact CD2-SG 3.27Å; F329-C341 PolarHBondContact N-O 2.72Å; D330-C341 HydrophobicContact CB-CB 3.97Å; D330-C341 PolarHBondContact N-O 2.74Å; D330-C341 WeakPolarHBondContact O-CB 3.37Å; D330-C341 PolarHBondContact O-N 3.46Å |
| 342 | V | 93.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.6 | 122 | 173 | 178.9 | 0 | 0 | 0 | 0 | 108.9 | L298 V299 L316 L325 F344 | L298-V342 CarbonylContact C-O 3.43Å; L298-V342 WeakPolarHBondContact CA-O 3.11Å; V299-V342 PolarHBondContact N-O 2.78Å; V299-V342 PolarHBondContact O-N 3.45Å; L316-V342 HydrophobicContact CD1-CG2 3.99Å; L325-V342 HydrophobicContact CD2-CG2 4.05Å; L325-V342 HydrophobicContact CG-CG1 4.44Å; L325-V342 HydrophobicContact CG-CG2 4.36Å; V342-F344 HydrophobicContact CB-CE2 4.16Å; V342-F344 HydrophobicContact CG1-CD2 4.41Å; V342-F344 HydrophobicContact CG1-CE2 3.61Å; V342-F344 HydrophobicContact CG1-CZ 3.91Å |
| 343 | R | 92.7 | Very high | 90.1 | Very high | 19 Ų | 19 | 57.3 Ų | 57.3 | 7% | 0.072 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 141.6 | -178.4 | -179.2 | 178.5 | 168.3 | -109.3 | -2.2 | 111.7 | L267 L270 P271 I273 L298 F329 | L267-R343 PolarHBondContact O-NE 3.38Å; L267-R343 PolarHBondContact O-NH2 2.99Å; L270-R343 VanDerWaalsContact CB-NH2 3.34Å; L270-R343 PolarHBondContact O-NH2 3.04Å; P271-R343 PolarHBondContact O-NH1 2.8Å; P271-R343 PolarHBondContact O-NH2 2.76Å; I273-R343 HydrophobicContact CD1-CB 3.58Å; I273-R343 HydrophobicContact CD1-CG 3.59Å; I273-R343 WeakPolarHBondContact CD1-O 3.46Å; L298-R343 HydrophobicContact CD2-CB 3.63Å; L298-R343 HydrophobicContact CD2-CG 3.85Å; F329-R343 HydrophobicContact CB-CB 3.79Å; F329-R343 HydrophobicContact CD1-CB 4.07Å; F329-R343 HydrophobicContact CD2-CB 4.26Å; F329-R343 HydrophobicContact CG-CB 3.75Å |
| 344 | F | 91.3 | Very high | 89.9 | Confident | 5 Ų | 5 | 55.6 Ų | 55.6 | 2% | 0.022 | 30% | 0.302 | C | S | . | . | trans | -124.1 | 163.7 | 174.7 | -64.6 | -98.7 | 0 | 0 | 0 | 110 | Q297 V299 L325 V342 S346 Q349 I350 I355 | Q297-F344 PolarHBondContact O-N 2.95Å; V299-F344 HydrophobicContact CB-CE2 3.96Å; V299-F344 HydrophobicContact CG2-CD2 3.96Å; V299-F344 HydrophobicContact CG2-CE2 3.36Å; V299-F344 HydrophobicContact CG2-CZ 4.14Å; L325-F344 HydrophobicContact CD1-CZ 4.4Å; L325-F344 WeakPolarHBondContact O-CE1 3.48Å; L325-F344 WeakPolarHBondContact O-CZ 3.16Å; V342-F344 HydrophobicContact CB-CE2 4.16Å; V342-F344 HydrophobicContact CG1-CD2 4.41Å; V342-F344 HydrophobicContact CG1-CE2 3.61Å; V342-F344 HydrophobicContact CG1-CZ 3.91Å; F344-S346 VanDerWaalsContact C-N 3.31Å; F344-Q349 HydrophobicContact CD1-CB 4.28Å; F344-I350 HydrophobicContact CB-CD1 4.31Å; F344-I350 HydrophobicContact CB-CG1 4Å; F344-I350 HydrophobicContact CD1-CG1 4.03Å; F344-I350 HydrophobicContact CD2-CD1 3.85Å; F344-I350 HydrophobicContact CD2-CG1 3.69Å; F344-I350 HydrophobicContact CE1-CG1 4.45Å; F344-I350 HydrophobicContact CE2-CD1 4.47Å; F344-I350 HydrophobicContact CE2-CG1 4.17Å; F344-I350 HydrophobicContact CG-CD1 4.14Å; F344-I350 HydrophobicContact CG-CG1 3.62Å; F344-I355 HydrophobicContact CE1-CD1 3.98Å; F344-I355 HydrophobicContact CZ-CD1 3.68Å | ||
| 345 | N | 89.9 | Confident | 89.9 | Confident | 55 Ų | 55 | 49.3 Ų | 49.3 | 29% | 0.294 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -81.5 | -12 | 178.8 | -59.8 | -23 | 0 | 0 | 0 | 113.3 | P272 I273 | P272-N345 WeakPolarHBondContact CA-OD1 3.48Å; I273-N345 PolarHBondContact N-OD1 3.41Å; I273-N345 PolarHBondContact O-ND2 3.3Å |
| 346 | S | 88.3 | Confident | 90.2 | Very high | 46 Ų | 46 | 49.8 Ų | 49.8 | 32% | 0.322 | 27% | 0.265 | S | S | . | . | trans | -169.1 | 146.7 | 175.9 | -171.9 | 0 | 0 | 0 | 0 | 110 | F344 K348 Q349 | F344-S346 VanDerWaalsContact C-N 3.31Å; S346-K348 PolarHBondContact O-N 3.04Å; S346-K348 PolarHBondContact OG-N 2.77Å; S346-Q349 WeakPolarHBondContact O-CB 3.45Å; S346-Q349 PolarHBondContact O-N 2.83Å | ||
| 347 | N | 88.1 | Confident | 90.5 | Very high | 67 Ų | 67 | 51.4 Ų | 51.4 | 36% | 0.358 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -49.1 | -32.7 | 168.5 | -172.2 | -97.8 | 0 | 0 | 0 | 113.1 | D296 Q349 I350 L351 | D296-N347 VanDerWaalsContact O-CB 3.28Å; D296-N347 WeakPolarHBondContact O-CB 3.13Å; D296-N347 PolarHBondContact O-ND2 2.83Å; N347-Q349 VanDerWaalsContact C-N 3.34Å; N347-Q349 PolarHBondContact O-N 3.23Å; N347-I350 WeakPolarHBondContact O-CB 3.15Å; N347-I350 PolarHBondContact O-N 3.16Å; N347-I350 VanDerWaalsContact O-N 3.09Å; N347-L351 PolarHBondContact O-N 2.86Å |
| 348 | K | 88.2 | Confident | 90.6 | Very high | 150 Ų | 150 | 49.4 Ų | 49.4 | 65% | 0.652 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -58 | -42.7 | 176.9 | -67.4 | -176.8 | 179.6 | 178.9 | 0 | 112.8 | S346 I350 L351 D352 | S346-K348 PolarHBondContact O-N 3.04Å; S346-K348 PolarHBondContact OG-N 2.77Å; K348-I350 PolarHBondContact O-N 3.02Å; K348-L351 CarbonylContact O-C 3.6Å; K348-L351 PolarHBondContact O-N 2.92Å; K348-L351 VanDerWaalsContact O-N 3.08Å; K348-D352 WeakPolarHBondContact O-CB 3.27Å; K348-D352 PolarHBondContact O-N 3.39Å; K348-D352 VanDerWaalsContact O-OD2 3.09Å |
| 349 | Q | 87.6 | Confident | 90.6 | Very high | 52 Ų | 52 | 51 Ų | 51 | 24% | 0.243 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.7 | -30.9 | 178.4 | -67.1 | -175.9 | -41.6 | 0 | 0 | 112.3 | F344 S346 N347 R353 | F344-Q349 HydrophobicContact CD1-CB 4.28Å; S346-Q349 WeakPolarHBondContact O-CB 3.45Å; S346-Q349 PolarHBondContact O-N 2.83Å; N347-Q349 VanDerWaalsContact C-N 3.34Å; N347-Q349 PolarHBondContact O-N 3.23Å; Q349-R353 VanDerWaalsContact O-CB 3.27Å; Q349-R353 WeakPolarHBondContact O-CB 3.38Å; Q349-R353 VanDerWaalsContact O-CG 3.25Å; Q349-R353 WeakPolarHBondContact O-CG 3.19Å; Q349-R353 PolarHBondContact O-N 2.8Å |
| 350 | I | 88.7 | Confident | 90.6 | Very high | 1 Ų | 1 | 51.7 Ų | 51.7 | 1% | 0.005 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -69.1 | -43.3 | 178.2 | -52.1 | 174.9 | 0 | 0 | 0 | 109.9 | I294 V299 F344 N347 K348 G354 I355 | I294-I350 HydrophobicContact CD1-CG2 3.95Å; I294-I350 HydrophobicContact CG2-CD1 3.84Å; I294-I350 HydrophobicContact CG2-CG2 4.13Å; V299-I350 HydrophobicContact CG2-CD1 3.85Å; V299-I350 HydrophobicContact CG2-CG1 4.21Å; V299-I350 HydrophobicContact CG2-CG2 3.8Å; F344-I350 HydrophobicContact CB-CD1 4.31Å; F344-I350 HydrophobicContact CB-CG1 4Å; F344-I350 HydrophobicContact CD1-CG1 4.03Å; F344-I350 HydrophobicContact CD2-CD1 3.85Å; F344-I350 HydrophobicContact CD2-CG1 3.69Å; F344-I350 HydrophobicContact CE1-CG1 4.45Å; F344-I350 HydrophobicContact CE2-CD1 4.47Å; F344-I350 HydrophobicContact CE2-CG1 4.17Å; F344-I350 HydrophobicContact CG-CD1 4.14Å; F344-I350 HydrophobicContact CG-CG1 3.62Å; N347-I350 WeakPolarHBondContact O-CB 3.15Å; N347-I350 PolarHBondContact O-N 3.16Å; N347-I350 VanDerWaalsContact O-N 3.09Å; K348-I350 PolarHBondContact O-N 3.02Å; I350-G354 PolarHBondContact O-N 3.19Å; I350-G354 VanDerWaalsContact O-N 3.15Å; I350-I355 HydrophobicContact CG2-CB 3.87Å; I350-I355 HydrophobicContact CG2-CD1 4.04Å; I350-I355 HydrophobicContact CG2-CG1 4.47Å; I350-I355 HydrophobicContact CG2-CG2 4.37Å; I350-I355 PolarHBondContact O-N 2.77Å; I350-I355 VanDerWaalsContact O-N 3.08Å |
| 351 | L | 88.8 | Confident | 90.6 | Very high | 114 Ų | 114 | 51.6 Ų | 51.6 | 60% | 0.597 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -70.2 | -41.2 | 176.2 | -61 | 174.4 | 0 | 0 | 0 | 112.6 | N347 K348 R353 G354 | N347-L351 PolarHBondContact O-N 2.86Å; K348-L351 CarbonylContact O-C 3.6Å; K348-L351 PolarHBondContact O-N 2.92Å; K348-L351 VanDerWaalsContact O-N 3.08Å; L351-R353 VanDerWaalsContact C-N 3.34Å; L351-G354 VanDerWaalsContact O-CA 3.29Å; L351-G354 WeakPolarHBondContact O-CA 3.1Å; L351-G354 PolarHBondContact O-N 2.92Å |
| 352 | D | 88.1 | Confident | 90.5 | Very high | 136 Ų | 136 | 53.4 Ų | 53.4 | 73% | 0.727 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -66.8 | -36.1 | 177.3 | -63.5 | -34.6 | 0 | 0 | 0 | 111.1 | K348 G354 | K348-D352 WeakPolarHBondContact O-CB 3.27Å; K348-D352 PolarHBondContact O-N 3.39Å; K348-D352 VanDerWaalsContact O-OD2 3.09Å; D352-G354 PolarHBondContact O-N 2.84Å |
| 353 | R | 85.4 | Confident | 90.3 | Very high | 29 Ų | 29 | 53.4 Ų | 53.4 | 11% | 0.109 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.8 | -6.8 | 167.4 | -70.6 | -175.4 | -172 | -167.9 | 24.2 | 113 | Q275 K323 V324 L325 Q349 L351 I355 | Q275-R353 VanDerWaalsContact OE1-CZ 3.29Å; K323-R353 WeakPolarHBondContact CE-O 3.47Å; K323-R353 PolarHBondContact NZ-O 2.78Å; V324-R353 PolarHBondContact O-NH1 2.91Å; L325-R353 PolarHBondContact O-NH1 2.83Å; Q349-R353 VanDerWaalsContact O-CB 3.27Å; Q349-R353 WeakPolarHBondContact O-CB 3.38Å; Q349-R353 VanDerWaalsContact O-CG 3.25Å; Q349-R353 WeakPolarHBondContact O-CG 3.19Å; Q349-R353 PolarHBondContact O-N 2.8Å; L351-R353 VanDerWaalsContact C-N 3.34Å; R353-I355 VanDerWaalsContact C-N 3.28Å; R353-I355 HydrophobicContact CB-CD1 3.86Å; R353-I355 HydrophobicContact CB-CG1 3.88Å; R353-I355 PolarHBondContact O-N 2.82Å |
| 354 | G | 87.6 | Confident | 90.2 | Very high | 35 Ų | 35 | 52.5 Ų | 52.5 | 36% | 0.361 | 28% | 0.283 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67.9 | 22.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115 | I350 L351 D352 K356 | I350-G354 PolarHBondContact O-N 3.19Å; I350-G354 VanDerWaalsContact O-N 3.15Å; L351-G354 VanDerWaalsContact O-CA 3.29Å; L351-G354 WeakPolarHBondContact O-CA 3.1Å; L351-G354 PolarHBondContact O-N 2.92Å; D352-G354 PolarHBondContact O-N 2.84Å; G354-K356 WeakPolarHBondContact O-CE 3.41Å; G354-K356 PolarHBondContact O-NZ 3.25Å |
| 355 | I | 90.1 | Very high | 89.9 | Confident | 5 Ų | 5 | 53.3 Ų | 53.3 | 3% | 0.026 | 29% | 0.289 | C | S | . | . | trans | -71.7 | 128.7 | -177 | -55.5 | 164.1 | 0 | 0 | 0 | 109 | V291 V299 L318 L325 F344 I350 R353 | V291-I355 HydrophobicContact CG2-CG2 4.19Å; V299-I355 HydrophobicContact CG1-CG2 4.43Å; L318-I355 HydrophobicContact CD1-CG1 3.95Å; L325-I355 HydrophobicContact CD1-CD1 3.69Å; L325-I355 HydrophobicContact CD1-CG1 4.18Å; L325-I355 HydrophobicContact CD1-CG2 3.99Å; F344-I355 HydrophobicContact CE1-CD1 3.98Å; F344-I355 HydrophobicContact CZ-CD1 3.68Å; I350-I355 HydrophobicContact CG2-CB 3.87Å; I350-I355 HydrophobicContact CG2-CD1 4.04Å; I350-I355 HydrophobicContact CG2-CG1 4.47Å; I350-I355 HydrophobicContact CG2-CG2 4.37Å; I350-I355 PolarHBondContact O-N 2.77Å; I350-I355 VanDerWaalsContact O-N 3.08Å; R353-I355 VanDerWaalsContact C-N 3.28Å; R353-I355 HydrophobicContact CB-CD1 3.86Å; R353-I355 HydrophobicContact CB-CG1 3.88Å; R353-I355 PolarHBondContact O-N 2.82Å | ||
| 356 | K | 91.6 | Very high | 89.4 | Confident | 125 Ų | 125 | 56.7 Ų | 56.7 | 54% | 0.543 | 30% | 0.301 | S | S | . | . | trans | -124.2 | 156.6 | 178.9 | -63.9 | 142.9 | -58 | -156.5 | 0 | 111.9 | V291 G354 G358 D359 | V291-K356 WeakPolarHBondContact CB-O 3.44Å; G354-K356 WeakPolarHBondContact O-CE 3.41Å; G354-K356 PolarHBondContact O-NZ 3.25Å; K356-G358 PolarHBondContact O-N 3.17Å; K356-D359 WeakPolarHBondContact CE-OD1 3.46Å; K356-D359 VanDerWaalsContact CE-OD2 3.23Å; K356-D359 WeakPolarHBondContact CE-OD2 3.37Å; K356-D359 PolarHBondContact N-OD2 2.93Å; K356-D359 WeakPolarHBondContact O-CB 3.27Å; K356-D359 PolarHBondContact O-N 2.87Å | ||
| 357 | I | 93.5 | Very high | 89 | Confident | 109 Ų | 109 | 55.9 Ų | 55.9 | 56% | 0.559 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | 130.2 | 169.1 | -60.7 | 170.9 | 0 | 0 | 0 | 108.8 | Q292 I294 | Q292-I357 WeakPolarHBondContact O-CG2 3.39Å; I294-I357 HydrophobicContact CD1-CG1 4.32Å; I294-I357 HydrophobicContact CG1-CG1 4.12Å |
| 358 | G | 92.4 | Very high | 88.7 | Confident | 45 Ų | 45 | 61.8 Ų | 61.8 | 46% | 0.464 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 93.2 | -9.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | V291 K356 | V291-G358 PolarHBondContact O-N 2.82Å; K356-G358 PolarHBondContact O-N 3.17Å |
| 359 | D | 93.3 | Very high | 88.2 | Confident | 45 Ų | 45 | 58.2 Ų | 58.2 | 24% | 0.241 | 31% | 0.305 | C | S | . | . | trans | -62.6 | 139.8 | 175.4 | -72.9 | -18.3 | 0 | 0 | 0 | 110.6 | K290 V291 L318 K356 | K290-D359 VanDerWaalsContact CA-O 3.31Å; K290-D359 WeakPolarHBondContact CA-O 3.48Å; V291-D359 HydrophobicContact CG2-CB 4.35Å; V291-D359 PolarHBondContact N-O 3.15Å; L318-D359 HydrophobicContact CD2-CB 4.31Å; K356-D359 WeakPolarHBondContact CE-OD1 3.46Å; K356-D359 VanDerWaalsContact CE-OD2 3.23Å; K356-D359 WeakPolarHBondContact CE-OD2 3.37Å; K356-D359 PolarHBondContact N-OD2 2.93Å; K356-D359 WeakPolarHBondContact O-CB 3.27Å; K356-D359 PolarHBondContact O-N 2.87Å | ||
| 360 | V | 93.9 | Very high | 88.1 | Confident | 44 Ų | 44 | 56.3 Ų | 56.3 | 27% | 0.267 | 30% | 0.297 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82 | 128 | -177.7 | -174.5 | 0 | 0 | 0 | 0 | 110.6 | E287 K290 L318 Y362 | E287-V360 HydrophobicContact CG-CG1 3.62Å; K290-V360 HydrophobicContact CG-CG2 4.37Å; L318-V360 WeakPolarHBondContact CD2-O 3.31Å; V360-Y362 HydrophobicContact CB-CE2 4.06Å; V360-Y362 HydrophobicContact CG1-CD2 4.49Å; V360-Y362 HydrophobicContact CG1-CE1 4.35Å; V360-Y362 HydrophobicContact CG1-CE2 3.74Å |
| 361 | V | 94.3 | Very high | 88 | Confident | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.8 | 136.1 | -177.5 | -175.7 | 0 | 0 | 0 | 0 | 109.8 | L288 G289 V291 V301 L316 F317 L318 L325 | L288-V361 HydrophobicContact CD2-CG1 4.48Å; L288-V361 PolarHBondContact N-O 3.1Å; G289-V361 PolarHBondContact N-O 3Å; G289-V361 PolarHBondContact O-N 2.79Å; V291-V361 HydrophobicContact CG2-CG2 3.85Å; V301-V361 HydrophobicContact CG1-CB 3.86Å; V301-V361 HydrophobicContact CG1-CG1 4.08Å; V301-V361 HydrophobicContact CG1-CG2 3.76Å; V301-V361 HydrophobicContact CG2-CG2 4.02Å; L316-V361 HydrophobicContact CB-CG1 3.96Å; L316-V361 HydrophobicContact CD1-CG1 4.18Å; F317-V361 WeakPolarHBondContact O-CA 3.24Å; L318-V361 HydrophobicContact CD2-CG2 4.07Å; L325-V361 HydrophobicContact CD2-CG1 3.91Å; L325-V361 HydrophobicContact CD2-CG2 4.02Å |
| 362 | Y | 92.7 | Very high | 88 | Confident | 39 Ų | 39 | 59.2 Ų | 59.2 | 15% | 0.153 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 150.8 | -179 | -62.5 | -89.4 | 0 | 0 | 0 | 110.3 | C285 V286 E287 F317 K320 V360 | C285-Y362 HydrophobicContact CB-CD1 4.38Å; V286-Y362 CarbonylContact O-C 3.53Å; V286-Y362 VanDerWaalsContact O-CA 3.24Å; V286-Y362 WeakPolarHBondContact O-CA 3.46Å; E287-Y362 HydrophobicContact CB-CD1 4.16Å; E287-Y362 HydrophobicContact CB-CE1 3.89Å; E287-Y362 HydrophobicContact CG-CE1 4.29Å; F317-Y362 PolarHBondContact N-O 2.92Å; F317-Y362 PolarHBondContact O-N 3.28Å; K320-Y362 HydrophobicContact CG-CD1 4.23Å; K320-Y362 HydrophobicContact CG-CD2 4.42Å; K320-Y362 HydrophobicContact CG-CE1 3.85Å; K320-Y362 HydrophobicContact CG-CE2 4.02Å; V360-Y362 HydrophobicContact CB-CE2 4.06Å; V360-Y362 HydrophobicContact CG1-CD2 4.49Å; V360-Y362 HydrophobicContact CG1-CE1 4.35Å; V360-Y362 HydrophobicContact CG1-CE2 3.74Å |
| 363 | C | 90.9 | Very high | 87.8 | Confident | 1 Ų | 1 | 54.6 Ų | 54.6 | 1% | 0.007 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 157 | 171.9 | -164.1 | 0 | 0 | 0 | 0 | 109.5 | C285 V286 L288 F310 L316 P365 T370 | C285-C363 WeakPolarHBondContact CA-O 3.33Å; V286-C363 PolarHBondContact N-O 3.03Å; V286-C363 PolarHBondContact O-N 3.48Å; L288-C363 HydrophobicContact CB-CB 4.3Å; L288-C363 HydrophobicContact CD2-CB 4.48Å; F310-C363 HydrophobicContact CE1-CB 4.27Å; F310-C363 WeakPolarHBondContact CE1-SG 3.28Å; F310-C363 HydrophobicContact CE2-CB 4.04Å; F310-C363 HydrophobicContact CZ-CB 3.82Å; F310-C363 WeakPolarHBondContact CZ-SG 3.24Å; L316-C363 HydrophobicContact CD2-CB 4.35Å; C363-P365 WeakPolarHBondContact O-CD 3.39Å; C363-T370 WeakPolarHBondContact SG-CG2 3.26Å |
| 364 | A | 89.8 | Confident | 87.9 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | trans | -115.4 | 64 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V280 F317 K366 T367 T370 | V280-A364 HydrophobicContact CB-CB 4.4Å; V280-A364 HydrophobicContact CG1-CB 3.81Å; V280-A364 HydrophobicContact CG2-CB 4.06Å; F317-A364 HydrophobicContact CD2-CB 4.08Å; F317-A364 HydrophobicContact CE2-CB 3.61Å; F317-A364 HydrophobicContact CZ-CB 4.38Å; A364-K366 PolarHBondContact O-N 3.08Å; A364-T367 HydrophobicContact CB-CG2 3.9Å; A364-T367 WeakPolarHBondContact CB-OG1 3.2Å; A364-T367 PolarHBondContact O-N 3.21Å; A364-T367 PolarHBondContact O-OG1 3.31Å; A364-T370 HydrophobicContact CB-CG2 4.37Å; A364-T370 WeakPolarHBondContact O-CG2 3.36Å; A364-T370 PolarHBondContact O-OG1 2.9Å | ||
| 365 | P | 83.9 | Confident | 87.7 | Confident | 21 Ų | 21 | 61.3 Ų | 61.3 | 14% | 0.136 | 31% | 0.311 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -2.3 | -165.1 | 25.6 | -37.8 | 0 | 0 | 0 | 117 | V286 M308 C363 T370 F372 | V286-P365 HydrophobicContact CB-CG 4.17Å; V286-P365 HydrophobicContact CG2-CG 3.6Å; M308-P365 HydrophobicContact CE-CB 3.79Å; M308-P365 HydrophobicContact CE-CG 3.93Å; C363-P365 WeakPolarHBondContact O-CD 3.39Å; P365-T370 WeakPolarHBondContact CA-OG1 3.48Å; P365-F372 HydrophobicContact CB-CE1 4.22Å; P365-F372 HydrophobicContact CB-CZ 3.62Å |
| 366 | K | 79.8 | Confident | 87.4 | Confident | 126 Ų | 126 | 64.5 Ų | 64.5 | 55% | 0.548 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.6 | -5.5 | 175.2 | -60.6 | 172.4 | -175.5 | 167 | 0 | 113 | D283 E284 A364 | D283-K366 PolarHBondContact O-NZ 3.47Å; E284-K366 HydrophobicContact CB-CD 4.01Å; E284-K366 HydrophobicContact CG-CD 3.76Å; E284-K366 WeakPolarHBondContact OE1-CD 3.47Å; A364-K366 PolarHBondContact O-N 3.08Å |
| 367 | T | 81.3 | Confident | 87.1 | Confident | 29 Ų | 29 | 64.4 Ų | 64.4 | 18% | 0.178 | 33% | 0.334 | C | S | . | . | S | Bend | trans | -101.8 | 153.8 | -172.6 | 67.3 | 0 | 0 | 0 | 0 | 111.5 | V280 A364 H369 T370 | V280-T367 HydrophobicContact CG1-CG2 4.25Å; V280-T367 HydrophobicContact CG2-CG2 4.34Å; A364-T367 HydrophobicContact CB-CG2 3.9Å; A364-T367 WeakPolarHBondContact CB-OG1 3.2Å; A364-T367 PolarHBondContact O-N 3.21Å; A364-T367 PolarHBondContact O-OG1 3.31Å; T367-H369 PolarHBondContact O-N 3.46Å; T367-T370 PolarHBondContact O-N 3.41Å; T367-T370 PolarHBondContact O-OG1 3.07Å; T367-T370 VanDerWaalsContact O-OG1 3.08Å |
| 368 | E | 80.7 | Confident | 86.6 | Confident | 192 Ų | 192 | 63.6 Ų | 63.6 | 90% | 0.897 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -13.4 | 174.9 | -63.2 | 171.2 | -167.4 | 0 | 0 | 113.3 | T370 | E368-T370 VanDerWaalsContact C-N 3.31Å; E368-T370 PolarHBondContact O-N 3.01Å |
| 369 | H | 77 | Confident | 86.1 | Confident | 74 Ų | 74 | 68.7 Ų | 68.7 | 34% | 0.343 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | 9.2 | -179.7 | -50.8 | -43.5 | 0 | 0 | 0 | 114 | V315 T367 | V315-H369 HydrophobicContact CB-CB 3.98Å; V315-H369 HydrophobicContact CG2-CB 3.86Å; V315-H369 PolarHBondContact N-O 3.08Å; T367-H369 PolarHBondContact O-N 3.46Å |
| 370 | T | 86.4 | Confident | 85.5 | Confident | 13 Ų | 13 | 74.2 Ų | 74.2 | 8% | 0.08 | 37% | 0.368 | C | S | . | . | trans | -129.7 | 115.5 | 178.2 | 58.4 | 0 | 0 | 0 | 0 | 112.4 | C363 A364 P365 T367 E368 | C363-T370 WeakPolarHBondContact SG-CG2 3.26Å; A364-T370 HydrophobicContact CB-CG2 4.37Å; A364-T370 WeakPolarHBondContact O-CG2 3.36Å; A364-T370 PolarHBondContact O-OG1 2.9Å; P365-T370 WeakPolarHBondContact CA-OG1 3.48Å; T367-T370 PolarHBondContact O-N 3.41Å; T367-T370 PolarHBondContact O-OG1 3.07Å; T367-T370 VanDerWaalsContact O-OG1 3.08Å; E368-T370 VanDerWaalsContact C-N 3.31Å; E368-T370 PolarHBondContact O-N 3.01Å | ||
| 371 | Q | 86.7 | Confident | 84.8 | Confident | 90 Ų | 90 | 77.2 Ų | 77.2 | 42% | 0.421 | 39% | 0.386 | S | S | . | . | trans | -99.6 | 144.9 | 172.3 | -57.5 | -171.5 | 67.6 | 0 | 0 | 110.9 | F310 D311 T314 | F310-Q371 WeakPolarHBondContact CA-O 3.14Å; D311-Q371 HydrophobicContact CB-CB 3.98Å; D311-Q371 PolarHBondContact N-O 3.2Å; T314-Q371 HydrophobicContact CG2-CB 3.97Å; T314-Q371 WeakPolarHBondContact CG2-O 3.4Å | ||
| 372 | F | 88.1 | Confident | 83.6 | Confident | 85 Ų | 85 | 88.5 Ų | 88.5 | 37% | 0.373 | 43% | 0.428 | S | S | . | . | B | Isolated β-bridge | trans | -112.4 | 140.2 | -177.1 | -65 | -83.3 | 0 | 0 | 0 | 112.4 | M308 F310 P365 I374 | M308-F372 HydrophobicContact CB-CD1 4.46Å; M308-F372 HydrophobicContact CB-CE1 4.24Å; M308-F372 HydrophobicContact CE-CE1 4.29Å; M308-F372 HydrophobicContact SD-CE1 3.8Å; F310-F372 HydrophobicContact CD1-CD1 4.19Å; F310-F372 HydrophobicContact CD1-CE1 4.11Å; F310-F372 AromaticContact CE1-CD1 3.94Å; F310-F372 HydrophobicContact CE1-CD1 3.94Å; F310-F372 AromaticContact CE1-CE1 3.41Å; F310-F372 HydrophobicContact CE1-CE1 3.41Å; F310-F372 VanDerWaalsContact CE1-CE1 3.41Å; F310-F372 HydrophobicContact CE1-CZ 4.01Å; F310-F372 AromaticContact CZ-CE1 3.95Å; F310-F372 HydrophobicContact CZ-CE1 3.95Å; P365-F372 HydrophobicContact CB-CE1 4.22Å; P365-F372 HydrophobicContact CB-CZ 3.62Å; F372-I374 PolarHBondContact O-N 3.49Å |
| 373 | V | 85.3 | Confident | 82.3 | Confident | 40 Ų | 40 | 89.6 Ų | 89.6 | 24% | 0.242 | 45% | 0.452 | C | S | . | . | trans | -75.2 | 99 | 175.1 | 179.5 | 0 | 0 | 0 | 0 | 110.2 | L309 F310 D311 L375 L378 | L309-V373 HydrophobicContact CB-CB 3.98Å; L309-V373 HydrophobicContact CB-CG2 4.35Å; L309-V373 PolarHBondContact O-N 3.33Å; F310-V373 WeakPolarHBondContact O-CG2 3.47Å; D311-V373 HydrophobicContact CB-CG2 3.97Å; V373-L375 PolarHBondContact O-N 3.28Å; V373-L378 HydrophobicContact CG1-CD1 3.47Å; V373-L378 VanDerWaalsContact CG1-CD1 3.47Å; V373-L378 HydrophobicContact CG1-CG 4.25Å | ||
| 374 | I | 86.4 | Confident | 81.2 | Confident | 98 Ų | 98 | 94 Ų | 94 | 50% | 0.503 | 48% | 0.482 | S | S | . | . | trans | -83.3 | 100.9 | 172.3 | -58.4 | 177.7 | 0 | 0 | 0 | 108.6 | F372 S376 K377 L378 | F372-I374 PolarHBondContact O-N 3.49Å; I374-S376 VanDerWaalsContact CG2-OG 3.32Å; I374-S376 WeakPolarHBondContact CG2-OG 3.27Å; I374-S376 PolarHBondContact O-N 2.91Å; I374-S376 VanDerWaalsContact O-N 3.14Å; I374-K377 HydrophobicContact CB-CB 4.16Å; I374-K377 HydrophobicContact CG2-CB 4.24Å; I374-K377 WeakPolarHBondContact O-CA 3.28Å; I374-K377 VanDerWaalsContact O-CB 3.27Å; I374-K377 WeakPolarHBondContact O-CB 3.33Å; I374-K377 PolarHBondContact O-N 3.07Å; I374-L378 PolarHBondContact O-N 3.22Å | ||
| 375 | L | 83 | Confident | 80 | Confident | 107 Ų | 107 | 101.6 Ų | 101.6 | 56% | 0.56 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -55.3 | -35.3 | -175.9 | -178.5 | 61 | 0 | 0 | 0 | 113.4 | V373 K377 L378 M379 | V373-L375 PolarHBondContact O-N 3.28Å; L375-K377 VanDerWaalsContact C-N 3.28Å; L375-K377 PolarHBondContact O-N 3.14Å; L375-L378 PolarHBondContact O-N 3.26Å; L375-M379 HydrophobicContact CD1-CG 4.4Å; L375-M379 HydrophobicContact CG-CG 4.42Å; L375-M379 HydrophobicContact CG-SD 4.24Å; L375-M379 WeakPolarHBondContact O-CG 3.49Å; L375-M379 PolarHBondContact O-N 3.38Å |
| 376 | S | 84.3 | Confident | 79.1 | Confident | 71 Ų | 71 | 103.3 Ų | 103.3 | 50% | 0.497 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.4 | -25 | 176.9 | 55.7 | 0 | 0 | 0 | 0 | 113.8 | I374 Q380 | I374-S376 VanDerWaalsContact CG2-OG 3.32Å; I374-S376 WeakPolarHBondContact CG2-OG 3.27Å; I374-S376 PolarHBondContact O-N 2.91Å; I374-S376 VanDerWaalsContact O-N 3.14Å; S376-Q380 WeakPolarHBondContact O-CG 3.32Å; S376-Q380 PolarHBondContact O-NE2 3.26Å |
| 377 | K | 85.3 | Confident | 78.4 | Confident | 124 Ų | 124 | 100.9 Ų | 100.9 | 54% | 0.539 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -72.9 | -47.7 | 170.6 | -176.5 | -172.2 | 174.2 | -166.3 | 0 | 109.8 | I374 L375 M379 Q380 V381 | I374-K377 HydrophobicContact CB-CB 4.16Å; I374-K377 HydrophobicContact CG2-CB 4.24Å; I374-K377 WeakPolarHBondContact O-CA 3.28Å; I374-K377 VanDerWaalsContact O-CB 3.27Å; I374-K377 WeakPolarHBondContact O-CB 3.33Å; I374-K377 PolarHBondContact O-N 3.07Å; L375-K377 VanDerWaalsContact C-N 3.28Å; L375-K377 PolarHBondContact O-N 3.14Å; K377-M379 VanDerWaalsContact C-N 3.32Å; K377-M379 PolarHBondContact O-N 2.92Å; K377-Q380 WeakPolarHBondContact O-CB 3.12Å; K377-Q380 PolarHBondContact O-N 3.2Å; K377-V381 PolarHBondContact O-N 3.47Å |
| 378 | L | 82.5 | Confident | 77.9 | Confident | 92 Ų | 92 | 105 Ų | 105 | 48% | 0.482 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -58.9 | -40.4 | 175.5 | -67.7 | -175 | 0 | 0 | 0 | 112.5 | V373 I374 L375 Q380 V381 | V373-L378 HydrophobicContact CG1-CD1 3.47Å; V373-L378 VanDerWaalsContact CG1-CD1 3.47Å; V373-L378 HydrophobicContact CG1-CG 4.25Å; I374-L378 PolarHBondContact O-N 3.22Å; L375-L378 PolarHBondContact O-N 3.26Å; L378-Q380 PolarHBondContact O-N 2.96Å; L378-V381 PolarHBondContact O-N 2.99Å; L378-V381 VanDerWaalsContact O-N 3.09Å |
| 379 | M | 81.9 | Confident | 77.3 | Confident | 152 Ų | 152 | 102.3 Ų | 102.3 | 75% | 0.749 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -17.9 | 177 | -71.7 | 179.3 | 71.5 | 0 | 0 | 114.3 | L375 K377 | L375-M379 HydrophobicContact CD1-CG 4.4Å; L375-M379 HydrophobicContact CG-CG 4.42Å; L375-M379 HydrophobicContact CG-SD 4.24Å; L375-M379 WeakPolarHBondContact O-CG 3.49Å; L375-M379 PolarHBondContact O-N 3.38Å; K377-M379 VanDerWaalsContact C-N 3.32Å; K377-M379 PolarHBondContact O-N 2.92Å |
| 380 | Q | 81.5 | Confident | 76.9 | Confident | 161 Ų | 161 | 103.1 Ų | 103.1 | 75% | 0.752 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.2 | -30.3 | 172.2 | -66.7 | 168.8 | 34 | 0 | 0 | 112 | S376 K377 L378 R382 | S376-Q380 WeakPolarHBondContact O-CG 3.32Å; S376-Q380 PolarHBondContact O-NE2 3.26Å; K377-Q380 WeakPolarHBondContact O-CB 3.12Å; K377-Q380 PolarHBondContact O-N 3.2Å; L378-Q380 PolarHBondContact O-N 2.96Å; Q380-R382 PolarHBondContact O-N 3.5Å |
| 381 | V | 78.3 | Confident | 76.1 | Confident | 106 Ų | 106 | 108.4 Ų | 108.4 | 64% | 0.642 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -77.8 | 75.8 | 176 | -175.3 | 0 | 0 | 0 | 0 | 109.4 | K377 L378 G383 | K377-V381 PolarHBondContact O-N 3.47Å; L378-V381 PolarHBondContact O-N 2.99Å; L378-V381 VanDerWaalsContact O-N 3.09Å; V381-G383 PolarHBondContact O-N 2.98Å |
| 382 | R | 69.3 | Low | 75.2 | Confident | 237 Ų | 237 | 108.1 Ų | 108.1 | 89% | 0.894 | 57% | 0.574 | S | S | * | * | trans | -73.5 | 90.6 | 176.1 | -173.6 | 177.8 | -177.9 | 168.6 | -0.2 | 110.6 | Q380 | Q380-R382 PolarHBondContact O-N 3.5Š| ||
| 383 | G | 66.4 | Low | 74.5 | Confident | 63 Ų | 63 | 111.3 Ų | 111.3 | 65% | 0.649 | 59% | 0.59 | S | S | * | * | trans | -60.9 | 156.8 | 166.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | V381 | V381-G383 PolarHBondContact O-N 2.98Š| ||
| 384 | S | 66.7 | Low | 74 | Confident | 92 Ų | 92 | 110.8 Ų | 110.8 | 64% | 0.643 | 59% | 0.587 | S | S | * | * | trans | -99.3 | 124.3 | 168.2 | -173.6 | 0 | 0 | 0 | 0 | 108.7 | A386 | S384-A386 PolarHBondContact O-N 2.91Š| ||
| 385 | D | 65.6 | Low | 73.5 | Confident | 161 Ų | 161 | 108.3 Ų | 108.3 | 86% | 0.861 | 58% | 0.577 | S | S | * | * | trans | -84.3 | 3.4 | 174.9 | 61.5 | -30 | 0 | 0 | 0 | 112.9 | S387 | D385-S387 PolarHBondContact O-N 3.09Š| ||
| 386 | A | 63.8 | Low | 72.9 | Confident | 57 Ų | 57 | 107.4 Ų | 107.4 | 47% | 0.471 | 59% | 0.585 | S | S | . | * | trans | -78.6 | 77.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S384 | S384-A386 PolarHBondContact O-N 2.91Š| ||
| 387 | S | 65.6 | Low | 72 | Confident | 75 Ų | 75 | 111 Ų | 111 | 52% | 0.524 | 59% | 0.588 | S | S | . | * | trans | -60.1 | 141.1 | 167.7 | 43 | 0 | 0 | 0 | 0 | 112.3 | D385 D391 | D385-S387 PolarHBondContact O-N 3.09Å; S387-D391 VanDerWaalsContact CB-OD1 3.28Å; S387-D391 WeakPolarHBondContact CB-OD1 3.38Å; S387-D391 PolarHBondContact OG-OD1 3.21Å | ||
| 388 | W | 70.4 | Confident | 71.2 | Confident | 116 Ų | 116 | 111.1 Ų | 111.1 | 44% | 0.439 | 59% | 0.586 | S | S | . | * | trans | -98.6 | -150.9 | 174 | -161.8 | 44.4 | 0 | 0 | 0 | 110.3 | H390 D391 V392 P394 P395 Y398 | W388-H390 PolarHBondContact O-N 3.2Å; W388-D391 PolarHBondContact O-N 3.37Å; W388-V392 WeakPolarHBondContact CA-O 3.5Å; W388-V392 WeakPolarHBondContact CB-O 3.47Å; W388-V392 PolarHBondContact N-O 3.23Å; W388-P394 HydrophobicContact CB-CB 4.02Å; W388-P394 HydrophobicContact CB-CG 4.5Å; W388-P394 HydrophobicContact CD2-CB 4.13Å; W388-P394 HydrophobicContact CG-CB 3.84Å; W388-P395 VanDerWaalsContact CE3-CD 3.43Å; W388-P395 HydrophobicContact CE3-CG 4.41Å; W388-P395 HydrophobicContact CH2-CG 4.28Å; W388-P395 HydrophobicContact CZ3-CG 3.8Å; W388-Y398 HydrophobicContact CH2-CD2 4.03Å; W388-Y398 HydrophobicContact CH2-CE2 4.15Å; W388-Y398 AromaticContact CZ2-CD2 3.74Å; W388-Y398 HydrophobicContact CZ2-CD2 3.74Å; W388-Y398 HydrophobicContact CZ2-CE2 4.06Å | ||
| 389 | E | 68.5 | Low | 70.9 | Confident | 134 Ų | 134 | 109.4 Ų | 109.4 | 63% | 0.626 | 58% | 0.579 | S | S | * | * | G | 310 helix | trans | -62.1 | 126.6 | 172 | -170.9 | 172 | -150.1 | 0 | 0 | 110.7 | ||
| 390 | H | 68.6 | Low | 70.2 | Confident | 92 Ų | 92 | 109.8 Ų | 109.8 | 43% | 0.426 | 58% | 0.584 | S | S | . | * | G | 310 helix | trans | 63.5 | 31.8 | -179.4 | -51.1 | -40.8 | 0 | 0 | 0 | 116.1 | V261 W388 V392 | V261-H390 HydrophobicContact CG1-CB 3.86Å; W388-H390 PolarHBondContact O-N 3.2Å; H390-V392 PolarHBondContact O-N 3.07Å; H390-V392 VanDerWaalsContact O-N 3.07Å |
| 391 | D | 70.3 | Confident | 69.9 | Low | 123 Ų | 123 | 104.3 Ų | 104.3 | 66% | 0.658 | 56% | 0.559 | S | S | * | * | G | 310 helix | trans | 59.9 | 18.1 | 178.3 | -57.4 | -55.8 | 0 | 0 | 0 | 115 | S387 W388 | S387-D391 VanDerWaalsContact CB-OD1 3.28Å; S387-D391 WeakPolarHBondContact CB-OD1 3.38Å; S387-D391 PolarHBondContact OG-OD1 3.21Å; W388-D391 PolarHBondContact O-N 3.37Å |
| 392 | V | 68.5 | Low | 69.4 | Low | 85 Ų | 85 | 105.5 Ų | 105.5 | 52% | 0.515 | 57% | 0.572 | S | S | . | * | P | Polyproline II helix | trans | -84.9 | 148.6 | 168.4 | -174.9 | 0 | 0 | 0 | 0 | 109.2 | W388 H390 | W388-V392 WeakPolarHBondContact CA-O 3.5Å; W388-V392 WeakPolarHBondContact CB-O 3.47Å; W388-V392 PolarHBondContact N-O 3.23Å; H390-V392 PolarHBondContact O-N 3.07Å; H390-V392 VanDerWaalsContact O-N 3.07Å |
| 393 | E | 73.1 | Confident | 69.9 | Low | 151 Ų | 151 | 98.6 Ų | 98.6 | 71% | 0.706 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 143.3 | 172.3 | -68.8 | -171.8 | 157.1 | 0 | 0 | 112.3 | P395 | E393-P395 WeakPolarHBondContact O-CD 3.33Š|
| 394 | P | 74.3 | Confident | 70.3 | Confident | 30 Ų | 30 | 101.2 Ų | 101.2 | 20% | 0.195 | 55% | 0.551 | C | S | . | * | P | Polyproline II helix | trans | -66 | 126.5 | 173.9 | 26.2 | -31.1 | 0 | 0 | 0 | 110.1 | W388 A396 V399 | W388-P394 HydrophobicContact CB-CB 4.02Å; W388-P394 HydrophobicContact CB-CG 4.5Å; W388-P394 HydrophobicContact CD2-CB 4.13Å; W388-P394 HydrophobicContact CG-CB 3.84Å; P394-A396 PolarHBondContact O-N 3.26Å; P394-V399 HydrophobicContact CG-CG2 4.22Å; P394-V399 WeakPolarHBondContact O-CG2 3.44Å |
| 395 | P | 75.2 | Confident | 71.1 | Confident | 45 Ų | 45 | 101.2 Ų | 101.2 | 29% | 0.292 | 54% | 0.541 | S | S | . | . | P | Polyproline II helix | trans | -57 | 138.9 | 178 | -26 | 33.5 | 0 | 0 | 0 | 111.3 | W388 E393 R397 Y398 | W388-P395 VanDerWaalsContact CE3-CD 3.43Å; W388-P395 HydrophobicContact CE3-CG 4.41Å; W388-P395 HydrophobicContact CH2-CG 4.28Å; W388-P395 HydrophobicContact CZ3-CG 3.8Å; E393-P395 WeakPolarHBondContact O-CD 3.33Å; P395-R397 PolarHBondContact O-N 3.37Å; P395-Y398 PolarHBondContact O-N 3.41Å |
| 396 | A | 70 | Confident | 71.8 | Confident | 88 Ų | 88 | 98.6 Ų | 98.6 | 73% | 0.727 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | 8.9 | -174.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | P394 | P394-A396 PolarHBondContact O-N 3.26Š|
| 397 | R | 67.3 | Low | 72.7 | Confident | 147 Ų | 147 | 99 Ų | 99 | 56% | 0.555 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.2 | -8.8 | 163.8 | 68.4 | -179.1 | -177.9 | -84.6 | -0.9 | 113.8 | P395 | P395-R397 PolarHBondContact O-N 3.37Š|
| 398 | Y | 68.1 | Low | 73.4 | Confident | 127 Ų | 127 | 101 Ų | 101 | 50% | 0.498 | 51% | 0.512 | S | S | . | . | S | Bend | trans | -130.6 | 9.9 | -179.7 | -55.4 | -49.7 | 0 | 0 | 0 | 112.4 | W388 P395 D400 | W388-Y398 HydrophobicContact CH2-CD2 4.03Å; W388-Y398 HydrophobicContact CH2-CE2 4.15Å; W388-Y398 AromaticContact CZ2-CD2 3.74Å; W388-Y398 HydrophobicContact CZ2-CD2 3.74Å; W388-Y398 HydrophobicContact CZ2-CE2 4.06Å; P395-Y398 PolarHBondContact O-N 3.41Å; Y398-D400 PolarHBondContact O-N 2.81Å |
| 399 | V | 75.1 | Confident | 74 | Confident | 56 Ų | 56 | 101.9 Ų | 101.9 | 34% | 0.339 | 52% | 0.521 | S | S | . | . | trans | -75.6 | 112.6 | 165.1 | 174.5 | 0 | 0 | 0 | 0 | 106.4 | P394 H401 | P394-V399 HydrophobicContact CG-CG2 4.22Å; P394-V399 WeakPolarHBondContact O-CG2 3.44Å; V399-H401 PolarHBondContact O-CD2 3.38Å; V399-H401 PolarHBondContact O-N 2.64Å | ||
| 400 | D | 68.4 | Low | 74.6 | Confident | 160 Ų | 160 | 97.1 Ų | 97.1 | 86% | 0.856 | 50% | 0.504 | S | S | * | . | trans | -84.5 | 107.4 | 173.3 | -77.5 | -29.7 | 0 | 0 | 0 | 108.6 | Y398 | Y398-D400 PolarHBondContact O-N 2.81Š| ||
| 401 | H | 73.9 | Confident | 75.1 | Confident | 46 Ų | 46 | 98.9 Ų | 98.9 | 21% | 0.213 | 51% | 0.507 | C | S | . | . | trans | -76.1 | 131.4 | -179.1 | -64.6 | -85.3 | 0 | 0 | 0 | 111 | V399 D403 E406 E407 A410 | V399-H401 PolarHBondContact O-CD2 3.38Å; V399-H401 PolarHBondContact O-N 2.64Å; H401-D403 VanDerWaalsContact C-N 3.34Å; H401-E406 HydrophobicContact CB-CB 4.31Å; H401-E406 IonicContact CE1-OE1 3.16Å; H401-E406 IonicContact CE1-OE2 2.75Å; H401-E406 IonicContact CG-OE2 3.44Å; H401-E406 WeakPolarHBondContact ND1-CG 3.43Å; H401-E406 IonicContact ND1-OE1 2.74Å; H401-E406 PolarHBondContact ND1-OE1 3.37Å; H401-E406 IonicContact ND1-OE2 2.72Å; H401-E406 PolarHBondContact ND1-OE2 3.46Å; H401-E407 HydrophobicContact CB-CB 4.05Å; H401-A410 WeakPolarHBondContact NE2-CB 3.18Å | ||
| 402 | S | 69.4 | Low | 75.6 | Confident | 131 Ų | 131 | 94.8 Ų | 94.8 | 92% | 0.916 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -85.6 | -7 | 177.8 | -171.3 | 0 | 0 | 0 | 0 | 113.6 | ||
| 403 | D | 79.4 | Confident | 76.3 | Confident | 92 Ų | 92 | 94.3 Ų | 94.3 | 49% | 0.492 | 48% | 0.483 | S | S | . | . | S | Bend | trans | -105.6 | 131.6 | 177.1 | -171.3 | -51.4 | 0 | 0 | 0 | 109.7 | H401 E405 E406 E407 | H401-D403 VanDerWaalsContact C-N 3.34Å; D403-E405 VanDerWaalsContact C-N 3.32Å; D403-E405 PolarHBondContact O-N 2.75Å; D403-E405 WeakPolarHBondContact OD1-CB 3.39Å; D403-E405 PolarHBondContact OD1-N 2.91Å; D403-E406 HydrophobicContact CB-CB 4.04Å; D403-E406 PolarHBondContact O-N 3.2Å; D403-E406 PolarHBondContact OD1-N 2.98Å; D403-E407 WeakPolarHBondContact O-CB 3.46Å; D403-E407 PolarHBondContact O-N 3.47Å |
| 404 | D | 75.3 | Confident | 76.7 | Confident | 117 Ų | 117 | 91.2 Ų | 91.2 | 63% | 0.626 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -8.4 | -174.9 | 82.1 | -89.6 | 0 | 0 | 0 | 114.5 | R408 | D404-R408 WeakPolarHBondContact O-CB 3.26Å; D404-R408 PolarHBondContact O-NE 3.44Å; D404-R408 PolarHBondContact O-NH2 3.29Å; D404-R408 IonicContact OD2-NH2 3.21Å; D404-R408 PolarHBondContact OD2-NH2 2.81Å |
| 405 | E | 83.1 | Confident | 77.1 | Confident | 93 Ų | 93 | 98.6 Ų | 98.6 | 44% | 0.435 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.4 | -45.5 | 164.7 | -160.9 | 65.3 | -115.9 | 0 | 0 | 110.3 | D403 E407 R408 E409 | D403-E405 VanDerWaalsContact C-N 3.32Å; D403-E405 PolarHBondContact O-N 2.75Å; D403-E405 WeakPolarHBondContact OD1-CB 3.39Å; D403-E405 PolarHBondContact OD1-N 2.91Å; E405-E407 PolarHBondContact O-N 3.14Å; E405-R408 WeakPolarHBondContact O-CA 3.45Å; E405-R408 WeakPolarHBondContact O-CB 3.44Å; E405-R408 PolarHBondContact O-N 2.7Å; E405-R408 IonicContact OE1-CZ 2.89Å; E405-R408 IonicContact OE1-NE 3.13Å; E405-R408 IonicContact OE1-NH1 3.09Å; E405-R408 PolarHBondContact OE1-NH1 3.24Å; E405-R408 IonicContact OE1-NH2 2.64Å; E405-R408 IonicContact OE2-CZ 3.79Å; E405-R408 IonicContact OE2-NH1 2.65Å; E405-R408 PolarHBondContact OE2-NH1 3.31Å; E405-R408 IonicContact OE2-NH2 2.89Å; E405-R408 PolarHBondContact OE2-NH2 3.16Å; E405-R408 VanDerWaalsContact OE2-NH2 3.09Å; E405-E409 PolarHBondContact O-N 3.34Å |
| 406 | E | 80.4 | Confident | 77.5 | Confident | 105 Ų | 105 | 101.2 Ų | 101.2 | 49% | 0.491 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.5 | -40.9 | -179.7 | -156.7 | -170.2 | -167.3 | 0 | 0 | 112 | H401 D403 R408 E409 A410 | H401-E406 HydrophobicContact CB-CB 4.31Å; H401-E406 IonicContact CE1-OE1 3.16Å; H401-E406 IonicContact CE1-OE2 2.75Å; H401-E406 IonicContact CG-OE2 3.44Å; H401-E406 WeakPolarHBondContact ND1-CG 3.43Å; H401-E406 IonicContact ND1-OE1 2.74Å; H401-E406 PolarHBondContact ND1-OE1 3.37Å; H401-E406 IonicContact ND1-OE2 2.72Å; H401-E406 PolarHBondContact ND1-OE2 3.46Å; D403-E406 HydrophobicContact CB-CB 4.04Å; D403-E406 PolarHBondContact O-N 3.2Å; D403-E406 PolarHBondContact OD1-N 2.98Å; E406-R408 PolarHBondContact O-N 3.46Å; E406-E409 PolarHBondContact O-N 3.39Å; E406-A410 WeakPolarHBondContact O-CB 3.45Å; E406-A410 PolarHBondContact O-N 3.48Å |
| 407 | E | 82.1 | Confident | 78.1 | Confident | 65 Ų | 65 | 105.1 Ų | 105.1 | 30% | 0.304 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.6 | -33.4 | 172.4 | -161.9 | -141 | -147.6 | 0 | 0 | 111.9 | H401 D403 E405 R411 | H401-E407 HydrophobicContact CB-CB 4.05Å; D403-E407 WeakPolarHBondContact O-CB 3.46Å; D403-E407 PolarHBondContact O-N 3.47Å; E405-E407 PolarHBondContact O-N 3.14Å; E407-R411 VanDerWaalsContact O-CB 3.25Å; E407-R411 WeakPolarHBondContact O-CB 3.11Å; E407-R411 WeakPolarHBondContact O-CD 3.41Å; E407-R411 WeakPolarHBondContact O-CG 3.25Å; E407-R411 PolarHBondContact O-N 3.06Å; E407-R411 IonicContact OE1-CZ 3.47Å; E407-R411 IonicContact OE1-NE 3.67Å; E407-R411 IonicContact OE1-NH1 3.74Å; E407-R411 PolarHBondContact OE1-NH1 3.47Å; E407-R411 IonicContact OE1-NH2 2.65Å; E407-R411 PolarHBondContact OE1-NH2 3.2Å; E407-R411 IonicContact OE2-CZ 2.7Å; E407-R411 IonicContact OE2-NE 3.68Å; E407-R411 IonicContact OE2-NH1 3.77Å; E407-R411 PolarHBondContact OE2-NH1 2.65Å; E407-R411 IonicContact OE2-NH2 3.31Å |
| 408 | R | 80.3 | Confident | 78.8 | Confident | 117 Ų | 117 | 105.5 Ų | 105.5 | 44% | 0.442 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -75.2 | -42.2 | -179.4 | -159 | -172.7 | -51 | 156.6 | 9.1 | 111.4 | D404 E405 E406 A412 | D404-R408 WeakPolarHBondContact O-CB 3.26Å; D404-R408 PolarHBondContact O-NE 3.44Å; D404-R408 PolarHBondContact O-NH2 3.29Å; D404-R408 IonicContact OD2-NH2 3.21Å; D404-R408 PolarHBondContact OD2-NH2 2.81Å; E405-R408 WeakPolarHBondContact O-CA 3.45Å; E405-R408 WeakPolarHBondContact O-CB 3.44Å; E405-R408 PolarHBondContact O-N 2.7Å; E405-R408 IonicContact OE1-CZ 2.89Å; E405-R408 IonicContact OE1-NE 3.13Å; E405-R408 IonicContact OE1-NH1 3.09Å; E405-R408 PolarHBondContact OE1-NH1 3.24Å; E405-R408 IonicContact OE1-NH2 2.64Å; E405-R408 IonicContact OE2-CZ 3.79Å; E405-R408 IonicContact OE2-NH1 2.65Å; E405-R408 PolarHBondContact OE2-NH1 3.31Å; E405-R408 IonicContact OE2-NH2 2.89Å; E405-R408 PolarHBondContact OE2-NH2 3.16Å; E405-R408 VanDerWaalsContact OE2-NH2 3.09Å; E406-R408 PolarHBondContact O-N 3.46Å; R408-A412 VanDerWaalsContact O-CB 3.28Å; R408-A412 WeakPolarHBondContact O-CB 3.32Å; R408-A412 PolarHBondContact O-N 3.04Å |
| 409 | E | 82.9 | Confident | 79.5 | Confident | 136 Ų | 136 | 105.9 Ų | 105.9 | 64% | 0.636 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.6 | -47.5 | 174.6 | -64.2 | -138.3 | 136.4 | 0 | 0 | 111.6 | E405 E406 R411 A412 E413 | E405-E409 PolarHBondContact O-N 3.34Å; E406-E409 PolarHBondContact O-N 3.39Å; E409-R411 VanDerWaalsContact C-N 3.34Å; E409-R411 PolarHBondContact O-N 3.48Å; E409-A412 CarbonylContact O-C 3.57Å; E409-A412 WeakPolarHBondContact O-CA 3.28Å; E409-A412 WeakPolarHBondContact O-CB 3.43Å; E409-A412 PolarHBondContact O-N 3.39Å; E409-E413 PolarHBondContact O-N 3Å |
| 410 | A | 80.5 | Confident | 79.8 | Confident | 33 Ų | 33 | 109.6 Ų | 109.6 | 27% | 0.273 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.1 | -44.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | H401 E406 A412 E413 Q414 | H401-A410 WeakPolarHBondContact NE2-CB 3.18Å; E406-A410 WeakPolarHBondContact O-CB 3.45Å; E406-A410 PolarHBondContact O-N 3.48Å; A410-A412 VanDerWaalsContact C-N 3.34Å; A410-A412 PolarHBondContact O-N 2.92Å; A410-E413 PolarHBondContact O-N 2.87Å; A410-Q414 WeakPolarHBondContact O-CB 3.43Å; A410-Q414 PolarHBondContact O-N 2.86Å |
| 411 | R | 78.9 | Confident | 80.2 | Confident | 130 Ų | 130 | 105.8 Ų | 105.8 | 49% | 0.491 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.9 | -34 | 172.7 | -76.9 | 174.4 | 172.1 | 166.8 | 8.2 | 112.8 | E407 E409 R415 | E407-R411 VanDerWaalsContact O-CB 3.25Å; E407-R411 WeakPolarHBondContact O-CB 3.11Å; E407-R411 WeakPolarHBondContact O-CD 3.41Å; E407-R411 WeakPolarHBondContact O-CG 3.25Å; E407-R411 PolarHBondContact O-N 3.06Å; E407-R411 IonicContact OE1-CZ 3.47Å; E407-R411 IonicContact OE1-NE 3.67Å; E407-R411 IonicContact OE1-NH1 3.74Å; E407-R411 PolarHBondContact OE1-NH1 3.47Å; E407-R411 IonicContact OE1-NH2 2.65Å; E407-R411 PolarHBondContact OE1-NH2 3.2Å; E407-R411 IonicContact OE2-CZ 2.7Å; E407-R411 IonicContact OE2-NE 3.68Å; E407-R411 IonicContact OE2-NH1 3.77Å; E407-R411 PolarHBondContact OE2-NH1 2.65Å; E407-R411 IonicContact OE2-NH2 3.31Å; E409-R411 VanDerWaalsContact C-N 3.34Å; E409-R411 PolarHBondContact O-N 3.48Å; R411-R415 WeakPolarHBondContact O-CB 3.23Å; R411-R415 WeakPolarHBondContact O-CD 3.19Å; R411-R415 WeakPolarHBondContact O-CG 3.49Å; R411-R415 PolarHBondContact O-N 2.84Å |
| 412 | A | 81.8 | Confident | 80.4 | Confident | 37 Ų | 37 | 112.8 Ų | 112.8 | 31% | 0.306 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69.3 | -45 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | R408 E409 A410 R415 K416 | R408-A412 VanDerWaalsContact O-CB 3.28Å; R408-A412 WeakPolarHBondContact O-CB 3.32Å; R408-A412 PolarHBondContact O-N 3.04Å; E409-A412 CarbonylContact O-C 3.57Å; E409-A412 WeakPolarHBondContact O-CA 3.28Å; E409-A412 WeakPolarHBondContact O-CB 3.43Å; E409-A412 PolarHBondContact O-N 3.39Å; A410-A412 VanDerWaalsContact C-N 3.34Å; A410-A412 PolarHBondContact O-N 2.92Å; A412-R415 WeakPolarHBondContact O-CB 3.42Å; A412-R415 PolarHBondContact O-N 3.19Å; A412-K416 WeakPolarHBondContact O-CG 3.35Å; A412-K416 PolarHBondContact O-N 2.66Å |
| 413 | E | 83.6 | Confident | 80.6 | Confident | 75 Ų | 75 | 110.4 Ų | 110.4 | 35% | 0.35 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -70.7 | -36.2 | 177 | -164.9 | 58 | -143.2 | 0 | 0 | 111.8 | E409 A410 R415 K416 R417 R420 | E409-E413 PolarHBondContact O-N 3Å; A410-E413 PolarHBondContact O-N 2.87Å; E413-R415 VanDerWaalsContact C-N 3.27Å; E413-R415 PolarHBondContact O-N 2.96Å; E413-K416 PolarHBondContact O-N 2.65Å; E413-K416 VanDerWaalsContact O-N 3.16Å; E413-K416 VanDerWaalsContact OE2-CD 3.23Å; E413-K416 WeakPolarHBondContact OE2-CD 3.17Å; E413-K416 WeakPolarHBondContact OE2-CE 3.47Å; E413-K416 IonicContact OE2-NZ 3.83Å; E413-K416 PolarHBondContact OE2-NZ 3.03Å; E413-R417 WeakPolarHBondContact O-CB 3.49Å; E413-R417 PolarHBondContact O-N 2.64Å; E413-R420 IonicContact OE1-CZ 2.66Å; E413-R420 IonicContact OE1-NH1 3.57Å; E413-R420 PolarHBondContact OE1-NH1 3.37Å; E413-R420 IonicContact OE1-NH2 3.6Å; E413-R420 PolarHBondContact OE1-NH2 2.94Å |
| 414 | Q | 80.4 | Confident | 79.7 | Confident | 85 Ų | 85 | 112.2 Ų | 112.2 | 40% | 0.397 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.9 | -38.3 | 171 | -163.5 | -162.5 | 93.7 | 0 | 0 | 111.6 | A410 R418 | A410-Q414 WeakPolarHBondContact O-CB 3.43Å; A410-Q414 PolarHBondContact O-N 2.86Å; Q414-R418 VanDerWaalsContact O-CG 3.26Å; Q414-R418 WeakPolarHBondContact O-CG 3.43Å; Q414-R418 PolarHBondContact O-N 3.29Å; Q414-R418 VanDerWaalsContact O-N 3.14Å |
| 415 | R | 82.3 | Confident | 78.9 | Confident | 186 Ų | 186 | 111.2 Ų | 111.2 | 70% | 0.702 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.1 | -44.4 | 172.4 | -73.3 | 167.8 | -176.7 | -173.5 | 3.3 | 112 | R411 A412 E413 R418 Q419 | R411-R415 WeakPolarHBondContact O-CB 3.23Å; R411-R415 WeakPolarHBondContact O-CD 3.19Å; R411-R415 WeakPolarHBondContact O-CG 3.49Å; R411-R415 PolarHBondContact O-N 2.84Å; A412-R415 WeakPolarHBondContact O-CB 3.42Å; A412-R415 PolarHBondContact O-N 3.19Å; E413-R415 VanDerWaalsContact C-N 3.27Å; E413-R415 PolarHBondContact O-N 2.96Å; R415-R418 PolarHBondContact O-N 3.09Å; R415-Q419 PolarHBondContact O-N 3.32Å |
| 416 | K | 85 | Confident | 77.7 | Confident | 100 Ų | 100 | 112.3 Ų | 112.3 | 44% | 0.435 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.3 | -46.4 | 175.8 | -74.1 | 179.5 | -112.8 | 159 | 0 | 111.5 | A412 E413 Q419 R420 | A412-K416 WeakPolarHBondContact O-CG 3.35Å; A412-K416 PolarHBondContact O-N 2.66Å; E413-K416 PolarHBondContact O-N 2.65Å; E413-K416 VanDerWaalsContact O-N 3.16Å; E413-K416 VanDerWaalsContact OE2-CD 3.23Å; E413-K416 WeakPolarHBondContact OE2-CD 3.17Å; E413-K416 WeakPolarHBondContact OE2-CE 3.47Å; E413-K416 IonicContact OE2-NZ 3.83Å; E413-K416 PolarHBondContact OE2-NZ 3.03Å; K416-Q419 WeakPolarHBondContact O-CB 3.31Å; K416-Q419 PolarHBondContact O-N 3.46Å; K416-Q419 VanDerWaalsContact O-N 3.11Å; K416-R420 PolarHBondContact O-N 3.42Å |
| 417 | R | 81.6 | Confident | 76.3 | Confident | 169 Ų | 169 | 114.1 Ų | 114.1 | 64% | 0.638 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -57.4 | -52.9 | 175.5 | -176.6 | 173.9 | 177.8 | 166.9 | 2.2 | 111.8 | E413 Q419 R420 D421 | E413-R417 WeakPolarHBondContact O-CB 3.49Å; E413-R417 PolarHBondContact O-N 2.64Å; R417-Q419 PolarHBondContact O-N 2.89Å; R417-R420 WeakPolarHBondContact O-CB 3.39Å; R417-R420 PolarHBondContact O-N 2.79Å; R417-D421 PolarHBondContact O-N 3.44Å |
| 418 | R | 82.6 | Confident | 74.8 | Confident | 156 Ų | 156 | 116 Ų | 116 | 59% | 0.589 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.4 | -16.2 | 177 | -66.3 | 173.1 | 82.1 | 175.9 | 7.6 | 113.8 | Q414 R415 R422 | Q414-R418 VanDerWaalsContact O-CG 3.26Å; Q414-R418 WeakPolarHBondContact O-CG 3.43Å; Q414-R418 PolarHBondContact O-N 3.29Å; Q414-R418 VanDerWaalsContact O-N 3.14Å; R415-R418 PolarHBondContact O-N 3.09Å; R418-R422 WeakPolarHBondContact O-CD 3.47Å; R418-R422 VanDerWaalsContact O-CG 3.31Å; R418-R422 WeakPolarHBondContact O-CG 3.5Å |
| 419 | Q | 81.8 | Confident | 73.4 | Confident | 134 Ų | 134 | 116.6 Ų | 116.6 | 63% | 0.626 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -83.9 | -44 | 169.5 | -174.7 | 174.3 | -14.3 | 0 | 0 | 111.9 | R415 K416 R417 D421 R422 T423 | R415-Q419 PolarHBondContact O-N 3.32Å; K416-Q419 WeakPolarHBondContact O-CB 3.31Å; K416-Q419 PolarHBondContact O-N 3.46Å; K416-Q419 VanDerWaalsContact O-N 3.11Å; R417-Q419 PolarHBondContact O-N 2.89Å; Q419-D421 PolarHBondContact O-N 2.99Å; Q419-R422 WeakPolarHBondContact O-CB 3.44Å; Q419-R422 PolarHBondContact O-N 3.44Å; Q419-T423 PolarHBondContact O-N 3.21Å; Q419-T423 VanDerWaalsContact O-N 3.11Å; Q419-T423 PolarHBondContact O-OG1 3.28Å |
| 420 | R | 81.8 | Confident | 71.5 | Confident | 134 Ų | 134 | 117 Ų | 117 | 51% | 0.506 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -58.2 | -45.9 | 173.4 | -65.2 | -178.3 | -172.5 | 116.1 | 0.4 | 111.6 | E413 K416 R417 R422 T423 N424 | E413-R420 IonicContact OE1-CZ 2.66Å; E413-R420 IonicContact OE1-NH1 3.57Å; E413-R420 PolarHBondContact OE1-NH1 3.37Å; E413-R420 IonicContact OE1-NH2 3.6Å; E413-R420 PolarHBondContact OE1-NH2 2.94Å; K416-R420 PolarHBondContact O-N 3.42Å; R417-R420 WeakPolarHBondContact O-CB 3.39Å; R417-R420 PolarHBondContact O-N 2.79Å; R420-R422 PolarHBondContact O-N 3.23Å; R420-T423 PolarHBondContact O-N 3.22Å; R420-T423 VanDerWaalsContact O-N 3.11Å; R420-T423 PolarHBondContact O-OG1 2.74Å; R420-N424 PolarHBondContact O-N 2.92Å; R420-N424 PolarHBondContact O-OD1 3.11Å |
| 421 | D | 77.6 | Confident | 69.8 | Low | 81 Ų | 81 | 122.2 Ų | 122.2 | 43% | 0.433 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -57.8 | -36.5 | 178.6 | -56.4 | -29.6 | 0 | 0 | 0 | 111.5 | R417 Q419 S425 | R417-D421 PolarHBondContact O-N 3.44Å; Q419-D421 PolarHBondContact O-N 2.99Å; D421-S425 PolarHBondContact O-N 2.97Å; D421-S425 PolarHBondContact O-OG 2.96Å |
| 422 | R | 76.7 | Confident | 68.1 | Low | 192 Ų | 192 | 122 Ų | 122 | 73% | 0.725 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -74.7 | -32.6 | 177.7 | -77 | 174.5 | 170 | -178.1 | -4.5 | 113.9 | R418 Q419 R420 | R418-R422 WeakPolarHBondContact O-CD 3.47Å; R418-R422 VanDerWaalsContact O-CG 3.31Å; R418-R422 WeakPolarHBondContact O-CG 3.5Å; Q419-R422 WeakPolarHBondContact O-CB 3.44Å; Q419-R422 PolarHBondContact O-N 3.44Å; R420-R422 PolarHBondContact O-N 3.23Å |
| 423 | T | 74.8 | Confident | 66.2 | Low | 81 Ų | 81 | 126.6 Ų | 126.6 | 50% | 0.497 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -79.2 | -34.6 | 177.6 | 50 | 0 | 0 | 0 | 0 | 112.4 | Q419 R420 S425 T426 | Q419-T423 PolarHBondContact O-N 3.21Å; Q419-T423 VanDerWaalsContact O-N 3.11Å; Q419-T423 PolarHBondContact O-OG1 3.28Å; R420-T423 PolarHBondContact O-N 3.22Å; R420-T423 VanDerWaalsContact O-N 3.11Å; R420-T423 PolarHBondContact O-OG1 2.74Å; T423-S425 VanDerWaalsContact C-N 3.27Å; T423-S425 PolarHBondContact O-N 2.97Å; T423-T426 PolarHBondContact O-OG1 3.05Å |
| 424 | N | 61 | Low | 64.1 | Low | 131 Ų | 131 | 128.6 Ų | 128.6 | 70% | 0.701 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -73.2 | -20.4 | 176.9 | -70.7 | 23.3 | 0 | 0 | 0 | 112.7 | R420 T426 | R420-N424 PolarHBondContact O-N 2.92Å; R420-N424 PolarHBondContact O-OD1 3.11Å; N424-T426 PolarHBondContact O-N 3.5Å |
| 425 | S | 57.8 | Low | 62.3 | Low | 96 Ų | 96 | 131.1 Ų | 131.1 | 67% | 0.671 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 4.6 | 178.1 | -63.6 | 0 | 0 | 0 | 0 | 114.8 | D421 T423 | D421-S425 PolarHBondContact O-N 2.97Å; D421-S425 PolarHBondContact O-OG 2.96Å; T423-S425 VanDerWaalsContact C-N 3.27Å; T423-S425 PolarHBondContact O-N 2.97Å |
| 426 | T | 57.2 | Low | 60.2 | Low | 115 Ų | 115 | 126.5 Ų | 126.5 | 71% | 0.706 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.4 | 12.4 | -175.1 | 60 | 0 | 0 | 0 | 0 | 115.2 | T423 N424 | T423-T426 PolarHBondContact O-OG1 3.05Å; N424-T426 PolarHBondContact O-N 3.5Å |
| 427 | D | 52.7 | Low | 57.9 | Low | 144 Ų | 144 | 128.8 Ų | 128.8 | 77% | 0.77 | 71% | 0.71 | S | S | * | * | trans | -105.2 | 85.2 | 177 | -168.9 | 17 | 0 | 0 | 0 | 111.2 | ||||
| 428 | S | 50.6 | Low | 56 | Low | 105 Ų | 105 | 127.4 Ų | 127.4 | 73% | 0.734 | 72% | 0.72 | S | S | * | * | trans | -166.7 | 37.5 | 171.5 | 31.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 429 | V | 50.6 | Low | 53.6 | Low | 128 Ų | 128 | 125 Ų | 125 | 78% | 0.776 | 73% | 0.734 | S | S | * | * | trans | -162.8 | 120.2 | 150.2 | -95.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 430 | D | 42.8 | Very low | 51.3 | Low | 146 Ų | 146 | 124.9 Ų | 124.9 | 78% | 0.781 | 74% | 0.742 | S | S | * | * | 169.7 | 75.5 | 122.7 | -90.8 | -16.4 | 0 | 0 | 0 | 111.6 | V432 | D430-V432 PolarHBondContact O-N 3.07Š| |||
| 431 | T | 43.6 | Very low | 49.2 | Very low | 142 Ų | 142 | 128.1 Ų | 128.1 | 87% | 0.871 | 76% | 0.76 | S | S | * | * | trans | -86.8 | 81.2 | 171.1 | -48.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 432 | V | 44.4 | Very low | 47.1 | Very low | 126 Ų | 126 | 128.7 Ų | 128.7 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | trans | -140 | 90.7 | 166.8 | -92.6 | 0 | 0 | 0 | 0 | 113.7 | D430 | D430-V432 PolarHBondContact O-N 3.07Š| ||
| 433 | T | 40.9 | Very low | 45.1 | Very low | 133 Ų | 133 | 124.9 Ų | 124.9 | 82% | 0.816 | 78% | 0.779 | S | S | * | * | trans | -11.7 | 126.2 | 142.6 | -49.8 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 434 | S | 40.2 | Very low | 43.4 | Very low | 116 Ų | 116 | 126 Ų | 126 | 81% | 0.811 | 79% | 0.79 | S | S | * | * | -169.8 | 139.2 | 125.3 | 35.3 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 435 | V | 42.2 | Very low | 42.4 | Very low | 138 Ų | 138 | 126.7 Ų | 126.7 | 84% | 0.836 | 80% | 0.798 | S | S | * | * | trans | -114.4 | 144.6 | 174.8 | -73.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 436 | A | 38.9 | Very low | 41.4 | Very low | 90 Ų | 90 | 126.6 Ų | 126.6 | 74% | 0.744 | 80% | 0.803 | S | S | * | * | trans | 35.5 | 127.7 | 158.4 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 437 | T | 36.2 | Very low | 40.9 | Very low | 148 Ų | 148 | 126.6 Ų | 126.6 | 91% | 0.908 | 81% | 0.805 | S | S | * | * | -171.2 | 166.5 | 114 | 20.6 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 438 | T | 41.3 | Very low | 40.7 | Very low | 139 Ų | 139 | 125.3 Ų | 125.3 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | trans | -101.3 | 129.2 | -174.7 | 52.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 439 | A | 32.8 | Very low | 40.5 | Very low | 106 Ų | 106 | 126.3 Ų | 126.3 | 88% | 0.876 | 81% | 0.809 | S | S | * | * | trans | -150.9 | 149.6 | 164.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 440 | T | 34.1 | Very low | 40 | Very low | 132 Ų | 132 | 131.8 Ų | 131.8 | 81% | 0.81 | 82% | 0.816 | S | S | * | * | trans | -72.2 | 137.5 | -166.7 | 48.4 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 441 | K | 37.3 | Very low | 40 | Very low | 202 Ų | 202 | 134.2 Ų | 134.2 | 88% | 0.878 | 82% | 0.822 | S | S | * | * | 55.5 | 103.3 | 125.6 | -169 | -170.7 | -177.7 | -177.5 | 0 | 119.6 | |||||
| 442 | A | 34.1 | Very low | 39.6 | Very low | 93 Ų | 93 | 139.7 Ų | 139.7 | 77% | 0.769 | 83% | 0.827 | S | S | * | * | 163.1 | 131.4 | 113.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 443 | S | 34.7 | Very low | 39.2 | Very low | 112 Ų | 112 | 136.2 Ų | 136.2 | 78% | 0.783 | 82% | 0.817 | S | S | * | * | trans | 32 | 111 | 143.7 | -161.5 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 444 | S | 37.7 | Very low | 39.1 | Very low | 105 Ų | 105 | 141 Ų | 141 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | 174.9 | 162.5 | 70.9 | 50.8 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 445 | V | 40.4 | Very low | 39 | Very low | 144 Ų | 144 | 147 Ų | 147 | 87% | 0.873 | 83% | 0.825 | S | S | * | * | trans | 46.6 | 94.9 | 165.3 | -168.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 446 | A | 37.5 | Very low | 38.8 | Very low | 94 Ų | 94 | 144.2 Ų | 144.2 | 78% | 0.777 | 82% | 0.824 | S | S | * | * | trans | -161.4 | 141 | 146.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 447 | P | 46.7 | Very low | 38.9 | Very low | 115 Ų | 115 | 148.4 Ų | 148.4 | 75% | 0.747 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -84 | 150.7 | 170 | 33.9 | -33.5 | 0 | 0 | 0 | 112.1 | ||
| 448 | P | 48.2 | Very low | 38.8 | Very low | 117 Ų | 117 | 152.7 Ų | 152.7 | 76% | 0.76 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 131.3 | -173 | 30 | -34.8 | 0 | 0 | 0 | 113.5 | ||
| 449 | P | 45.3 | Very low | 38.5 | Very low | 127 Ų | 127 | 154 Ų | 154 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 130.7 | 171.3 | 29.5 | -33.3 | 0 | 0 | 0 | 111 | Q451 | P449-Q451 PolarHBondContact O-N 3.41Š|
| 450 | R | 40.7 | Very low | 38.8 | Very low | 242 Ų | 242 | 153.2 Ų | 153.2 | 91% | 0.913 | 81% | 0.812 | S | S | * | * | trans | -84 | 114.3 | -178.1 | -64.2 | 171.2 | 69.6 | 168.8 | 3.3 | 110.5 | R452 | R450-R452 PolarHBondContact O-N 3.11Š| ||
| 451 | Q | 42.1 | Very low | 38.7 | Very low | 198 Ų | 198 | 155.8 Ų | 155.8 | 93% | 0.925 | 81% | 0.813 | S | S | * | * | trans | -56.1 | 131.7 | 167.3 | -71.7 | -176.1 | -13 | 0 | 0 | 110.5 | P449 | P449-Q451 PolarHBondContact O-N 3.41Š| ||
| 452 | R | 36.6 | Very low | 38.6 | Very low | 256 Ų | 256 | 158.5 Ų | 158.5 | 97% | 0.966 | 82% | 0.817 | S | S | * | * | trans | -113.9 | 76.3 | -174 | -162.7 | -178.8 | -166.7 | -137.1 | 4.1 | 111.8 | R450 | R450-R452 PolarHBondContact O-N 3.11Š| ||
| 453 | G | 36.4 | Very low | 38.7 | Very low | 54 Ų | 54 | 162.3 Ų | 162.3 | 56% | 0.557 | 82% | 0.819 | S | S | * | * | trans | -118.1 | 91.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 454 | R | 38.3 | Very low | 38.7 | Very low | 232 Ų | 232 | 162 Ų | 162 | 88% | 0.875 | 82% | 0.817 | S | S | * | * | trans | -151.9 | 128.1 | 162.6 | -71.2 | -57.7 | -178.4 | -109.6 | 12 | 106.4 | ||||
| 455 | R | 38.2 | Very low | 38.6 | Very low | 244 Ų | 244 | 166.4 Ų | 166.4 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | cis | 62.3 | 86.8 | 30.8 | -144.6 | -178.3 | -160.8 | -166.3 | 6.6 | 111.8 | ||||
| 456 | G | 36.8 | Very low | 38.4 | Very low | 79 Ų | 79 | 169.4 Ų | 169.4 | 81% | 0.814 | 82% | 0.822 | S | S | * | * | trans | -120.5 | 65.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 457 | Q | 42 | Very low | 38.5 | Very low | 177 Ų | 177 | 171.3 Ų | 171.3 | 83% | 0.827 | 83% | 0.826 | S | S | * | * | trans | -68.6 | 133.5 | 154.8 | -101 | -70.5 | 17.6 | 0 | 0 | 108 | ||||
| 458 | R | 34.2 | Very low | 37.9 | Very low | 238 Ų | 238 | 170 Ų | 170 | 90% | 0.898 | 82% | 0.819 | S | S | * | * | trans | -159.1 | 99.7 | 176.9 | -158.6 | 172.5 | -160.3 | -86.9 | -4.1 | 113.4 | ||||
| 459 | E | 33.8 | Very low | 37.1 | Very low | 167 Ų | 167 | 172.4 Ų | 172.4 | 78% | 0.78 | 82% | 0.824 | S | S | * | * | trans | -124.4 | 144.5 | 177.9 | -174.8 | 152.5 | -138.1 | 0 | 0 | 111.4 | ||||
| 460 | S | 40 | Very low | 36.5 | Very low | 90 Ų | 90 | 172.4 Ų | 172.4 | 63% | 0.629 | 82% | 0.817 | S | S | * | * | trans | 69.4 | 163.5 | 166.5 | 76.3 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 461 | F | 32.2 | Very low | 36.3 | Very low | 186 Ų | 186 | 167.9 Ų | 167.9 | 82% | 0.816 | 81% | 0.806 | S | S | * | * | trans | 53.8 | 95.3 | 171.5 | -63.3 | -77.5 | 0 | 0 | 0 | 120.6 | ||||
| 462 | R | 35.1 | Very low | 35.9 | Very low | 259 Ų | 259 | 165.2 Ų | 165.2 | 98% | 0.977 | 79% | 0.794 | S | S | * | * | -142.4 | 149.4 | 113.8 | -77 | -149.7 | 171.1 | -164.1 | -4.6 | 110.9 | |||||
| 463 | Q | 36.3 | Very low | 35.6 | Very low | 173 Ų | 173 | 158.1 Ų | 158.1 | 81% | 0.808 | 78% | 0.775 | S | S | * | * | trans | -113.4 | 150.4 | -169.5 | -168.1 | 175.8 | 9.6 | 0 | 0 | 111 | ||||
| 464 | S | 34.7 | Very low | 35.6 | Very low | 104 Ų | 104 | 162.7 Ų | 162.7 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | 49.3 | 114.1 | 159.3 | 58.8 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 465 | Q | 36.3 | Very low | 35.4 | Very low | 199 Ų | 199 | 158.6 Ų | 158.6 | 93% | 0.93 | 78% | 0.777 | S | S | * | * | -145.1 | 150.6 | 110.9 | -78.6 | -138.8 | 38.2 | 0 | 0 | 109.8 | |||||
| 466 | R | 34.4 | Very low | 35.4 | Very low | 207 Ų | 207 | 155.8 Ų | 155.8 | 78% | 0.781 | 78% | 0.775 | S | S | * | * | trans | -102.3 | 155.5 | 174.4 | -98.4 | -176.2 | 167.9 | -166.1 | -4.5 | 109.8 | ||||
| 467 | P | 39.9 | Very low | 35.7 | Very low | 134 Ų | 134 | 157.7 Ų | 157.7 | 87% | 0.87 | 77% | 0.773 | S | S | * | * | -107.9 | 177 | 110.2 | -17.3 | 33.6 | 0 | 0 | 0 | 113.4 | |||||
| 468 | S | 34.9 | Very low | 35.4 | Very low | 86 Ų | 86 | 157.5 Ų | 157.5 | 60% | 0.601 | 77% | 0.772 | S | S | * | * | trans | -143.3 | 137.4 | -179.8 | 179.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 469 | I | 31.7 | Very low | 35.5 | Very low | 168 Ų | 168 | 153.8 Ų | 153.8 | 86% | 0.862 | 77% | 0.77 | S | S | * | * | trans | -148.1 | 147.5 | 164.6 | -105.1 | 158.1 | 0 | 0 | 0 | 109.4 | ||||
| 470 | N | 32.4 | Very low | 35.6 | Very low | 127 Ų | 127 | 154.1 Ų | 154.1 | 68% | 0.679 | 77% | 0.771 | S | S | * | * | trans | -68 | 161.5 | -177.2 | -67.3 | -31.7 | 0 | 0 | 0 | 112.9 | ||||
| 471 | Q | 37 | Very low | 35.2 | Very low | 147 Ų | 147 | 159 Ų | 159 | 69% | 0.687 | 78% | 0.784 | S | S | * | * | cis | -162.2 | -147.5 | -15.1 | -106.5 | 179.9 | 50.9 | 0 | 0 | 106.4 | ||||
| 472 | H | 32.2 | Very low | 35.2 | Very low | 142 Ų | 142 | 160.9 Ų | 160.9 | 66% | 0.657 | 79% | 0.787 | S | S | * | * | cis | -165.1 | 161.7 | 11 | -164 | 56.1 | 0 | 0 | 0 | 112.5 | ||||
| 473 | N | 31.9 | Very low | 35.1 | Very low | 107 Ų | 107 | 154.8 Ų | 154.8 | 57% | 0.572 | 77% | 0.774 | S | S | * | * | trans | 52.9 | 126.1 | 159.3 | -107.1 | 2.5 | 0 | 0 | 0 | 124.4 | ||||
| 474 | Q | 36.3 | Very low | 34.8 | Very low | 150 Ų | 150 | 155 Ų | 155 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | 69.8 | 107.8 | 130 | -75.2 | 175.8 | 35.4 | 0 | 0 | 123.9 | |||||
| 475 | N | 33.9 | Very low | 34.9 | Very low | 147 Ų | 147 | 157.2 Ų | 157.2 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | 73.8 | 138.4 | 120.6 | -77.4 | 9 | 0 | 0 | 0 | 124.5 | |||||
| 476 | Q | 36.8 | Very low | 35.1 | Very low | 184 Ų | 184 | 152.8 Ų | 152.8 | 86% | 0.86 | 76% | 0.76 | S | S | * | * | trans | 76.6 | 141.8 | 165.5 | -65.9 | -158.5 | 13 | 0 | 0 | 119 | ||||
| 477 | P | 44.2 | Very low | 35.3 | Very low | 119 Ų | 119 | 148.6 Ų | 148.6 | 77% | 0.773 | 76% | 0.763 | S | S | * | * | trans | -92.3 | 161.1 | 174 | 38.8 | -34.4 | 0 | 0 | 0 | 111.6 | ||||
| 478 | Q | 34.9 | Very low | 35.1 | Very low | 174 Ų | 174 | 153.4 Ų | 153.4 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | trans | -148.7 | 132.3 | 161.6 | -169.6 | 167.7 | -8.4 | 0 | 0 | 109.2 | ||||
| 479 | D | 37.6 | Very low | 35.2 | Very low | 160 Ų | 160 | 156.1 Ų | 156.1 | 86% | 0.856 | 77% | 0.773 | S | S | * | * | trans | -75.7 | 132.7 | 173.9 | -57.8 | -80.4 | 0 | 0 | 0 | 110.4 | ||||
| 480 | E | 34.2 | Very low | 35.9 | Very low | 173 Ų | 173 | 154.4 Ų | 154.4 | 81% | 0.808 | 77% | 0.773 | S | S | * | * | trans | -131.2 | 138 | 163.1 | -73.5 | -159.9 | 143.8 | 0 | 0 | 111 | ||||
| 481 | Q | 33.3 | Very low | 36.2 | Very low | 193 Ų | 193 | 151 Ų | 151 | 90% | 0.902 | 77% | 0.767 | S | S | * | * | trans | -82 | 130.9 | -172.3 | -61.7 | 167.8 | -64.7 | 0 | 0 | 110.6 | N483 | Q481-N483 PolarHBondContact O-N 2.89Š| ||
| 482 | Y | 31.6 | Very low | 36.2 | Very low | 225 Ų | 225 | 148.3 Ų | 148.3 | 88% | 0.882 | 76% | 0.764 | S | S | * | * | trans | -73.3 | 95.1 | 179.9 | -112.2 | -97.6 | 0 | 0 | 0 | 111.8 | F484 | Y482-F484 PolarHBondContact O-N 3.27Š| ||
| 483 | N | 32.2 | Very low | 36.8 | Very low | 132 Ų | 132 | 153.1 Ų | 153.1 | 71% | 0.706 | 78% | 0.777 | S | S | * | * | trans | -81.9 | 97.6 | 177.9 | -157.7 | 59.6 | 0 | 0 | 0 | 110.8 | Q481 H485 | Q481-N483 PolarHBondContact O-N 2.89Å; N483-H485 PolarHBondContact ND2-NE2 3.44Å; N483-H485 PolarHBondContact O-N 2.95Å | ||
| 484 | F | 30.2 | Very low | 37.2 | Very low | 176 Ų | 176 | 156.1 Ų | 156.1 | 77% | 0.772 | 79% | 0.787 | S | S | * | * | trans | -84.1 | 102.8 | -168.4 | -158.7 | -86.4 | 0 | 0 | 0 | 112.9 | Y482 | Y482-F484 PolarHBondContact O-N 3.27Š| ||
| 485 | H | 37 | Very low | 37.4 | Very low | 151 Ų | 151 | 154 Ų | 154 | 70% | 0.699 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 120.9 | 171.3 | -73.8 | -93 | 0 | 0 | 0 | 111.1 | N483 S487 | N483-H485 PolarHBondContact ND2-NE2 3.44Å; N483-H485 PolarHBondContact O-N 2.95Å; H485-S487 PolarHBondContact O-N 2.64Å |
| 486 | P | 40.8 | Very low | 37.6 | Very low | 107 Ų | 107 | 154.6 Ų | 154.6 | 70% | 0.695 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 124 | 174 | 29.3 | -33 | 0 | 0 | 0 | 110.8 | ||
| 487 | S | 37.4 | Very low | 37.7 | Very low | 119 Ų | 119 | 156.2 Ų | 156.2 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 125.8 | 176.3 | 43.8 | 0 | 0 | 0 | 0 | 111.6 | H485 N489 | H485-S487 PolarHBondContact O-N 2.64Å; S487-N489 PolarHBondContact O-N 3.33Å |
| 488 | Y | 37.1 | Very low | 37.2 | Very low | 235 Ų | 235 | 161.1 Ų | 161.1 | 92% | 0.922 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 129.6 | 175.5 | -101.3 | -110.5 | 0 | 0 | 0 | 111.4 | ||
| 489 | N | 36.7 | Very low | 37.1 | Very low | 143 Ų | 143 | 160.7 Ų | 160.7 | 77% | 0.765 | 79% | 0.794 | S | S | * | * | trans | -109.5 | 107.3 | 174.4 | -176.5 | 11.4 | 0 | 0 | 0 | 110 | S487 G491 | S487-N489 PolarHBondContact O-N 3.33Å; N489-G491 PolarHBondContact O-N 3.44Å | ||
| 490 | P | 46.3 | Very low | 36.8 | Very low | 132 Ų | 132 | 159.4 Ų | 159.4 | 86% | 0.857 | 79% | 0.788 | S | S | * | * | trans | -79.1 | 81.6 | -174.4 | 32.3 | -35 | 0 | 0 | 0 | 111.7 | ||||
| 491 | G | 38.9 | Very low | 36.8 | Very low | 54 Ų | 54 | 161.5 Ų | 161.5 | 56% | 0.557 | 79% | 0.79 | S | S | * | * | trans | -150.8 | 8.6 | -176.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | N489 | N489-G491 PolarHBondContact O-N 3.44Š| ||
| 492 | S | 36.6 | Very low | 36.9 | Very low | 91 Ų | 91 | 161.7 Ų | 161.7 | 64% | 0.636 | 79% | 0.79 | S | S | * | * | trans | -92.2 | 124.2 | 179.9 | -169.2 | 0 | 0 | 0 | 0 | 112.2 | H494 | S492-H494 VanDerWaalsContact C-N 3.31Å; S492-H494 PolarHBondContact O-N 3.31Å | ||
| 493 | W | 45.1 | Very low | 37 | Very low | 244 Ų | 244 | 160.5 Ų | 160.5 | 92% | 0.924 | 79% | 0.793 | S | S | * | * | trans | -89.5 | 30.8 | -174.7 | -84.7 | 75.7 | 0 | 0 | 0 | 114.3 | ||||
| 494 | H | 40.4 | Very low | 37 | Very low | 170 Ų | 170 | 158.9 Ų | 158.9 | 79% | 0.787 | 80% | 0.797 | S | S | * | * | trans | -126.4 | 25.5 | -170.1 | -60.5 | 110.9 | 0 | 0 | 0 | 115.2 | S492 | S492-H494 VanDerWaalsContact C-N 3.31Å; S492-H494 PolarHBondContact O-N 3.31Å | ||
| 495 | S | 40.6 | Very low | 37.2 | Very low | 106 Ų | 106 | 155.4 Ų | 155.4 | 74% | 0.741 | 80% | 0.801 | S | S | * | * | trans | -121.1 | 75 | 175.1 | -58.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 496 | N | 37.6 | Very low | 37.2 | Very low | 159 Ų | 159 | 152.5 Ų | 152.5 | 85% | 0.85 | 80% | 0.803 | S | S | * | * | trans | -159.9 | 45.8 | 170.6 | -107.7 | -22.3 | 0 | 0 | 0 | 113.4 | ||||
| 497 | Y | 39.7 | Very low | 37.1 | Very low | 218 Ų | 218 | 154.9 Ų | 154.9 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -143.7 | 150 | 155.8 | -107.8 | -84.8 | 0 | 0 | 0 | 108.6 | ||
| 498 | Y | 32.7 | Very low | 37 | Very low | 221 Ų | 221 | 158.1 Ų | 158.1 | 87% | 0.867 | 81% | 0.81 | S | S | * | * | trans | 71.1 | 122.1 | -167.3 | -62.5 | -79.2 | 0 | 0 | 0 | 116.6 | ||||
| 499 | Q | 34.3 | Very low | 36.9 | Very low | 165 Ų | 165 | 154.8 Ų | 154.8 | 77% | 0.771 | 81% | 0.808 | S | S | * | * | trans | -145.6 | 142.7 | 175 | -105.1 | -87.5 | -3.8 | 0 | 0 | 106.2 | ||||
| 500 | N | 30.6 | Very low | 36.8 | Very low | 133 Ų | 133 | 155.8 Ų | 155.8 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | trans | 61.4 | 130.4 | -167.7 | -55.5 | -60.8 | 0 | 0 | 0 | 113.8 | ||||
| 501 | Y | 33.3 | Very low | 36.1 | Very low | 217 Ų | 217 | 153.2 Ų | 153.2 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | cis | -128.1 | 136 | 27.1 | -88.5 | -104.7 | 0 | 0 | 0 | 113.6 | ||||
| 502 | H | 36.5 | Very low | 36 | Very low | 197 Ų | 197 | 158.7 Ų | 158.7 | 91% | 0.912 | 81% | 0.811 | S | S | * | * | trans | -129 | 123.9 | 158.3 | -76 | -29.3 | 0 | 0 | 0 | 109.5 | ||||
| 503 | Q | 33.3 | Very low | 35.8 | Very low | 201 Ų | 201 | 160.9 Ų | 160.9 | 94% | 0.939 | 81% | 0.811 | S | S | * | * | trans | -90.9 | 145.1 | 174.6 | -159.6 | 167.7 | 78.1 | 0 | 0 | 109.3 | ||||
| 504 | A | 32.3 | Very low | 35.4 | Very low | 97 Ų | 97 | 157 Ų | 157 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | -73 | 135.2 | -162.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | A506 | A504-A506 PolarHBondContact O-N 3.26Š| ||
| 505 | A | 35.1 | Very low | 35.6 | Very low | 103 Ų | 103 | 154.9 Ų | 154.9 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | trans | -71.8 | 110.5 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 506 | A | 36.2 | Very low | 35.1 | Very low | 90 Ų | 90 | 153.5 Ų | 153.5 | 74% | 0.744 | 81% | 0.807 | S | S | * | * | trans | -90.4 | 114.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111 | A504 F508 | A504-A506 PolarHBondContact O-N 3.26Å; A506-F508 PolarHBondContact O-N 2.99Å | ||
| 507 | N | 37.8 | Very low | 35 | Very low | 157 Ų | 157 | 154.8 Ų | 154.8 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | trans | -65.2 | 123 | 167.6 | -71.9 | -38.5 | 0 | 0 | 0 | 109.9 | ||||
| 508 | F | 35.1 | Very low | 35.1 | Very low | 188 Ų | 188 | 149.8 Ų | 149.8 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -134.1 | 112.5 | 159.2 | -107.3 | -82.2 | 0 | 0 | 0 | 111.9 | A506 | A506-F508 PolarHBondContact O-N 2.99Š| ||
| 509 | N | 36.1 | Very low | 35.1 | Very low | 164 Ų | 164 | 149.4 Ų | 149.4 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | -109.5 | 106.6 | 171.2 | 175.5 | 8.6 | 0 | 0 | 0 | 107.1 | ||||
| 510 | M | 33.8 | Very low | 35.3 | Very low | 164 Ų | 164 | 147 Ų | 147 | 81% | 0.808 | 81% | 0.807 | S | S | * | * | trans | -147.8 | 134.1 | 177.2 | -174.5 | 165.3 | 169.1 | 0 | 0 | 110.2 | ||||
| 511 | A | 33 | Very low | 35.8 | Very low | 78 Ų | 78 | 147.1 Ų | 147.1 | 65% | 0.645 | 81% | 0.812 | S | S | * | * | trans | -115.1 | -175.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 512 | Q | 35.8 | Very low | 36.4 | Very low | 169 Ų | 169 | 142 Ų | 142 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | 93.2 | 133.9 | 177.8 | -63.6 | -160.4 | 74 | 0 | 0 | 115.1 | ||||
| 513 | Q | 33.3 | Very low | 36.1 | Very low | 138 Ų | 138 | 138 Ų | 138 | 65% | 0.645 | 79% | 0.79 | S | S | * | * | cis | -144.2 | 145.2 | -0.5 | -67.9 | -160.9 | -12 | 0 | 0 | 113.5 | ||||
| 514 | H | 36.8 | Very low | 36 | Very low | 161 Ų | 161 | 138.6 Ų | 138.6 | 75% | 0.745 | 79% | 0.785 | S | S | * | * | trans | 54.5 | 168.2 | 136.7 | -61.7 | -34.1 | 0 | 0 | 0 | 122.2 | ||||
| 515 | P | 43.6 | Very low | 35.9 | Very low | 126 Ų | 126 | 137.8 Ų | 137.8 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | cis | -135.4 | 165.8 | -45.2 | 37.4 | -22.7 | 0 | 0 | 0 | 113.7 | ||||
| 516 | G | 29.4 | Very low | 36.1 | Very low | 78 Ų | 78 | 144.8 Ų | 144.8 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | 142.2 | 110.6 | 157.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 517 | M | 35.7 | Very low | 35.9 | Very low | 185 Ų | 185 | 143.8 Ų | 143.8 | 91% | 0.911 | 79% | 0.791 | S | S | * | * | trans | -91.7 | 175 | 168.2 | -33.9 | -74.1 | -83.5 | 0 | 0 | 109.6 | ||||
| 518 | P | 42 | Very low | 36 | Very low | 113 Ų | 113 | 144.5 Ų | 144.5 | 73% | 0.734 | 79% | 0.792 | S | S | * | * | cis | -132.2 | 162.9 | -9.3 | 39.1 | -23.6 | 0 | 0 | 0 | 114.8 | ||||
| 519 | F | 33.9 | Very low | 36.7 | Very low | 214 Ų | 214 | 141.4 Ų | 141.4 | 94% | 0.939 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -94.6 | 130.6 | 157.2 | -92.7 | -90.7 | 0 | 0 | 0 | 110.6 | ||
| 520 | P | 38.8 | Very low | 36.9 | Very low | 115 Ų | 115 | 144.3 Ų | 144.3 | 75% | 0.747 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -98 | 120.9 | 166.2 | 34.1 | -27.9 | 0 | 0 | 0 | 111.9 | ||
| 521 | V | 40.2 | Very low | 37.2 | Very low | 135 Ų | 135 | 141 Ų | 141 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -97.4 | 166.9 | 144.9 | -60.1 | 0 | 0 | 0 | 0 | 107 | ||
| 522 | P | 46.3 | Very low | 37.5 | Very low | 109 Ų | 109 | 145.8 Ų | 145.8 | 71% | 0.708 | 80% | 0.801 | S | S | * | * | cis | -144.5 | -176.5 | 11.4 | 38.6 | -16.8 | 0 | 0 | 0 | 117.1 | ||||
| 523 | N | 29.8 | Very low | 37.9 | Very low | 112 Ų | 112 | 142.5 Ų | 142.5 | 60% | 0.599 | 79% | 0.794 | S | S | * | * | trans | 90.5 | 152.4 | 133.4 | -131.5 | -13.9 | 0 | 0 | 0 | 123.6 | ||||
| 524 | Y | 31.9 | Very low | 38.5 | Very low | 214 Ų | 214 | 141 Ų | 141 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | trans | 63.7 | 138.7 | 160.7 | -60.8 | -56.8 | 0 | 0 | 0 | 121.8 | ||||
| 525 | G | 29.6 | Very low | 38.9 | Very low | 81 Ų | 81 | 142 Ų | 142 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | trans | 158.5 | 80.5 | 161.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 526 | Y | 40.3 | Very low | 38.8 | Very low | 249 Ų | 249 | 145.5 Ų | 145.5 | 98% | 0.976 | 80% | 0.802 | S | S | * | * | trans | -83.9 | 131.1 | 165.8 | -127.3 | -92.1 | 0 | 0 | 0 | 109.2 | ||||
| 527 | G | 31.8 | Very low | 39.5 | Very low | 69 Ų | 69 | 146.9 Ų | 146.9 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | -179.3 | 112.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 528 | M | 39.8 | Very low | 40.3 | Very low | 173 Ų | 173 | 146.4 Ų | 146.4 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | trans | -75.3 | 155.2 | 164.2 | -72 | -74 | -170.3 | 0 | 0 | 110.1 | ||||
| 529 | P | 48 | Very low | 40.2 | Very low | 122 Ų | 122 | 149.1 Ų | 149.1 | 79% | 0.792 | 80% | 0.797 | S | S | * | * | -139.4 | 152.7 | 102.4 | 37.5 | -26.7 | 0 | 0 | 0 | 115 | |||||
| 530 | Y | 41.6 | Very low | 41.4 | Very low | 225 Ų | 225 | 148.7 Ų | 148.7 | 88% | 0.882 | 79% | 0.79 | S | S | * | * | trans | -66.6 | 141.8 | 163.5 | -100 | -117.2 | 0 | 0 | 0 | 111.2 | ||||
| 531 | A | 39 | Very low | 42.5 | Very low | 95 Ų | 95 | 148.5 Ų | 148.5 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -142.3 | 151.2 | 161 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 532 | M | 40.8 | Very low | 43.7 | Very low | 179 Ų | 179 | 147.7 Ų | 147.7 | 88% | 0.882 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 152.4 | -171 | -61.7 | -134.6 | 97.9 | 0 | 0 | 113.4 | ||
| 533 | P | 44.4 | Very low | 44.7 | Very low | 99 Ų | 99 | 148.1 Ų | 148.1 | 64% | 0.643 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 144.6 | 173.4 | 30.3 | -35.5 | 0 | 0 | 0 | 111.8 | ||
| 534 | P | 44.7 | Very low | 46.6 | Very low | 107 Ų | 107 | 148 Ų | 148 | 70% | 0.695 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 127.9 | 173.5 | 30.2 | -33.2 | 0 | 0 | 0 | 111.1 | Y536 | P534-Y536 HydrophobicContact CB-CE2 4.43Å; P534-Y536 PolarHBondContact O-N 3.31Å |
| 535 | M | 45.1 | Very low | 48 | Very low | 182 Ų | 182 | 143.9 Ų | 143.9 | 90% | 0.897 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 123.1 | 171.7 | -69.4 | -74.5 | 169.6 | 0 | 0 | 110.3 | ||
| 536 | Y | 41.8 | Very low | 49.5 | Very low | 200 Ų | 200 | 150 Ų | 150 | 78% | 0.784 | 80% | 0.798 | S | S | * | * | trans | -108.9 | 144.9 | 167.6 | -92.4 | -95.3 | 0 | 0 | 0 | 110.5 | P534 | P534-Y536 HydrophobicContact CB-CE2 4.43Å; P534-Y536 PolarHBondContact O-N 3.31Å | ||
| 537 | P | 44.8 | Very low | 50.7 | Low | 107 Ų | 107 | 142.2 Ų | 142.2 | 70% | 0.695 | 79% | 0.785 | S | S | * | * | trans | -80.3 | 145.2 | -165.7 | 31.8 | -35.7 | 0 | 0 | 0 | 113.2 | M539 | P537-M539 PolarHBondContact O-N 3.27Š| ||
| 538 | H | 52.1 | Low | 52.4 | Low | 175 Ų | 175 | 144.5 Ų | 144.5 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | trans | -64.7 | 120.6 | 168.7 | -55.6 | -77 | 0 | 0 | 0 | 110.6 | ||||
| 539 | M | 40.4 | Very low | 53.9 | Low | 170 Ų | 170 | 141.7 Ų | 141.7 | 84% | 0.837 | 78% | 0.782 | S | S | * | * | trans | -121.4 | 117.5 | 164.7 | -77 | -88.6 | 70.7 | 0 | 0 | 109.3 | P537 | P537-M539 PolarHBondContact O-N 3.27Š| ||
| 540 | Y | 57.5 | Low | 54.6 | Low | 204 Ų | 204 | 141.3 Ų | 141.3 | 80% | 0.8 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 147.2 | 169.9 | -75.9 | -101.1 | 0 | 0 | 0 | 109.9 | ||
| 541 | P | 62.8 | Low | 55.4 | Low | 112 Ų | 112 | 136.7 Ų | 136.7 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 145.9 | 165.6 | 28.9 | -34.2 | 0 | 0 | 0 | 110.2 | ||
| 542 | P | 66.2 | Low | 55.8 | Low | 118 Ų | 118 | 139.1 Ų | 139.1 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 148.7 | -180 | 30 | -35 | 0 | 0 | 0 | 111.8 | ||
| 543 | P | 65.9 | Low | 56.4 | Low | 118 Ų | 118 | 138 Ų | 138 | 77% | 0.766 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 150.6 | 173.7 | 30.3 | -35 | 0 | 0 | 0 | 111.5 | ||
| 544 | P | 69.5 | Low | 56.4 | Low | 110 Ų | 110 | 141 Ų | 141 | 71% | 0.714 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 153.4 | 177.4 | 29.1 | -35.4 | 0 | 0 | 0 | 112.2 | ||
| 545 | P | 62.3 | Low | 56.2 | Low | 127 Ų | 127 | 141.3 Ų | 141.3 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 139.8 | 178 | 28.6 | -34.6 | 0 | 0 | 0 | 111.9 | A547 | P545-A547 PolarHBondContact O-N 3.11Š|
| 546 | F | 61.1 | Low | 56.1 | Low | 209 Ų | 209 | 142 Ų | 142 | 92% | 0.917 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 131.8 | 175.9 | -82.8 | -103 | 0 | 0 | 0 | 111.7 | ||
| 547 | A | 64.3 | Low | 56.4 | Low | 85 Ų | 85 | 142.1 Ų | 142.1 | 70% | 0.702 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 145.3 | 163.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | P545 | P545-A547 PolarHBondContact O-N 3.11Š|
| 548 | P | 69 | Low | 56.4 | Low | 117 Ų | 117 | 140.5 Ų | 140.5 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 144 | 174.2 | 29.5 | -34.3 | 0 | 0 | 0 | 111.1 | ||
| 549 | P | 70.3 | Confident | 56.5 | Low | 114 Ų | 114 | 141 Ų | 141 | 74% | 0.74 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 153.8 | 179.8 | 30.2 | -35.6 | 0 | 0 | 0 | 112.2 | ||
| 550 | P | 62.1 | Low | 57.4 | Low | 115 Ų | 115 | 138.4 Ų | 138.4 | 75% | 0.747 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 153.1 | 173.1 | 29.1 | -35.3 | 0 | 0 | 0 | 111.7 | N552 | P550-N552 PolarHBondContact O-N 3.41Š|
| 551 | P | 59.4 | Low | 57.6 | Low | 128 Ų | 128 | 134.4 Ų | 134.4 | 83% | 0.831 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 120.6 | -179.6 | 26.6 | -34 | 0 | 0 | 0 | 111.5 | N553 | P551-N553 PolarHBondContact O-N 3.26Å; P551-N553 VanDerWaalsContact O-N 3.11Å |
| 552 | N | 47 | Very low | 57.6 | Low | 145 Ų | 145 | 134.7 Ų | 134.7 | 78% | 0.775 | 80% | 0.795 | S | S | * | * | trans | -71.8 | 103.1 | 179.5 | -175.8 | 15.7 | 0 | 0 | 0 | 111.1 | P550 Q554 | P550-N552 PolarHBondContact O-N 3.41Å; N552-Q554 PolarHBondContact O-N 3.48Å | ||
| 553 | N | 52.8 | Low | 57 | Low | 155 Ų | 155 | 138.4 Ų | 138.4 | 83% | 0.829 | 82% | 0.824 | S | S | * | * | trans | -90.2 | 76.5 | -174.4 | -169.9 | 18.4 | 0 | 0 | 0 | 112.3 | P551 | P551-N553 PolarHBondContact O-N 3.26Å; P551-N553 VanDerWaalsContact O-N 3.11Å | ||
| 554 | Q | 44.7 | Very low | 56.5 | Low | 163 Ų | 163 | 139.5 Ų | 139.5 | 76% | 0.762 | 83% | 0.827 | S | S | * | * | trans | -161.3 | 117.3 | 173.6 | -121.2 | 170.2 | 91.1 | 0 | 0 | 113.2 | N552 | N552-Q554 PolarHBondContact O-N 3.48Š| ||
| 555 | S | 41.6 | Very low | 55.8 | Low | 114 Ų | 114 | 141 Ų | 141 | 80% | 0.797 | 83% | 0.833 | S | S | * | * | trans | 173.6 | 48.8 | 147 | 43.2 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 556 | H | 43.3 | Very low | 55.5 | Low | 197 Ų | 197 | 141.8 Ų | 141.8 | 91% | 0.912 | 83% | 0.833 | S | S | * | * | trans | -132.1 | 63 | 165.8 | -76.5 | -25.4 | 0 | 0 | 0 | 112.6 | G558 | H556-G558 PolarHBondContact O-N 3.4Š| ||
| 557 | Q | 48 | Very low | 55.1 | Low | 201 Ų | 201 | 137.8 Ų | 137.8 | 94% | 0.939 | 83% | 0.828 | S | S | * | * | trans | -77.9 | 108.7 | 154.6 | -80.2 | -167.8 | -9 | 0 | 0 | 108.5 | ||||
| 558 | G | 44.1 | Very low | 54.6 | Low | 73 Ų | 73 | 141.1 Ų | 141.1 | 75% | 0.753 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -73 | 171.1 | 172 | 0 | 0 | 0 | 0 | 0 | 112.8 | H556 | H556-G558 PolarHBondContact O-N 3.4Š|
| 559 | Q | 54.5 | Low | 53.6 | Low | 187 Ų | 187 | 142.7 Ų | 142.7 | 87% | 0.874 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 158.7 | -175.9 | -69.7 | 164.6 | -25 | 0 | 0 | 114.2 | ||
| 560 | P | 58.8 | Low | 52.4 | Low | 115 Ų | 115 | 144.8 Ų | 144.8 | 75% | 0.747 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 156.3 | 174.5 | 30.6 | -37.1 | 0 | 0 | 0 | 112.6 | ||
| 561 | P | 61.8 | Low | 51.7 | Low | 120 Ų | 120 | 147.1 Ų | 147.1 | 78% | 0.779 | 86% | 0.857 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 151.9 | 167.8 | 30.7 | -34.9 | 0 | 0 | 0 | 111.3 | ||
| 562 | P | 62.7 | Low | 51 | Low | 118 Ų | 118 | 148.7 Ų | 148.7 | 77% | 0.766 | 86% | 0.859 | S | S | * | * | P | Polyproline II helix | trans | -91.4 | 156.6 | -171.7 | 35.6 | -36.3 | 0 | 0 | 0 | 114.9 | ||
| 563 | S | 53.1 | Low | 51.4 | Low | 196 Ų | 196 | 149 Ų | 149 | 100% | 1.371 | 87% | 0.866 | S | S | * | * | trans | 69.9 | 0 | 161.5 | -63.1 | 0 | 0 | 0 | 0 | 117.5 |
Retrieved 563 of 563 residues in 211.3 ms
(Link to these results)