| 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 | 41.8 | Very low | 41.6 | Very low | 251 Ų | 251 | 160.8 Ų | 160.8 | 100% | 1.236 | 85% | 0.848 | S | S | * | * | 0 | 101.6 | 0 | -72.3 | 169.2 | -179.8 | 0 | 0 | 107.4 | |||||
| 2 | S | 37.3 | Very low | 41.3 | Very low | 109 Ų | 109 | 160.1 Ų | 160.1 | 76% | 0.762 | 84% | 0.843 | S | S | * | * | trans | -109.8 | 108.3 | -178.3 | -172.7 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 3 | Q | 40.5 | Very low | 40.9 | Very low | 193 Ų | 193 | 159.1 Ų | 159.1 | 90% | 0.902 | 84% | 0.838 | S | S | * | * | trans | -96.4 | 107.6 | 176.7 | -87.7 | -99.7 | -5.3 | 0 | 0 | 107.8 | ||||
| 4 | I | 46.8 | Very low | 41.3 | Very low | 134 Ų | 134 | 156.6 Ų | 156.6 | 69% | 0.687 | 83% | 0.831 | S | S | * | * | trans | -87.7 | 119 | 177.7 | -69 | 165.9 | 0 | 0 | 0 | 108 | F6 | I4-F6 PolarHBondContact O-N 3.29Š| ||
| 5 | S | 41.2 | Very low | 41.4 | Very low | 111 Ų | 111 | 153.5 Ų | 153.5 | 78% | 0.776 | 82% | 0.821 | S | S | * | * | trans | -70.5 | 114.6 | 175.4 | -177.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 6 | F | 43.5 | Very low | 41.5 | Very low | 195 Ų | 195 | 157.9 Ų | 157.9 | 86% | 0.855 | 82% | 0.822 | S | S | * | * | trans | -81.6 | 115 | 173.8 | -110.5 | -98.4 | 0 | 0 | 0 | 110.1 | I4 | I4-F6 PolarHBondContact O-N 3.29Š| ||
| 7 | R | 46.6 | Very low | 41.1 | Very low | 234 Ų | 234 | 155.5 Ų | 155.5 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -79.3 | 127.5 | 170.9 | -72.2 | -174.1 | 172 | -169.1 | -1.9 | 109.9 | A9 | R7-A9 PolarHBondContact O-N 3.09Š| ||
| 8 | V | 39.1 | Very low | 41.1 | Very low | 142 Ų | 142 | 153.7 Ų | 153.7 | 86% | 0.861 | 82% | 0.817 | S | S | * | * | trans | -71.6 | 116 | 170.5 | 175.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 9 | A | 44.3 | Very low | 41.2 | Very low | 88 Ų | 88 | 150.4 Ų | 150.4 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | trans | -102.1 | 104.8 | 170 | 0 | 0 | 0 | 0 | 0 | 108.9 | R7 L11 | R7-A9 PolarHBondContact O-N 3.09Å; A9-L11 PolarHBondContact O-N 3.35Å | ||
| 10 | L | 37.7 | Very low | 41.3 | Very low | 156 Ų | 156 | 151.5 Ų | 151.5 | 82% | 0.817 | 81% | 0.812 | S | S | * | * | trans | -77.3 | 98.5 | 172 | -174.8 | 72.7 | 0 | 0 | 0 | 108.3 | ||||
| 11 | L | 38.4 | Very low | 41.4 | Very low | 156 Ų | 156 | 153 Ų | 153 | 82% | 0.817 | 82% | 0.815 | S | S | * | * | trans | -89.6 | 102.8 | 176.1 | -143.5 | 89.8 | 0 | 0 | 0 | 109.4 | A9 L13 | A9-L11 PolarHBondContact O-N 3.35Å; L11-L13 PolarHBondContact O-N 3.24Å | ||
| 12 | L | 38.7 | Very low | 41.5 | Very low | 152 Ų | 152 | 147 Ų | 147 | 80% | 0.796 | 79% | 0.792 | S | S | * | * | trans | -68.3 | 104.2 | 170.9 | -87.8 | 150.8 | 0 | 0 | 0 | 109.7 | V14 | L12-V14 PolarHBondContact O-N 3.3Š| ||
| 13 | L | 36.4 | Very low | 41.8 | Very low | 147 Ų | 147 | 147.7 Ų | 147.7 | 77% | 0.77 | 79% | 0.792 | S | S | * | * | trans | -80 | 104.4 | 171.9 | -160 | 97 | 0 | 0 | 0 | 109.3 | L11 V15 | L11-L13 PolarHBondContact O-N 3.24Å; L13-V15 PolarHBondContact O-N 3.42Å | ||
| 14 | V | 45.4 | Very low | 42.1 | Very low | 124 Ų | 124 | 144 Ų | 144 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | -75.2 | 106.1 | 172.8 | 179.7 | 0 | 0 | 0 | 0 | 108.6 | L12 R16 | L12-V14 PolarHBondContact O-N 3.3Å; V14-R16 PolarHBondContact O-N 2.89Å | ||
| 15 | V | 42.8 | Very low | 42 | Very low | 111 Ų | 111 | 143 Ų | 143 | 67% | 0.673 | 79% | 0.79 | S | S | * | * | trans | -73 | 104.3 | 171.5 | 178.4 | 0 | 0 | 0 | 0 | 108.4 | L13 C17 | L13-V15 PolarHBondContact O-N 3.42Å; V15-C17 PolarHBondContact O-N 2.9Å | ||
| 16 | R | 42.8 | Very low | 42.3 | Very low | 223 Ų | 223 | 147.3 Ų | 147.3 | 84% | 0.842 | 79% | 0.794 | S | S | * | * | trans | -82.7 | 100.8 | 163.9 | -84 | -165.6 | 172 | -169.9 | -1 | 108.7 | V14 V18 | V14-R16 PolarHBondContact O-N 2.89Å; R16-V18 PolarHBondContact O-N 3.31Å | ||
| 17 | C | 35.6 | Very low | 42.4 | Very low | 118 Ų | 118 | 141.1 Ų | 141.1 | 80% | 0.797 | 79% | 0.785 | S | S | * | * | trans | -71.4 | 104.7 | 162.2 | -70.5 | 0 | 0 | 0 | 0 | 108.5 | V15 | V15-C17 PolarHBondContact O-N 2.9Š| ||
| 18 | V | 41.6 | Very low | 42.7 | Very low | 123 Ų | 123 | 136.3 Ų | 136.3 | 75% | 0.745 | 79% | 0.786 | S | S | * | * | trans | -86.9 | 107.2 | 162.3 | 175 | 0 | 0 | 0 | 0 | 106.1 | R16 E20 | R16-V18 PolarHBondContact O-N 3.31Å; V18-E20 PolarHBondContact O-N 3.02Å | ||
| 19 | A | 43.1 | Very low | 43.2 | Very low | 90 Ų | 90 | 135.8 Ų | 135.8 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | -78.4 | 105.8 | 168.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | E21 | A19-E21 PolarHBondContact O-N 3.13Š| ||
| 20 | E | 43.3 | Very low | 43.6 | Very low | 172 Ų | 172 | 137.1 Ų | 137.1 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | -74.8 | 98.9 | 165 | -94.5 | 178.4 | 156.7 | 0 | 0 | 108.5 | V18 T22 | V18-E20 PolarHBondContact O-N 3.02Å; E20-T22 VanDerWaalsContact C-N 3.34Å; E20-T22 PolarHBondContact O-N 3.31Å | ||
| 21 | E | 43.5 | Very low | 44.5 | Very low | 185 Ų | 185 | 132.9 Ų | 132.9 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | trans | -70.2 | 91.7 | 164.2 | -76 | -176.3 | 162.4 | 0 | 0 | 108.9 | A19 T23 | A19-E21 PolarHBondContact O-N 3.13Å; E21-T23 PolarHBondContact O-N 3.45Å | ||
| 22 | T | 42.4 | Very low | 45.3 | Very low | 125 Ų | 125 | 136 Ų | 136 | 77% | 0.767 | 78% | 0.782 | S | S | * | * | trans | -84.8 | 102.3 | 164.4 | 35.3 | 0 | 0 | 0 | 0 | 108.8 | E20 | E20-T22 VanDerWaalsContact C-N 3.34Å; E20-T22 PolarHBondContact O-N 3.31Å | ||
| 23 | T | 45.2 | Very low | 46.3 | Very low | 122 Ų | 122 | 134.8 Ų | 134.8 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | -55.2 | 125.2 | 169.6 | 50.1 | 0 | 0 | 0 | 0 | 110.7 | E21 S25 | E21-T23 PolarHBondContact O-N 3.45Å; T23-S25 PolarHBondContact O-N 3.37Å; T23-S25 VanDerWaalsContact O-N 3.11Å | ||
| 24 | P | 45.8 | Very low | 47.2 | Very low | 117 Ų | 117 | 131 Ų | 131 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | trans | -82.9 | 90.1 | 171.1 | 31.3 | -28.5 | 0 | 0 | 0 | 108.7 | K26 | P24-K26 PolarHBondContact O-N 3.4Š| ||
| 25 | S | 45 | Very low | 47.6 | Very low | 112 Ų | 112 | 133 Ų | 133 | 78% | 0.783 | 78% | 0.784 | S | S | * | * | trans | -70.6 | 82.9 | 165 | 64.4 | 0 | 0 | 0 | 0 | 109 | T23 G27 | T23-S25 PolarHBondContact O-N 3.37Å; T23-S25 VanDerWaalsContact O-N 3.11Å; S25-G27 PolarHBondContact O-N 3.22Å | ||
| 26 | K | 48.2 | Very low | 48.4 | Very low | 202 Ų | 202 | 133.2 Ų | 133.2 | 88% | 0.878 | 79% | 0.788 | S | S | * | * | trans | -71 | 80.6 | 166.2 | -76.7 | -174.5 | 177.1 | 178.9 | 0 | 108.9 | P24 C28 | P24-K26 PolarHBondContact O-N 3.4Å; K26-C28 PolarHBondContact O-N 3.11Å | ||
| 27 | G | 45 | Very low | 49 | Very low | 64 Ų | 64 | 126.1 Ų | 126.1 | 66% | 0.66 | 79% | 0.785 | S | S | * | * | trans | -69.2 | 109.8 | 161.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | S25 V29 | S25-G27 PolarHBondContact O-N 3.22Å; G27-V29 PolarHBondContact O-N 3.41Å | ||
| 28 | C | 51.6 | Low | 49.4 | Very low | 133 Ų | 133 | 127.6 Ų | 127.6 | 90% | 0.899 | 78% | 0.784 | S | S | * | * | trans | -68.3 | 96.5 | 165.1 | -112.3 | 0 | 0 | 0 | 0 | 107.9 | K26 | K26-C28 PolarHBondContact O-N 3.11Š| ||
| 29 | V | 49.7 | Very low | 50.2 | Low | 132 Ų | 132 | 127.1 Ų | 127.1 | 80% | 0.8 | 78% | 0.784 | S | S | * | * | trans | -81.6 | 111.5 | 163.8 | -179 | 0 | 0 | 0 | 0 | 106.6 | G27 G31 | G27-V29 PolarHBondContact O-N 3.41Å; V29-G31 PolarHBondContact O-N 3.36Å; V29-G31 VanDerWaalsContact O-N 3.13Å | ||
| 30 | C | 54.4 | Low | 50.4 | Low | 116 Ų | 116 | 126.2 Ų | 126.2 | 78% | 0.784 | 78% | 0.784 | S | S | * | * | trans | -63.6 | 110.7 | 165.4 | -72.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 31 | G | 55 | Low | 50.1 | Low | 66 Ų | 66 | 126.6 Ų | 126.6 | 68% | 0.68 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 135.6 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110 | V29 | V29-G31 PolarHBondContact O-N 3.36Å; V29-G31 VanDerWaalsContact O-N 3.13Å |
| 32 | Y | 54.9 | Low | 50.5 | Low | 223 Ų | 223 | 125.5 Ų | 125.5 | 88% | 0.875 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 143 | 171 | -65.6 | -83.3 | 0 | 0 | 0 | 109.9 | G34 | Y32-G34 PolarHBondContact O-N 3.36Š|
| 33 | P | 60.1 | Low | 50.3 | Low | 125 Ų | 125 | 123 Ų | 123 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 132.1 | 172.6 | -21.3 | 30.4 | 0 | 0 | 0 | 110.2 | ||
| 34 | G | 56.1 | Low | 50 | Low | 69 Ų | 69 | 122.4 Ų | 122.4 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 141.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y32 | Y32-G34 PolarHBondContact O-N 3.36Š|
| 35 | I | 53.5 | Low | 50.1 | Low | 164 Ų | 164 | 122.7 Ų | 122.7 | 84% | 0.841 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 129.8 | 175.4 | -57.7 | 171.6 | 0 | 0 | 0 | 107.9 | G37 | I35-G37 PolarHBondContact O-N 3.35Š|
| 36 | P | 58.7 | Low | 49.9 | Very low | 116 Ų | 116 | 120.8 Ų | 120.8 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 132.7 | 174.9 | -25 | 33.9 | 0 | 0 | 0 | 110.6 | ||
| 37 | G | 55.6 | Low | 49.3 | Very low | 75 Ų | 75 | 123.1 Ų | 123.1 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 144.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | I35 | I35-G37 PolarHBondContact O-N 3.35Š|
| 38 | D | 45.1 | Very low | 49.3 | Very low | 148 Ų | 148 | 127.8 Ų | 127.8 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 145.6 | 177.7 | -69.7 | -49.2 | 0 | 0 | 0 | 111.3 | G40 | D38-G40 PolarHBondContact O-N 3.48Š|
| 39 | P | 58.9 | Low | 48.7 | Very low | 113 Ų | 113 | 124.8 Ų | 124.8 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 133.7 | 174.2 | -25.6 | 33.9 | 0 | 0 | 0 | 111.8 | H41 | P39-H41 PolarHBondContact O-N 3.39Š|
| 40 | G | 45.8 | Very low | 48 | Very low | 72 Ų | 72 | 130.3 Ų | 130.3 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -55 | 135 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | D38 | D38-G40 PolarHBondContact O-N 3.48Š|
| 41 | H | 37.5 | Very low | 47.5 | Very low | 180 Ų | 180 | 132.4 Ų | 132.4 | 83% | 0.833 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 141.9 | 179.9 | -59.1 | -11.7 | 0 | 0 | 0 | 110.8 | P39 G43 | P39-H41 PolarHBondContact O-N 3.39Å; H41-G43 PolarHBondContact O-N 3.05Å |
| 42 | N | 51.3 | Low | 46.7 | Very low | 161 Ų | 161 | 132.9 Ų | 132.9 | 86% | 0.861 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 137.1 | 174.5 | -68.5 | -18.8 | 0 | 0 | 0 | 110.1 | S44 | N42-S44 PolarHBondContact O-N 3.41Š|
| 43 | G | 40.1 | Very low | 45.7 | Very low | 74 Ų | 74 | 130.7 Ų | 130.7 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 137.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | H41 | H41-G43 PolarHBondContact O-N 3.05Š|
| 44 | S | 38.2 | Very low | 44.8 | Very low | 108 Ų | 108 | 136.1 Ų | 136.1 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 144.1 | 176.2 | 53.6 | 0 | 0 | 0 | 0 | 111 | N42 | N42-S44 PolarHBondContact O-N 3.41Š|
| 45 | P | 47.3 | Very low | 44 | Very low | 124 Ų | 124 | 136 Ų | 136 | 81% | 0.805 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 144 | 172 | -25.9 | 34.2 | 0 | 0 | 0 | 112.1 | ||
| 46 | G | 40.5 | Very low | 43.1 | Very low | 72 Ų | 72 | 136.1 Ų | 136.1 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -59 | 144.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 47 | R | 36.3 | Very low | 42.2 | Very low | 251 Ų | 251 | 140.2 Ų | 140.2 | 95% | 0.947 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 143.7 | 177.7 | -71.7 | -174.6 | 174.1 | -169.7 | -1.7 | 110.9 | ||
| 48 | D | 45.7 | Very low | 41.4 | Very low | 161 Ų | 161 | 139.8 Ų | 139.8 | 86% | 0.861 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -55 | 144.6 | 170.8 | -63.9 | -30.9 | 0 | 0 | 0 | 111 | ||
| 49 | G | 38.2 | Very low | 41 | Very low | 71 Ų | 71 | 140.7 Ų | 140.7 | 73% | 0.732 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 144.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 50 | R | 35.5 | Very low | 40 | Very low | 248 Ų | 248 | 144.5 Ų | 144.5 | 94% | 0.936 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 140.5 | 177.9 | -60.3 | -172 | -143.6 | -149.5 | 5.7 | 110.5 | ||
| 51 | D | 42.6 | Very low | 39.6 | Very low | 160 Ų | 160 | 144.3 Ų | 144.3 | 86% | 0.856 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 139.9 | 169.8 | -66.7 | -30.1 | 0 | 0 | 0 | 110.8 | ||
| 52 | G | 37.9 | Very low | 39.6 | Very low | 76 Ų | 76 | 145.2 Ų | 145.2 | 78% | 0.784 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 145.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 53 | L | 35.5 | Very low | 39 | Very low | 176 Ų | 176 | 144.5 Ų | 144.5 | 92% | 0.921 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 137.3 | 178.5 | -65.6 | 170.3 | 0 | 0 | 0 | 110.8 | G55 | L53-G55 PolarHBondContact O-N 3.44Š|
| 54 | R | 39.6 | Very low | 39 | Very low | 240 Ų | 240 | 143.8 Ų | 143.8 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 127.2 | 173.6 | -176 | -179.5 | -174.5 | 177.6 | 2.6 | 108.9 | ||
| 55 | G | 39.6 | Very low | 38.9 | Very low | 66 Ų | 66 | 145 Ų | 145 | 68% | 0.68 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 148 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L53 | L53-G55 PolarHBondContact O-N 3.44Š|
| 56 | D | 36.2 | Very low | 38.6 | Very low | 166 Ų | 166 | 145.1 Ų | 145.1 | 89% | 0.888 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -65 | 152.8 | -178.5 | -64.1 | -45.2 | 0 | 0 | 0 | 112.4 | ||
| 57 | K | 38.4 | Very low | 38.6 | Very low | 202 Ų | 202 | 145 Ų | 145 | 88% | 0.878 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 127.6 | 178 | -175.8 | -177.2 | 177 | -172 | 0 | 109.2 | ||
| 58 | G | 39.1 | Very low | 38.7 | Very low | 67 Ų | 67 | 139.4 Ų | 139.4 | 69% | 0.691 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 149.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 59 | D | 35.8 | Very low | 38.4 | Very low | 166 Ų | 166 | 136.6 Ų | 136.6 | 89% | 0.888 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 155 | -177.2 | -63.6 | -41.9 | 0 | 0 | 0 | 113.2 | ||
| 60 | Q | 38.1 | Very low | 38.6 | Very low | 193 Ų | 193 | 136.9 Ų | 136.9 | 90% | 0.902 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 129.4 | 179.8 | -178.4 | 174.4 | -17 | 0 | 0 | 111 | ||
| 61 | G | 38.9 | Very low | 38.6 | Very low | 68 Ų | 68 | 132 Ų | 132 | 70% | 0.701 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -69 | 151.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 62 | E | 37.1 | Very low | 38.3 | Very low | 200 Ų | 200 | 132.6 Ų | 132.6 | 94% | 0.935 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 152.4 | -177.8 | -62.6 | -168.8 | 155.6 | 0 | 0 | 113.8 | ||
| 63 | V | 38.8 | Very low | 38.4 | Very low | 145 Ų | 145 | 132.7 Ų | 132.7 | 88% | 0.879 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 131.2 | -179 | -179.5 | 0 | 0 | 0 | 0 | 110.5 | ||
| 64 | G | 38.9 | Very low | 38.1 | Very low | 59 Ų | 59 | 133.2 Ų | 133.2 | 61% | 0.608 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 154.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 65 | P | 37 | Very low | 38.1 | Very low | 135 Ų | 135 | 132.1 Ų | 132.1 | 88% | 0.877 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 150.9 | -176.8 | 29.7 | -34.6 | 0 | 0 | 0 | 113.5 | ||
| 66 | S | 39.8 | Very low | 37.9 | Very low | 125 Ų | 125 | 132.6 Ų | 132.6 | 87% | 0.874 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 142.3 | 177.4 | -61.3 | 0 | 0 | 0 | 0 | 112.9 | ||
| 67 | G | 40.5 | Very low | 37.6 | Very low | 69 Ų | 69 | 133 Ų | 133 | 71% | 0.711 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 158.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 68 | P | 38.8 | Very low | 37.6 | Very low | 135 Ų | 135 | 133.5 Ų | 133.5 | 88% | 0.877 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 151.3 | -177.8 | 29.6 | -33.9 | 0 | 0 | 0 | 113.3 | ||
| 69 | A | 39.2 | Very low | 37.5 | Very low | 102 Ų | 102 | 133.5 Ų | 133.5 | 84% | 0.843 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 138.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 70 | G | 43.3 | Very low | 37.3 | Very low | 77 Ų | 77 | 133.4 Ų | 133.4 | 79% | 0.794 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 149.8 | 179 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 71 | T | 35.3 | Very low | 37.2 | Very low | 144 Ų | 144 | 131.6 Ų | 131.6 | 88% | 0.883 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 141.1 | 177.4 | 51.6 | 0 | 0 | 0 | 0 | 112.1 | ||
| 72 | D | 36.9 | Very low | 37.5 | Very low | 174 Ų | 174 | 131.6 Ų | 131.6 | 93% | 0.93 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 137.9 | -178.3 | -68.9 | -32.7 | 0 | 0 | 0 | 113.8 | ||
| 73 | G | 39.5 | Very low | 37.4 | Very low | 77 Ų | 77 | 127 Ų | 127 | 79% | 0.794 | 84% | 0.841 | S | S | * | * | trans | -126.3 | 143.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 74 | L | 29.9 | Very low | 37.5 | Very low | 187 Ų | 187 | 128 Ų | 128 | 98% | 0.979 | 84% | 0.84 | S | S | * | * | trans | -71 | 155 | -166.8 | -69.4 | 159.9 | 0 | 0 | 0 | 116 | ||||
| 75 | K | 38.4 | Very low | 37.7 | Very low | 217 Ų | 217 | 128.5 Ų | 128.5 | 94% | 0.943 | 85% | 0.845 | S | S | * | * | trans | -72 | 139.2 | -172.6 | -110.5 | 174.8 | 178.8 | 174.7 | 0 | 115.5 | ||||
| 76 | G | 36.3 | Very low | 37.8 | Very low | 76 Ų | 76 | 129.8 Ų | 129.8 | 78% | 0.784 | 85% | 0.845 | S | S | * | * | trans | -167.1 | 141.4 | 160.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 77 | I | 29.2 | Very low | 37.9 | Very low | 174 Ų | 174 | 130.8 Ų | 130.8 | 89% | 0.892 | 85% | 0.845 | S | S | * | * | trans | -97.8 | 138 | -149.6 | 38.8 | 169.5 | 0 | 0 | 0 | 117.5 | ||||
| 78 | K | 39.3 | Very low | 38.1 | Very low | 214 Ų | 214 | 130.3 Ų | 130.3 | 93% | 0.93 | 84% | 0.84 | S | S | * | * | trans | 62.1 | 115.6 | 149.2 | -155.2 | 174.5 | -176 | -179.9 | 0 | 121.8 | ||||
| 79 | G | 35.9 | Very low | 38.2 | Very low | 67 Ų | 67 | 130 Ų | 130 | 69% | 0.691 | 84% | 0.839 | S | S | * | * | trans | -166.4 | 123.7 | 153.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 80 | D | 31.5 | Very low | 38.3 | Very low | 164 Ų | 164 | 134.9 Ų | 134.9 | 88% | 0.877 | 84% | 0.84 | S | S | * | * | trans | 38.6 | 136.7 | 164.9 | -55.8 | -23.1 | 0 | 0 | 0 | 123.2 | G82 | D80-G82 PolarHBondContact O-N 3.47Š| ||
| 81 | T | 37.2 | Very low | 38.2 | Very low | 154 Ų | 154 | 134.5 Ų | 134.5 | 95% | 0.945 | 84% | 0.837 | S | S | * | * | trans | -61.1 | 102.5 | 171.6 | -51.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 82 | G | 43.5 | Very low | 38.2 | Very low | 68 Ų | 68 | 137.8 Ų | 137.8 | 70% | 0.701 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 149.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | D80 | D80-G82 PolarHBondContact O-N 3.47Š|
| 83 | A | 36.7 | Very low | 38.3 | Very low | 103 Ų | 103 | 139.2 Ų | 139.2 | 85% | 0.851 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 152.6 | -170.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | G85 | A83-G85 PolarHBondContact O-N 3.43Š|
| 84 | I | 41 | Very low | 38.4 | Very low | 166 Ų | 166 | 138.8 Ų | 138.8 | 85% | 0.851 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 124 | 172 | -64.2 | 166.8 | 0 | 0 | 0 | 109.9 | ||
| 85 | G | 42.7 | Very low | 38.7 | Very low | 70 Ų | 70 | 139.2 Ų | 139.2 | 72% | 0.722 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -69 | 138.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | A83 | A83-G85 PolarHBondContact O-N 3.43Š|
| 86 | N | 38.8 | Very low | 38.7 | Very low | 163 Ų | 163 | 136.8 Ų | 136.8 | 87% | 0.872 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 145.5 | -179.3 | -68.6 | -44.9 | 0 | 0 | 0 | 113.3 | ||
| 87 | V | 41.9 | Very low | 38.9 | Very low | 146 Ų | 146 | 136.2 Ų | 136.2 | 89% | 0.885 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -60 | 131.6 | 171.8 | 177.7 | 0 | 0 | 0 | 0 | 110.4 | ||
| 88 | G | 44.8 | Very low | 39.3 | Very low | 58 Ų | 58 | 137.4 Ų | 137.4 | 60% | 0.598 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 146.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 89 | P | 41 | Very low | 39.2 | Very low | 130 Ų | 130 | 137 Ų | 137 | 84% | 0.844 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 136.4 | -176.8 | 26.2 | -33.3 | 0 | 0 | 0 | 112 | G91 | P89-G91 PolarHBondContact O-N 3.41Š|
| 90 | K | 40.6 | Very low | 39.4 | Very low | 203 Ų | 203 | 136.9 Ų | 136.9 | 88% | 0.883 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -58 | 131.4 | 172.3 | -171.6 | 175.2 | -177.7 | 175.7 | 0 | 110.1 | ||
| 91 | G | 42 | Very low | 39.6 | Very low | 70 Ų | 70 | 134.5 Ų | 134.5 | 72% | 0.722 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 140.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | P89 | P89-G91 PolarHBondContact O-N 3.41Š|
| 92 | K | 36.2 | Very low | 39.9 | Very low | 212 Ų | 212 | 133.2 Ų | 133.2 | 92% | 0.922 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -67 | 134.7 | -179.6 | -65.6 | -177.3 | 178.9 | -179.5 | 0 | 110.3 | ||
| 93 | K | 37.7 | Very low | 39.7 | Very low | 204 Ų | 204 | 133.6 Ų | 133.6 | 89% | 0.887 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 131.6 | 171.6 | -173.6 | 179.6 | -179.8 | -176.8 | 0 | 108.8 | ||
| 94 | G | 41.6 | Very low | 39.6 | Very low | 68 Ų | 68 | 138.8 Ų | 138.8 | 70% | 0.701 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -58 | 145.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 95 | E | 36.2 | Very low | 39.3 | Very low | 196 Ų | 196 | 139.9 Ų | 139.9 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 142.4 | 178.2 | -70.9 | -178.9 | 146.3 | 0 | 0 | 111.2 | ||
| 96 | N | 37.8 | Very low | 39.1 | Very low | 167 Ų | 167 | 139.1 Ų | 139.1 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 131 | 178.8 | -163 | 53.6 | 0 | 0 | 0 | 109 | ||
| 97 | G | 41.1 | Very low | 39 | Very low | 63 Ų | 63 | 137.8 Ų | 137.8 | 65% | 0.649 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 145.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | K99 | G97-K99 PolarHBondContact O-N 3.21Š|
| 98 | E | 37.2 | Very low | 38.8 | Very low | 199 Ų | 199 | 140 Ų | 140 | 93% | 0.93 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 135.2 | -178.6 | -67.6 | -172.2 | 151.4 | 0 | 0 | 111.8 | G100 | E98-G100 PolarHBondContact O-N 3.43Š|
| 99 | K | 37.4 | Very low | 38.5 | Very low | 205 Ų | 205 | 140.4 Ų | 140.4 | 89% | 0.891 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 123 | 176.7 | -171.5 | 179.1 | -172.9 | 178.5 | 0 | 108.9 | G97 | G97-K99 PolarHBondContact O-N 3.21Š|
| 100 | G | 41.6 | Very low | 38.1 | Very low | 66 Ų | 66 | 142.5 Ų | 142.5 | 68% | 0.68 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 144.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | E98 | E98-G100 PolarHBondContact O-N 3.43Š|
| 101 | S | 36 | Very low | 37.8 | Very low | 114 Ų | 114 | 141.7 Ų | 141.7 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 143.6 | -176.5 | 45.2 | 0 | 0 | 0 | 0 | 112.2 | G103 | S101-G103 PolarHBondContact O-N 3.25Š|
| 102 | P | 41.7 | Very low | 37.7 | Very low | 127 Ų | 127 | 140.9 Ų | 140.9 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 135.5 | 176.7 | -22.8 | 33.1 | 0 | 0 | 0 | 111.8 | ||
| 103 | G | 39.8 | Very low | 37.6 | Very low | 75 Ų | 75 | 137.1 Ų | 137.1 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 145 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S101 M105 | S101-G103 PolarHBondContact O-N 3.25Å; G103-M105 PolarHBondContact O-N 3.48Å |
| 104 | K | 34.6 | Very low | 37.5 | Very low | 213 Ų | 213 | 135.1 Ų | 135.1 | 93% | 0.926 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 133.9 | -179.4 | -66.8 | -176.6 | 178.6 | -178.8 | 0 | 110.8 | G106 | K104-G106 PolarHBondContact O-N 3.48Š|
| 105 | M | 35.8 | Very low | 37.4 | Very low | 188 Ų | 188 | 135 Ų | 135 | 93% | 0.926 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 129.4 | 175.9 | -174.5 | 161.7 | 68.2 | 0 | 0 | 110.4 | G103 | G103-M105 PolarHBondContact O-N 3.48Š|
| 106 | G | 38.3 | Very low | 37.2 | Very low | 55 Ų | 55 | 134.1 Ų | 134.1 | 57% | 0.567 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 157.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | K104 | K104-G106 PolarHBondContact O-N 3.48Š|
| 107 | P | 36.4 | Very low | 37.2 | Very low | 135 Ų | 135 | 136.1 Ų | 136.1 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 141.9 | -178.4 | 25.3 | -33 | 0 | 0 | 0 | 111.7 | G109 | P107-G109 PolarHBondContact O-N 3.34Š|
| 108 | Q | 37.7 | Very low | 37.2 | Very low | 192 Ų | 192 | 136.4 Ų | 136.4 | 90% | 0.897 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 127.5 | 179.6 | -174.1 | 175.5 | -20.8 | 0 | 0 | 110.5 | ||
| 109 | G | 37.2 | Very low | 36.9 | Very low | 67 Ų | 67 | 132.9 Ų | 132.9 | 69% | 0.691 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 140.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | P107 | P107-G109 PolarHBondContact O-N 3.34Š|
| 110 | I | 32.7 | Very low | 36.7 | Very low | 173 Ų | 173 | 131.7 Ų | 131.7 | 89% | 0.887 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 135.1 | 175.7 | 43.2 | 171.7 | 0 | 0 | 0 | 111.4 | G112 | I110-G112 PolarHBondContact O-N 3.28Š|
| 111 | Q | 36 | Very low | 36.5 | Very low | 186 Ų | 186 | 132.1 Ų | 132.1 | 87% | 0.869 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 125.6 | -179.1 | -172.4 | 173.3 | 13.3 | 0 | 0 | 110.6 | ||
| 112 | G | 37.9 | Very low | 36.3 | Very low | 53 Ų | 53 | 135.1 Ų | 135.1 | 55% | 0.546 | 81% | 0.807 | S | S | . | * | P | Polyproline II helix | trans | -65 | 154.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | I110 | I110-G112 PolarHBondContact O-N 3.28Š|
| 113 | P | 34.8 | Very low | 35.8 | Very low | 134 Ų | 134 | 136.4 Ų | 136.4 | 87% | 0.87 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 143.9 | -176 | 24.9 | -32.7 | 0 | 0 | 0 | 112.5 | G115 | P113-G115 PolarHBondContact O-N 3.22Š|
| 114 | I | 36.7 | Very low | 35.6 | Very low | 162 Ų | 162 | 136.2 Ų | 136.2 | 83% | 0.831 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 125.5 | -177.8 | -64.5 | 168 | 0 | 0 | 0 | 110 | ||
| 115 | G | 38.3 | Very low | 35.4 | Very low | 66 Ų | 66 | 133.8 Ų | 133.8 | 68% | 0.68 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 140.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P113 | P113-G115 PolarHBondContact O-N 3.22Š|
| 116 | I | 33.3 | Very low | 35.3 | Very low | 176 Ų | 176 | 130.2 Ų | 130.2 | 90% | 0.903 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -60 | 134.9 | 178.6 | 37.8 | 172.9 | 0 | 0 | 0 | 112.4 | ||
| 117 | K | 36.3 | Very low | 35.8 | Very low | 209 Ų | 209 | 131.1 Ų | 131.1 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -67 | 123.1 | -173.9 | -174.5 | 177.4 | -177.6 | 177.6 | 0 | 111.7 | ||
| 118 | G | 40.6 | Very low | 35.4 | Very low | 69 Ų | 69 | 130.8 Ų | 130.8 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 141.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 119 | S | 32.6 | Very low | 35 | Very low | 126 Ų | 126 | 130.7 Ų | 130.7 | 88% | 0.881 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 150.6 | -178.6 | 44.8 | 0 | 0 | 0 | 0 | 113.5 | ||
| 120 | K | 31.8 | Very low | 35 | Very low | 180 Ų | 180 | 130.5 Ų | 130.5 | 78% | 0.783 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 125.7 | -167.7 | -169.1 | -176.8 | -177.7 | -167.8 | 0 | 113.6 | ||
| 121 | G | 38.7 | Very low | 34.8 | Very low | 74 Ų | 74 | 131 Ų | 131 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -90.6 | 133 | 154.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 122 | E | 31.6 | Very low | 34.5 | Very low | 178 Ų | 178 | 130 Ų | 130 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 169.2 | -173.7 | -76.4 | -171.4 | 147.5 | 0 | 0 | 115.2 | ||
| 123 | L | 31 | Very low | 34.8 | Very low | 153 Ų | 153 | 130.2 Ų | 130.2 | 80% | 0.801 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -81 | 124.3 | -149.7 | -156.3 | 82.2 | 0 | 0 | 0 | 113.7 | ||
| 124 | G | 35.7 | Very low | 34.6 | Very low | 72 Ų | 72 | 130.8 Ų | 130.8 | 74% | 0.742 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 131.6 | 155.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 125 | L | 29.9 | Very low | 34.2 | Very low | 161 Ų | 161 | 131.6 Ų | 131.6 | 84% | 0.843 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 149.4 | -165 | -69.5 | 161.2 | 0 | 0 | 0 | 116.1 | ||
| 126 | P | 34.6 | Very low | 34.3 | Very low | 113 Ų | 113 | 131.1 Ų | 131.1 | 73% | 0.734 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 134.4 | 179.9 | -18.5 | 30.5 | 0 | 0 | 0 | 113.4 | ||
| 127 | G | 48 | Very low | 34.7 | Very low | 74 Ų | 74 | 128.8 Ų | 128.8 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 160.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 128 | P | 29.1 | Very low | 34.5 | Very low | 129 Ų | 129 | 124.8 Ų | 124.8 | 84% | 0.838 | 78% | 0.782 | S | S | * | * | trans | -112 | 145.8 | 160.1 | 36 | -24.6 | 0 | 0 | 0 | 109 | ||||
| 129 | Q | 28.9 | Very low | 34.3 | Very low | 189 Ų | 189 | 124.9 Ų | 124.9 | 88% | 0.883 | 78% | 0.783 | S | S | * | * | cis | -151.9 | 143.7 | 4.3 | 174.5 | 176.5 | -11.4 | 0 | 0 | 105.6 | ||||
| 130 | G | 35.9 | Very low | 34.2 | Very low | 64 Ų | 64 | 124.4 Ų | 124.4 | 66% | 0.66 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 157.2 | -177 | 0 | 0 | 0 | 0 | 0 | 113.7 | K132 | G130-K132 PolarHBondContact O-N 3.48Å; G130-K132 VanDerWaalsContact O-N 3.09Å |
| 131 | L | 29.3 | Very low | 34.2 | Very low | 183 Ų | 183 | 125.2 Ų | 125.2 | 96% | 0.958 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 117.7 | 163.6 | -78 | 167.3 | 0 | 0 | 0 | 108.4 | G133 | L131-G133 PolarHBondContact O-N 3.46Š|
| 132 | K | 29.1 | Very low | 34.1 | Very low | 166 Ų | 166 | 125 Ų | 125 | 72% | 0.722 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 117.3 | 169.6 | -177.2 | -178.2 | -177 | -174.5 | 0 | 109.5 | G130 D134 | G130-K132 PolarHBondContact O-N 3.48Å; G130-K132 VanDerWaalsContact O-N 3.09Å; K132-D134 VanDerWaalsContact CE-O 3.28Å; K132-D134 WeakPolarHBondContact CE-O 3.28Å |
| 133 | G | 44 | Very low | 34 | Very low | 57 Ų | 57 | 123 Ų | 123 | 59% | 0.588 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 130 | 134.3 | 0 | 0 | 0 | 0 | 0 | 106.7 | L131 | L131-G133 PolarHBondContact O-N 3.46Š|
| 134 | D | 30.4 | Very low | 34.3 | Very low | 145 Ų | 145 | 125.5 Ų | 125.5 | 78% | 0.775 | 79% | 0.788 | S | S | * | * | trans | 164.5 | 142.8 | 149 | -77.6 | -18.3 | 0 | 0 | 0 | 112.6 | K132 | K132-D134 VanDerWaalsContact CE-O 3.28Å; K132-D134 WeakPolarHBondContact CE-O 3.28Å | ||
| 135 | L | 28.6 | Very low | 34.2 | Very low | 180 Ų | 180 | 125.3 Ų | 125.3 | 94% | 0.942 | 79% | 0.786 | S | S | * | * | trans | -81.9 | 131.9 | -174.3 | -175.1 | 82.9 | 0 | 0 | 0 | 113.9 | ||||
| 136 | G | 41.3 | Very low | 34 | Very low | 56 Ų | 56 | 125.6 Ų | 125.6 | 58% | 0.577 | 78% | 0.783 | S | S | * | * | trans | 61.2 | 173.9 | 160.7 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 137 | P | 41.8 | Very low | 33.5 | Very low | 126 Ų | 126 | 126.2 Ų | 126.2 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | cis | -118.4 | -168.9 | -31.5 | 35.4 | -14.9 | 0 | 0 | 0 | 109.9 | ||||
| 138 | P | 32.3 | Very low | 32.8 | Very low | 126 Ų | 126 | 126.3 Ų | 126.3 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | -154.2 | 161.2 | 84.7 | 31.1 | -6.5 | 0 | 0 | 0 | 116.5 | |||||
| 139 | G | 34.7 | Very low | 32.6 | Very low | 70 Ų | 70 | 126.4 Ų | 126.4 | 72% | 0.722 | 77% | 0.772 | S | S | * | * | trans | -65.5 | 156.9 | -179 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 140 | P | 32 | Very low | 32.7 | Very low | 117 Ų | 117 | 127 Ų | 127 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | trans | -78.7 | 160.9 | -157.1 | 33.9 | -36.3 | 0 | 0 | 0 | 114.3 | ||||
| 141 | H | 31.8 | Very low | 33.1 | Very low | 197 Ų | 197 | 126.9 Ų | 126.9 | 91% | 0.912 | 77% | 0.765 | S | S | * | * | trans | 75.7 | 132.8 | 147.9 | -97.5 | 67.2 | 0 | 0 | 0 | 121.1 | ||||
| 142 | G | 36.7 | Very low | 33.1 | Very low | 68 Ų | 68 | 125.5 Ų | 125.5 | 70% | 0.701 | 76% | 0.758 | S | S | * | * | trans | 93.9 | 122.9 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 143 | P | 29.7 | Very low | 33.3 | Very low | 136 Ų | 136 | 128.8 Ų | 128.8 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | cis | -124.5 | 162.6 | 44 | 21.6 | -0.7 | 0 | 0 | 0 | 115.4 | ||||
| 144 | K | 36.5 | Very low | 32.7 | Very low | 207 Ų | 207 | 129 Ų | 129 | 90% | 0.9 | 77% | 0.769 | S | S | * | * | trans | -85.8 | 146.5 | 172.8 | -178.4 | -177.8 | -178.9 | -177.5 | 0 | 109.4 | ||||
| 145 | G | 33.3 | Very low | 32.6 | Very low | 68 Ų | 68 | 130.4 Ų | 130.4 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | trans | 89.7 | 150.2 | 162.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 146 | E | 26.6 | Very low | 32.7 | Very low | 167 Ų | 167 | 131.2 Ų | 131.2 | 78% | 0.78 | 77% | 0.774 | S | S | * | * | cis | -155.2 | 139.6 | -1.8 | -108.3 | -176.7 | 176.2 | 0 | 0 | 103.7 | ||||
| 147 | I | 23.1 | Very low | 32.5 | Very low | 126 Ų | 126 | 131.9 Ų | 131.9 | 65% | 0.646 | 78% | 0.78 | S | S | * | * | 48.8 | 103.8 | 109.9 | -53.7 | 174.6 | 0 | 0 | 0 | 111.1 | L149 | I147-L149 HydrophobicContact CG2-CB 4.17Å; I147-L149 HydrophobicContact CG2-CD1 4.32Å; I147-L149 HydrophobicContact CG2-CG 4.03Å; I147-L149 PolarHBondContact O-N 3.45Å | |||
| 148 | G | 33.9 | Very low | 32.3 | Very low | 75 Ų | 75 | 132.1 Ų | 132.1 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | trans | -59.5 | 128.1 | 153.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 149 | L | 25.5 | Very low | 32.1 | Very low | 132 Ų | 132 | 134 Ų | 134 | 69% | 0.691 | 78% | 0.784 | S | S | * | * | trans | -166.1 | 129.7 | 157.8 | -95.3 | -168 | 0 | 0 | 0 | 105.8 | I147 | I147-L149 HydrophobicContact CG2-CB 4.17Å; I147-L149 HydrophobicContact CG2-CD1 4.32Å; I147-L149 HydrophobicContact CG2-CG 4.03Å; I147-L149 PolarHBondContact O-N 3.45Å | ||
| 150 | R | 30.4 | Very low | 32.3 | Very low | 201 Ų | 201 | 133.6 Ų | 133.6 | 76% | 0.758 | 78% | 0.779 | S | S | * | * | 83.3 | 111.8 | 108.6 | -165.6 | -178 | -151.9 | 174.3 | 5.1 | 109.8 | |||||
| 151 | G | 43.2 | Very low | 32.4 | Very low | 61 Ų | 61 | 133.9 Ų | 133.9 | 63% | 0.629 | 78% | 0.782 | S | S | * | * | cis | 106.5 | 174.8 | 38.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 152 | D | 31.2 | Very low | 32.5 | Very low | 155 Ų | 155 | 129.9 Ų | 129.9 | 83% | 0.829 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -139 | 113.4 | 151.2 | -82.6 | -47.4 | 0 | 0 | 0 | 104.7 | ||
| 153 | R | 31.3 | Very low | 32.6 | Very low | 234 Ų | 234 | 130.3 Ų | 130.3 | 88% | 0.883 | 78% | 0.778 | S | S | * | * | 84.6 | 121.7 | 87.6 | -160.7 | -178 | -165.8 | -170.6 | 4.1 | 109 | |||||
| 154 | G | 32.8 | Very low | 32.7 | Very low | 63 Ų | 63 | 132.6 Ų | 132.6 | 65% | 0.649 | 77% | 0.774 | S | S | * | * | cis | -172 | 164.7 | 0.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 155 | I | 28.1 | Very low | 33.1 | Very low | 173 Ų | 173 | 128.6 Ų | 128.6 | 89% | 0.887 | 77% | 0.769 | S | S | * | * | trans | -133.2 | 128 | 162.3 | 12.8 | 172 | 0 | 0 | 0 | 105.5 | ||||
| 156 | Q | 30.2 | Very low | 33.4 | Very low | 198 Ų | 198 | 128.4 Ų | 128.4 | 93% | 0.925 | 77% | 0.767 | S | S | * | * | trans | -92.2 | 124.9 | 175.7 | -172 | 171.8 | 11.5 | 0 | 0 | 107.4 | ||||
| 157 | G | 37.2 | Very low | 33.9 | Very low | 69 Ų | 69 | 126.9 Ų | 126.9 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | trans | -70.6 | -179.5 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 158 | P | 38.5 | Very low | 34.7 | Very low | 131 Ų | 131 | 130.7 Ų | 130.7 | 85% | 0.851 | 78% | 0.784 | S | S | * | * | cis | -119.3 | -168.4 | 25 | 30.8 | -8.7 | 0 | 0 | 0 | 112.1 | ||||
| 159 | L | 26.6 | Very low | 35.3 | Very low | 166 Ų | 166 | 130.4 Ų | 130.4 | 87% | 0.869 | 78% | 0.781 | S | S | * | * | cis | -155.7 | 151.5 | 30.9 | -174.4 | 85.3 | 0 | 0 | 0 | 108.3 | ||||
| 160 | G | 39.1 | Very low | 35.9 | Very low | 61 Ų | 61 | 133.5 Ų | 133.5 | 63% | 0.629 | 79% | 0.792 | S | S | * | * | trans | -77.9 | -178.9 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 161 | P | 34.3 | Very low | 36.3 | Very low | 124 Ų | 124 | 131.9 Ų | 131.9 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | cis | -116.3 | -172.2 | -0.9 | 43.7 | -28.1 | 0 | 0 | 0 | 110.6 | ||||
| 162 | P | 34.3 | Very low | 36.2 | Very low | 112 Ų | 112 | 132 Ų | 132 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | -146.5 | 159.5 | 74.7 | 23.2 | 2.3 | 0 | 0 | 0 | 115.6 | |||||
| 163 | G | 39.9 | Very low | 36.6 | Very low | 78 Ų | 78 | 131.2 Ų | 131.2 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -68.7 | 150.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 164 | K | 30.6 | Very low | 37.4 | Very low | 183 Ų | 183 | 125.5 Ų | 125.5 | 80% | 0.796 | 79% | 0.792 | S | S | * | * | trans | -158.9 | 170.2 | 175.6 | -58.9 | -172.5 | -178.8 | -178.4 | 0 | 107.8 | ||||
| 165 | P | 44.4 | Very low | 37.9 | Very low | 123 Ų | 123 | 126 Ų | 126 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | cis | -122.9 | 166.1 | -16.4 | 6.9 | 18.6 | 0 | 0 | 0 | 112.4 | ||||
| 166 | G | 40.9 | Very low | 38.2 | Very low | 65 Ų | 65 | 127 Ų | 127 | 67% | 0.67 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 162.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 167 | P | 35.6 | Very low | 38.8 | Very low | 135 Ų | 135 | 127.2 Ų | 127.2 | 88% | 0.877 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 142.3 | -172.6 | 24.4 | -33.1 | 0 | 0 | 0 | 112.4 | G169 | P167-G169 PolarHBondContact O-N 3.28Š|
| 168 | K | 41 | Very low | 39.1 | Very low | 206 Ų | 206 | 127.3 Ų | 127.3 | 90% | 0.896 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 123.1 | -179.4 | -167.3 | 178 | -177 | -178.2 | 0 | 109.9 | ||
| 169 | G | 46.4 | Very low | 39 | Very low | 69 Ų | 69 | 128.8 Ų | 128.8 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 143.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | P167 | P167-G169 PolarHBondContact O-N 3.28Š|
| 170 | E | 37.3 | Very low | 39.7 | Very low | 197 Ų | 197 | 128.5 Ų | 128.5 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 144.2 | -178.2 | -67.9 | -178.5 | 161.5 | 0 | 0 | 112 | G172 | E170-G172 PolarHBondContact O-N 3.44Š|
| 171 | L | 38.5 | Very low | 39.8 | Very low | 167 Ų | 167 | 128.9 Ų | 128.9 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 120.7 | 179.5 | -169.5 | 74.9 | 0 | 0 | 0 | 109.4 | V173 | L171-V173 PolarHBondContact O-N 3.4Š|
| 172 | G | 41.6 | Very low | 40.1 | Very low | 63 Ų | 63 | 134 Ų | 134 | 65% | 0.649 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 132.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | E170 | E170-G172 PolarHBondContact O-N 3.44Š|
| 173 | V | 38.9 | Very low | 40.5 | Very low | 139 Ų | 139 | 140.3 Ų | 140.3 | 84% | 0.842 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 133.3 | -179.5 | -112.3 | 0 | 0 | 0 | 0 | 110.7 | L171 G175 | L171-V173 PolarHBondContact O-N 3.4Å; V173-G175 PolarHBondContact O-N 3.45Å |
| 174 | P | 49.3 | Very low | 40.8 | Very low | 114 Ų | 114 | 139.8 Ų | 139.8 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 131.3 | 175.3 | -24.4 | 33.5 | 0 | 0 | 0 | 111.6 | ||
| 175 | G | 42.8 | Very low | 41.5 | Very low | 74 Ų | 74 | 140.5 Ų | 140.5 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 140.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | V173 K177 | V173-G175 PolarHBondContact O-N 3.45Å; G175-K177 PolarHBondContact O-N 3.42Å |
| 176 | H | 35.3 | Very low | 41.7 | Very low | 194 Ų | 194 | 146.1 Ų | 146.1 | 90% | 0.898 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 135.7 | -177.8 | -63.2 | -60.3 | 0 | 0 | 0 | 112 | G178 | H176-G178 PolarHBondContact O-N 2.88Š|
| 177 | K | 41.3 | Very low | 41.9 | Very low | 201 Ų | 201 | 146.2 Ų | 146.2 | 87% | 0.874 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 123.7 | 178.2 | -146.5 | 176 | -170.8 | 178.7 | 0 | 109.3 | G175 | G175-K177 PolarHBondContact O-N 3.42Š|
| 178 | G | 43.5 | Very low | 42.7 | Very low | 71 Ų | 71 | 146.7 Ų | 146.7 | 73% | 0.732 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 139.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | H176 | H176-G178 PolarHBondContact O-N 2.88Š|
| 179 | N | 38.1 | Very low | 43.6 | Very low | 162 Ų | 162 | 148.4 Ų | 148.4 | 87% | 0.866 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 139.3 | -178.6 | -66.7 | -20.4 | 0 | 0 | 0 | 111.4 | G181 | N179-G181 PolarHBondContact O-N 3.45Š|
| 180 | I | 40.5 | Very low | 43.9 | Very low | 160 Ų | 160 | 148.3 Ų | 148.3 | 82% | 0.821 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 126.6 | 176.3 | -60.8 | 171.2 | 0 | 0 | 0 | 108.9 | ||
| 181 | G | 41.2 | Very low | 45 | Very low | 69 Ų | 69 | 148.3 Ų | 148.3 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 132.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | N179 | N179-G181 PolarHBondContact O-N 3.45Š|
| 182 | Y | 40.6 | Very low | 46.2 | Very low | 233 Ų | 233 | 150 Ų | 150 | 91% | 0.914 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 139.3 | 178.8 | -66.9 | -80.5 | 0 | 0 | 0 | 111.5 | G184 | Y182-G184 PolarHBondContact O-N 3.12Š|
| 183 | R | 42.7 | Very low | 47.2 | Very low | 243 Ų | 243 | 150.1 Ų | 150.1 | 92% | 0.917 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 126.9 | 175.9 | 179.7 | -179.1 | -74.2 | -141.7 | -1.3 | 109.4 | ||
| 184 | G | 46 | Very low | 48.6 | Very low | 68 Ų | 68 | 152.9 Ų | 152.9 | 70% | 0.701 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 147.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y182 | Y182-G184 PolarHBondContact O-N 3.12Š|
| 185 | E | 44.5 | Very low | 49.7 | Very low | 197 Ų | 197 | 153.3 Ų | 153.3 | 92% | 0.921 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -66 | 142.4 | -178.7 | -66.7 | -172.2 | 162 | 0 | 0 | 111.9 | G187 | E185-G187 PolarHBondContact O-N 2.88Š|
| 186 | R | 49.6 | Very low | 50.9 | Low | 242 Ų | 242 | 152.9 Ų | 152.9 | 91% | 0.913 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 127.2 | 178.7 | -178.1 | -177.1 | -65.9 | 176.6 | -0.5 | 109.2 | ||
| 187 | G | 45.4 | Very low | 52.7 | Low | 67 Ų | 67 | 153.1 Ų | 153.1 | 69% | 0.691 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 148.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | E185 | E185-G187 PolarHBondContact O-N 2.88Š|
| 188 | T | 51.4 | Low | 54.1 | Low | 144 Ų | 144 | 152.9 Ų | 152.9 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 147 | -178.7 | 50.1 | 0 | 0 | 0 | 0 | 111.4 | G190 | T188-G190 PolarHBondContact O-N 2.91Š|
| 189 | R | 59.5 | Low | 55.1 | Low | 243 Ų | 243 | 152.5 Ų | 152.5 | 92% | 0.917 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 129 | 176.6 | -176.4 | 177.6 | -178 | 173.4 | 1.3 | 108.9 | ||
| 190 | G | 52.8 | Low | 56.6 | Low | 66 Ų | 66 | 153.9 Ų | 153.9 | 68% | 0.68 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -57 | 147.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | T188 | T188-G190 PolarHBondContact O-N 2.91Š|
| 191 | E | 60.6 | Low | 57.9 | Low | 197 Ų | 197 | 150.9 Ų | 150.9 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 143.3 | -178.9 | -65.8 | -173.3 | 152.5 | 0 | 0 | 111.3 | G193 | E191-G193 PolarHBondContact O-N 2.7Š|
| 192 | K | 65.3 | Low | 59.1 | Low | 204 Ų | 204 | 153 Ų | 153 | 89% | 0.887 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 125.2 | 177.5 | -175.2 | -179 | 178.9 | -175.8 | 0 | 108 | ||
| 193 | G | 61.7 | Low | 60.7 | Low | 65 Ų | 65 | 148.6 Ų | 148.6 | 67% | 0.67 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 145.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | E191 | E191-G193 PolarHBondContact O-N 2.7Š|
| 194 | E | 68.7 | Low | 62.2 | Low | 197 Ų | 197 | 143.3 Ų | 143.3 | 92% | 0.921 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -61 | 142.2 | 179.3 | -67.2 | -175.6 | 156.1 | 0 | 0 | 111 | G196 | E194-G196 PolarHBondContact O-N 2.99Š|
| 195 | S | 71.8 | Confident | 64 | Low | 122 Ų | 122 | 142.3 Ų | 142.3 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 130 | 175.7 | -167.2 | 0 | 0 | 0 | 0 | 108.7 | ||
| 196 | G | 69.3 | Low | 66.3 | Low | 66 Ų | 66 | 140.2 Ų | 140.2 | 68% | 0.68 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 147.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | E194 K198 | E194-G196 PolarHBondContact O-N 2.99Å; G196-K198 PolarHBondContact O-N 3.24Å |
| 197 | E | 72.7 | Confident | 68.6 | Low | 198 Ų | 198 | 128.9 Ų | 128.9 | 93% | 0.925 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 137.2 | 177.6 | -66.5 | -173.9 | 155.1 | 0 | 0 | 110.5 | G199 | E197-G199 PolarHBondContact O-N 3.39Å; E197-G199 VanDerWaalsContact O-N 3.12Å |
| 198 | K | 70.1 | Confident | 71 | Confident | 197 Ų | 197 | 126.8 Ų | 126.8 | 86% | 0.857 | 71% | 0.708 | S | S | * | * | trans | -64.8 | 115 | 177.3 | -171.6 | -178.4 | -173.8 | -176.5 | 0 | 108 | G196 | G196-K198 PolarHBondContact O-N 3.24Š| ||
| 199 | G | 64.9 | Low | 73.3 | Confident | 62 Ų | 62 | 120.1 Ų | 120.1 | 64% | 0.639 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 142.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | E197 | E197-G199 PolarHBondContact O-N 3.39Å; E197-G199 VanDerWaalsContact O-N 3.12Å |
| 200 | E | 69.9 | Low | 75.1 | Confident | 191 Ų | 191 | 109.8 Ų | 109.8 | 89% | 0.893 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 139.4 | 178.7 | -69.7 | -173.9 | 159.2 | 0 | 0 | 110.8 | ||
| 201 | S | 67.5 | Low | 77.3 | Confident | 98 Ų | 98 | 106.6 Ų | 106.6 | 69% | 0.685 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 128.7 | 176.2 | -54.9 | 0 | 0 | 0 | 0 | 108.5 | V203 | S201-V203 PolarHBondContact O-N 2.77Å; S201-V203 VanDerWaalsContact O-N 3.14Å |
| 202 | P | 67.1 | Low | 79.1 | Confident | 114 Ų | 114 | 97.2 Ų | 97.2 | 74% | 0.74 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 123.1 | -179.3 | 20.2 | -29.4 | 0 | 0 | 0 | 109.8 | I204 | P202-I204 PolarHBondContact O-N 2.94Å; P202-I204 VanDerWaalsContact O-N 3.08Å |
| 203 | V | 72.8 | Confident | 80.5 | Confident | 140 Ų | 140 | 87.6 Ų | 87.6 | 85% | 0.848 | 51% | 0.513 | S | S | * | . | trans | -73.4 | 100.3 | 174.9 | -179.8 | 0 | 0 | 0 | 0 | 107.4 | S201 P205 | S201-V203 PolarHBondContact O-N 2.77Å; S201-V203 VanDerWaalsContact O-N 3.14Å; V203-P205 WeakPolarHBondContact O-CD 3.32Å | ||
| 204 | I | 74.3 | Confident | 82 | Confident | 131 Ų | 131 | 86.1 Ų | 86.1 | 67% | 0.672 | 49% | 0.491 | S | S | * | . | P | Polyproline II helix | trans | -75.5 | 119.4 | 177.9 | -57 | 171.6 | 0 | 0 | 0 | 108.1 | P202 K206 | P202-I204 PolarHBondContact O-N 2.94Å; P202-I204 VanDerWaalsContact O-N 3.08Å; I204-K206 PolarHBondContact O-N 2.85Å |
| 205 | P | 84.9 | Confident | 83 | Confident | 47 Ų | 47 | 79.4 Ų | 79.4 | 31% | 0.305 | 47% | 0.47 | S | S | . | . | P | Polyproline II helix | trans | -60.9 | 125.2 | 176.1 | 23.6 | -31.5 | 0 | 0 | 0 | 109.5 | V203 V250 I333 | V203-P205 WeakPolarHBondContact O-CD 3.32Å; P205-V250 HydrophobicContact CB-CG1 4.21Å; P205-V250 HydrophobicContact CB-CG2 4.27Å; P205-V250 HydrophobicContact CG-CG1 4.38Å; P205-I333 HydrophobicContact CB-CD1 4.47Å; P205-I333 HydrophobicContact CG-CD1 4.16Å; P205-I333 WeakPolarHBondContact O-CG2 3.39Å |
| 206 | K | 92.5 | Very high | 83.8 | Confident | 154 Ų | 154 | 85.1 Ų | 85.1 | 67% | 0.67 | 47% | 0.472 | S | S | * | . | P | Polyproline II helix | trans | -96.4 | 125.5 | 177.3 | -65.8 | -177.9 | -177.2 | 178.4 | 0 | 109.2 | I204 | I204-K206 PolarHBondContact O-N 2.85Š|
| 207 | S | 96.6 | Very high | 84.7 | Confident | 4 Ų | 4 | 83 Ų | 83 | 3% | 0.028 | 45% | 0.447 | C | S | . | . | trans | -154.1 | 109.9 | 167.9 | 175.1 | 0 | 0 | 0 | 0 | 109.1 | H238 Y246 F332 I333 | S207-H238 WeakPolarHBondContact CB-ND1 3.24Å; S207-H238 PolarHBondContact OG-ND1 2.83Å; S207-Y246 PolarHBondContact OG-OH 3.07Å; S207-F332 CarbonylContact O-C 3.53Å; S207-F332 WeakPolarHBondContact O-CA 3.45Å; S207-I333 PolarHBondContact O-N 3.36Å | ||
| 208 | A | 97.6 | Very high | 85.3 | Confident | 23 Ų | 23 | 76.1 Ų | 76.1 | 19% | 0.19 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149 | 155 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y233 Q236 G331 F332 | A208-Y233 HydrophobicContact CB-CD1 4.08Å; A208-Y233 HydrophobicContact CB-CE1 3.77Å; A208-Y233 WeakPolarHBondContact O-CD1 3.24Å; A208-Y233 WeakPolarHBondContact O-CE1 3.39Å; A208-Q236 PolarHBondContact O-OE1 2.92Å; A208-G331 CarbonylContact C-O 3.59Å; A208-G331 VanDerWaalsContact CA-O 3.22Å; A208-G331 WeakPolarHBondContact CA-O 3.31Å; A208-F332 HydrophobicContact CB-CB 3.55Å |
| 209 | F | 98.5 | Very high | 86 | Confident | 4 Ų | 4 | 71.9 Ų | 71.9 | 2% | 0.018 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.3 | 153.4 | 167.7 | 73.2 | -78.5 | 0 | 0 | 0 | 109.9 | V211 Y233 Y239 Y246 F256 F329 S330 G331 | F209-V211 HydrophobicContact CD2-CG1 4.31Å; F209-V211 HydrophobicContact CD2-CG2 3.94Å; F209-V211 HydrophobicContact CE2-CG2 4.1Å; F209-Y233 CarbonylContact C-O 3.57Å; F209-Y233 WeakPolarHBondContact CA-O 3.48Å; F209-Y239 HydrophobicContact CB-CG 4.41Å; F209-Y239 AromaticContact CD2-CD2 3.68Å; F209-Y239 HydrophobicContact CD2-CD2 3.68Å; F209-Y239 HydrophobicContact CD2-CE2 4.42Å; F209-Y239 AromaticContact CD2-CG 3.81Å; F209-Y239 HydrophobicContact CD2-CG 3.81Å; F209-Y239 AromaticContact CE2-CD2 3.76Å; F209-Y239 HydrophobicContact CE2-CD2 3.76Å; F209-Y239 HydrophobicContact CE2-CE2 4.26Å; F209-Y239 HydrophobicContact CE2-CG 4.36Å; F209-Y239 HydrophobicContact CG-CD2 4.25Å; F209-Y239 HydrophobicContact CG-CG 4.13Å; F209-Y239 HydrophobicContact CZ-CD2 4.38Å; F209-Y246 AromaticContact CD1-CD2 3.26Å; F209-Y246 HydrophobicContact CD1-CD2 3.26Å; F209-Y246 AromaticContact CD1-CE2 3.86Å; F209-Y246 HydrophobicContact CD1-CE2 3.86Å; F209-Y246 AromaticContact CD1-CG 3.92Å; F209-Y246 HydrophobicContact CD1-CG 3.92Å; F209-Y246 HydrophobicContact CE1-CD1 4.39Å; F209-Y246 AromaticContact CE1-CD2 3.42Å; F209-Y246 HydrophobicContact CE1-CD2 3.42Å; F209-Y246 VanDerWaalsContact CE1-CD2 3.42Å; F209-Y246 HydrophobicContact CE1-CE2 4.19Å; F209-Y246 AromaticContact CE1-CG 3.55Å; F209-Y246 HydrophobicContact CE1-CG 3.55Å; F209-Y246 HydrophobicContact CG-CD2 4.26Å; F209-Y246 HydrophobicContact CZ-CG 4.39Å; F209-F256 HydrophobicContact CE1-CD1 4.13Å; F209-F256 AromaticContact CE1-CE1 3.76Å; F209-F256 HydrophobicContact CE1-CE1 3.76Å; F209-F256 HydrophobicContact CZ-CD1 4.09Å; F209-F256 HydrophobicContact CZ-CE1 4.07Å; F209-F329 AromaticContact CE2-CD1 3.54Å; F209-F329 HydrophobicContact CE2-CD1 3.54Å; F209-F329 AromaticContact CE2-CE1 3.61Å; F209-F329 HydrophobicContact CE2-CE1 3.61Å; F209-F329 HydrophobicContact CE2-CG 4.07Å; F209-F329 HydrophobicContact CE2-CZ 4.22Å; F209-F329 AromaticContact CZ-CD1 3.89Å; F209-F329 HydrophobicContact CZ-CD1 3.89Å; F209-F329 AromaticContact CZ-CE1 3.47Å; F209-F329 HydrophobicContact CZ-CE1 3.47Å; F209-F329 VanDerWaalsContact CZ-CE1 3.47Å; F209-F329 HydrophobicContact CZ-CE2 4.26Å; F209-F329 HydrophobicContact CZ-CG 4.44Å; F209-F329 AromaticContact CZ-CZ 3.69Å; F209-F329 HydrophobicContact CZ-CZ 3.69Å; F209-S330 CarbonylContact O-C 3.52Å; F209-S330 VanDerWaalsContact O-CA 3.31Å; F209-S330 WeakPolarHBondContact O-CA 3.49Å; F209-G331 WeakPolarHBondContact CD1-O 3.45Å; F209-G331 PolarHBondContact N-O 2.94Å; F209-G331 PolarHBondContact O-N 2.88Å |
| 210 | S | 98.4 | Very high | 87.1 | Confident | 25 Ų | 25 | 69.3 Ų | 69.3 | 18% | 0.175 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.9 | 124.9 | 169.7 | -173.4 | 0 | 0 | 0 | 0 | 107.1 | I232 Y233 S330 | S210-I232 WeakPolarHBondContact O-CA 3.23Å; S210-I232 VanDerWaalsContact O-CB 3.32Å; S210-I232 WeakPolarHBondContact O-CB 3.46Å; S210-I232 PolarHBondContact O-N 2.81Å; S210-Y233 PolarHBondContact N-O 2.62Å; S210-Y233 PolarHBondContact O-N 2.79Å; S210-S330 WeakPolarHBondContact CB-OG 2.85Å; S210-S330 PolarHBondContact OG-OG 3.04Å |
| 211 | V | 98.3 | Very high | 87.8 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.9 | 152.3 | -171.5 | -66.5 | 0 | 0 | 0 | 0 | 110.4 | F209 F228 K230 I231 Y239 T328 F329 | F209-V211 HydrophobicContact CD2-CG1 4.31Å; F209-V211 HydrophobicContact CD2-CG2 3.94Å; F209-V211 HydrophobicContact CE2-CG2 4.1Å; V211-F228 HydrophobicContact CB-CB 3.59Å; V211-F228 HydrophobicContact CB-CG 4.43Å; V211-F228 HydrophobicContact CG2-CB 3.34Å; V211-F228 HydrophobicContact CG2-CD1 4.41Å; V211-F228 HydrophobicContact CG2-CD2 4.13Å; V211-F228 HydrophobicContact CG2-CG 3.74Å; V211-K230 CarbonylContact C-O 3.54Å; V211-K230 VanDerWaalsContact CA-O 3.24Å; V211-K230 WeakPolarHBondContact CA-O 3.41Å; V211-I231 HydrophobicContact CG1-CD1 3.67Å; V211-Y239 HydrophobicContact CB-CE1 4.22Å; V211-Y239 HydrophobicContact CG1-CD1 3.69Å; V211-Y239 HydrophobicContact CG1-CE1 3.67Å; V211-Y239 HydrophobicContact CG1-CG 4.33Å; V211-Y239 HydrophobicContact CG2-CE1 4.04Å; V211-Y239 HydrophobicContact CG2-CE2 4.09Å; V211-T328 CarbonylContact O-C 3.51Å; V211-T328 VanDerWaalsContact O-CA 3.27Å; V211-T328 WeakPolarHBondContact O-CA 3.21Å; V211-F329 HydrophobicContact CG2-CB 4.26Å; V211-F329 VanDerWaalsContact CG2-O 3.26Å; V211-F329 WeakPolarHBondContact CG2-O 3.47Å; V211-F329 PolarHBondContact N-O 2.67Å; V211-F329 PolarHBondContact O-N 3.25Å |
| 212 | G | 97.3 | Very high | 88.6 | Confident | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 161.2 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | F228 D229 K230 T327 | G212-F228 CarbonylContact O-C 3.47Å; G212-F228 WeakPolarHBondContact O-CA 3.48Å; G212-F228 WeakPolarHBondContact O-CB 3.38Å; G212-D229 PolarHBondContact O-N 3.09Å; G212-K230 PolarHBondContact N-O 2.87Å; G212-K230 WeakPolarHBondContact O-CB 3.22Å; G212-K230 PolarHBondContact O-N 2.98Å; G212-T327 CarbonylContact C-O 3.58Å; G212-T327 VanDerWaalsContact CA-O 3.23Å; G212-T327 WeakPolarHBondContact CA-O 3.31Å |
| 213 | L | 96.2 | Very high | 89.4 | Confident | 1 Ų | 1 | 59.2 Ų | 59.2 | 1% | 0.005 | 32% | 0.317 | C | S | . | . | trans | -75.3 | 160.3 | 166.1 | -71 | 178.2 | 0 | 0 | 0 | 110.3 | S217 I226 F228 L319 A321 T327 | L213-S217 WeakPolarHBondContact CD2-OG 3.36Å; L213-I226 HydrophobicContact CD1-CG2 4.44Å; L213-I226 HydrophobicContact CD2-CG2 3.73Å; L213-I226 HydrophobicContact CG-CG2 4.49Å; L213-F228 HydrophobicContact CD1-CE1 4.5Å; L213-F228 HydrophobicContact CD2-CD1 3.93Å; L213-F228 HydrophobicContact CD2-CE1 4.25Å; L213-F228 HydrophobicContact CD2-CG 4.35Å; L213-F228 HydrophobicContact CG-CD1 3.78Å; L213-F228 HydrophobicContact CG-CE1 3.89Å; L213-L319 HydrophobicContact CD1-CB 3.92Å; L213-L319 HydrophobicContact CD1-CD2 3.97Å; L213-A321 HydrophobicContact CB-CB 3.64Å; L213-T327 HydrophobicContact CD1-CG2 3.5Å; L213-T327 VanDerWaalsContact CD1-CG2 3.5Å; L213-T327 HydrophobicContact CG-CG2 4.02Å; L213-T327 PolarHBondContact N-O 3.37Å | ||
| 214 | T | 93.3 | Very high | 90.2 | Very high | 34 Ų | 34 | 58.7 Ų | 58.7 | 21% | 0.209 | 30% | 0.304 | C | S | . | . | trans | -119 | 169.1 | 167.2 | 68.2 | 0 | 0 | 0 | 0 | 109.2 | R216 S217 K218 D229 K230 | T214-R216 PolarHBondContact O-N 3.03Å; T214-R216 PolarHBondContact OG1-N 2.82Å; T214-S217 PolarHBondContact N-OG 2.78Å; T214-S217 PolarHBondContact O-N 2.82Å; T214-S217 PolarHBondContact O-OG 3.3Å; T214-S217 PolarHBondContact OG1-OG 2.85Å; T214-K218 PolarHBondContact O-N 3.47Å; T214-D229 VanDerWaalsContact CG2-CG 3.49Å; T214-D229 WeakPolarHBondContact CG2-OD1 3.43Å; T214-D229 WeakPolarHBondContact CG2-OD2 3.31Å; T214-D229 PolarHBondContact N-OD1 2.83Å; T214-D229 PolarHBondContact OG1-OD1 2.83Å; T214-D229 PolarHBondContact OG1-OD2 2.82Å; T214-K230 HydrophobicContact CG2-CB 3.93Å | ||
| 215 | A | 89.5 | Confident | 91.1 | Very high | 57 Ų | 57 | 53.3 Ų | 53.3 | 47% | 0.471 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | -20.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | A321 | A215-A321 WeakPolarHBondContact CA-O 3.38Š|
| 216 | R | 88.4 | Confident | 91.6 | Very high | 241 Ų | 241 | 51.1 Ų | 51.1 | 91% | 0.909 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -26.5 | 179.6 | -58.6 | -179.5 | -175.3 | -172.4 | 1.8 | 113.4 | T214 | T214-R216 PolarHBondContact O-N 3.03Å; T214-R216 PolarHBondContact OG1-N 2.82Å |
| 217 | S | 87.9 | Confident | 91.8 | Very high | 21 Ų | 21 | 50.2 Ų | 50.2 | 15% | 0.147 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.3 | -2.5 | -174.7 | 56.8 | 0 | 0 | 0 | 0 | 114 | L213 T214 L219 R227 D229 | L213-S217 WeakPolarHBondContact CD2-OG 3.36Å; T214-S217 PolarHBondContact N-OG 2.78Å; T214-S217 PolarHBondContact O-N 2.82Å; T214-S217 PolarHBondContact O-OG 3.3Å; T214-S217 PolarHBondContact OG1-OG 2.85Å; S217-L219 PolarHBondContact O-N 3.36Å; S217-L219 VanDerWaalsContact O-N 3.14Å; S217-R227 WeakPolarHBondContact CB-O 3.4Å; S217-D229 VanDerWaalsContact CB-OD1 3.31Å; S217-D229 WeakPolarHBondContact CB-OD1 3.22Å; S217-D229 PolarHBondContact OG-OD1 3.14Å |
| 218 | K | 84.8 | Confident | 91.8 | Very high | 54 Ų | 54 | 50 Ų | 50 | 24% | 0.235 | 25% | 0.254 | C | S | . | . | S | Bend | trans | -62.3 | -17.7 | -175.6 | 67.2 | -179 | 173 | -171.8 | 0 | 116.9 | T214 P220 F320 | T214-K218 PolarHBondContact O-N 3.47Å; K218-P220 WeakPolarHBondContact O-CD 3.41Å; K218-F320 HydrophobicContact CD-CD2 4.22Å; K218-F320 HydrophobicContact CD-CE2 4.42Å |
| 219 | L | 86.1 | Confident | 91.7 | Very high | 109 Ų | 109 | 52 Ų | 52 | 57% | 0.571 | 26% | 0.262 | S | S | * | . | S | Bend | trans | -115.1 | 71.7 | 177.6 | -68.3 | 172.8 | 0 | 0 | 0 | 111.6 | S217 | S217-L219 PolarHBondContact O-N 3.36Å; S217-L219 VanDerWaalsContact O-N 3.14Å |
| 220 | P | 86.4 | Confident | 91.5 | Very high | 8 Ų | 8 | 55.5 Ų | 55.5 | 5% | 0.052 | 28% | 0.277 | C | S | . | . | P | Polyproline II helix | trans | -67.9 | 147.5 | 177.9 | 29 | -34.5 | 0 | 0 | 0 | 111.1 | K218 I226 V310 L319 | K218-P220 WeakPolarHBondContact O-CD 3.41Å; P220-I226 HydrophobicContact CB-CG1 4.32Å; P220-I226 HydrophobicContact CG-CG1 4.01Å; P220-I226 HydrophobicContact CG-CG2 4.43Å; P220-V310 HydrophobicContact CG-CG2 3.68Å; P220-L319 HydrophobicContact CG-CD1 4.3Å |
| 221 | P | 85.8 | Confident | 91.5 | Very high | 79 Ų | 79 | 58.3 Ų | 58.3 | 51% | 0.513 | 29% | 0.289 | S | S | . | . | P | Polyproline II helix | trans | -65.8 | 146.2 | 175.1 | 21.6 | -25.6 | 0 | 0 | 0 | 111.3 | F224 | P221-F224 HydrophobicContact CB-CD2 3.92Å; P221-F224 HydrophobicContact CB-CG 4.49Å; P221-F224 HydrophobicContact CG-CB 3.93Å; P221-F224 HydrophobicContact CG-CD2 3.99Å; P221-F224 HydrophobicContact CG-CG 4.06Å; P221-F224 PolarHBondContact O-N 3.01Å |
| 222 | A | 83.3 | Confident | 91.4 | Very high | 16 Ų | 16 | 62.7 Ų | 62.7 | 13% | 0.132 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | 139.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | F224 G313 E314 | A222-F224 WeakPolarHBondContact O-CD2 3.26Å; A222-F224 PolarHBondContact O-N 3.49Å; A222-G313 VanDerWaalsContact CB-C 3.48Å; A222-E314 HydrophobicContact CB-CG 4.15Å |
| 223 | N | 84.3 | Confident | 91.5 | Very high | 96 Ų | 96 | 66.8 Ų | 66.8 | 51% | 0.513 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 64.3 | 16.8 | -178.1 | -50.5 | -56.5 | 0 | 0 | 0 | 115.8 | Q309 V310 | N223-Q309 VanDerWaalsContact CA-NE2 3.27Å; N223-Q309 PolarHBondContact O-NE2 2.95Å; N223-V310 WeakPolarHBondContact CA-O 3.5Å; N223-V310 PolarHBondContact N-O 3.41Å |
| 224 | F | 88.9 | Confident | 91.5 | Very high | 128 Ų | 128 | 67.9 Ų | 67.9 | 56% | 0.561 | 33% | 0.333 | S | S | * | . | S | Bend | trans | -109.8 | 155.2 | 169.9 | -75.5 | -93.7 | 0 | 0 | 0 | 111.4 | P221 A222 I226 Q309 | P221-F224 HydrophobicContact CB-CD2 3.92Å; P221-F224 HydrophobicContact CB-CG 4.49Å; P221-F224 HydrophobicContact CG-CB 3.93Å; P221-F224 HydrophobicContact CG-CD2 3.99Å; P221-F224 HydrophobicContact CG-CG 4.06Å; P221-F224 PolarHBondContact O-N 3.01Å; A222-F224 WeakPolarHBondContact O-CD2 3.26Å; A222-F224 PolarHBondContact O-N 3.49Å; F224-I226 PolarHBondContact O-N 2.85Å; F224-Q309 WeakPolarHBondContact O-CG 3.39Å |
| 225 | P | 94.5 | Very high | 91.7 | Very high | 19 Ų | 19 | 72.7 Ų | 72.7 | 12% | 0.123 | 35% | 0.353 | C | S | . | . | B | Isolated β-bridge | trans | -55.5 | 137.3 | 170.1 | -22.5 | 33 | 0 | 0 | 0 | 111.5 | R227 T243 W307 | P225-R227 PolarHBondContact O-N 2.85Å; P225-T243 VanDerWaalsContact CB-O 3.29Å; P225-T243 WeakPolarHBondContact CB-O 3.32Å; P225-W307 HydrophobicContact CB-CB 4.48Å; P225-W307 HydrophobicContact CB-CG 4.14Å; P225-W307 HydrophobicContact CG-CG 4.36Å |
| 226 | I | 95.4 | Very high | 92 | Very high | 0 Ų | 0 | 72 Ų | 72 | 0% | 0 | 34% | 0.34 | C | S | . | . | trans | -74 | 126.3 | 173.2 | -60.5 | 165.8 | 0 | 0 | 0 | 107.6 | L213 P220 F224 F228 G244 V269 L308 V310 L319 | L213-I226 HydrophobicContact CD1-CG2 4.44Å; L213-I226 HydrophobicContact CD2-CG2 3.73Å; L213-I226 HydrophobicContact CG-CG2 4.49Å; P220-I226 HydrophobicContact CB-CG1 4.32Å; P220-I226 HydrophobicContact CG-CG1 4.01Å; P220-I226 HydrophobicContact CG-CG2 4.43Å; F224-I226 PolarHBondContact O-N 2.85Å; I226-F228 HydrophobicContact CB-CD2 4.45Å; I226-F228 HydrophobicContact CB-CE2 3.78Å; I226-F228 HydrophobicContact CB-CZ 4.15Å; I226-F228 HydrophobicContact CG2-CD2 4.05Å; I226-F228 HydrophobicContact CG2-CE1 4.16Å; I226-F228 HydrophobicContact CG2-CE2 3.55Å; I226-F228 HydrophobicContact CG2-CZ 3.61Å; I226-G244 WeakPolarHBondContact O-CA 3.12Å; I226-V269 HydrophobicContact CD1-CG1 3.96Å; I226-L308 HydrophobicContact CD1-CB 4.13Å; I226-L308 HydrophobicContact CD1-CD2 3.9Å; I226-L308 HydrophobicContact CD1-CG 3.91Å; I226-L308 PolarHBondContact N-O 2.79Å; I226-V310 HydrophobicContact CD1-CG2 3.93Å; I226-V310 HydrophobicContact CG1-CG2 3.98Å; I226-L319 HydrophobicContact CD1-CD2 3.7Å | ||
| 227 | R | 96.1 | Very high | 92.4 | Very high | 135 Ų | 135 | 66.8 Ų | 66.8 | 51% | 0.509 | 33% | 0.331 | S | S | . | . | trans | -97.3 | 98.1 | -178.9 | -67.7 | 178.5 | 59.8 | -178.2 | 1.4 | 109.9 | S217 P225 S241 Q242 | S217-R227 WeakPolarHBondContact CB-O 3.4Å; P225-R227 PolarHBondContact O-N 2.85Å; R227-S241 PolarHBondContact NE-O 2.91Å; R227-Q242 WeakPolarHBondContact CD-O 3.25Å; R227-Q242 PolarHBondContact NE-O 2.68Å | ||
| 228 | F | 96.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 33% | 0.334 | C | S | . | . | trans | -81.9 | 116.6 | 170.9 | -53.9 | -97.7 | 0 | 0 | 0 | 109.3 | V211 G212 L213 I226 Y239 L308 T327 F329 | V211-F228 HydrophobicContact CB-CB 3.59Å; V211-F228 HydrophobicContact CB-CG 4.43Å; V211-F228 HydrophobicContact CG2-CB 3.34Å; V211-F228 HydrophobicContact CG2-CD1 4.41Å; V211-F228 HydrophobicContact CG2-CD2 4.13Å; V211-F228 HydrophobicContact CG2-CG 3.74Å; G212-F228 CarbonylContact O-C 3.47Å; G212-F228 WeakPolarHBondContact O-CA 3.48Å; G212-F228 WeakPolarHBondContact O-CB 3.38Å; L213-F228 HydrophobicContact CD1-CE1 4.5Å; L213-F228 HydrophobicContact CD2-CD1 3.93Å; L213-F228 HydrophobicContact CD2-CE1 4.25Å; L213-F228 HydrophobicContact CD2-CG 4.35Å; L213-F228 HydrophobicContact CG-CD1 3.78Å; L213-F228 HydrophobicContact CG-CE1 3.89Å; I226-F228 HydrophobicContact CB-CD2 4.45Å; I226-F228 HydrophobicContact CB-CE2 3.78Å; I226-F228 HydrophobicContact CB-CZ 4.15Å; I226-F228 HydrophobicContact CG2-CD2 4.05Å; I226-F228 HydrophobicContact CG2-CE1 4.16Å; I226-F228 HydrophobicContact CG2-CE2 3.55Å; I226-F228 HydrophobicContact CG2-CZ 3.61Å; F228-Y239 WeakPolarHBondContact CB-OH 3.48Å; F228-Y239 PolarHBondContact N-OH 2.97Å; F228-Y239 VanDerWaalsContact N-OH 3.09Å; F228-Y239 WeakPolarHBondContact O-CE1 3.35Å; F228-Y239 PolarHBondContact O-OH 3.48Å; F228-L308 HydrophobicContact CE2-CB 4.12Å; F228-L308 HydrophobicContact CZ-CB 4.34Å; F228-L308 HydrophobicContact CZ-CD2 3.94Å; F228-T327 HydrophobicContact CE1-CG2 4.12Å; F228-F329 HydrophobicContact CD1-CB 4.22Å; F228-F329 HydrophobicContact CD2-CB 4.08Å; F228-F329 HydrophobicContact CD2-CD1 4.18Å; F228-F329 HydrophobicContact CE1-CB 3.81Å; F228-F329 HydrophobicContact CE2-CB 3.66Å; F228-F329 AromaticContact CE2-CD1 3.9Å; F228-F329 HydrophobicContact CE2-CD1 3.9Å; F228-F329 HydrophobicContact CE2-CG 4.12Å; F228-F329 HydrophobicContact CG-CB 4.35Å; F228-F329 HydrophobicContact CZ-CB 3.52Å; F228-F329 HydrophobicContact CZ-CG 4.34Å | ||
| 229 | D | 94.9 | Very high | 93.5 | Very high | 66 Ų | 66 | 65.6 Ų | 65.6 | 35% | 0.353 | 32% | 0.323 | S | S | . | . | trans | -107 | -19.7 | -173.5 | 57.1 | -42.4 | 0 | 0 | 0 | 113.2 | G212 T214 S217 I231 | G212-D229 PolarHBondContact O-N 3.09Å; T214-D229 VanDerWaalsContact CG2-CG 3.49Å; T214-D229 WeakPolarHBondContact CG2-OD1 3.43Å; T214-D229 WeakPolarHBondContact CG2-OD2 3.31Å; T214-D229 PolarHBondContact N-OD1 2.83Å; T214-D229 PolarHBondContact OG1-OD1 2.83Å; T214-D229 PolarHBondContact OG1-OD2 2.82Å; S217-D229 VanDerWaalsContact CB-OD1 3.31Å; S217-D229 WeakPolarHBondContact CB-OD1 3.22Å; S217-D229 PolarHBondContact OG-OD1 3.14Å; D229-I231 PolarHBondContact O-N 2.9Å | ||
| 230 | K | 95.9 | Very high | 94.1 | Very high | 76 Ų | 76 | 63.4 Ų | 63.4 | 33% | 0.33 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.6 | 102.3 | 171.1 | -174.7 | 179.1 | 177.9 | -178.6 | 0 | 108.9 | V211 G212 T214 I232 D326 | V211-K230 CarbonylContact C-O 3.54Å; V211-K230 VanDerWaalsContact CA-O 3.24Å; V211-K230 WeakPolarHBondContact CA-O 3.41Å; G212-K230 PolarHBondContact N-O 2.87Å; G212-K230 WeakPolarHBondContact O-CB 3.22Å; G212-K230 PolarHBondContact O-N 2.98Å; T214-K230 HydrophobicContact CG2-CB 3.93Å; K230-I232 PolarHBondContact O-N 2.96Å; K230-D326 IonicContact NZ-OD1 2.67Å; K230-D326 PolarHBondContact NZ-OD1 2.57Å; K230-D326 IonicContact NZ-OD2 3.25Å; K230-D326 PolarHBondContact NZ-OD2 2.94Å |
| 231 | I | 97.1 | Very high | 94.5 | Very high | 84 Ų | 84 | 65 Ų | 65 | 43% | 0.431 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.2 | 112.5 | 178.7 | -53.7 | -56.3 | 0 | 0 | 0 | 109.9 | V211 D229 N234 Y239 | V211-I231 HydrophobicContact CG1-CD1 3.67Å; D229-I231 PolarHBondContact O-N 2.9Å; I231-N234 HydrophobicContact CG2-CB 3.65Å; I231-Y239 HydrophobicContact CD1-CD1 4.49Å; I231-Y239 HydrophobicContact CD1-CE1 4.48Å |
| 232 | I | 97.3 | Very high | 94.9 | Very high | 93 Ų | 93 | 68.2 Ų | 68.2 | 48% | 0.477 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.3 | -45.4 | 173.7 | -55.5 | 167.7 | 0 | 0 | 0 | 109.2 | S210 K230 T328 | S210-I232 WeakPolarHBondContact O-CA 3.23Å; S210-I232 VanDerWaalsContact O-CB 3.32Å; S210-I232 WeakPolarHBondContact O-CB 3.46Å; S210-I232 PolarHBondContact O-N 2.81Å; K230-I232 PolarHBondContact O-N 2.96Å; I232-T328 HydrophobicContact CD1-CG2 4.2Å |
| 233 | Y | 98.2 | Very high | 95.5 | Very high | 86 Ų | 86 | 70.2 Ų | 70.2 | 34% | 0.337 | 34% | 0.342 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.9 | 129.3 | 173.2 | -174.9 | -90.7 | 0 | 0 | 0 | 109.9 | A208 F209 S210 Q235 Q236 | A208-Y233 HydrophobicContact CB-CD1 4.08Å; A208-Y233 HydrophobicContact CB-CE1 3.77Å; A208-Y233 WeakPolarHBondContact O-CD1 3.24Å; A208-Y233 WeakPolarHBondContact O-CE1 3.39Å; F209-Y233 CarbonylContact C-O 3.57Å; F209-Y233 WeakPolarHBondContact CA-O 3.48Å; S210-Y233 PolarHBondContact N-O 2.62Å; S210-Y233 PolarHBondContact O-N 2.79Å; Y233-Q235 HydrophobicContact CE1-CB 4.19Å; Y233-Q235 HydrophobicContact CE2-CB 3.97Å; Y233-Q235 WeakPolarHBondContact OH-CB 3.5Å; Y233-Q235 PolarHBondContact OH-OE1 2.91Å; Y233-Q236 PolarHBondContact OH-NE2 2.93Å |
| 234 | N | 97.3 | Very high | 96 | Very high | 23 Ų | 23 | 65.6 Ų | 65.6 | 12% | 0.123 | 32% | 0.318 | C | S | . | . | trans | -159.3 | 44.6 | 171 | -168.8 | 23.6 | 0 | 0 | 0 | 110.7 | I231 Q236 N237 H238 Y239 | I231-N234 HydrophobicContact CG2-CB 3.65Å; N234-Q236 PolarHBondContact O-N 2.9Å; N234-Q236 VanDerWaalsContact O-N 3.14Å; N234-N237 PolarHBondContact O-N 3.24Å; N234-N237 PolarHBondContact O-OD1 2.94Å; N234-N237 WeakPolarHBondContact OD1-CA 3.48Å; N234-H238 PolarHBondContact OD1-N 3.08Å; N234-Y239 PolarHBondContact ND2-O 2.83Å; N234-Y239 PolarHBondContact OD1-N 3Å | ||
| 235 | Q | 96.8 | Very high | 96.5 | Very high | 135 Ų | 135 | 63.5 Ų | 63.5 | 63% | 0.631 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | -30.3 | -169.4 | -172.3 | 178.2 | 16 | 0 | 0 | 113.2 | Y233 | Y233-Q235 HydrophobicContact CE1-CB 4.19Å; Y233-Q235 HydrophobicContact CE2-CB 3.97Å; Y233-Q235 WeakPolarHBondContact OH-CB 3.5Å; Y233-Q235 PolarHBondContact OH-OE1 2.91Å |
| 236 | Q | 96.3 | Very high | 96.6 | Very high | 43 Ų | 43 | 62.6 Ų | 62.6 | 20% | 0.201 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.1 | -3.2 | 178.8 | -58.3 | 81.1 | 33.9 | 0 | 0 | 113.9 | A208 Y233 N234 H238 | A208-Q236 PolarHBondContact O-OE1 2.92Å; Y233-Q236 PolarHBondContact OH-NE2 2.93Å; N234-Q236 PolarHBondContact O-N 2.9Å; N234-Q236 VanDerWaalsContact O-N 3.14Å; Q236-H238 WeakPolarHBondContact CB-CE1 3.12Å; Q236-H238 WeakPolarHBondContact CB-ND1 2.99Å; Q236-H238 PolarHBondContact O-CD2 2.92Å; Q236-H238 PolarHBondContact O-N 3.41Å; Q236-H238 PolarHBondContact O-NE2 2.85Å |
| 237 | N | 97.1 | Very high | 96.8 | Very high | 131 Ų | 131 | 65.2 Ų | 65.2 | 70% | 0.701 | 32% | 0.316 | S | S | * | . | trans | 55.8 | 33 | -178.6 | -56.9 | -59.5 | 0 | 0 | 0 | 114.3 | N234 | N234-N237 PolarHBondContact O-N 3.24Å; N234-N237 PolarHBondContact O-OD1 2.94Å; N234-N237 WeakPolarHBondContact OD1-CA 3.48Å | ||
| 238 | H | 97.8 | Very high | 96.9 | Very high | 46 Ų | 46 | 58.9 Ų | 58.9 | 21% | 0.213 | 29% | 0.293 | C | S | . | . | trans | -85.1 | -17.2 | 177.2 | -59.9 | 154.6 | 0 | 0 | 0 | 112.7 | S207 N234 Q236 Y246 T247 P249 | S207-H238 WeakPolarHBondContact CB-ND1 3.24Å; S207-H238 PolarHBondContact OG-ND1 2.83Å; N234-H238 PolarHBondContact OD1-N 3.08Å; Q236-H238 WeakPolarHBondContact CB-CE1 3.12Å; Q236-H238 WeakPolarHBondContact CB-ND1 2.99Å; Q236-H238 PolarHBondContact O-CD2 2.92Å; Q236-H238 PolarHBondContact O-N 3.41Å; Q236-H238 PolarHBondContact O-NE2 2.85Å; H238-Y246 HydrophobicContact CB-CD2 4.01Å; H238-Y246 HydrophobicContact CB-CE2 3.5Å; H238-Y246 VanDerWaalsContact CB-CE2 3.5Å; H238-Y246 WeakPolarHBondContact O-CA 3.31Å; H238-T247 PolarHBondContact O-N 3.46Å; H238-P249 WeakPolarHBondContact CE1-CG 3.46Å; H238-P249 WeakPolarHBondContact ND1-CG 3.28Å | ||
| 239 | Y | 98.4 | Very high | 96.8 | Very high | 5 Ų | 5 | 60.9 Ų | 60.9 | 2% | 0.02 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 131.6 | 168 | 175.3 | -90.3 | 0 | 0 | 0 | 110.5 | F209 V211 F228 I231 N234 G244 | F209-Y239 HydrophobicContact CB-CG 4.41Å; F209-Y239 AromaticContact CD2-CD2 3.68Å; F209-Y239 HydrophobicContact CD2-CD2 3.68Å; F209-Y239 HydrophobicContact CD2-CE2 4.42Å; F209-Y239 AromaticContact CD2-CG 3.81Å; F209-Y239 HydrophobicContact CD2-CG 3.81Å; F209-Y239 AromaticContact CE2-CD2 3.76Å; F209-Y239 HydrophobicContact CE2-CD2 3.76Å; F209-Y239 HydrophobicContact CE2-CE2 4.26Å; F209-Y239 HydrophobicContact CE2-CG 4.36Å; F209-Y239 HydrophobicContact CG-CD2 4.25Å; F209-Y239 HydrophobicContact CG-CG 4.13Å; F209-Y239 HydrophobicContact CZ-CD2 4.38Å; V211-Y239 HydrophobicContact CB-CE1 4.22Å; V211-Y239 HydrophobicContact CG1-CD1 3.69Å; V211-Y239 HydrophobicContact CG1-CE1 3.67Å; V211-Y239 HydrophobicContact CG1-CG 4.33Å; V211-Y239 HydrophobicContact CG2-CE1 4.04Å; V211-Y239 HydrophobicContact CG2-CE2 4.09Å; F228-Y239 WeakPolarHBondContact CB-OH 3.48Å; F228-Y239 PolarHBondContact N-OH 2.97Å; F228-Y239 VanDerWaalsContact N-OH 3.09Å; F228-Y239 WeakPolarHBondContact O-CE1 3.35Å; F228-Y239 PolarHBondContact O-OH 3.48Å; I231-Y239 HydrophobicContact CD1-CD1 4.49Å; I231-Y239 HydrophobicContact CD1-CE1 4.48Å; N234-Y239 PolarHBondContact ND2-O 2.83Å; N234-Y239 PolarHBondContact OD1-N 3Å; Y239-G244 WeakPolarHBondContact OH-CA 3.42Å |
| 240 | D | 97.6 | Very high | 96.8 | Very high | 62 Ų | 62 | 59.8 Ų | 59.8 | 33% | 0.332 | 30% | 0.301 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 112.7 | 176.3 | 172.2 | 15.9 | 0 | 0 | 0 | 110.5 | Q242 T243 G244 R245 | D240-Q242 VanDerWaalsContact C-N 3.28Å; D240-Q242 PolarHBondContact O-N 2.93Å; D240-Q242 WeakPolarHBondContact OD1-CB 3.34Å; D240-Q242 PolarHBondContact OD1-N 3.21Å; D240-T243 VanDerWaalsContact CG-OG1 3.26Å; D240-T243 PolarHBondContact O-N 2.86Å; D240-T243 WeakPolarHBondContact OD2-CB 3.1Å; D240-T243 WeakPolarHBondContact OD2-CG2 3.33Å; D240-T243 PolarHBondContact OD2-OG1 2.81Å; D240-G244 WeakPolarHBondContact O-CA 3.22Å; D240-G244 PolarHBondContact O-N 2.91Å; D240-R245 PolarHBondContact N-O 2.84Å; D240-R245 PolarHBondContact O-N 2.87Å |
| 241 | S | 95.2 | Very high | 96.8 | Very high | 43 Ų | 43 | 57 Ų | 57 | 30% | 0.301 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -17.7 | 179.4 | 59.7 | 0 | 0 | 0 | 0 | 113.9 | R227 | R227-S241 PolarHBondContact NE-O 2.91Š|
| 242 | Q | 94.2 | Very high | 96.8 | Very high | 146 Ų | 146 | 53.1 Ų | 53.1 | 68% | 0.682 | 27% | 0.273 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | -34.4 | 174.6 | -59.7 | -168.6 | 3.3 | 0 | 0 | 111.5 | R227 D240 | R227-Q242 WeakPolarHBondContact CD-O 3.25Å; R227-Q242 PolarHBondContact NE-O 2.68Å; D240-Q242 VanDerWaalsContact C-N 3.28Å; D240-Q242 PolarHBondContact O-N 2.93Å; D240-Q242 WeakPolarHBondContact OD1-CB 3.34Å; D240-Q242 PolarHBondContact OD1-N 3.21Å |
| 243 | T | 95.1 | Very high | 96.7 | Very high | 57 Ų | 57 | 49.7 Ų | 49.7 | 35% | 0.35 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | -16.1 | -179.2 | 61.1 | 0 | 0 | 0 | 0 | 114.1 | P225 D240 R245 | P225-T243 VanDerWaalsContact CB-O 3.29Å; P225-T243 WeakPolarHBondContact CB-O 3.32Å; D240-T243 VanDerWaalsContact CG-OG1 3.26Å; D240-T243 PolarHBondContact O-N 2.86Å; D240-T243 WeakPolarHBondContact OD2-CB 3.1Å; D240-T243 WeakPolarHBondContact OD2-CG2 3.33Å; D240-T243 PolarHBondContact OD2-OG1 2.81Å; T243-R245 VanDerWaalsContact C-N 3.31Å |
| 244 | G | 96.1 | Very high | 96.7 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 24% | 0.242 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 75.2 | 18.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | I226 Y239 D240 W307 | I226-G244 WeakPolarHBondContact O-CA 3.12Å; Y239-G244 WeakPolarHBondContact OH-CA 3.42Å; D240-G244 WeakPolarHBondContact O-CA 3.22Å; D240-G244 PolarHBondContact O-N 2.91Å; G244-W307 WeakPolarHBondContact O-CB 3.13Å |
| 245 | R | 97.9 | Very high | 96.8 | Very high | 83 Ų | 83 | 47.5 Ų | 47.5 | 31% | 0.313 | 25% | 0.25 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 134.6 | -170.2 | -64.2 | 178.9 | 175.4 | 154.3 | -1.5 | 111.7 | D240 T243 W307 | D240-R245 PolarHBondContact N-O 2.84Å; D240-R245 PolarHBondContact O-N 2.87Å; T243-R245 VanDerWaalsContact C-N 3.31Å; R245-W307 HydrophobicContact CG-CB 3.96Å; R245-W307 HydrophobicContact CG-CD2 4.2Å; R245-W307 HydrophobicContact CG-CE3 4.12Å; R245-W307 HydrophobicContact CG-CG 4.17Å |
| 246 | Y | 98.4 | Very high | 96.9 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 22% | 0.22 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -86.9 | 134.3 | 164.2 | 173.2 | -97.6 | 0 | 0 | 0 | 109.7 | S207 F209 H238 C248 P249 Y254 F256 L300 K305 V306 | S207-Y246 PolarHBondContact OG-OH 3.07Å; F209-Y246 AromaticContact CD1-CD2 3.26Å; F209-Y246 HydrophobicContact CD1-CD2 3.26Å; F209-Y246 AromaticContact CD1-CE2 3.86Å; F209-Y246 HydrophobicContact CD1-CE2 3.86Å; F209-Y246 AromaticContact CD1-CG 3.92Å; F209-Y246 HydrophobicContact CD1-CG 3.92Å; F209-Y246 HydrophobicContact CE1-CD1 4.39Å; F209-Y246 AromaticContact CE1-CD2 3.42Å; F209-Y246 HydrophobicContact CE1-CD2 3.42Å; F209-Y246 VanDerWaalsContact CE1-CD2 3.42Å; F209-Y246 HydrophobicContact CE1-CE2 4.19Å; F209-Y246 AromaticContact CE1-CG 3.55Å; F209-Y246 HydrophobicContact CE1-CG 3.55Å; F209-Y246 HydrophobicContact CG-CD2 4.26Å; F209-Y246 HydrophobicContact CZ-CG 4.39Å; H238-Y246 HydrophobicContact CB-CD2 4.01Å; H238-Y246 HydrophobicContact CB-CE2 3.5Å; H238-Y246 VanDerWaalsContact CB-CE2 3.5Å; H238-Y246 WeakPolarHBondContact O-CA 3.31Å; Y246-C248 HydrophobicContact CE1-CB 4.35Å; Y246-P249 WeakPolarHBondContact OH-CD 3.46Å; Y246-Y254 HydrophobicContact CE1-CD1 4.33Å; Y246-Y254 HydrophobicContact CE1-CE1 4.21Å; Y246-Y254 AromaticContact CZ-CE1 3.88Å; Y246-Y254 WeakPolarHBondContact OH-CE1 3.48Å; Y246-F256 AromaticContact CD1-CE1 3.87Å; Y246-F256 HydrophobicContact CD1-CE1 3.87Å; Y246-F256 AromaticContact CD1-CZ 3.8Å; Y246-F256 HydrophobicContact CD1-CZ 3.8Å; Y246-F256 HydrophobicContact CE1-CE1 4.4Å; Y246-F256 HydrophobicContact CE1-CZ 4.02Å; Y246-F256 HydrophobicContact CG-CE1 4.25Å; Y246-L300 HydrophobicContact CE1-CD1 4.02Å; Y246-K305 CarbonylContact O-C 3.5Å; Y246-K305 VanDerWaalsContact O-CA 3.24Å; Y246-K305 WeakPolarHBondContact O-CA 3.37Å; Y246-V306 HydrophobicContact CD1-CB 4.35Å; Y246-V306 PolarHBondContact N-O 2.86Å; Y246-V306 PolarHBondContact O-N 2.77Å |
| 247 | T | 98.3 | Very high | 97 | Very high | 55 Ų | 55 | 40.5 Ų | 40.5 | 34% | 0.337 | 22% | 0.219 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 126.1 | 174.7 | -55.6 | 0 | 0 | 0 | 0 | 109.6 | H238 P249 | H238-T247 PolarHBondContact O-N 3.46Å; T247-P249 VanDerWaalsContact O-CD 3.31Å; T247-P249 WeakPolarHBondContact O-CD 3.42Å |
| 248 | C | 97.6 | Very high | 97 | Very high | 2 Ų | 2 | 34.2 Ų | 34.2 | 1% | 0.014 | 19% | 0.186 | C | C | . | . | trans | -70.6 | 118.7 | -178.2 | -177.6 | 0 | 0 | 0 | 0 | 111.2 | Y246 V250 L300 D301 G303 D304 | Y246-C248 HydrophobicContact CE1-CB 4.35Å; C248-V250 PolarHBondContact SG-O 3.04Å; C248-L300 HydrophobicContact CB-CB 4.05Å; C248-L300 HydrophobicContact CB-CD1 4.07Å; C248-L300 VanDerWaalsContact SG-CB 3.57Å; C248-D301 WeakPolarHBondContact CB-O 3.5Å; C248-D301 PolarHBondContact SG-O 3.03Å; C248-D301 VanDerWaalsContact SG-O 3.39Å; C248-G303 PolarHBondContact O-N 2.98Å; C248-D304 HydrophobicContact CB-CB 4.12Å; C248-D304 WeakPolarHBondContact CB-O 3.48Å; C248-D304 PolarHBondContact N-O 2.91Å | ||
| 249 | P | 96.3 | Very high | 97 | Very high | 42 Ų | 42 | 36.3 Ų | 36.3 | 27% | 0.273 | 20% | 0.195 | S | C | . | . | S | Bend | trans | -86.1 | -27.4 | 179.1 | 37.5 | -41.2 | 0 | 0 | 0 | 113.2 | H238 Y246 T247 | H238-P249 WeakPolarHBondContact CE1-CG 3.46Å; H238-P249 WeakPolarHBondContact ND1-CG 3.28Å; Y246-P249 WeakPolarHBondContact OH-CD 3.46Å; T247-P249 VanDerWaalsContact O-CD 3.31Å; T247-P249 WeakPolarHBondContact O-CD 3.42Å |
| 250 | V | 95.1 | Very high | 96.9 | Very high | 44 Ų | 44 | 36 Ų | 36 | 27% | 0.267 | 19% | 0.194 | S | C | . | . | S | Bend | trans | -143.5 | 129.3 | -168.3 | 178.8 | 0 | 0 | 0 | 0 | 106.7 | P205 C248 Y254 I333 | P205-V250 HydrophobicContact CB-CG1 4.21Å; P205-V250 HydrophobicContact CB-CG2 4.27Å; P205-V250 HydrophobicContact CG-CG1 4.38Å; C248-V250 PolarHBondContact SG-O 3.04Å; V250-Y254 WeakPolarHBondContact O-CE2 3.24Å; V250-Y254 PolarHBondContact O-OH 3.32Å; V250-I333 HydrophobicContact CG1-CD1 4.47Å |
| 251 | A | 95.9 | Very high | 96.7 | Very high | 18 Ų | 18 | 33.2 Ų | 33.2 | 15% | 0.149 | 18% | 0.179 | C | C | . | . | trans | -62.9 | 147 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | L300 V302 S337 | A251-L300 CarbonylContact C-O 3.58Å; A251-L300 VanDerWaalsContact CA-O 3.22Å; A251-L300 WeakPolarHBondContact CA-O 3.44Å; A251-V302 HydrophobicContact CB-CG2 4.23Å; A251-S337 WeakPolarHBondContact CB-OG 3.47Å; A251-S337 PolarHBondContact O-N 3.32Å; A251-S337 PolarHBondContact O-OG 3.01Å | ||
| 252 | G | 95.7 | Very high | 96.6 | Very high | 2 Ų | 2 | 31.1 Ų | 31.1 | 2% | 0.021 | 17% | 0.165 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 158.8 | -173.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | Y254 H299 L300 F335 | G252-Y254 WeakPolarHBondContact O-CD2 3.46Å; G252-H299 CarbonylContact O-C 3.43Å; G252-H299 WeakPolarHBondContact O-CA 3.4Å; G252-H299 PolarHBondContact O-ND1 3.07Å; G252-L300 PolarHBondContact N-O 2.88Å; G252-L300 PolarHBondContact O-N 3.45Å; G252-F335 CarbonylContact C-O 3.6Å; G252-F335 WeakPolarHBondContact CA-O 3.47Å |
| 253 | A | 96.6 | Very high | 96.4 | Very high | 20 Ų | 20 | 28 Ų | 28 | 17% | 0.165 | 15% | 0.149 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.3 | 128.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | V297 I334 F335 | A253-V297 HydrophobicContact CB-CG1 4.47Å; A253-I334 PolarHBondContact O-N 3.26Å; A253-F335 HydrophobicContact CB-CB 4.32Å; A253-F335 HydrophobicContact CB-CD2 4.11Å; A253-F335 PolarHBondContact N-O 2.67Å; A253-F335 PolarHBondContact O-N 3.19Å |
| 254 | Y | 97.9 | Very high | 96 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 16% | 0.157 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.7 | 138.3 | -178.2 | -74.6 | -97.9 | 0 | 0 | 0 | 110.6 | Y246 V250 G252 F256 V297 L298 L300 F332 I333 | Y246-Y254 HydrophobicContact CE1-CD1 4.33Å; Y246-Y254 HydrophobicContact CE1-CE1 4.21Å; Y246-Y254 AromaticContact CZ-CE1 3.88Å; Y246-Y254 WeakPolarHBondContact OH-CE1 3.48Å; V250-Y254 WeakPolarHBondContact O-CE2 3.24Å; V250-Y254 PolarHBondContact O-OH 3.32Å; G252-Y254 WeakPolarHBondContact O-CD2 3.46Å; Y254-F256 VanDerWaalsContact CB-CE2 3.47Å; Y254-F256 HydrophobicContact CG-CE2 4.38Å; Y254-F256 HydrophobicContact CG-CZ 4.5Å; Y254-V297 CarbonylContact O-C 3.59Å; Y254-V297 VanDerWaalsContact O-CA 3.26Å; Y254-V297 WeakPolarHBondContact O-CA 3.5Å; Y254-L298 PolarHBondContact N-O 2.9Å; Y254-L298 PolarHBondContact O-N 3.49Å; Y254-L300 HydrophobicContact CD1-CD1 4.39Å; Y254-L300 HydrophobicContact CD2-CB 3.84Å; Y254-L300 HydrophobicContact CD2-CD1 3.63Å; Y254-L300 HydrophobicContact CD2-CG 3.76Å; Y254-L300 HydrophobicContact CE2-CB 4.06Å; Y254-L300 HydrophobicContact CE2-CD1 4.15Å; Y254-L300 HydrophobicContact CE2-CG 4.41Å; Y254-L300 HydrophobicContact CG-CD1 3.76Å; Y254-L300 HydrophobicContact CG-CG 4.25Å; Y254-F332 CarbonylContact C-O 3.59Å; Y254-F332 VanDerWaalsContact CA-O 3.32Å; Y254-F332 WeakPolarHBondContact CA-O 3.48Å; Y254-I333 HydrophobicContact CD1-CB 3.93Å; Y254-I333 HydrophobicContact CD1-CG1 4.44Å; Y254-I333 HydrophobicContact CE1-CB 3.48Å; Y254-I333 VanDerWaalsContact CE1-CB 3.48Å; Y254-I333 HydrophobicContact CE1-CD1 4.39Å; Y254-I333 HydrophobicContact CE1-CG1 3.95Å; Y254-I333 HydrophobicContact CE2-CD1 4.25Å; Y254-I333 HydrophobicContact CE2-CG1 4.07Å |
| 255 | F | 98.2 | Very high | 95.7 | Very high | 64 Ų | 64 | 34.3 Ų | 34.3 | 28% | 0.281 | 18% | 0.178 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -97.5 | 132.9 | 168 | -175.4 | -121.6 | 0 | 0 | 0 | 109.3 | T257 V297 G331 F332 I334 | F255-T257 HydrophobicContact CE1-CG2 4.06Å; F255-V297 HydrophobicContact CD2-CG2 3.8Å; F255-G331 CarbonylContact O-C 3.46Å; F255-G331 WeakPolarHBondContact O-CA 3.36Å; F255-F332 HydrophobicContact CB-CE1 4.32Å; F255-F332 HydrophobicContact CB-CE2 4.13Å; F255-F332 HydrophobicContact CB-CZ 3.98Å; F255-F332 AromaticContact CD1-CE1 3.66Å; F255-F332 HydrophobicContact CD1-CE1 3.66Å; F255-F332 AromaticContact CD1-CZ 3.64Å; F255-F332 HydrophobicContact CD1-CZ 3.64Å; F255-F332 HydrophobicContact CG-CE1 4.49Å; F255-F332 HydrophobicContact CG-CZ 4.26Å; F255-F332 PolarHBondContact N-O 2.87Å; F255-F332 PolarHBondContact O-N 3.47Å; F255-I334 HydrophobicContact CB-CD1 3.77Å; F255-I334 HydrophobicContact CB-CG1 4.02Å |
| 256 | F | 98.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 18% | 0.176 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 138.9 | 171.4 | -65.4 | -88.1 | 0 | 0 | 0 | 109.3 | F209 Y246 Y254 L271 G295 A296 L298 L300 V306 F329 S330 | F209-F256 HydrophobicContact CE1-CD1 4.13Å; F209-F256 AromaticContact CE1-CE1 3.76Å; F209-F256 HydrophobicContact CE1-CE1 3.76Å; F209-F256 HydrophobicContact CZ-CD1 4.09Å; F209-F256 HydrophobicContact CZ-CE1 4.07Å; Y246-F256 AromaticContact CD1-CE1 3.87Å; Y246-F256 HydrophobicContact CD1-CE1 3.87Å; Y246-F256 AromaticContact CD1-CZ 3.8Å; Y246-F256 HydrophobicContact CD1-CZ 3.8Å; Y246-F256 HydrophobicContact CE1-CE1 4.4Å; Y246-F256 HydrophobicContact CE1-CZ 4.02Å; Y246-F256 HydrophobicContact CG-CE1 4.25Å; Y254-F256 VanDerWaalsContact CB-CE2 3.47Å; Y254-F256 HydrophobicContact CG-CE2 4.38Å; Y254-F256 HydrophobicContact CG-CZ 4.5Å; F256-L271 HydrophobicContact CB-CD1 4.44Å; F256-L271 HydrophobicContact CB-CD2 4.07Å; F256-G295 CarbonylContact O-C 3.54Å; F256-G295 WeakPolarHBondContact O-CA 3.38Å; F256-A296 PolarHBondContact N-O 2.86Å; F256-A296 PolarHBondContact O-N 3.33Å; F256-L298 HydrophobicContact CD2-CB 4.45Å; F256-L298 HydrophobicContact CD2-CD1 3.87Å; F256-L298 HydrophobicContact CD2-CG 4.15Å; F256-L298 HydrophobicContact CE2-CB 4.33Å; F256-L298 HydrophobicContact CE2-CD1 4.04Å; F256-L298 HydrophobicContact CE2-CG 4.43Å; F256-L300 HydrophobicContact CE2-CD1 3.88Å; F256-L300 HydrophobicContact CZ-CD1 3.76Å; F256-V306 HydrophobicContact CD1-CG1 3.92Å; F256-V306 HydrophobicContact CD2-CG1 4.31Å; F256-V306 HydrophobicContact CE1-CB 3.91Å; F256-V306 HydrophobicContact CE1-CG1 3.7Å; F256-V306 HydrophobicContact CE1-CG2 4.38Å; F256-V306 HydrophobicContact CE2-CB 4.43Å; F256-V306 HydrophobicContact CE2-CG1 4.13Å; F256-V306 HydrophobicContact CE2-CG2 4.09Å; F256-V306 HydrophobicContact CG-CG1 4.21Å; F256-V306 HydrophobicContact CZ-CB 3.83Å; F256-V306 HydrophobicContact CZ-CG1 3.83Å; F256-V306 HydrophobicContact CZ-CG2 3.78Å; F256-F329 HydrophobicContact CB-CE2 4.23Å; F256-F329 HydrophobicContact CD1-CE2 4.02Å; F256-F329 AromaticContact CD1-CZ 3.87Å; F256-F329 HydrophobicContact CD1-CZ 3.87Å; F256-S330 CarbonylContact C-O 3.56Å; F256-S330 WeakPolarHBondContact CA-O 3.14Å |
| 257 | T | 98.3 | Very high | 95.1 | Very high | 30 Ų | 30 | 32.8 Ų | 32.8 | 18% | 0.184 | 18% | 0.176 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -143.4 | 147.1 | 176.2 | -169.1 | 0 | 0 | 0 | 0 | 110.3 | F255 G294 F329 S330 | F255-T257 HydrophobicContact CE1-CG2 4.06Å; T257-G294 CarbonylContact C-O 3Å; T257-G294 VanDerWaalsContact CA-O 3.32Å; T257-G294 WeakPolarHBondContact CA-O 3.38Å; T257-G294 PolarHBondContact OG1-O 2.9Å; T257-F329 WeakPolarHBondContact O-CD2 3.4Å; T257-S330 PolarHBondContact N-O 3.31Å; T257-S330 PolarHBondContact O-N 2.83Å; T257-S330 VanDerWaalsContact O-O 3.1Å |
| 258 | Y | 98.1 | Very high | 95 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.174 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.3 | 149.5 | 174.5 | 50 | -92.3 | 0 | 0 | 0 | 110.4 | I260 V269 L271 I279 T281 A293 G294 L308 T328 F329 | Y258-I260 HydrophobicContact CD2-CD1 3.84Å; Y258-I260 HydrophobicContact CD2-CG1 4.17Å; Y258-I260 HydrophobicContact CE2-CD1 4.25Å; Y258-V269 HydrophobicContact CE2-CG2 3.91Å; Y258-L271 HydrophobicContact CE1-CB 4.26Å; Y258-I279 HydrophobicContact CE1-CD1 3.89Å; Y258-I279 WeakPolarHBondContact OH-CD1 3.42Å; Y258-T281 HydrophobicContact CE2-CG2 4.46Å; Y258-T281 WeakPolarHBondContact CE2-OG1 3.12Å; Y258-T281 PolarHBondContact OH-OG1 2.83Å; Y258-A293 VanDerWaalsContact O-CA 3.25Å; Y258-A293 WeakPolarHBondContact O-CA 3.31Å; Y258-A293 WeakPolarHBondContact O-CB 3.18Å; Y258-G294 WeakPolarHBondContact CD1-O 3.45Å; Y258-G294 PolarHBondContact N-O 3.5Å; Y258-G294 PolarHBondContact O-N 3.38Å; Y258-L308 HydrophobicContact CD1-CD1 3.59Å; Y258-L308 HydrophobicContact CD1-CD2 4.41Å; Y258-L308 HydrophobicContact CD2-CD1 4.34Å; Y258-L308 HydrophobicContact CD2-CD2 4.25Å; Y258-L308 HydrophobicContact CE1-CD1 3.6Å; Y258-L308 HydrophobicContact CE2-CD1 4.35Å; Y258-L308 HydrophobicContact CG-CD1 3.97Å; Y258-L308 HydrophobicContact CG-CD2 3.99Å; Y258-T328 CarbonylContact C-O 3.5Å; Y258-T328 WeakPolarHBondContact CA-O 3.41Å; Y258-T328 VanDerWaalsContact CB-O 3.3Å; Y258-T328 WeakPolarHBondContact CB-O 3.27Å; Y258-F329 HydrophobicContact CD1-CD2 4.42Å |
| 259 | H | 97.3 | Very high | 94.8 | Very high | 89 Ų | 89 | 33.3 Ų | 33.3 | 41% | 0.412 | 17% | 0.173 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 131.3 | 176.2 | -61.6 | -96.3 | 0 | 0 | 0 | 107.3 | A292 T327 T328 | H259-A292 CarbonylContact C-O 3.6Å; H259-A292 WeakPolarHBondContact CA-O 3.19Å; H259-T327 CarbonylContact O-C 3.48Å; H259-T327 WeakPolarHBondContact O-CA 3.32Å; H259-T328 PolarHBondContact N-O 2.81Å; H259-T328 PolarHBondContact O-N 3.22Å |
| 260 | I | 95.9 | Very high | 94.8 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 16% | 0.16 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 119.7 | -169.6 | -55.3 | 171.2 | 0 | 0 | 0 | 108.2 | Y258 V262 V267 V269 A292 L308 L319 T327 | Y258-I260 HydrophobicContact CD2-CD1 3.84Å; Y258-I260 HydrophobicContact CD2-CG1 4.17Å; Y258-I260 HydrophobicContact CE2-CD1 4.25Å; I260-V262 HydrophobicContact CG2-CG2 4.42Å; I260-V267 HydrophobicContact CD1-CG1 4.29Å; I260-V267 HydrophobicContact CG2-CG1 4.09Å; I260-V267 HydrophobicContact CG2-CG2 4.45Å; I260-V269 HydrophobicContact CD1-CB 4.22Å; I260-V269 HydrophobicContact CD1-CG1 3.8Å; I260-V269 HydrophobicContact CD1-CG2 3.48Å; I260-V269 VanDerWaalsContact CD1-CG2 3.48Å; I260-A292 HydrophobicContact CB-CB 4.37Å; I260-A292 PolarHBondContact N-O 2.76Å; I260-A292 PolarHBondContact O-N 2.73Å; I260-L308 HydrophobicContact CD1-CD2 4.2Å; I260-L319 HydrophobicContact CG2-CB 4.41Å; I260-L319 HydrophobicContact CG2-CD2 4.21Å; I260-L319 HydrophobicContact CG2-CG 3.97Å; I260-T327 HydrophobicContact CB-CG2 4.22Å; I260-T327 HydrophobicContact CG1-CG2 4.05Å; I260-T327 HydrophobicContact CG2-CG2 4.07Å |
| 261 | T | 94.7 | Very high | 95 | Very high | 2 Ų | 2 | 29.2 Ų | 29.2 | 1% | 0.012 | 15% | 0.148 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -73.7 | 122.5 | 164.4 | -55.9 | 0 | 0 | 0 | 0 | 108.9 | E289 Q291 F320 D325 D326 T327 | T261-E289 HydrophobicContact CG2-CG 3.53Å; T261-E289 VanDerWaalsContact CG2-OE1 3.31Å; T261-E289 WeakPolarHBondContact CG2-OE1 3.3Å; T261-Q291 PolarHBondContact OG1-NE2 2.94Å; T261-F320 HydrophobicContact CG2-CB 4.01Å; T261-F320 HydrophobicContact CG2-CD1 4.13Å; T261-F320 PolarHBondContact O-N 3.3Å; T261-D325 HydrophobicContact CG2-CB 4.48Å; T261-D326 PolarHBondContact OG1-O 3.36Å; T261-T327 PolarHBondContact N-OG1 2.68Å |
| 262 | V | 92.6 | Very high | 95 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 114.6 | -177.4 | -178.1 | 0 | 0 | 0 | 0 | 108.6 | I260 V267 D283 E289 D290 A292 | I260-V262 HydrophobicContact CG2-CG2 4.42Å; V262-V267 HydrophobicContact CB-CG2 4.28Å; V262-V267 HydrophobicContact CG1-CB 4.26Å; V262-V267 HydrophobicContact CG1-CG2 3.87Å; V262-V267 HydrophobicContact CG2-CB 4.08Å; V262-V267 HydrophobicContact CG2-CG2 3.98Å; V262-D283 HydrophobicContact CG1-CB 4.47Å; V262-D283 HydrophobicContact CG2-CB 3.93Å; V262-E289 WeakPolarHBondContact O-CA 3.48Å; V262-D290 HydrophobicContact CB-CB 4.22Å; V262-D290 PolarHBondContact N-O 2.99Å; V262-D290 PolarHBondContact O-N 3.28Å; V262-D290 VanDerWaalsContact O-N 3.14Å; V262-A292 HydrophobicContact CG2-CB 3.93Å |
| 263 | F | 90.6 | Very high | 95.1 | Very high | 81 Ų | 81 | 30.8 Ų | 30.8 | 36% | 0.355 | 15% | 0.151 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -143 | 142.6 | -179 | -173.5 | -102.6 | 0 | 0 | 0 | 112.7 | R265 Y285 E289 G318 F320 | F263-R265 PolarHBondContact O-N 2.79Å; F263-Y285 HydrophobicContact CD2-CE2 4.04Å; F263-E289 HydrophobicContact CD2-CB 4.46Å; F263-G318 PolarHBondContact N-O 3.14Å; F263-G318 VanDerWaalsContact N-O 3.08Å; F263-F320 HydrophobicContact CB-CB 3.74Å; F263-F320 HydrophobicContact CB-CD1 4.43Å; F263-F320 HydrophobicContact CB-CD2 3.99Å; F263-F320 HydrophobicContact CB-CG 3.81Å; F263-F320 AromaticContact CD1-CD2 3.8Å; F263-F320 HydrophobicContact CD1-CD2 3.8Å; F263-F320 AromaticContact CD1-CE2 3.87Å; F263-F320 HydrophobicContact CD1-CE2 3.87Å; F263-F320 HydrophobicContact CD1-CG 4.4Å; F263-F320 HydrophobicContact CE1-CE2 4.41Å; F263-F320 HydrophobicContact CG-CD2 4.22Å; F263-F320 HydrophobicContact CG-CG 4.37Å |
| 264 | S | 86.8 | Confident | 95.1 | Very high | 74 Ų | 74 | 34 Ų | 34 | 52% | 0.517 | 17% | 0.165 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | 63.8 | -23.4 | 174.6 | -178.4 | 0 | 0 | 0 | 0 | 116.8 | Y285 | S264-Y285 VanDerWaalsContact N-CE2 3.34Å |
| 265 | R | 89.3 | Confident | 94.9 | Very high | 114 Ų | 114 | 36.1 Ų | 36.1 | 43% | 0.43 | 19% | 0.187 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -145.3 | 160.8 | 178 | -56.5 | 177.8 | -178.1 | -171.8 | -3.1 | 110.6 | F263 Y285 N317 | F263-R265 PolarHBondContact O-N 2.79Å; R265-Y285 WeakPolarHBondContact O-CB 3.46Å; R265-N317 WeakPolarHBondContact CD-OD1 3.25Å; R265-N317 PolarHBondContact NH1-OD1 3.48Å |
| 266 | N | 91.4 | Very high | 94.8 | Very high | 51 Ų | 51 | 37.5 Ų | 37.5 | 27% | 0.273 | 20% | 0.201 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -60.6 | 153.5 | 171.4 | -61 | -18.8 | 0 | 0 | 0 | 110.3 | D283 N284 Y285 F316 N317 G318 | N266-D283 WeakPolarHBondContact CA-O 3.41Å; N266-N284 VanDerWaalsContact OD1-CA 3.32Å; N266-N284 WeakPolarHBondContact OD1-CA 3.26Å; N266-Y285 PolarHBondContact OD1-N 2.8Å; N266-F316 HydrophobicContact CB-CD1 3.65Å; N266-F316 HydrophobicContact CB-CE1 3.95Å; N266-F316 CarbonylContact O-C 3.51Å; N266-F316 WeakPolarHBondContact O-CA 3.39Å; N266-N317 PolarHBondContact O-N 3.42Å; N266-G318 PolarHBondContact O-N 2.9Å |
| 267 | V | 92.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.224 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 132.7 | 175.7 | 166.8 | 0 | 0 | 0 | 0 | 108.8 | I260 V262 V269 T282 D283 F316 G318 L319 | I260-V267 HydrophobicContact CD1-CG1 4.29Å; I260-V267 HydrophobicContact CG2-CG1 4.09Å; I260-V267 HydrophobicContact CG2-CG2 4.45Å; V262-V267 HydrophobicContact CB-CG2 4.28Å; V262-V267 HydrophobicContact CG1-CB 4.26Å; V262-V267 HydrophobicContact CG1-CG2 3.87Å; V262-V267 HydrophobicContact CG2-CB 4.08Å; V262-V267 HydrophobicContact CG2-CG2 3.98Å; V267-V269 HydrophobicContact CG1-CG1 4.01Å; V267-T282 CarbonylContact O-C 3.54Å; V267-T282 WeakPolarHBondContact O-CA 3.47Å; V267-D283 PolarHBondContact N-O 2.89Å; V267-D283 PolarHBondContact O-N 2.97Å; V267-D283 VanDerWaalsContact O-O 3.11Å; V267-F316 WeakPolarHBondContact CA-O 3.33Å; V267-G318 VanDerWaalsContact CG2-O 3.25Å; V267-G318 WeakPolarHBondContact CG2-O 3.34Å; V267-L319 HydrophobicContact CG2-CD1 4.49Å; V267-L319 HydrophobicContact CG2-CG 4.42Å |
| 268 | K | 94.3 | Very high | 94.5 | Very high | 69 Ų | 69 | 44.5 Ų | 44.5 | 30% | 0.3 | 23% | 0.231 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.7 | 111.2 | 168.6 | -166.8 | -179.1 | -176.1 | 166.8 | 0 | 109.7 | T281 T282 V310 V311 F316 | K268-T281 WeakPolarHBondContact CA-O 2.97Å; K268-T282 HydrophobicContact CB-CG2 4.29Å; K268-T282 HydrophobicContact CD-CG2 4.37Å; K268-T282 HydrophobicContact CG-CG2 4.11Å; K268-T282 WeakPolarHBondContact CG-OG1 3.36Å; K268-V310 WeakPolarHBondContact O-CA 3.44Å; K268-V311 HydrophobicContact CB-CG2 4.29Å; K268-V311 WeakPolarHBondContact CB-O 3.43Å; K268-V311 HydrophobicContact CD-CG2 3.88Å; K268-V311 HydrophobicContact CG-CG2 3.58Å; K268-V311 PolarHBondContact O-N 3.43Å; K268-F316 HydrophobicContact CB-CB 3.69Å; K268-F316 HydrophobicContact CB-CD1 3.83Å; K268-F316 HydrophobicContact CB-CG 3.94Å; K268-F316 PolarHBondContact N-O 3.32Å; K268-F316 VanDerWaalsContact N-O 3.11Å |
| 269 | V | 95.1 | Very high | 94.4 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.8 | 156.6 | -179.2 | -63.4 | 0 | 0 | 0 | 0 | 111.4 | I226 Y258 I260 V267 H280 T281 L308 Q309 L319 | I226-V269 HydrophobicContact CD1-CG1 3.96Å; Y258-V269 HydrophobicContact CE2-CG2 3.91Å; I260-V269 HydrophobicContact CD1-CB 4.22Å; I260-V269 HydrophobicContact CD1-CG1 3.8Å; I260-V269 HydrophobicContact CD1-CG2 3.48Å; I260-V269 VanDerWaalsContact CD1-CG2 3.48Å; V267-V269 HydrophobicContact CG1-CG1 4.01Å; V269-H280 WeakPolarHBondContact O-CA 3.22Å; V269-T281 PolarHBondContact N-O 3.11Å; V269-T281 PolarHBondContact O-N 2.9Å; V269-L308 HydrophobicContact CB-CD1 4.27Å; V269-L308 HydrophobicContact CB-CD2 4.35Å; V269-L308 HydrophobicContact CB-CG 4.15Å; V269-L308 HydrophobicContact CG1-CD2 4.4Å; V269-L308 HydrophobicContact CG2-CD1 4.28Å; V269-L308 HydrophobicContact CG2-CD2 4.45Å; V269-Q309 CarbonylContact C-O 3.45Å; V269-Q309 VanDerWaalsContact CA-O 3.28Å; V269-Q309 WeakPolarHBondContact CA-O 3.34Å; V269-L319 HydrophobicContact CG1-CD2 4.36Å |
| 270 | A | 96.1 | Very high | 94.2 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 135.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | M272 K277 I279 H280 Q309 V311 | A270-M272 HydrophobicContact CB-SD 3.92Å; A270-K277 HydrophobicContact CB-CG 4.1Å; A270-I279 CarbonylContact C-O 3.51Å; A270-I279 VanDerWaalsContact CA-O 3.24Å; A270-I279 WeakPolarHBondContact CA-O 3.47Å; A270-H280 VanDerWaalsContact CB-CE1 3.5Å; A270-H280 WeakPolarHBondContact CB-CE1 3.47Å; A270-H280 WeakPolarHBondContact CB-ND1 3.39Å; A270-Q309 PolarHBondContact N-O 2.86Å; A270-Q309 PolarHBondContact O-N 3.41Å; A270-V311 HydrophobicContact CB-CG1 3.68Å; A270-V311 HydrophobicContact CB-CG2 4.36Å |
| 271 | L | 97.8 | Very high | 94.2 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.25 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.4 | 124.4 | 163.5 | -173.4 | 67.2 | 0 | 0 | 0 | 108 | F256 Y258 I278 I279 A296 L298 V306 L308 F329 | F256-L271 HydrophobicContact CB-CD1 4.44Å; F256-L271 HydrophobicContact CB-CD2 4.07Å; Y258-L271 HydrophobicContact CE1-CB 4.26Å; L271-I278 PolarHBondContact O-N 2.84Å; L271-I279 HydrophobicContact CB-CD1 4.28Å; L271-I279 HydrophobicContact CB-CG1 3.53Å; L271-I279 HydrophobicContact CD2-CD1 4.23Å; L271-I279 HydrophobicContact CD2-CG1 4.06Å; L271-I279 HydrophobicContact CG-CG1 4.45Å; L271-I279 PolarHBondContact N-O 2.84Å; L271-A296 HydrophobicContact CD2-CB 4.12Å; L271-L298 HydrophobicContact CD2-CD1 4.09Å; L271-V306 HydrophobicContact CD1-CG1 3.75Å; L271-V306 HydrophobicContact CG-CG1 4.29Å; L271-L308 HydrophobicContact CB-CD1 4.38Å; L271-L308 HydrophobicContact CD1-CD1 4.42Å; L271-F329 HydrophobicContact CD1-CE2 3.8Å; L271-F329 HydrophobicContact CD1-CZ 3.85Å |
| 272 | M | 97.2 | Very high | 94.1 | Very high | 8 Ų | 8 | 51.3 Ų | 51.3 | 4% | 0.039 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 136.7 | -173.7 | -57.1 | -66.8 | -70.9 | 0 | 0 | 109.7 | A270 G275 V276 K277 V306 W307 Q309 | A270-M272 HydrophobicContact CB-SD 3.92Å; M272-G275 VanDerWaalsContact CE-O 3.25Å; M272-G275 WeakPolarHBondContact CE-O 3.29Å; M272-V276 CarbonylContact C-O 3.56Å; M272-V276 VanDerWaalsContact CA-O 3.31Å; M272-V276 WeakPolarHBondContact CA-O 3.18Å; M272-K277 HydrophobicContact CE-CG 3.99Å; M272-K277 HydrophobicContact SD-CB 4.16Å; M272-K277 HydrophobicContact SD-CG 3.38Å; M272-K277 WeakPolarHBondContact SD-CG 3.37Å; M272-V306 VanDerWaalsContact O-CA 3.23Å; M272-V306 WeakPolarHBondContact O-CA 3.4Å; M272-V306 WeakPolarHBondContact O-CG1 3.33Å; M272-W307 HydrophobicContact CB-CD2 3.62Å; M272-W307 HydrophobicContact CB-CE3 4.13Å; M272-W307 HydrophobicContact CB-CG 4.03Å; M272-W307 HydrophobicContact CB-CH2 4.25Å; M272-W307 HydrophobicContact CB-CZ2 3.71Å; M272-W307 HydrophobicContact CB-CZ3 4.42Å; M272-W307 WeakPolarHBondContact CB-O 3.32Å; M272-W307 HydrophobicContact CE-CZ2 4.23Å; M272-W307 HydrophobicContact CG-CD2 4.35Å; M272-W307 HydrophobicContact CG-CG 4.46Å; M272-W307 HydrophobicContact CG-CZ2 4.2Å; M272-W307 PolarHBondContact N-O 3.27Å; M272-W307 PolarHBondContact O-N 3.25Å; M272-W307 VanDerWaalsContact O-N 3.09Å; M272-Q309 HydrophobicContact CG-CB 3.88Å |
| 273 | K | 97.6 | Very high | 94.1 | Very high | 44 Ų | 44 | 52.8 Ų | 52.8 | 19% | 0.191 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 118.1 | 167.1 | -179.2 | -173.2 | 174.9 | 178.9 | 0 | 108.4 | G275 V276 I278 H299 L300 D304 K305 V306 | K273-G275 PolarHBondContact O-N 2.99Å; K273-V276 PolarHBondContact N-O 3.41Å; K273-V276 WeakPolarHBondContact O-CB 3.39Å; K273-V276 PolarHBondContact O-N 3.14Å; K273-I278 HydrophobicContact CB-CD1 3.9Å; K273-I278 HydrophobicContact CB-CG1 3.75Å; K273-H299 PolarHBondContact NZ-O 2.93Å; K273-L300 HydrophobicContact CD-CD2 3.85Å; K273-L300 HydrophobicContact CG-CD2 4.23Å; K273-D304 WeakPolarHBondContact CE-OD2 3.39Å; K273-D304 IonicContact NZ-OD2 2.88Å; K273-D304 PolarHBondContact NZ-OD2 2.99Å; K273-K305 WeakPolarHBondContact CA-O 3.13Å; K273-V306 HydrophobicContact CG-CG2 4.49Å |
| 274 | N | 96.5 | Very high | 94.1 | Very high | 87 Ų | 87 | 53.2 Ų | 53.2 | 47% | 0.465 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 48.4 | 33.1 | 179.5 | -63.9 | -18.5 | 0 | 0 | 0 | 114.6 | D304 K305 | N274-D304 PolarHBondContact ND2-OD1 3.08Å; N274-K305 PolarHBondContact N-O 3.4Å; N274-K305 PolarHBondContact OD1-N 2.99Å |
| 275 | G | 94 | Very high | 94.1 | Very high | 46 Ų | 46 | 52.4 Ų | 52.4 | 47% | 0.474 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.3 | -7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | M272 K273 | M272-G275 VanDerWaalsContact CE-O 3.25Å; M272-G275 WeakPolarHBondContact CE-O 3.29Å; K273-G275 PolarHBondContact O-N 2.99Å |
| 276 | V | 95.4 | Very high | 93.9 | Very high | 93 Ų | 93 | 54.6 Ų | 54.6 | 56% | 0.564 | 29% | 0.285 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 134.4 | 174.1 | -175.6 | 0 | 0 | 0 | 0 | 109.7 | M272 K273 I278 | M272-V276 CarbonylContact C-O 3.56Å; M272-V276 VanDerWaalsContact CA-O 3.31Å; M272-V276 WeakPolarHBondContact CA-O 3.18Å; K273-V276 PolarHBondContact N-O 3.41Å; K273-V276 WeakPolarHBondContact O-CB 3.39Å; K273-V276 PolarHBondContact O-N 3.14Å; V276-I278 HydrophobicContact CG1-CD1 4.4Å |
| 277 | K | 95.4 | Very high | 93.5 | Very high | 111 Ų | 111 | 58.4 Ų | 58.4 | 48% | 0.483 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.5 | 123.7 | 173.8 | -68.2 | 155 | 170 | -176.3 | 0 | 109.2 | A270 M272 H280 | A270-K277 HydrophobicContact CB-CG 4.1Å; M272-K277 HydrophobicContact CE-CG 3.99Å; M272-K277 HydrophobicContact SD-CB 4.16Å; M272-K277 HydrophobicContact SD-CG 3.38Å; M272-K277 WeakPolarHBondContact SD-CG 3.37Å; K277-H280 WeakPolarHBondContact CB-NE2 3.5Å; K277-H280 VanDerWaalsContact CD-CE1 3.48Å; K277-H280 WeakPolarHBondContact CD-CE1 3.41Å |
| 278 | I | 96.1 | Very high | 93.3 | Very high | 66 Ų | 66 | 62.1 Ų | 62.1 | 34% | 0.338 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | -56.9 | -179.7 | -55.9 | -53.1 | 0 | 0 | 0 | 111.2 | L271 K273 V276 L298 | L271-I278 PolarHBondContact O-N 2.84Å; K273-I278 HydrophobicContact CB-CD1 3.9Å; K273-I278 HydrophobicContact CB-CG1 3.75Å; V276-I278 HydrophobicContact CG1-CD1 4.4Å; I278-L298 HydrophobicContact CG1-CD1 4.48Å; I278-L298 HydrophobicContact CG1-CD2 4.43Å; I278-L298 HydrophobicContact CG2-CD2 3.58Å |
| 279 | I | 95.1 | Very high | 93.1 | Very high | 46 Ų | 46 | 62.6 Ų | 62.6 | 24% | 0.236 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 150.2 | 176.6 | 57.8 | 166.4 | 0 | 0 | 0 | 110 | Y258 A270 L271 A296 | Y258-I279 HydrophobicContact CE1-CD1 3.89Å; Y258-I279 WeakPolarHBondContact OH-CD1 3.42Å; A270-I279 CarbonylContact C-O 3.51Å; A270-I279 VanDerWaalsContact CA-O 3.24Å; A270-I279 WeakPolarHBondContact CA-O 3.47Å; L271-I279 HydrophobicContact CB-CD1 4.28Å; L271-I279 HydrophobicContact CB-CG1 3.53Å; L271-I279 HydrophobicContact CD2-CD1 4.23Å; L271-I279 HydrophobicContact CD2-CG1 4.06Å; L271-I279 HydrophobicContact CG-CG1 4.45Å; L271-I279 PolarHBondContact N-O 2.84Å; I279-A296 HydrophobicContact CD1-CB 4.11Å; I279-A296 HydrophobicContact CG2-CB 4.36Å |
| 280 | H | 93.6 | Very high | 93 | Very high | 94 Ų | 94 | 66.1 Ų | 66.1 | 44% | 0.435 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120 | 132 | 177.5 | -73.2 | -74.7 | 0 | 0 | 0 | 109.7 | V269 A270 K277 | V269-H280 WeakPolarHBondContact O-CA 3.22Å; A270-H280 VanDerWaalsContact CB-CE1 3.5Å; A270-H280 WeakPolarHBondContact CB-CE1 3.47Å; A270-H280 WeakPolarHBondContact CB-ND1 3.39Å; K277-H280 WeakPolarHBondContact CB-NE2 3.5Å; K277-H280 VanDerWaalsContact CD-CE1 3.48Å; K277-H280 WeakPolarHBondContact CD-CE1 3.41Å |
| 281 | T | 95 | Very high | 92.9 | Very high | 21 Ų | 21 | 70.8 Ų | 70.8 | 13% | 0.129 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 126.1 | 169.8 | -57.1 | 0 | 0 | 0 | 0 | 107.5 | Y258 K268 V269 A292 | Y258-T281 HydrophobicContact CE2-CG2 4.46Å; Y258-T281 WeakPolarHBondContact CE2-OG1 3.12Å; Y258-T281 PolarHBondContact OH-OG1 2.83Å; K268-T281 WeakPolarHBondContact CA-O 2.97Å; V269-T281 PolarHBondContact N-O 3.11Å; V269-T281 PolarHBondContact O-N 2.9Å; T281-A292 HydrophobicContact CG2-CB 3.99Å |
| 282 | T | 93.7 | Very high | 92.8 | Very high | 73 Ų | 73 | 71 Ų | 71 | 45% | 0.448 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.6 | 133.7 | 176.2 | -48.4 | 0 | 0 | 0 | 0 | 107.8 | V267 K268 | V267-T282 CarbonylContact O-C 3.54Å; V267-T282 WeakPolarHBondContact O-CA 3.47Å; K268-T282 HydrophobicContact CB-CG2 4.29Å; K268-T282 HydrophobicContact CD-CG2 4.37Å; K268-T282 HydrophobicContact CG-CG2 4.11Å; K268-T282 WeakPolarHBondContact CG-OG1 3.36Å |
| 283 | D | 92.8 | Very high | 92.7 | Very high | 30 Ų | 30 | 73.4 Ų | 73.4 | 16% | 0.16 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 138.5 | 174.4 | -153.4 | -38.3 | 0 | 0 | 0 | 109.4 | V262 N266 V267 A292 | V262-D283 HydrophobicContact CG1-CB 4.47Å; V262-D283 HydrophobicContact CG2-CB 3.93Å; N266-D283 WeakPolarHBondContact CA-O 3.41Å; V267-D283 PolarHBondContact N-O 2.89Å; V267-D283 PolarHBondContact O-N 2.97Å; V267-D283 VanDerWaalsContact O-O 3.11Å; D283-A292 HydrophobicContact CB-CB 3.93Å |
| 284 | N | 90.9 | Very high | 92.7 | Very high | 90 Ų | 90 | 72 Ų | 72 | 48% | 0.481 | 40% | 0.402 | S | S | . | . | trans | -109 | 113.1 | -177.1 | -67.5 | -36.6 | 0 | 0 | 0 | 108.9 | N266 Q286 | N266-N284 VanDerWaalsContact OD1-CA 3.32Å; N266-N284 WeakPolarHBondContact OD1-CA 3.26Å; N284-Q286 PolarHBondContact O-N 2.79Å | ||
| 285 | Y | 86.8 | Confident | 92.7 | Very high | 58 Ų | 58 | 69.7 Ų | 69.7 | 23% | 0.227 | 40% | 0.398 | C | S | . | . | trans | -64.9 | 132.5 | 177.1 | 179 | -99.4 | 0 | 0 | 0 | 110.3 | F263 S264 R265 N266 S288 | F263-Y285 HydrophobicContact CD2-CE2 4.04Å; S264-Y285 VanDerWaalsContact N-CE2 3.34Å; R265-Y285 WeakPolarHBondContact O-CB 3.46Å; N266-Y285 PolarHBondContact OD1-N 2.8Å; Y285-S288 WeakPolarHBondContact CE2-O 3.32Å | ||
| 286 | Q | 84.8 | Confident | 92.8 | Very high | 159 Ų | 159 | 68.2 Ų | 68.2 | 74% | 0.743 | 38% | 0.381 | S | S | * | . | trans | -108.2 | -104.3 | 177.6 | -60.5 | -177.9 | 17 | 0 | 0 | 110.2 | N284 | N284-Q286 PolarHBondContact O-N 2.79Š| ||
| 287 | T | 83.2 | Confident | 92.9 | Very high | 131 Ų | 131 | 68.1 Ų | 68.1 | 80% | 0.804 | 38% | 0.381 | S | S | * | . | S | Bend | trans | -118.3 | -13.5 | -175.3 | 52 | 0 | 0 | 0 | 0 | 113.9 | ||
| 288 | S | 88.5 | Confident | 93 | Very high | 79 Ų | 79 | 63.7 Ų | 63.7 | 55% | 0.552 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -132.7 | 163.4 | 178.5 | 58.1 | 0 | 0 | 0 | 0 | 109.5 | Y285 | Y285-S288 WeakPolarHBondContact CE2-O 3.32Š|
| 289 | E | 89.9 | Confident | 93.1 | Very high | 78 Ų | 78 | 66.1 Ų | 66.1 | 36% | 0.364 | 37% | 0.372 | S | S | . | . | trans | -54.6 | 144.4 | 169.9 | -170.4 | -172.5 | 121 | 0 | 0 | 111.3 | T261 V262 F263 Q291 | T261-E289 HydrophobicContact CG2-CG 3.53Å; T261-E289 VanDerWaalsContact CG2-OE1 3.31Å; T261-E289 WeakPolarHBondContact CG2-OE1 3.3Å; V262-E289 WeakPolarHBondContact O-CA 3.48Å; F263-E289 HydrophobicContact CD2-CB 4.46Å; E289-Q291 PolarHBondContact OE1-NE2 2.89Å; E289-Q291 VanDerWaalsContact OE1-NE2 3.09Å | ||
| 290 | D | 92.9 | Very high | 93.2 | Very high | 74 Ų | 74 | 64 Ų | 64 | 40% | 0.396 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 167.8 | 173.7 | -152 | -12.2 | 0 | 0 | 0 | 110.8 | V262 | V262-D290 HydrophobicContact CB-CB 4.22Å; V262-D290 PolarHBondContact N-O 2.99Å; V262-D290 PolarHBondContact O-N 3.28Å; V262-D290 VanDerWaalsContact O-N 3.14Å |
| 291 | Q | 94.1 | Very high | 93.4 | Very high | 98 Ų | 98 | 63.6 Ų | 63.6 | 46% | 0.458 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.9 | 114.6 | -176.3 | -70.1 | -65.9 | -33.1 | 0 | 0 | 110.8 | T261 E289 | T261-Q291 PolarHBondContact OG1-NE2 2.94Å; E289-Q291 PolarHBondContact OE1-NE2 2.89Å; E289-Q291 VanDerWaalsContact OE1-NE2 3.09Å |
| 292 | A | 94.4 | Very high | 93.5 | Very high | 6 Ų | 6 | 67.4 Ų | 67.4 | 5% | 0.05 | 39% | 0.385 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 136.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | H259 I260 V262 T281 D283 | H259-A292 CarbonylContact C-O 3.6Å; H259-A292 WeakPolarHBondContact CA-O 3.19Å; I260-A292 HydrophobicContact CB-CB 4.37Å; I260-A292 PolarHBondContact N-O 2.76Å; I260-A292 PolarHBondContact O-N 2.73Å; V262-A292 HydrophobicContact CG2-CB 3.93Å; T281-A292 HydrophobicContact CG2-CB 3.99Å; D283-A292 HydrophobicContact CB-CB 3.93Å |
| 293 | A | 96.4 | Very high | 93.6 | Very high | 57 Ų | 57 | 65.8 Ų | 65.8 | 47% | 0.471 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.1 | 160.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y258 | Y258-A293 VanDerWaalsContact O-CA 3.25Å; Y258-A293 WeakPolarHBondContact O-CA 3.31Å; Y258-A293 WeakPolarHBondContact O-CB 3.18Å |
| 294 | G | 96.6 | Very high | 93.9 | Very high | 16 Ų | 16 | 65.2 Ų | 65.2 | 17% | 0.165 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -164.2 | 155.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111 | T257 Y258 | T257-G294 CarbonylContact C-O 3Å; T257-G294 VanDerWaalsContact CA-O 3.32Å; T257-G294 WeakPolarHBondContact CA-O 3.38Å; T257-G294 PolarHBondContact OG1-O 2.9Å; Y258-G294 WeakPolarHBondContact CD1-O 3.45Å; Y258-G294 PolarHBondContact N-O 3.5Å; Y258-G294 PolarHBondContact O-N 3.38Å |
| 295 | G | 96.3 | Very high | 94.3 | Very high | 37 Ų | 37 | 65.2 Ų | 65.2 | 38% | 0.381 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -161.5 | 154.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F256 | F256-G295 CarbonylContact O-C 3.54Å; F256-G295 WeakPolarHBondContact O-CA 3.38Å |
| 296 | A | 97.3 | Very high | 94.8 | Very high | 15 Ų | 15 | 62.4 Ų | 62.4 | 12% | 0.124 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.2 | 147.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | F256 L271 I279 L298 | F256-A296 PolarHBondContact N-O 2.86Å; F256-A296 PolarHBondContact O-N 3.33Å; L271-A296 HydrophobicContact CD2-CB 4.12Å; I279-A296 HydrophobicContact CD1-CB 4.11Å; I279-A296 HydrophobicContact CG2-CB 4.36Å; A296-L298 HydrophobicContact CB-CD2 4.11Å; A296-L298 HydrophobicContact CB-CG 4.45Å |
| 297 | V | 97.7 | Very high | 95.4 | Very high | 92 Ų | 92 | 55.7 Ų | 55.7 | 56% | 0.558 | 33% | 0.333 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.1 | 124.1 | 165.7 | 179.9 | 0 | 0 | 0 | 0 | 108 | A253 Y254 F255 I334 | A253-V297 HydrophobicContact CB-CG1 4.47Å; Y254-V297 CarbonylContact O-C 3.59Å; Y254-V297 VanDerWaalsContact O-CA 3.26Å; Y254-V297 WeakPolarHBondContact O-CA 3.5Å; F255-V297 HydrophobicContact CD2-CG2 3.8Å; V297-I334 HydrophobicContact CG1-CD1 4Å; V297-I334 HydrophobicContact CG2-CD1 4.09Å |
| 298 | L | 97.3 | Very high | 96.1 | Very high | 17 Ų | 17 | 49.5 Ų | 49.5 | 9% | 0.089 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 134.5 | -179.4 | -55 | -179.1 | 0 | 0 | 0 | 109.8 | Y254 F256 L271 I278 A296 L300 V306 | Y254-L298 PolarHBondContact N-O 2.9Å; Y254-L298 PolarHBondContact O-N 3.49Å; F256-L298 HydrophobicContact CD2-CB 4.45Å; F256-L298 HydrophobicContact CD2-CD1 3.87Å; F256-L298 HydrophobicContact CD2-CG 4.15Å; F256-L298 HydrophobicContact CE2-CB 4.33Å; F256-L298 HydrophobicContact CE2-CD1 4.04Å; F256-L298 HydrophobicContact CE2-CG 4.43Å; L271-L298 HydrophobicContact CD2-CD1 4.09Å; I278-L298 HydrophobicContact CG1-CD1 4.48Å; I278-L298 HydrophobicContact CG1-CD2 4.43Å; I278-L298 HydrophobicContact CG2-CD2 3.58Å; A296-L298 HydrophobicContact CB-CD2 4.11Å; A296-L298 HydrophobicContact CB-CG 4.45Å; L298-L300 HydrophobicContact CB-CD2 4Å; L298-L300 HydrophobicContact CB-CG 4.44Å; L298-V306 HydrophobicContact CD1-CG1 4.43Å; L298-V306 HydrophobicContact CD1-CG2 4.43Å |
| 299 | H | 96.9 | Very high | 96.4 | Very high | 118 Ų | 118 | 46.8 Ų | 46.8 | 55% | 0.546 | 27% | 0.273 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.3 | 127.2 | 161.9 | -169.2 | 76.5 | 0 | 0 | 0 | 108.7 | G252 K273 | G252-H299 CarbonylContact O-C 3.43Å; G252-H299 WeakPolarHBondContact O-CA 3.4Å; G252-H299 PolarHBondContact O-ND1 3.07Å; K273-H299 PolarHBondContact NZ-O 2.93Å |
| 300 | L | 97.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 26% | 0.256 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 139.6 | -179.3 | -58.3 | -174.4 | 0 | 0 | 0 | 110.2 | Y246 C248 A251 G252 Y254 F256 K273 L298 D304 V306 | Y246-L300 HydrophobicContact CE1-CD1 4.02Å; C248-L300 HydrophobicContact CB-CB 4.05Å; C248-L300 HydrophobicContact CB-CD1 4.07Å; C248-L300 VanDerWaalsContact SG-CB 3.57Å; A251-L300 CarbonylContact C-O 3.58Å; A251-L300 VanDerWaalsContact CA-O 3.22Å; A251-L300 WeakPolarHBondContact CA-O 3.44Å; G252-L300 PolarHBondContact N-O 2.88Å; G252-L300 PolarHBondContact O-N 3.45Å; Y254-L300 HydrophobicContact CD1-CD1 4.39Å; Y254-L300 HydrophobicContact CD2-CB 3.84Å; Y254-L300 HydrophobicContact CD2-CD1 3.63Å; Y254-L300 HydrophobicContact CD2-CG 3.76Å; Y254-L300 HydrophobicContact CE2-CB 4.06Å; Y254-L300 HydrophobicContact CE2-CD1 4.15Å; Y254-L300 HydrophobicContact CE2-CG 4.41Å; Y254-L300 HydrophobicContact CG-CD1 3.76Å; Y254-L300 HydrophobicContact CG-CG 4.25Å; F256-L300 HydrophobicContact CE2-CD1 3.88Å; F256-L300 HydrophobicContact CZ-CD1 3.76Å; K273-L300 HydrophobicContact CD-CD2 3.85Å; K273-L300 HydrophobicContact CG-CD2 4.23Å; L298-L300 HydrophobicContact CB-CD2 4Å; L298-L300 HydrophobicContact CB-CG 4.44Å; L300-D304 WeakPolarHBondContact CA-OD2 3.33Å; L300-D304 HydrophobicContact CB-CB 4.22Å; L300-D304 HydrophobicContact CD2-CB 4.2Å; L300-V306 HydrophobicContact CD1-CG2 3.89Å; L300-V306 HydrophobicContact CD2-CG2 3.79Å |
| 301 | D | 97.6 | Very high | 96.4 | Very high | 87 Ų | 87 | 39.8 Ų | 39.8 | 47% | 0.465 | 24% | 0.239 | S | C | . | . | trans | -92.9 | 158.3 | 167.3 | -66.1 | -58.1 | 0 | 0 | 0 | 110.2 | C248 G303 D304 | C248-D301 WeakPolarHBondContact CB-O 3.5Å; C248-D301 PolarHBondContact SG-O 3.03Å; C248-D301 VanDerWaalsContact SG-O 3.39Å; D301-G303 PolarHBondContact O-N 3.09Å; D301-D304 PolarHBondContact N-OD2 2.66Å; D301-D304 VanDerWaalsContact O-CB 3.22Å; D301-D304 WeakPolarHBondContact O-CB 3.25Å; D301-D304 PolarHBondContact O-N 3.18Å | ||
| 302 | V | 97.2 | Very high | 95.8 | Very high | 100 Ų | 100 | 37.3 Ų | 37.3 | 61% | 0.606 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -57 | 127.4 | 178.2 | 179.8 | 0 | 0 | 0 | 0 | 110.1 | A251 | A251-V302 HydrophobicContact CB-CG2 4.23Š|
| 303 | G | 97 | Very high | 95.1 | Very high | 40 Ų | 40 | 38.1 Ų | 38.1 | 41% | 0.412 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 91.1 | -9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115 | C248 D301 | C248-G303 PolarHBondContact O-N 2.98Å; D301-G303 PolarHBondContact O-N 3.09Å |
| 304 | D | 98.3 | Very high | 94.3 | Very high | 18 Ų | 18 | 42.4 Ų | 42.4 | 10% | 0.096 | 26% | 0.259 | C | S | . | . | trans | -57.4 | 140 | 172.1 | -81 | -11.7 | 0 | 0 | 0 | 110.9 | C248 K273 N274 L300 D301 | C248-D304 HydrophobicContact CB-CB 4.12Å; C248-D304 WeakPolarHBondContact CB-O 3.48Å; C248-D304 PolarHBondContact N-O 2.91Å; K273-D304 WeakPolarHBondContact CE-OD2 3.39Å; K273-D304 IonicContact NZ-OD2 2.88Å; K273-D304 PolarHBondContact NZ-OD2 2.99Å; N274-D304 PolarHBondContact ND2-OD1 3.08Å; L300-D304 WeakPolarHBondContact CA-OD2 3.33Å; L300-D304 HydrophobicContact CB-CB 4.22Å; L300-D304 HydrophobicContact CD2-CB 4.2Å; D301-D304 PolarHBondContact N-OD2 2.66Å; D301-D304 VanDerWaalsContact O-CB 3.22Å; D301-D304 WeakPolarHBondContact O-CB 3.25Å; D301-D304 PolarHBondContact O-N 3.18Å | ||
| 305 | K | 98.3 | Very high | 93.6 | Very high | 89 Ų | 89 | 48.3 Ų | 48.3 | 39% | 0.387 | 29% | 0.286 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 131.9 | 179.8 | -64.3 | -176.4 | -176.8 | 179.6 | 0 | 111.3 | Y246 K273 N274 W307 | Y246-K305 CarbonylContact O-C 3.5Å; Y246-K305 VanDerWaalsContact O-CA 3.24Å; Y246-K305 WeakPolarHBondContact O-CA 3.37Å; K273-K305 WeakPolarHBondContact CA-O 3.13Å; N274-K305 PolarHBondContact N-O 3.4Å; N274-K305 PolarHBondContact OD1-N 2.99Å; K305-W307 HydrophobicContact CB-CE3 4.29Å; K305-W307 HydrophobicContact CB-CZ3 4.04Å |
| 306 | V | 98.4 | Very high | 93 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 136.2 | 178.1 | -176.7 | 0 | 0 | 0 | 0 | 110.4 | Y246 F256 L271 M272 K273 L298 L300 F329 | Y246-V306 HydrophobicContact CD1-CB 4.35Å; Y246-V306 PolarHBondContact N-O 2.86Å; Y246-V306 PolarHBondContact O-N 2.77Å; F256-V306 HydrophobicContact CD1-CG1 3.92Å; F256-V306 HydrophobicContact CD2-CG1 4.31Å; F256-V306 HydrophobicContact CE1-CB 3.91Å; F256-V306 HydrophobicContact CE1-CG1 3.7Å; F256-V306 HydrophobicContact CE1-CG2 4.38Å; F256-V306 HydrophobicContact CE2-CB 4.43Å; F256-V306 HydrophobicContact CE2-CG1 4.13Å; F256-V306 HydrophobicContact CE2-CG2 4.09Å; F256-V306 HydrophobicContact CG-CG1 4.21Å; F256-V306 HydrophobicContact CZ-CB 3.83Å; F256-V306 HydrophobicContact CZ-CG1 3.83Å; F256-V306 HydrophobicContact CZ-CG2 3.78Å; L271-V306 HydrophobicContact CD1-CG1 3.75Å; L271-V306 HydrophobicContact CG-CG1 4.29Å; M272-V306 VanDerWaalsContact O-CA 3.23Å; M272-V306 WeakPolarHBondContact O-CA 3.4Å; M272-V306 WeakPolarHBondContact O-CG1 3.33Å; K273-V306 HydrophobicContact CG-CG2 4.49Å; L298-V306 HydrophobicContact CD1-CG1 4.43Å; L298-V306 HydrophobicContact CD1-CG2 4.43Å; L300-V306 HydrophobicContact CD1-CG2 3.89Å; L300-V306 HydrophobicContact CD2-CG2 3.79Å; V306-F329 HydrophobicContact CG1-CZ 4.43Å |
| 307 | W | 98 | Very high | 92.5 | Very high | 18 Ų | 18 | 48.9 Ų | 48.9 | 7% | 0.068 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.5 | 163.2 | 176.3 | 65.5 | 96.9 | 0 | 0 | 0 | 112.3 | P225 G244 R245 M272 K305 | P225-W307 HydrophobicContact CB-CB 4.48Å; P225-W307 HydrophobicContact CB-CG 4.14Å; P225-W307 HydrophobicContact CG-CG 4.36Å; G244-W307 WeakPolarHBondContact O-CB 3.13Å; R245-W307 HydrophobicContact CG-CB 3.96Å; R245-W307 HydrophobicContact CG-CD2 4.2Å; R245-W307 HydrophobicContact CG-CE3 4.12Å; R245-W307 HydrophobicContact CG-CG 4.17Å; M272-W307 HydrophobicContact CB-CD2 3.62Å; M272-W307 HydrophobicContact CB-CE3 4.13Å; M272-W307 HydrophobicContact CB-CG 4.03Å; M272-W307 HydrophobicContact CB-CH2 4.25Å; M272-W307 HydrophobicContact CB-CZ2 3.71Å; M272-W307 HydrophobicContact CB-CZ3 4.42Å; M272-W307 WeakPolarHBondContact CB-O 3.32Å; M272-W307 HydrophobicContact CE-CZ2 4.23Å; M272-W307 HydrophobicContact CG-CD2 4.35Å; M272-W307 HydrophobicContact CG-CG 4.46Å; M272-W307 HydrophobicContact CG-CZ2 4.2Å; M272-W307 PolarHBondContact N-O 3.27Å; M272-W307 PolarHBondContact O-N 3.25Å; M272-W307 VanDerWaalsContact O-N 3.09Å; K305-W307 HydrophobicContact CB-CE3 4.29Å; K305-W307 HydrophobicContact CB-CZ3 4.04Å |
| 308 | L | 97.2 | Very high | 92 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 25% | 0.25 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 140.7 | 168.9 | -157.2 | 70.9 | 0 | 0 | 0 | 109.7 | I226 F228 Y258 I260 V269 L271 | I226-L308 HydrophobicContact CD1-CB 4.13Å; I226-L308 HydrophobicContact CD1-CD2 3.9Å; I226-L308 HydrophobicContact CD1-CG 3.91Å; I226-L308 PolarHBondContact N-O 2.79Å; F228-L308 HydrophobicContact CE2-CB 4.12Å; F228-L308 HydrophobicContact CZ-CB 4.34Å; F228-L308 HydrophobicContact CZ-CD2 3.94Å; Y258-L308 HydrophobicContact CD1-CD1 3.59Å; Y258-L308 HydrophobicContact CD1-CD2 4.41Å; Y258-L308 HydrophobicContact CD2-CD1 4.34Å; Y258-L308 HydrophobicContact CD2-CD2 4.25Å; Y258-L308 HydrophobicContact CE1-CD1 3.6Å; Y258-L308 HydrophobicContact CE2-CD1 4.35Å; Y258-L308 HydrophobicContact CG-CD1 3.97Å; Y258-L308 HydrophobicContact CG-CD2 3.99Å; I260-L308 HydrophobicContact CD1-CD2 4.2Å; V269-L308 HydrophobicContact CB-CD1 4.27Å; V269-L308 HydrophobicContact CB-CD2 4.35Å; V269-L308 HydrophobicContact CB-CG 4.15Å; V269-L308 HydrophobicContact CG1-CD2 4.4Å; V269-L308 HydrophobicContact CG2-CD1 4.28Å; V269-L308 HydrophobicContact CG2-CD2 4.45Å; L271-L308 HydrophobicContact CB-CD1 4.38Å; L271-L308 HydrophobicContact CD1-CD1 4.42Å |
| 309 | Q | 94.9 | Very high | 91.8 | Very high | 22 Ų | 22 | 43.9 Ų | 43.9 | 10% | 0.103 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -141.6 | 140.1 | -176 | 165.2 | 168.5 | -12.6 | 0 | 0 | 111.2 | N223 F224 V269 A270 M272 V311 | N223-Q309 VanDerWaalsContact CA-NE2 3.27Å; N223-Q309 PolarHBondContact O-NE2 2.95Å; F224-Q309 WeakPolarHBondContact O-CG 3.39Å; V269-Q309 CarbonylContact C-O 3.45Å; V269-Q309 VanDerWaalsContact CA-O 3.28Å; V269-Q309 WeakPolarHBondContact CA-O 3.34Å; A270-Q309 PolarHBondContact N-O 2.86Å; A270-Q309 PolarHBondContact O-N 3.41Å; M272-Q309 HydrophobicContact CG-CB 3.88Å; Q309-V311 HydrophobicContact CG-CG1 4.31Å |
| 310 | V | 93.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -73.4 | 132.2 | 170.4 | -179.1 | 0 | 0 | 0 | 0 | 109.9 | P220 N223 I226 K268 F316 N317 L319 | P220-V310 HydrophobicContact CG-CG2 3.68Å; N223-V310 WeakPolarHBondContact CA-O 3.5Å; N223-V310 PolarHBondContact N-O 3.41Å; I226-V310 HydrophobicContact CD1-CG2 3.93Å; I226-V310 HydrophobicContact CG1-CG2 3.98Å; K268-V310 WeakPolarHBondContact O-CA 3.44Å; V310-F316 WeakPolarHBondContact CG1-O 3.32Å; V310-N317 HydrophobicContact CG1-CB 4.13Å; V310-L319 HydrophobicContact CG2-CD1 3.62Å |
| 311 | V | 89.8 | Confident | 91.4 | Very high | 5 Ų | 5 | 39.8 Ų | 39.8 | 3% | 0.03 | 23% | 0.227 | C | C | . | . | trans | -126.1 | 152.6 | 179.7 | -58.3 | 0 | 0 | 0 | 0 | 110.4 | K268 A270 Q309 | K268-V311 HydrophobicContact CB-CG2 4.29Å; K268-V311 WeakPolarHBondContact CB-O 3.43Å; K268-V311 HydrophobicContact CD-CG2 3.88Å; K268-V311 HydrophobicContact CG-CG2 3.58Å; K268-V311 PolarHBondContact O-N 3.43Å; A270-V311 HydrophobicContact CB-CG1 3.68Å; A270-V311 HydrophobicContact CB-CG2 4.36Å; Q309-V311 HydrophobicContact CG-CG1 4.31Å | ||
| 312 | G | 81.1 | Confident | 91.1 | Very high | 47 Ų | 47 | 38.6 Ų | 38.6 | 49% | 0.485 | 22% | 0.221 | S | C | . | . | S | Bend | trans | 94.6 | 4.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | F316 | G312-F316 WeakPolarHBondContact O-CD2 3.34Å; G312-F316 WeakPolarHBondContact O-CE2 3.4Å |
| 313 | G | 80.9 | Confident | 90.7 | Very high | 23 Ų | 23 | 42.7 Ų | 42.7 | 24% | 0.237 | 23% | 0.233 | C | C | . | . | trans | 97.6 | -176.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | A222 L315 F316 | A222-G313 VanDerWaalsContact CB-C 3.48Å; G313-L315 PolarHBondContact O-N 2.84Å; G313-F316 PolarHBondContact O-N 3.14Å | ||
| 314 | E | 78.5 | Confident | 90.3 | Very high | 147 Ų | 147 | 47.9 Ų | 47.9 | 69% | 0.687 | 25% | 0.252 | S | S | * | . | G | 310 helix | trans | -68.8 | -12.9 | -173.8 | -62.3 | -171.5 | 165.3 | 0 | 0 | 114.3 | A222 F316 N317 | A222-E314 HydrophobicContact CB-CG 4.15Å; E314-F316 VanDerWaalsContact C-N 3.27Å; E314-F316 PolarHBondContact O-N 3.09Å; E314-N317 PolarHBondContact O-OD1 2.99Å |
| 315 | L | 82.1 | Confident | 90 | Very high | 139 Ų | 139 | 49 Ų | 49 | 73% | 0.728 | 26% | 0.258 | S | S | * | . | G | 310 helix | trans | -77.8 | -12.6 | 177.5 | -63.4 | 174.1 | 0 | 0 | 0 | 113.1 | G313 | G313-L315 PolarHBondContact O-N 2.84Š|
| 316 | F | 84.1 | Confident | 89.9 | Confident | 50 Ų | 50 | 48.1 Ų | 48.1 | 22% | 0.219 | 26% | 0.257 | C | S | . | . | G | 310 helix | trans | -114.6 | 24.1 | -173.6 | -65.3 | -85.3 | 0 | 0 | 0 | 113.8 | N266 V267 K268 V310 G312 G313 E314 | N266-F316 HydrophobicContact CB-CD1 3.65Å; N266-F316 HydrophobicContact CB-CE1 3.95Å; N266-F316 CarbonylContact O-C 3.51Å; N266-F316 WeakPolarHBondContact O-CA 3.39Å; V267-F316 WeakPolarHBondContact CA-O 3.33Å; K268-F316 HydrophobicContact CB-CB 3.69Å; K268-F316 HydrophobicContact CB-CD1 3.83Å; K268-F316 HydrophobicContact CB-CG 3.94Å; K268-F316 PolarHBondContact N-O 3.32Å; K268-F316 VanDerWaalsContact N-O 3.11Å; V310-F316 WeakPolarHBondContact CG1-O 3.32Å; G312-F316 WeakPolarHBondContact O-CD2 3.34Å; G312-F316 WeakPolarHBondContact O-CE2 3.4Å; G313-F316 PolarHBondContact O-N 3.14Å; E314-F316 VanDerWaalsContact C-N 3.27Å; E314-F316 PolarHBondContact O-N 3.09Å |
| 317 | N | 85.4 | Confident | 89.8 | Confident | 14 Ų | 14 | 48.1 Ų | 48.1 | 8% | 0.075 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 28.7 | -177.6 | 74.7 | -17.5 | 0 | 0 | 0 | 113.9 | R265 N266 V310 E314 L319 | R265-N317 WeakPolarHBondContact CD-OD1 3.25Å; R265-N317 PolarHBondContact NH1-OD1 3.48Å; N266-N317 PolarHBondContact O-N 3.42Å; V310-N317 HydrophobicContact CG1-CB 4.13Å; E314-N317 PolarHBondContact O-OD1 2.99Å; N317-L319 PolarHBondContact O-N 3.02Å |
| 318 | G | 88.4 | Confident | 89.8 | Confident | 2 Ų | 2 | 48.4 Ų | 48.4 | 2% | 0.021 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.5 | 33.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | F263 N266 V267 | F263-G318 PolarHBondContact N-O 3.14Å; F263-G318 VanDerWaalsContact N-O 3.08Å; N266-G318 PolarHBondContact O-N 2.9Å; V267-G318 VanDerWaalsContact CG2-O 3.25Å; V267-G318 WeakPolarHBondContact CG2-O 3.34Å |
| 319 | L | 92.1 | Very high | 89.8 | Confident | 3 Ų | 3 | 48.4 Ų | 48.4 | 2% | 0.016 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71 | 142.6 | 174.9 | -63.3 | 87.3 | 0 | 0 | 0 | 108.8 | L213 P220 I226 I260 V267 V269 V310 N317 T327 | L213-L319 HydrophobicContact CD1-CB 3.92Å; L213-L319 HydrophobicContact CD1-CD2 3.97Å; P220-L319 HydrophobicContact CG-CD1 4.3Å; I226-L319 HydrophobicContact CD1-CD2 3.7Å; I260-L319 HydrophobicContact CG2-CB 4.41Å; I260-L319 HydrophobicContact CG2-CD2 4.21Å; I260-L319 HydrophobicContact CG2-CG 3.97Å; V267-L319 HydrophobicContact CG2-CD1 4.49Å; V267-L319 HydrophobicContact CG2-CG 4.42Å; V269-L319 HydrophobicContact CG1-CD2 4.36Å; V310-L319 HydrophobicContact CG2-CD1 3.62Å; N317-L319 PolarHBondContact O-N 3.02Å; L319-T327 HydrophobicContact CD2-CG2 4.22Å |
| 320 | F | 93.2 | Very high | 90 | Very high | 31 Ų | 31 | 48.4 Ų | 48.4 | 14% | 0.136 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.5 | 144.7 | -177 | -165.4 | -101.2 | 0 | 0 | 0 | 112.4 | K218 T261 F263 D322 D325 T327 | K218-F320 HydrophobicContact CD-CD2 4.22Å; K218-F320 HydrophobicContact CD-CE2 4.42Å; T261-F320 HydrophobicContact CG2-CB 4.01Å; T261-F320 HydrophobicContact CG2-CD1 4.13Å; T261-F320 PolarHBondContact O-N 3.3Å; F263-F320 HydrophobicContact CB-CB 3.74Å; F263-F320 HydrophobicContact CB-CD1 4.43Å; F263-F320 HydrophobicContact CB-CD2 3.99Å; F263-F320 HydrophobicContact CB-CG 3.81Å; F263-F320 AromaticContact CD1-CD2 3.8Å; F263-F320 HydrophobicContact CD1-CD2 3.8Å; F263-F320 AromaticContact CD1-CE2 3.87Å; F263-F320 HydrophobicContact CD1-CE2 3.87Å; F263-F320 HydrophobicContact CD1-CG 4.4Å; F263-F320 HydrophobicContact CE1-CE2 4.41Å; F263-F320 HydrophobicContact CG-CD2 4.22Å; F263-F320 HydrophobicContact CG-CG 4.37Å; F320-D322 HydrophobicContact CE1-CB 4.33Å; F320-D322 WeakPolarHBondContact CE1-OD2 3.24Å; F320-D322 HydrophobicContact CZ-CB 4.4Å; F320-D322 WeakPolarHBondContact CZ-OD2 3.23Å; F320-D325 HydrophobicContact CD1-CB 3.93Å; F320-D325 HydrophobicContact CE1-CB 4.06Å; F320-D325 WeakPolarHBondContact CE1-OD2 3.27Å; F320-T327 WeakPolarHBondContact O-CB 3.43Å; F320-T327 PolarHBondContact O-OG1 3.21Å |
| 321 | A | 93.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 26% | 0.264 | C | S | . | . | trans | -162.5 | 139.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | L213 A215 D325 | L213-A321 HydrophobicContact CB-CB 3.64Å; A215-A321 WeakPolarHBondContact CA-O 3.38Å; A321-D325 VanDerWaalsContact CA-O 3.27Å; A321-D325 WeakPolarHBondContact CA-O 3.36Å | ||
| 322 | D | 90.8 | Very high | 90.6 | Very high | 62 Ų | 62 | 52.6 Ų | 52.6 | 33% | 0.332 | 28% | 0.282 | S | S | . | . | trans | -145.4 | -143.6 | 172 | 65.3 | 19.4 | 0 | 0 | 0 | 111.3 | F320 D324 D325 | F320-D322 HydrophobicContact CE1-CB 4.33Å; F320-D322 WeakPolarHBondContact CE1-OD2 3.24Å; F320-D322 HydrophobicContact CZ-CB 4.4Å; F320-D322 WeakPolarHBondContact CZ-OD2 3.23Å; D322-D324 PolarHBondContact OD1-N 3.32Å; D322-D325 PolarHBondContact N-O 3.18Å; D322-D325 PolarHBondContact OD1-N 2.92Å | ||
| 323 | E | 90 | Very high | 91.4 | Very high | 186 Ų | 186 | 51.5 Ų | 51.5 | 87% | 0.869 | 27% | 0.265 | S | S | * | . | S | Bend | trans | -76.7 | -28.5 | 179.9 | -66 | -171.9 | 170.4 | 0 | 0 | 112.3 | ||
| 324 | D | 88.9 | Confident | 92 | Very high | 150 Ų | 150 | 53.6 Ų | 53.6 | 80% | 0.802 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -116.1 | -17.6 | -173.9 | -63.8 | -39.2 | 0 | 0 | 0 | 112.6 | D322 | D322-D324 PolarHBondContact OD1-N 3.32Š|
| 325 | D | 92.2 | Very high | 92.7 | Very high | 42 Ų | 42 | 53.7 Ų | 53.7 | 23% | 0.225 | 27% | 0.268 | C | S | . | . | trans | -107.9 | 135.5 | 177.3 | -68.4 | -51.2 | 0 | 0 | 0 | 113.7 | T261 F320 A321 D322 | T261-D325 HydrophobicContact CG2-CB 4.48Å; F320-D325 HydrophobicContact CD1-CB 3.93Å; F320-D325 HydrophobicContact CE1-CB 4.06Å; F320-D325 WeakPolarHBondContact CE1-OD2 3.27Å; A321-D325 VanDerWaalsContact CA-O 3.27Å; A321-D325 WeakPolarHBondContact CA-O 3.36Å; D322-D325 PolarHBondContact N-O 3.18Å; D322-D325 PolarHBondContact OD1-N 2.92Å | ||
| 326 | D | 94.4 | Very high | 92.9 | Very high | 69 Ų | 69 | 48.9 Ų | 48.9 | 37% | 0.369 | 25% | 0.252 | S | S | . | . | trans | -123.5 | 122.9 | -175 | -89.7 | -48.9 | 0 | 0 | 0 | 113 | K230 T261 T328 | K230-D326 IonicContact NZ-OD1 2.67Å; K230-D326 PolarHBondContact NZ-OD1 2.57Å; K230-D326 IonicContact NZ-OD2 3.25Å; K230-D326 PolarHBondContact NZ-OD2 2.94Å; T261-D326 PolarHBondContact OG1-O 3.36Å; D326-T328 HydrophobicContact CB-CG2 4.15Å | ||
| 327 | T | 96.5 | Very high | 92.5 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.287 | C | S | . | . | trans | -104 | 120.8 | 161 | -74.3 | 0 | 0 | 0 | 0 | 109 | G212 L213 F228 H259 I260 T261 L319 F320 | G212-T327 CarbonylContact C-O 3.58Å; G212-T327 VanDerWaalsContact CA-O 3.23Å; G212-T327 WeakPolarHBondContact CA-O 3.31Å; L213-T327 HydrophobicContact CD1-CG2 3.5Å; L213-T327 VanDerWaalsContact CD1-CG2 3.5Å; L213-T327 HydrophobicContact CG-CG2 4.02Å; L213-T327 PolarHBondContact N-O 3.37Å; F228-T327 HydrophobicContact CE1-CG2 4.12Å; H259-T327 CarbonylContact O-C 3.48Å; H259-T327 WeakPolarHBondContact O-CA 3.32Å; I260-T327 HydrophobicContact CB-CG2 4.22Å; I260-T327 HydrophobicContact CG1-CG2 4.05Å; I260-T327 HydrophobicContact CG2-CG2 4.07Å; T261-T327 PolarHBondContact N-OG1 2.68Å; L319-T327 HydrophobicContact CD2-CG2 4.22Å; F320-T327 WeakPolarHBondContact O-CB 3.43Å; F320-T327 PolarHBondContact O-OG1 3.21Å | ||
| 328 | T | 97.9 | Very high | 92.9 | Very high | 25 Ų | 25 | 55 Ų | 55 | 15% | 0.153 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.1 | 152.9 | -169.7 | 65 | 0 | 0 | 0 | 0 | 113.7 | V211 I232 Y258 H259 D326 | V211-T328 CarbonylContact O-C 3.51Å; V211-T328 VanDerWaalsContact O-CA 3.27Å; V211-T328 WeakPolarHBondContact O-CA 3.21Å; I232-T328 HydrophobicContact CD1-CG2 4.2Å; Y258-T328 CarbonylContact C-O 3.5Å; Y258-T328 WeakPolarHBondContact CA-O 3.41Å; Y258-T328 VanDerWaalsContact CB-O 3.3Å; Y258-T328 WeakPolarHBondContact CB-O 3.27Å; H259-T328 PolarHBondContact N-O 2.81Å; H259-T328 PolarHBondContact O-N 3.22Å; D326-T328 HydrophobicContact CB-CG2 4.15Å |
| 329 | F | 98.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.1 | 128.5 | 171.3 | 176.6 | -136.6 | 0 | 0 | 0 | 109.4 | F209 V211 F228 F256 T257 Y258 L271 V306 | F209-F329 AromaticContact CE2-CD1 3.54Å; F209-F329 HydrophobicContact CE2-CD1 3.54Å; F209-F329 AromaticContact CE2-CE1 3.61Å; F209-F329 HydrophobicContact CE2-CE1 3.61Å; F209-F329 HydrophobicContact CE2-CG 4.07Å; F209-F329 HydrophobicContact CE2-CZ 4.22Å; F209-F329 AromaticContact CZ-CD1 3.89Å; F209-F329 HydrophobicContact CZ-CD1 3.89Å; F209-F329 AromaticContact CZ-CE1 3.47Å; F209-F329 HydrophobicContact CZ-CE1 3.47Å; F209-F329 VanDerWaalsContact CZ-CE1 3.47Å; F209-F329 HydrophobicContact CZ-CE2 4.26Å; F209-F329 HydrophobicContact CZ-CG 4.44Å; F209-F329 AromaticContact CZ-CZ 3.69Å; F209-F329 HydrophobicContact CZ-CZ 3.69Å; V211-F329 HydrophobicContact CG2-CB 4.26Å; V211-F329 VanDerWaalsContact CG2-O 3.26Å; V211-F329 WeakPolarHBondContact CG2-O 3.47Å; V211-F329 PolarHBondContact N-O 2.67Å; V211-F329 PolarHBondContact O-N 3.25Å; F228-F329 HydrophobicContact CD1-CB 4.22Å; F228-F329 HydrophobicContact CD2-CB 4.08Å; F228-F329 HydrophobicContact CD2-CD1 4.18Å; F228-F329 HydrophobicContact CE1-CB 3.81Å; F228-F329 HydrophobicContact CE2-CB 3.66Å; F228-F329 AromaticContact CE2-CD1 3.9Å; F228-F329 HydrophobicContact CE2-CD1 3.9Å; F228-F329 HydrophobicContact CE2-CG 4.12Å; F228-F329 HydrophobicContact CG-CB 4.35Å; F228-F329 HydrophobicContact CZ-CB 3.52Å; F228-F329 HydrophobicContact CZ-CG 4.34Å; F256-F329 HydrophobicContact CB-CE2 4.23Å; F256-F329 HydrophobicContact CD1-CE2 4.02Å; F256-F329 AromaticContact CD1-CZ 3.87Å; F256-F329 HydrophobicContact CD1-CZ 3.87Å; T257-F329 WeakPolarHBondContact O-CD2 3.4Å; Y258-F329 HydrophobicContact CD1-CD2 4.42Å; L271-F329 HydrophobicContact CD1-CE2 3.8Å; L271-F329 HydrophobicContact CD1-CZ 3.85Å; V306-F329 HydrophobicContact CG1-CZ 4.43Å |
| 330 | S | 98.6 | Very high | 93.2 | Very high | 21 Ų | 21 | 60.8 Ų | 60.8 | 15% | 0.147 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.6 | 150.3 | -177.2 | -57.2 | 0 | 0 | 0 | 0 | 110.7 | F209 S210 F256 T257 | F209-S330 CarbonylContact O-C 3.52Å; F209-S330 VanDerWaalsContact O-CA 3.31Å; F209-S330 WeakPolarHBondContact O-CA 3.49Å; S210-S330 WeakPolarHBondContact CB-OG 2.85Å; S210-S330 PolarHBondContact OG-OG 3.04Å; F256-S330 CarbonylContact C-O 3.56Å; F256-S330 WeakPolarHBondContact CA-O 3.14Å; T257-S330 PolarHBondContact N-O 3.31Å; T257-S330 PolarHBondContact O-N 2.83Å; T257-S330 VanDerWaalsContact O-O 3.1Å |
| 331 | G | 98.3 | Very high | 93.2 | Very high | 1 Ų | 1 | 62.6 Ų | 62.6 | 1% | 0.01 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.4 | 146.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A208 F209 F255 | A208-G331 CarbonylContact C-O 3.59Å; A208-G331 VanDerWaalsContact CA-O 3.22Å; A208-G331 WeakPolarHBondContact CA-O 3.31Å; F209-G331 WeakPolarHBondContact CD1-O 3.45Å; F209-G331 PolarHBondContact N-O 2.94Å; F209-G331 PolarHBondContact O-N 2.88Å; F255-G331 CarbonylContact O-C 3.46Å; F255-G331 WeakPolarHBondContact O-CA 3.36Å |
| 332 | F | 97.8 | Very high | 93.2 | Very high | 92 Ų | 92 | 66.5 Ų | 66.5 | 40% | 0.404 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.6 | 152.8 | -179.2 | 58 | -92.4 | 0 | 0 | 0 | 112.4 | S207 A208 Y254 F255 I334 | S207-F332 CarbonylContact O-C 3.53Å; S207-F332 WeakPolarHBondContact O-CA 3.45Å; A208-F332 HydrophobicContact CB-CB 3.55Å; Y254-F332 CarbonylContact C-O 3.59Å; Y254-F332 VanDerWaalsContact CA-O 3.32Å; Y254-F332 WeakPolarHBondContact CA-O 3.48Å; F255-F332 HydrophobicContact CB-CE1 4.32Å; F255-F332 HydrophobicContact CB-CE2 4.13Å; F255-F332 HydrophobicContact CB-CZ 3.98Å; F255-F332 AromaticContact CD1-CE1 3.66Å; F255-F332 HydrophobicContact CD1-CE1 3.66Å; F255-F332 AromaticContact CD1-CZ 3.64Å; F255-F332 HydrophobicContact CD1-CZ 3.64Å; F255-F332 HydrophobicContact CG-CE1 4.49Å; F255-F332 HydrophobicContact CG-CZ 4.26Å; F255-F332 PolarHBondContact N-O 2.87Å; F255-F332 PolarHBondContact O-N 3.47Å; F332-I334 HydrophobicContact CE2-CG1 4.32Å |
| 333 | I | 96.9 | Very high | 93.3 | Very high | 25 Ų | 25 | 66.8 Ų | 66.8 | 13% | 0.128 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 133.2 | 173.3 | -164.5 | 171.3 | 0 | 0 | 0 | 110.3 | P205 S207 V250 Y254 | P205-I333 HydrophobicContact CB-CD1 4.47Å; P205-I333 HydrophobicContact CG-CD1 4.16Å; P205-I333 WeakPolarHBondContact O-CG2 3.39Å; S207-I333 PolarHBondContact O-N 3.36Å; V250-I333 HydrophobicContact CG1-CD1 4.47Å; Y254-I333 HydrophobicContact CD1-CB 3.93Å; Y254-I333 HydrophobicContact CD1-CG1 4.44Å; Y254-I333 HydrophobicContact CE1-CB 3.48Å; Y254-I333 VanDerWaalsContact CE1-CB 3.48Å; Y254-I333 HydrophobicContact CE1-CD1 4.39Å; Y254-I333 HydrophobicContact CE1-CG1 3.95Å; Y254-I333 HydrophobicContact CE2-CD1 4.25Å; Y254-I333 HydrophobicContact CE2-CG1 4.07Å |
| 334 | I | 94.6 | Very high | 93.6 | Very high | 67 Ų | 67 | 58.3 Ų | 58.3 | 34% | 0.344 | 33% | 0.327 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99 | -50.5 | 174.4 | -44.8 | 174.8 | 0 | 0 | 0 | 109.2 | A253 F255 V297 F332 | A253-I334 PolarHBondContact O-N 3.26Å; F255-I334 HydrophobicContact CB-CD1 3.77Å; F255-I334 HydrophobicContact CB-CG1 4.02Å; V297-I334 HydrophobicContact CG1-CD1 4Å; V297-I334 HydrophobicContact CG2-CD1 4.09Å; F332-I334 HydrophobicContact CE2-CG1 4.32Å |
| 335 | F | 91.8 | Very high | 93.9 | Very high | 149 Ų | 149 | 51.2 Ų | 51.2 | 65% | 0.654 | 29% | 0.291 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -135.3 | 114.4 | -178.9 | -55.3 | -64.9 | 0 | 0 | 0 | 108.8 | G252 A253 | G252-F335 CarbonylContact C-O 3.6Å; G252-F335 WeakPolarHBondContact CA-O 3.47Å; A253-F335 HydrophobicContact CB-CB 4.32Å; A253-F335 HydrophobicContact CB-CD2 4.11Å; A253-F335 PolarHBondContact N-O 2.67Å; A253-F335 PolarHBondContact O-N 3.19Å |
| 336 | G | 86.6 | Confident | 94.1 | Very high | 38 Ų | 38 | 52 Ų | 52 | 39% | 0.392 | 30% | 0.297 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.7 | 140.1 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 337 | S | 77 | Confident | 94 | Very high | 137 Ų | 137 | 50.5 Ų | 50.5 | 96% | 0.958 | 29% | 0.29 | S | S | * | . | trans | -91.8 | 0 | 172.2 | 56.8 | 0 | 0 | 0 | 0 | 112.2 | A251 | A251-S337 WeakPolarHBondContact CB-OG 3.47Å; A251-S337 PolarHBondContact O-N 3.32Å; A251-S337 PolarHBondContact O-OG 3.01Å |
Retrieved 337 of 337 residues in 174.6 ms
(Link to these results)