| 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 | 41.5 | Very low | 39.4 | Very low | 209 Ų | 209 | 126 Ų | 126 | 100% | 1.03 | 82% | 0.816 | S | S | * | * | 0 | 93.4 | 0 | -53.2 | 78 | 176.1 | 0 | 0 | 107.3 | |||||
| 2 | E | 37.2 | Very low | 40 | Very low | 177 Ų | 177 | 127.3 Ų | 127.3 | 83% | 0.827 | 83% | 0.825 | S | S | * | * | cis | 68.4 | 134.7 | 42.7 | -48.1 | 147.7 | 106.1 | 0 | 0 | 110.9 | ||||
| 3 | A | 42.8 | Very low | 39.4 | Very low | 87 Ų | 87 | 122.8 Ų | 122.8 | 72% | 0.719 | 82% | 0.816 | S | S | * | * | cis | -146.1 | 155.2 | -1.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 4 | Q | 44.2 | Very low | 39.1 | Very low | 188 Ų | 188 | 121.6 Ų | 121.6 | 88% | 0.879 | 82% | 0.821 | S | S | * | * | 63.2 | 138.6 | 65.2 | -129.2 | 165.3 | 29.9 | 0 | 0 | 113.3 | V6 | Q4-V6 HydrophobicContact CG-CG2 4.48Š| |||
| 5 | G | 36.6 | Very low | 38.9 | Very low | 67 Ų | 67 | 119.3 Ų | 119.3 | 69% | 0.691 | 81% | 0.814 | S | S | * | * | cis | -138 | -166.2 | 1.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 6 | V | 41.1 | Very low | 38.5 | Very low | 124 Ų | 124 | 119.9 Ų | 119.9 | 75% | 0.752 | 82% | 0.819 | S | S | * | * | cis | 122.9 | 115.2 | 18.3 | 164.2 | 0 | 0 | 0 | 0 | 109.2 | Q4 | Q4-V6 HydrophobicContact CG-CG2 4.48Š| ||
| 7 | A | 41.9 | Very low | 38.1 | Very low | 97 Ų | 97 | 117.2 Ų | 117.2 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | trans | 176 | 92.4 | 158.7 | 0 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 8 | E | 40 | Very low | 38.2 | Very low | 180 Ų | 180 | 118.5 Ų | 118.5 | 84% | 0.841 | 82% | 0.818 | S | S | * | * | 59.1 | 121.1 | 52.3 | -154.3 | 179.9 | 142.1 | 0 | 0 | 113.9 | |||||
| 9 | G | 34.6 | Very low | 38.5 | Very low | 80 Ų | 80 | 118.8 Ų | 118.8 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -175.4 | 100.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 10 | A | 36.6 | Very low | 38.6 | Very low | 103 Ų | 103 | 121.4 Ų | 121.4 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | trans | -106.9 | 151.6 | -171.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 11 | G | 36.9 | Very low | 39.2 | Very low | 74 Ų | 74 | 121.4 Ų | 121.4 | 76% | 0.763 | 82% | 0.815 | S | S | * | * | trans | -168.7 | 119.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 12 | P | 46.9 | Very low | 38.8 | Very low | 142 Ų | 142 | 115.8 Ų | 115.8 | 92% | 0.922 | 80% | 0.801 | S | S | * | * | trans | -112.3 | 159.5 | -166.4 | 39.9 | -34.6 | 0 | 0 | 0 | 116.6 | ||||
| 13 | G | 32 | Very low | 38.7 | Very low | 69 Ų | 69 | 111.9 Ų | 111.9 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | 176.3 | 118.6 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 14 | A | 34.8 | Very low | 38.4 | Very low | 106 Ų | 106 | 116.4 Ų | 116.4 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | 70.5 | 126.8 | 51.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 15 | A | 36.3 | Very low | 38 | Very low | 87 Ų | 87 | 111.8 Ų | 111.8 | 72% | 0.719 | 81% | 0.805 | S | S | * | * | cis | -165 | 163.7 | -10.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 16 | S | 32.3 | Very low | 38.6 | Very low | 128 Ų | 128 | 114.4 Ų | 114.4 | 90% | 0.895 | 81% | 0.809 | S | S | * | * | trans | 65.3 | 147.6 | 154.7 | -58.8 | 0 | 0 | 0 | 0 | 121 | ||||
| 17 | G | 32.4 | Very low | 38.2 | Very low | 75 Ų | 75 | 113 Ų | 113 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | trans | 143.5 | 66.1 | 153.2 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 18 | V | 40.2 | Very low | 37.9 | Very low | 140 Ų | 140 | 113 Ų | 113 | 85% | 0.848 | 81% | 0.811 | S | S | * | * | trans | -141.9 | 121.8 | 162.5 | 175.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 19 | P | 42.7 | Very low | 37.8 | Very low | 124 Ų | 124 | 109 Ų | 109 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | -145.5 | 162.6 | 106 | 38.2 | -22.3 | 0 | 0 | 0 | 116.6 | |||||
| 20 | H | 40.8 | Very low | 38.3 | Very low | 170 Ų | 170 | 111.1 Ų | 111.1 | 79% | 0.787 | 81% | 0.808 | S | S | * | * | trans | -62.7 | 164.6 | 162.1 | -114.8 | -134.8 | 0 | 0 | 0 | 111.5 | ||||
| 21 | P | 50.4 | Low | 38.2 | Very low | 122 Ų | 122 | 110 Ų | 110 | 79% | 0.792 | 80% | 0.799 | S | S | * | * | -139.1 | -170.8 | 57.2 | 41.4 | -21.1 | 0 | 0 | 0 | 113.1 | |||||
| 22 | A | 33.7 | Very low | 38.5 | Very low | 91 Ų | 91 | 114.7 Ų | 114.7 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | cis | -149.9 | 170.8 | 17.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 23 | A | 36.3 | Very low | 38.1 | Very low | 95 Ų | 95 | 112.8 Ų | 112.8 | 79% | 0.785 | 80% | 0.802 | S | S | * | * | trans | -120.9 | 141 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 24 | L | 35.6 | Very low | 38.4 | Very low | 182 Ų | 182 | 114 Ų | 114 | 95% | 0.953 | 81% | 0.805 | S | S | * | * | trans | -141.5 | 135.5 | 158 | -75.3 | -179.6 | 0 | 0 | 0 | 109.6 | ||||
| 25 | A | 34.9 | Very low | 38.9 | Very low | 91 Ų | 91 | 115.8 Ų | 115.8 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | trans | -121.9 | -174.8 | 168.3 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 26 | P | 51 | Low | 39.6 | Very low | 122 Ų | 122 | 116.5 Ų | 116.5 | 79% | 0.792 | 81% | 0.812 | S | S | * | * | cis | -131.6 | -174.8 | -4.5 | 42.8 | -27.7 | 0 | 0 | 0 | 113.1 | ||||
| 27 | A | 31.4 | Very low | 40.3 | Very low | 94 Ų | 94 | 114.2 Ų | 114.2 | 78% | 0.777 | 80% | 0.8 | S | S | * | * | 172.4 | 157.4 | 127.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 28 | A | 35.6 | Very low | 41.8 | Very low | 99 Ų | 99 | 115.1 Ų | 115.1 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | 53.1 | 100.2 | 154.1 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 29 | A | 38.2 | Very low | 42.7 | Very low | 96 Ų | 96 | 116.8 Ų | 116.8 | 79% | 0.793 | 79% | 0.793 | S | S | * | * | trans | -80.9 | 158.5 | 137.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 30 | P | 45.8 | Very low | 43 | Very low | 123 Ų | 123 | 119.7 Ų | 119.7 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | -148.5 | 164.5 | 80.8 | 40.6 | -23.9 | 0 | 0 | 0 | 117.2 | |||||
| 31 | A | 33.3 | Very low | 43.7 | Very low | 81 Ų | 81 | 117.1 Ų | 117.1 | 67% | 0.669 | 79% | 0.79 | S | S | * | * | trans | 66.6 | 108.9 | 141.6 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 32 | L | 44 | Very low | 44 | Very low | 171 Ų | 171 | 118.5 Ų | 118.5 | 90% | 0.895 | 79% | 0.79 | S | S | * | * | trans | 80.2 | 154.9 | 130.3 | -60.8 | 172.4 | 0 | 0 | 0 | 121 | ||||
| 33 | A | 37.9 | Very low | 45.4 | Very low | 102 Ų | 102 | 121.7 Ų | 121.7 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | 67.6 | 135.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 34 | A | 39.7 | Very low | 46.8 | Very low | 94 Ų | 94 | 123 Ų | 123 | 78% | 0.777 | 79% | 0.791 | S | S | * | * | cis | -149.3 | 144 | -12.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | A36 | A34-A36 PolarHBondContact O-N 2.54Š| ||
| 35 | T | 43.5 | Very low | 48.4 | Very low | 144 Ų | 144 | 123 Ų | 123 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | trans | -75.2 | 106.6 | 176.8 | -17.2 | 0 | 0 | 0 | 0 | 110.1 | A37 | T35-A37 VanDerWaalsContact C-N 3.32Å; T35-A37 PolarHBondContact O-N 3.41Å | ||
| 36 | A | 51.5 | Low | 49.6 | Very low | 103 Ų | 103 | 127 Ų | 127 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -72.6 | 83.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111 | A34 S38 | A34-A36 PolarHBondContact O-N 2.54Å; A36-S38 PolarHBondContact O-N 3.26Å | ||
| 37 | A | 48 | Very low | 50.1 | Low | 79 Ų | 79 | 126.9 Ų | 126.9 | 65% | 0.653 | 79% | 0.791 | S | S | * | * | trans | -64.8 | 114.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | T35 Q39 | T35-A37 VanDerWaalsContact C-N 3.32Å; T35-A37 PolarHBondContact O-N 3.41Å; A37-Q39 PolarHBondContact O-N 2.87Å | ||
| 38 | S | 62.7 | Low | 50.5 | Low | 95 Ų | 95 | 128.9 Ų | 128.9 | 66% | 0.664 | 80% | 0.798 | S | S | * | * | trans | -72.9 | 97.5 | 177.9 | -168.5 | 0 | 0 | 0 | 0 | 110.4 | A36 F40 | A36-S38 PolarHBondContact O-N 3.26Å; S38-F40 PolarHBondContact O-N 3.49Å; S38-F40 VanDerWaalsContact O-N 3.13Å; S38-F40 WeakPolarHBondContact OG-CE2 3.32Å | ||
| 39 | Q | 59.4 | Low | 50.9 | Low | 174 Ų | 174 | 128.5 Ų | 128.5 | 81% | 0.813 | 80% | 0.795 | S | S | * | * | trans | -82.7 | 88.6 | -175.3 | -62.1 | -148 | 90.5 | 0 | 0 | 111.9 | A37 T41 | A37-Q39 PolarHBondContact O-N 2.87Å; Q39-T41 PolarHBondContact O-N 2.96Å; Q39-T41 VanDerWaalsContact O-N 3.11Å | ||
| 40 | F | 49.3 | Very low | 51.1 | Low | 185 Ų | 185 | 127.8 Ų | 127.8 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | -77 | 86.8 | 167.5 | -75.9 | -81.6 | 0 | 0 | 0 | 110.8 | S38 L42 | S38-F40 PolarHBondContact O-N 3.49Å; S38-F40 VanDerWaalsContact O-N 3.13Å; S38-F40 WeakPolarHBondContact OG-CE2 3.32Å; F40-L42 PolarHBondContact O-N 3.23Å; F40-L42 VanDerWaalsContact O-N 3.07Å | ||
| 41 | T | 55.4 | Low | 50.7 | Low | 116 Ų | 116 | 131.4 Ų | 131.4 | 71% | 0.712 | 80% | 0.803 | S | S | * | * | trans | -66.4 | 103.9 | 175.3 | -54.5 | 0 | 0 | 0 | 0 | 110.9 | Q39 L43 | Q39-T41 PolarHBondContact O-N 2.96Å; Q39-T41 VanDerWaalsContact O-N 3.11Å; T41-L43 PolarHBondContact O-N 2.93Å | ||
| 42 | L | 57.1 | Low | 51.2 | Low | 151 Ų | 151 | 134.4 Ų | 134.4 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -80.9 | 97.7 | 179.5 | -137.7 | 176.9 | 0 | 0 | 0 | 110.2 | F40 V44 | F40-L42 PolarHBondContact O-N 3.23Å; F40-L42 VanDerWaalsContact O-N 3.07Å; L42-V44 PolarHBondContact O-N 3Å | ||
| 43 | L | 61.9 | Low | 51.5 | Low | 158 Ų | 158 | 133.7 Ų | 133.7 | 83% | 0.827 | 80% | 0.8 | S | S | * | * | trans | -70.9 | 91.3 | 177.5 | -77.5 | 159 | 0 | 0 | 0 | 111 | T41 M45 | T41-L43 PolarHBondContact O-N 2.93Å; L43-M45 PolarHBondContact O-N 3.22Å | ||
| 44 | V | 66.3 | Low | 51.4 | Low | 122 Ų | 122 | 133.5 Ų | 133.5 | 74% | 0.739 | 80% | 0.798 | S | S | * | * | trans | -74.6 | 116.7 | 171.3 | 177.8 | 0 | 0 | 0 | 0 | 109.3 | L42 Q46 | L42-V44 PolarHBondContact O-N 3Å; V44-Q46 PolarHBondContact O-N 3.28Å; V44-Q46 VanDerWaalsContact O-N 3.15Å | ||
| 45 | M | 69.3 | Low | 51.2 | Low | 184 Ų | 184 | 132.6 Ų | 132.6 | 91% | 0.906 | 79% | 0.791 | S | S | * | * | trans | -75.4 | 103.7 | -179.2 | -167.2 | 164.2 | 67.4 | 0 | 0 | 110.5 | L43 | L43-M45 PolarHBondContact O-N 3.22Š| ||
| 46 | Q | 61.4 | Low | 50.9 | Low | 175 Ų | 175 | 132.4 Ų | 132.4 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | -79.1 | 124.6 | -172.8 | -166.7 | 164 | 3 | 0 | 0 | 111.4 | V44 C48 | V44-Q46 PolarHBondContact O-N 3.28Å; V44-Q46 VanDerWaalsContact O-N 3.15Å; Q46-C48 PolarHBondContact O-N 3.13Å | ||
| 47 | P | 60 | Low | 50.6 | Low | 119 Ų | 119 | 133.1 Ų | 133.1 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | trans | -65.2 | 130 | 179 | -22 | 33.8 | 0 | 0 | 0 | 111.8 | A49 | P47-A49 PolarHBondContact O-N 3.22Š| ||
| 48 | C | 41.2 | Very low | 49.9 | Very low | 135 Ų | 135 | 133.5 Ų | 133.5 | 91% | 0.912 | 80% | 0.796 | S | S | * | * | trans | -77.9 | 103.9 | 177.8 | -151.2 | 0 | 0 | 0 | 0 | 109.8 | Q46 G50 | Q46-C48 PolarHBondContact O-N 3.13Å; C48-G50 PolarHBondContact O-N 3.25Å | ||
| 49 | A | 43.9 | Very low | 48.4 | Very low | 92 Ų | 92 | 132.9 Ų | 132.9 | 76% | 0.76 | 81% | 0.805 | S | S | * | * | trans | -76.6 | 111 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | P47 Q51 | P47-A49 PolarHBondContact O-N 3.22Å; A49-Q51 PolarHBondContact O-N 2.93Å | ||
| 50 | G | 40.8 | Very low | 47.5 | Very low | 81 Ų | 81 | 130.6 Ų | 130.6 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 129.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | C48 | C48-G50 PolarHBondContact O-N 3.25Š|
| 51 | Q | 38.9 | Very low | 47 | Very low | 199 Ų | 199 | 128.6 Ų | 128.6 | 93% | 0.93 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -93.8 | 153 | -178.6 | -170.5 | 164 | 89.7 | 0 | 0 | 111.2 | A49 | A49-Q51 PolarHBondContact O-N 2.93Š|
| 52 | D | 43.3 | Very low | 46 | Very low | 143 Ų | 143 | 126.9 Ų | 126.9 | 77% | 0.765 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 151.2 | -169.3 | -170.2 | -137.2 | 0 | 0 | 0 | 113.4 | ||
| 53 | E | 50.7 | Low | 45.5 | Very low | 157 Ų | 157 | 124.8 Ų | 124.8 | 73% | 0.734 | 82% | 0.821 | S | S | * | * | trans | 40.7 | 126.7 | 162.3 | -83.5 | -71.9 | 84.8 | 0 | 0 | 123.7 | ||||
| 54 | A | 35.9 | Very low | 44.2 | Very low | 97 Ų | 97 | 120.7 Ų | 120.7 | 80% | 0.802 | 82% | 0.817 | S | S | * | * | trans | -170.2 | 83.8 | 144.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 55 | A | 35.8 | Very low | 43.2 | Very low | 76 Ų | 76 | 124.7 Ų | 124.7 | 63% | 0.628 | 82% | 0.824 | S | S | * | * | 55.3 | 105.1 | 127.1 | 0 | 0 | 0 | 0 | 0 | 124.7 | |||||
| 56 | V | 36.6 | Very low | 42.9 | Very low | 139 Ų | 139 | 121.7 Ų | 121.7 | 84% | 0.842 | 82% | 0.818 | S | S | * | * | trans | 55.1 | 169.8 | 134.3 | -88.9 | 0 | 0 | 0 | 0 | 123 | ||||
| 57 | P | 45.5 | Very low | 41.8 | Very low | 118 Ų | 118 | 119.6 Ų | 119.6 | 77% | 0.766 | 82% | 0.817 | S | S | * | * | cis | -134.2 | 152.1 | -12.3 | 29.1 | -8 | 0 | 0 | 0 | 118.1 | ||||
| 58 | G | 32.1 | Very low | 41 | Very low | 87 Ų | 87 | 124.7 Ų | 124.7 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | trans | 75.1 | 156.9 | 151.2 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 59 | G | 32.8 | Very low | 40.7 | Very low | 82 Ų | 82 | 127.3 Ų | 127.3 | 85% | 0.845 | 81% | 0.813 | S | S | * | * | cis | 154.4 | 125.9 | -13.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 60 | S | 38.5 | Very low | 40.7 | Very low | 127 Ų | 127 | 130 Ų | 130 | 89% | 0.888 | 81% | 0.814 | S | S | * | * | trans | -167.4 | 155.4 | 156.4 | -162.2 | 0 | 0 | 0 | 0 | 114 | ||||
| 61 | V | 40 | Very low | 40.5 | Very low | 143 Ų | 143 | 130 Ų | 130 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -73.2 | 148.9 | -174.7 | 177.9 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 62 | G | 33.7 | Very low | 40.4 | Very low | 80 Ų | 80 | 129.6 Ų | 129.6 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | 179.1 | 93.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 63 | A | 46.8 | Very low | 40 | Very low | 106 Ų | 106 | 126.3 Ų | 126.3 | 88% | 0.876 | 80% | 0.798 | S | S | * | * | trans | -126.8 | 127.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 64 | G | 35.1 | Very low | 39.4 | Very low | 72 Ų | 72 | 124.4 Ų | 124.4 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | trans | 167.3 | 84.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 65 | K | 45.5 | Very low | 39.4 | Very low | 207 Ų | 207 | 123.4 Ų | 123.4 | 90% | 0.9 | 81% | 0.808 | S | S | * | * | trans | 60.8 | 144.5 | 143 | -53.5 | 178.4 | -176.3 | 177.8 | 0 | 120.8 | ||||
| 66 | P | 61.7 | Low | 39.4 | Very low | 120 Ų | 120 | 127.6 Ų | 127.6 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -94.5 | 169.7 | 168.3 | 39.2 | -35.5 | 0 | 0 | 0 | 112.9 | ||||
| 67 | V | 39.6 | Very low | 39.6 | Very low | 132 Ų | 132 | 124.3 Ų | 124.3 | 80% | 0.8 | 81% | 0.814 | S | S | * | * | trans | 171 | 149.5 | 144.2 | 141.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 68 | R | 42 | Very low | 39.5 | Very low | 225 Ų | 225 | 127.2 Ų | 127.2 | 85% | 0.849 | 82% | 0.817 | S | S | * | * | trans | 76.1 | 150.9 | 174.4 | 96.5 | -149.7 | -64 | -170.8 | -0.4 | 115.6 | ||||
| 69 | Y | 36.2 | Very low | 40.1 | Very low | 191 Ų | 191 | 131.6 Ų | 131.6 | 75% | 0.749 | 82% | 0.815 | S | S | * | * | cis | -140.6 | -166.1 | -8.9 | -147.5 | -172.6 | 0 | 0 | 0 | 107.4 | ||||
| 70 | L | 42.5 | Very low | 40.6 | Very low | 148 Ų | 148 | 136.2 Ų | 136.2 | 78% | 0.775 | 81% | 0.814 | S | S | * | * | cis | -138.4 | -177.3 | 16 | -121.1 | 169.8 | 0 | 0 | 0 | 109.6 | ||||
| 71 | C | 36.2 | Very low | 40.9 | Very low | 81 Ų | 81 | 134 Ų | 134 | 55% | 0.547 | 80% | 0.804 | S | S | . | * | trans | -129.7 | 138.2 | -169.4 | -150.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 72 | E | 37.6 | Very low | 40.6 | Very low | 191 Ų | 191 | 130.3 Ų | 130.3 | 89% | 0.893 | 79% | 0.794 | S | S | * | * | trans | 39.4 | 148.8 | 153.5 | -67.4 | 175.2 | 124.9 | 0 | 0 | 123.3 | ||||
| 73 | G | 34.5 | Very low | 40.9 | Very low | 73 Ų | 73 | 135.9 Ų | 135.9 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | 166.3 | 102.2 | 157.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 74 | A | 38.2 | Very low | 40.6 | Very low | 117 Ų | 117 | 137.9 Ų | 137.9 | 97% | 0.967 | 80% | 0.795 | S | S | * | * | trans | 62.2 | 167.6 | 159.6 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 75 | G | 36.1 | Very low | 41.2 | Very low | 76 Ų | 76 | 142.7 Ų | 142.7 | 78% | 0.784 | 80% | 0.798 | S | S | * | * | trans | -148.1 | -176.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 76 | D | 35.6 | Very low | 41.1 | Very low | 165 Ų | 165 | 136.3 Ų | 136.3 | 88% | 0.882 | 78% | 0.784 | S | S | * | * | trans | -157 | 163.8 | -168.3 | -171.1 | 50.8 | 0 | 0 | 0 | 111.4 | ||||
| 77 | G | 42.3 | Very low | 40.4 | Very low | 69 Ų | 69 | 136.1 Ų | 136.1 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | trans | 168.8 | 105 | 171.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 78 | E | 42.7 | Very low | 41 | Very low | 179 Ų | 179 | 138.1 Ų | 138.1 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | trans | -166.5 | 156.6 | 166.7 | 51.6 | -177 | 67.7 | 0 | 0 | 108.5 | ||||
| 79 | E | 43.7 | Very low | 41.5 | Very low | 180 Ų | 180 | 134.4 Ų | 134.4 | 84% | 0.841 | 78% | 0.778 | S | S | * | * | cis | -160.2 | -173.9 | -33.6 | -168.4 | 143.8 | 74.6 | 0 | 0 | 107.5 | ||||
| 80 | E | 44.7 | Very low | 41.8 | Very low | 178 Ų | 178 | 131.7 Ų | 131.7 | 83% | 0.832 | 78% | 0.776 | S | S | * | * | trans | 68.2 | 155.1 | 168.2 | -65 | -75.2 | 81.4 | 0 | 0 | 119.3 | ||||
| 81 | A | 43.8 | Very low | 42 | Very low | 82 Ų | 82 | 129.8 Ų | 129.8 | 68% | 0.678 | 77% | 0.771 | S | S | * | * | cis | -167.7 | 168.7 | -19.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 82 | G | 33.4 | Very low | 42.4 | Very low | 64 Ų | 64 | 131 Ų | 131 | 66% | 0.66 | 78% | 0.78 | S | S | * | * | trans | 102.3 | 111.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 83 | E | 40.2 | Very low | 43.2 | Very low | 197 Ų | 197 | 128.8 Ų | 128.8 | 92% | 0.921 | 77% | 0.774 | S | S | * | * | 79.7 | 136.1 | 54.2 | 93.8 | -174.2 | 166.1 | 0 | 0 | 114 | |||||
| 84 | D | 41.9 | Very low | 44.3 | Very low | 149 Ų | 149 | 130.7 Ų | 130.7 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | cis | -95.2 | -117.6 | -2 | -167.8 | -163.7 | 0 | 0 | 0 | 112.5 | ||||
| 85 | E | 46.7 | Very low | 45.1 | Very low | 173 Ų | 173 | 130.9 Ų | 130.9 | 81% | 0.808 | 77% | 0.765 | S | S | * | * | cis | -145.4 | 167.5 | 9.5 | -124.9 | -93.7 | 55.1 | 0 | 0 | 109.3 | ||||
| 86 | A | 43.7 | Very low | 45.2 | Very low | 72 Ų | 72 | 131.2 Ų | 131.2 | 60% | 0.595 | 77% | 0.769 | S | S | * | * | trans | -84.1 | 139.8 | -151.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 87 | D | 46.9 | Very low | 45.3 | Very low | 116 Ų | 116 | 127.2 Ų | 127.2 | 62% | 0.62 | 77% | 0.766 | S | S | * | * | trans | 2.6 | 124.4 | 139.1 | -159.7 | 60 | 0 | 0 | 0 | 119.6 | L89 | D87-L89 WeakPolarHBondContact OD1-CG 3.5Å; D87-L89 WeakPolarHBondContact OD2-CG 3.41Å | ||
| 88 | L | 51.8 | Low | 45.1 | Very low | 175 Ų | 175 | 127 Ų | 127 | 92% | 0.916 | 76% | 0.763 | S | S | * | * | trans | -137.9 | 87.1 | 156.9 | -81.5 | -177.4 | 0 | 0 | 0 | 110.6 | ||||
| 89 | L | 52.2 | Low | 45.4 | Very low | 146 Ų | 146 | 127.3 Ų | 127.3 | 76% | 0.764 | 77% | 0.765 | S | S | * | * | trans | -79 | 118.2 | 173.4 | -59.8 | 167.6 | 0 | 0 | 0 | 111.6 | D87 | D87-L89 WeakPolarHBondContact OD1-CG 3.5Å; D87-L89 WeakPolarHBondContact OD2-CG 3.41Å | ||
| 90 | D | 43.8 | Very low | 45.8 | Very low | 135 Ų | 135 | 124.8 Ų | 124.8 | 72% | 0.722 | 77% | 0.767 | S | S | * | * | trans | -149.1 | 109.3 | 143.6 | -152.7 | 8.4 | 0 | 0 | 0 | 107.2 | ||||
| 91 | T | 46.6 | Very low | 45.8 | Very low | 108 Ų | 108 | 121.6 Ų | 121.6 | 66% | 0.663 | 77% | 0.771 | S | S | * | * | 30.9 | 136 | 93.6 | 112.6 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 92 | S | 44.8 | Very low | 45.7 | Very low | 106 Ų | 106 | 122.4 Ų | 122.4 | 74% | 0.741 | 78% | 0.778 | S | S | * | * | cis | -147.3 | 145.1 | 17 | -75.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 93 | D | 53.2 | Low | 46.3 | Very low | 144 Ų | 144 | 125.1 Ų | 125.1 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | trans | -102.2 | 121.4 | 160.8 | -174.8 | -84.2 | 0 | 0 | 0 | 108.7 | P95 | D93-P95 WeakPolarHBondContact O-CD 3.39Š| ||
| 94 | P | 58.3 | Low | 46.9 | Very low | 113 Ų | 113 | 123.3 Ų | 123.3 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | -92.1 | 114.1 | 177.3 | 32.4 | -29.8 | 0 | 0 | 0 | 111.7 | ||||
| 95 | P | 54.4 | Low | 47.1 | Very low | 122 Ų | 122 | 124.3 Ų | 124.3 | 79% | 0.792 | 78% | 0.783 | S | S | * | * | trans | -83.9 | 140.3 | -176 | 32.5 | -35.6 | 0 | 0 | 0 | 114 | D93 | D93-P95 WeakPolarHBondContact O-CD 3.39Š| ||
| 96 | G | 37.6 | Very low | 47 | Very low | 83 Ų | 83 | 122.8 Ų | 122.8 | 86% | 0.856 | 78% | 0.78 | S | S | * | * | trans | 84 | 158.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 97 | G | 38 | Very low | 47.3 | Very low | 81 Ų | 81 | 127.2 Ų | 127.2 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | cis | -178.5 | 177.1 | -1 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 98 | G | 37.8 | Very low | 47 | Very low | 63 Ų | 63 | 130.5 Ų | 130.5 | 65% | 0.649 | 81% | 0.805 | S | S | * | * | trans | 95.4 | 95.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 99 | E | 49.3 | Very low | 46.8 | Very low | 186 Ų | 186 | 129.5 Ų | 129.5 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | 87.1 | 110.6 | 66.9 | 84.1 | -165.9 | 87.4 | 0 | 0 | 113.7 | |||||
| 100 | S | 52.5 | Low | 46.4 | Very low | 128 Ų | 128 | 130.3 Ų | 130.3 | 90% | 0.895 | 80% | 0.8 | S | S | * | * | trans | -166.9 | 61.8 | 163.8 | -80.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 101 | A | 44.2 | Very low | 46.3 | Very low | 110 Ų | 110 | 132.9 Ų | 132.9 | 91% | 0.909 | 81% | 0.807 | S | S | * | * | trans | -98.8 | 85.5 | 175 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 102 | A | 42.1 | Very low | 46 | Very low | 100 Ų | 100 | 132.2 Ų | 132.2 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | trans | -158.2 | 93.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 103 | S | 45.4 | Very low | 46.2 | Very low | 120 Ų | 120 | 137 Ų | 137 | 84% | 0.839 | 81% | 0.814 | S | S | * | * | trans | 172.2 | 54.5 | 144.1 | -169 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 104 | L | 53.3 | Low | 46 | Very low | 159 Ų | 159 | 135.2 Ų | 135.2 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -93.5 | 155.2 | 155 | -172.3 | 152.9 | 0 | 0 | 0 | 106 | ||||
| 105 | E | 46.9 | Very low | 45.6 | Very low | 171 Ų | 171 | 133.4 Ų | 133.4 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | trans | 70.8 | 120.8 | -156.5 | -44.1 | -174.5 | 145.9 | 0 | 0 | 108.8 | ||||
| 106 | D | 45.3 | Very low | 44.8 | Very low | 140 Ų | 140 | 131.4 Ų | 131.4 | 75% | 0.749 | 82% | 0.816 | S | S | * | * | cis | -117.1 | 166.1 | 49.2 | -169.1 | -152.7 | 0 | 0 | 0 | 116.2 | ||||
| 107 | L | 49.6 | Very low | 45.6 | Very low | 165 Ų | 165 | 136.9 Ų | 136.9 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | -131.5 | 99.9 | 177.6 | -81.2 | 170.1 | 0 | 0 | 0 | 110.8 | ||||
| 108 | E | 39.8 | Very low | 45.8 | Very low | 186 Ų | 186 | 136.4 Ų | 136.4 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | trans | -111.6 | 113.9 | 159.6 | -68.7 | -163.6 | 121.4 | 0 | 0 | 109.9 | ||||
| 109 | D | 46.8 | Very low | 45.8 | Very low | 154 Ų | 154 | 139.2 Ų | 139.2 | 82% | 0.824 | 82% | 0.824 | S | S | * | * | trans | -97 | 170.3 | 171.1 | -172.5 | -153.5 | 0 | 0 | 0 | 109.7 | ||||
| 110 | E | 44.2 | Very low | 46.1 | Very low | 163 Ų | 163 | 136 Ų | 136 | 76% | 0.762 | 82% | 0.822 | S | S | * | * | trans | 58.2 | 108.5 | -179.2 | -67.6 | -143 | 78.8 | 0 | 0 | 117.9 | ||||
| 111 | E | 41.9 | Very low | 45.6 | Very low | 188 Ų | 188 | 133.7 Ų | 133.7 | 88% | 0.879 | 82% | 0.819 | S | S | * | * | -134.6 | 90 | 128.5 | -164.8 | 174.8 | 73.5 | 0 | 0 | 111.8 | |||||
| 112 | T | 40.2 | Very low | 45.2 | Very low | 95 Ų | 95 | 132.4 Ų | 132.4 | 58% | 0.583 | 82% | 0.816 | S | S | * | * | trans | 48.1 | 127.4 | 150.8 | 73.7 | 0 | 0 | 0 | 0 | 120.9 | S114 | T112-S114 PolarHBondContact O-N 2.9Å; T112-S114 VanDerWaalsContact O-N 3.14Å | ||
| 113 | H | 50.1 | Low | 45.9 | Very low | 206 Ų | 206 | 132.2 Ų | 132.2 | 95% | 0.954 | 82% | 0.815 | S | S | * | * | trans | -67 | 103.6 | 147.1 | -58.4 | 139.2 | 0 | 0 | 0 | 109.4 | ||||
| 114 | S | 48.9 | Very low | 45.8 | Very low | 107 Ų | 107 | 138.5 Ų | 138.5 | 75% | 0.748 | 82% | 0.82 | S | S | * | * | trans | -107.1 | 119.4 | 171.8 | -166.2 | 0 | 0 | 0 | 0 | 111.5 | T112 | T112-S114 PolarHBondContact O-N 2.9Å; T112-S114 VanDerWaalsContact O-N 3.14Å | ||
| 115 | G | 49 | Very low | 46 | Very low | 75 Ų | 75 | 142.5 Ų | 142.5 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | trans | -72.8 | 140.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 116 | G | 38.3 | Very low | 46 | Very low | 79 Ų | 79 | 146.1 Ų | 146.1 | 81% | 0.814 | 83% | 0.83 | S | S | * | * | trans | -127.5 | 45.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | G118 | G116-G118 PolarHBondContact O-N 3.37Š| ||
| 117 | E | 53.7 | Low | 45.7 | Very low | 198 Ų | 198 | 142.7 Ų | 142.7 | 93% | 0.925 | 83% | 0.827 | S | S | * | * | trans | -67 | 125.6 | 166.2 | 61.7 | -173.5 | 96.8 | 0 | 0 | 109.8 | ||||
| 118 | G | 41.6 | Very low | 46 | Very low | 71 Ų | 71 | 141.6 Ų | 141.6 | 73% | 0.732 | 83% | 0.834 | S | S | * | * | trans | -172.2 | 100.9 | -167.3 | 0 | 0 | 0 | 0 | 0 | 117 | G116 | G116-G118 PolarHBondContact O-N 3.37Š| ||
| 119 | S | 39.5 | Very low | 46.3 | Very low | 122 Ų | 122 | 136.2 Ų | 136.2 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | 62 | 108.6 | 147.3 | -153.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 120 | S | 54.3 | Low | 46.7 | Very low | 119 Ų | 119 | 132.3 Ų | 132.3 | 83% | 0.832 | 82% | 0.824 | S | S | * | * | trans | -60.6 | 139.7 | 154.1 | 54 | 0 | 0 | 0 | 0 | 113 | ||||
| 121 | G | 43.1 | Very low | 46.9 | Very low | 80 Ų | 80 | 127.8 Ų | 127.8 | 83% | 0.825 | 82% | 0.821 | S | S | * | * | trans | 170 | 149.1 | 160.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 122 | G | 35.9 | Very low | 48 | Very low | 83 Ų | 83 | 123.6 Ų | 123.6 | 86% | 0.856 | 81% | 0.813 | S | S | * | * | trans | 94.8 | 79.1 | 154.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 123 | A | 55.4 | Low | 49.2 | Very low | 96 Ų | 96 | 127 Ų | 127 | 79% | 0.793 | 82% | 0.824 | S | S | * | * | trans | -82.6 | 117.7 | 161.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 124 | R | 45.1 | Very low | 50.3 | Low | 252 Ų | 252 | 119.5 Ų | 119.5 | 95% | 0.951 | 80% | 0.795 | S | S | * | * | trans | -166.3 | 167.7 | 152.1 | -102.7 | 143.3 | -145.9 | -102.1 | 3 | 112.3 | ||||
| 125 | R | 56.9 | Low | 52.1 | Low | 243 Ų | 243 | 116.9 Ų | 116.9 | 92% | 0.917 | 77% | 0.77 | S | S | * | * | trans | -91.6 | 151.4 | -164.2 | -41 | 175.4 | -169.2 | -87.6 | 4.3 | 112.4 | ||||
| 126 | R | 45.9 | Very low | 54 | Low | 247 Ų | 247 | 117.6 Ų | 117.6 | 93% | 0.932 | 76% | 0.759 | S | S | * | * | 157 | 130.9 | 126.3 | 173.6 | 178.7 | -91.4 | -116.9 | 2.3 | 112.8 | |||||
| 127 | G | 39.3 | Very low | 56.5 | Low | 67 Ų | 67 | 114.1 Ų | 114.1 | 69% | 0.691 | 72% | 0.723 | S | S | * | * | trans | 91.7 | 130.3 | 152.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | G129 | G127-G129 PolarHBondContact O-N 3.36Š| ||
| 128 | S | 55.3 | Low | 58.4 | Low | 143 Ų | 143 | 109.1 Ų | 109.1 | 100% | 1 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -78.9 | 89.3 | 169.1 | -55.7 | 0 | 0 | 0 | 0 | 110.3 | ||
| 129 | G | 47.5 | Very low | 60.8 | Low | 72 Ų | 72 | 110.4 Ų | 110.4 | 74% | 0.742 | 69% | 0.689 | S | S | * | * | trans | -168.6 | 141 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | G127 G131 | G127-G129 PolarHBondContact O-N 3.36Å; G129-G131 PolarHBondContact O-N 2.93Å | ||
| 130 | G | 53.9 | Low | 63.3 | Low | 72 Ų | 72 | 113 Ų | 113 | 74% | 0.742 | 69% | 0.688 | S | S | * | * | trans | 86.2 | -2.2 | 152.2 | 0 | 0 | 0 | 0 | 0 | 119.3 | S132 | G130-S132 PolarHBondContact O-N 3.45Å; G130-S132 VanDerWaalsContact O-N 3.12Å | ||
| 131 | G | 48.4 | Very low | 65 | Low | 68 Ų | 68 | 111 Ų | 111 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | trans | -69.5 | 104.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | G129 M133 | G129-G131 PolarHBondContact O-N 2.93Å; G131-M133 VanDerWaalsContact C-N 3.26Å; G131-M133 PolarHBondContact O-N 2.92Å | ||
| 132 | S | 64.9 | Low | 67.2 | Low | 100 Ų | 100 | 108 Ų | 108 | 70% | 0.699 | 65% | 0.652 | S | S | * | * | trans | -82.7 | 63.2 | 177.3 | -173 | 0 | 0 | 0 | 0 | 112.5 | G130 | G130-S132 PolarHBondContact O-N 3.45Å; G130-S132 VanDerWaalsContact O-N 3.12Å | ||
| 133 | M | 65.4 | Low | 69.7 | Low | 167 Ų | 167 | 109.2 Ų | 109.2 | 82% | 0.823 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -118.9 | 54 | -177.1 | -48.7 | -60.1 | -176.7 | 0 | 0 | 111.3 | G131 | G131-M133 VanDerWaalsContact C-N 3.26Å; G131-M133 PolarHBondContact O-N 2.92Å |
| 134 | S | 74.9 | Confident | 71.5 | Confident | 49 Ų | 49 | 107.8 Ų | 107.8 | 34% | 0.343 | 63% | 0.625 | S | S | . | * | trans | 67 | 139.8 | -171.1 | -53 | 0 | 0 | 0 | 0 | 117.1 | T146 S147 | S134-T146 CarbonylContact C-O 3.4Å; S134-T146 WeakPolarHBondContact CA-O 3.44Å; S134-T146 WeakPolarHBondContact CB-O 3.41Å; S134-S147 WeakPolarHBondContact OG-CA 3.31Å | ||
| 135 | K | 85.9 | Confident | 73.5 | Confident | 52 Ų | 52 | 99.8 Ų | 99.8 | 23% | 0.226 | 60% | 0.604 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -81.2 | 126.8 | 167.1 | -85 | -177.9 | -179.6 | 174.8 | 0 | 110.3 | T145 T146 V149 K151 Q152 K154 W156 | K135-T145 CarbonylContact O-C 3.59Å; K135-T145 VanDerWaalsContact O-CA 3.26Å; K135-T145 WeakPolarHBondContact O-CA 3.36Å; K135-T146 HydrophobicContact CB-CG2 4.02Å; K135-T146 PolarHBondContact N-O 2.88Å; K135-T146 PolarHBondContact O-N 3.33Å; K135-V149 HydrophobicContact CB-CG2 4.39Å; K135-V149 HydrophobicContact CD-CG1 4.28Å; K135-V149 HydrophobicContact CD-CG2 3.69Å; K135-V149 HydrophobicContact CG-CG2 3.9Å; K135-K151 PolarHBondContact NZ-O 3.3Å; K135-Q152 PolarHBondContact NZ-O 3.39Å; K135-K154 PolarHBondContact NZ-O 3.21Å; K135-W156 HydrophobicContact CB-CB 4.2Å; K135-W156 HydrophobicContact CD-CB 3.9Å |
| 136 | T | 88.4 | Confident | 74.9 | Confident | 89 Ų | 89 | 89.9 Ų | 89.9 | 55% | 0.546 | 57% | 0.57 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -71.7 | 155 | 165.6 | 47.1 | 0 | 0 | 0 | 0 | 111.9 | E144 T145 | T136-E144 CarbonylContact C-O 3.57Å; T136-E144 WeakPolarHBondContact CA-O 3.31Å; T136-T145 HydrophobicContact CG2-CG2 3.71Å |
| 137 | C | 91.7 | Very high | 76.4 | Confident | 7 Ų | 7 | 82.1 Ų | 82.1 | 5% | 0.047 | 55% | 0.554 | C | S | . | * | P | Polyproline II helix | trans | -69.1 | 126.5 | 171.1 | 178.5 | 0 | 0 | 0 | 0 | 110.9 | Y139 C142 E144 W156 C158 | C137-Y139 PolarHBondContact O-N 2.93Å; C137-C142 HydrophobicContact CB-CB 4.06Å; C137-C142 VanDerWaalsContact CB-SG 3.52Å; C137-E144 HydrophobicContact CB-CB 4.32Å; C137-E144 PolarHBondContact N-O 3.44Å; C137-W156 WeakPolarHBondContact CA-O 3.39Å; C137-W156 HydrophobicContact CB-CE3 4.17Å; C137-W156 HydrophobicContact CB-CZ3 3.93Å; C137-C158 HydrophobicContact CB-CB 4.07Å; C137-C158 PolarHBondContact SG-N 2.91Å |
| 138 | T | 92.6 | Very high | 77.8 | Confident | 93 Ų | 93 | 87.7 Ų | 87.7 | 57% | 0.571 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -76.2 | 38.8 | 178.2 | -34.4 | 0 | 0 | 0 | 0 | 113.3 | P155 W156 | T138-P155 HydrophobicContact CG2-CB 4.48Å; T138-W156 PolarHBondContact N-O 2.81Å; T138-W156 PolarHBondContact OG1-O 3.06Å |
| 139 | Y | 92.3 | Very high | 78 | Confident | 97 Ų | 97 | 83.7 Ų | 83.7 | 38% | 0.38 | 53% | 0.532 | S | S | . | . | S | Bend | trans | -118.9 | 135.5 | 174.9 | -174.9 | -96.3 | 0 | 0 | 0 | 109.4 | C137 G141 C142 H161 K164 | C137-Y139 PolarHBondContact O-N 2.93Å; Y139-G141 PolarHBondContact O-N 3.5Å; Y139-C142 HydrophobicContact CD1-CB 4.29Å; Y139-C142 WeakPolarHBondContact O-CB 3.21Å; Y139-C142 PolarHBondContact O-N 3.04Å; Y139-H161 AromaticContact CD1-CD2 3.3Å; Y139-H161 WeakPolarHBondContact CD1-CD2 3.39Å; Y139-H161 AromaticContact CD1-CE1 3.63Å; Y139-H161 AromaticContact CD1-CG 3.63Å; Y139-H161 AromaticContact CD1-ND1 3.81Å; Y139-H161 AromaticContact CD1-NE2 3.36Å; Y139-H161 WeakPolarHBondContact CD1-NE2 3.27Å; Y139-H161 HydrophobicContact CD2-CB 4.41Å; Y139-H161 AromaticContact CE1-CD2 3.5Å; Y139-H161 VanDerWaalsContact CE1-CD2 3.5Å; Y139-H161 WeakPolarHBondContact CE1-CD2 3.36Å; Y139-H161 AromaticContact CE1-NE2 3.49Å; Y139-H161 WeakPolarHBondContact CE1-NE2 3.32Å; Y139-H161 HydrophobicContact CG-CB 4.08Å; Y139-H161 AromaticContact CG-CD2 3.63Å; Y139-H161 AromaticContact CG-CG 3.59Å; Y139-K164 PolarHBondContact OH-NZ 3Å |
| 140 | E | 92.1 | Very high | 78.7 | Confident | 177 Ų | 177 | 85.8 Ų | 85.8 | 83% | 0.827 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | 133.8 | -173.9 | -163.1 | 51.3 | -102.5 | 0 | 0 | 111.9 | C142 | E140-C142 VanDerWaalsContact C-N 3.27Å; E140-C142 PolarHBondContact O-N 3.32Å |
| 141 | G | 90.1 | Very high | 79.2 | Confident | 77 Ų | 77 | 91.2 Ų | 91.2 | 79% | 0.794 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66 | 15.4 | -174.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | Y139 | Y139-G141 PolarHBondContact O-N 3.5Š|
| 142 | C | 90.3 | Very high | 80.2 | Confident | 17 Ų | 17 | 95.7 Ų | 95.7 | 12% | 0.115 | 55% | 0.548 | C | S | . | . | trans | -102.4 | 113.3 | 176.9 | -172.8 | 0 | 0 | 0 | 0 | 113 | C137 Y139 E140 E144 H161 | C137-C142 HydrophobicContact CB-CB 4.06Å; C137-C142 VanDerWaalsContact CB-SG 3.52Å; Y139-C142 HydrophobicContact CD1-CB 4.29Å; Y139-C142 WeakPolarHBondContact O-CB 3.21Å; Y139-C142 PolarHBondContact O-N 3.04Å; E140-C142 VanDerWaalsContact C-N 3.27Å; E140-C142 PolarHBondContact O-N 3.32Å; C142-E144 PolarHBondContact SG-OE1 3.07Å; C142-H161 PolarHBondContact SG-CE1 2.87Å; C142-H161 PolarHBondContact SG-ND1 3.44Å | ||
| 143 | S | 88.4 | Confident | 80.6 | Confident | 109 Ų | 109 | 102.8 Ų | 102.8 | 76% | 0.762 | 56% | 0.559 | S | S | * | * | trans | -86.1 | 2.9 | 176.1 | 52.7 | 0 | 0 | 0 | 0 | 115 | T145 | S143-T145 PolarHBondContact O-N 3.41Š| ||
| 144 | E | 91.3 | Very high | 81.3 | Confident | 66 Ų | 66 | 102.9 Ų | 102.9 | 31% | 0.308 | 56% | 0.555 | S | S | . | * | trans | -63.7 | 135.7 | 179.6 | -67.4 | 172.4 | -116.6 | 0 | 0 | 110.9 | T136 C137 C142 C158 K160 H161 | T136-E144 CarbonylContact C-O 3.57Å; T136-E144 WeakPolarHBondContact CA-O 3.31Å; C137-E144 HydrophobicContact CB-CB 4.32Å; C137-E144 PolarHBondContact N-O 3.44Å; C142-E144 PolarHBondContact SG-OE1 3.07Å; E144-C158 HydrophobicContact CB-CB 3.87Å; E144-C158 HydrophobicContact CG-CB 4.39Å; E144-C158 PolarHBondContact OE1-SG 3.12Å; E144-C158 WeakPolarHBondContact OE2-CB 3.3Å; E144-C158 PolarHBondContact OE2-SG 2.87Å; E144-K160 VanDerWaalsContact OE1-CD 3.3Å; E144-K160 WeakPolarHBondContact OE1-CD 3.35Å; E144-H161 IonicContact OE1-CE1 3.97Å; E144-H161 IonicContact OE1-ND1 3.98Å | ||
| 145 | T | 89.2 | Confident | 81.9 | Confident | 83 Ų | 83 | 105.8 Ų | 105.8 | 51% | 0.509 | 57% | 0.573 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -126.4 | 152.7 | -176.7 | 43.9 | 0 | 0 | 0 | 0 | 112.1 | K135 T136 S143 | K135-T145 CarbonylContact O-C 3.59Å; K135-T145 VanDerWaalsContact O-CA 3.26Å; K135-T145 WeakPolarHBondContact O-CA 3.36Å; T136-T145 HydrophobicContact CG2-CG2 3.71Å; S143-T145 PolarHBondContact O-N 3.41Å |
| 146 | T | 86.1 | Confident | 81.9 | Confident | 36 Ų | 36 | 106.8 Ų | 106.8 | 22% | 0.221 | 58% | 0.575 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -131.7 | 126.6 | 170.9 | -172.3 | 0 | 0 | 0 | 0 | 111.4 | S134 K135 W156 | S134-T146 CarbonylContact C-O 3.4Å; S134-T146 WeakPolarHBondContact CA-O 3.44Å; S134-T146 WeakPolarHBondContact CB-O 3.41Å; K135-T146 HydrophobicContact CB-CG2 4.02Å; K135-T146 PolarHBondContact N-O 2.88Å; K135-T146 PolarHBondContact O-N 3.33Å; T146-W156 HydrophobicContact CG2-CD2 3.42Å; T146-W156 VanDerWaalsContact CG2-CD2 3.42Å; T146-W156 HydrophobicContact CG2-CE3 3.82Å; T146-W156 HydrophobicContact CG2-CG 3.78Å; T146-W156 HydrophobicContact CG2-CH2 4.09Å; T146-W156 HydrophobicContact CG2-CZ2 3.74Å; T146-W156 HydrophobicContact CG2-CZ3 4.13Å |
| 147 | S | 77.3 | Confident | 82 | Confident | 84 Ų | 84 | 105.8 Ų | 105.8 | 59% | 0.587 | 57% | 0.565 | S | S | * | * | trans | -76.5 | -44.1 | -178 | -170.3 | 0 | 0 | 0 | 0 | 112.6 | S134 V149 | S134-S147 WeakPolarHBondContact OG-CA 3.31Å; S147-V149 PolarHBondContact O-N 2.89Å | ||
| 148 | Q | 67.7 | Low | 82 | Confident | 183 Ų | 183 | 105.5 Ų | 105.5 | 86% | 0.855 | 56% | 0.563 | S | S | * | * | trans | -70.9 | 116.1 | -175.6 | -71.3 | -175 | -10.7 | 0 | 0 | 113.1 | ||||
| 149 | V | 58.9 | Low | 82.1 | Confident | 60 Ų | 60 | 109 Ų | 109 | 36% | 0.364 | 57% | 0.57 | S | S | . | * | trans | -145.3 | 97.7 | 173.2 | -175.5 | 0 | 0 | 0 | 0 | 112.5 | K135 S147 K151 | K135-V149 HydrophobicContact CB-CG2 4.39Å; K135-V149 HydrophobicContact CD-CG1 4.28Å; K135-V149 HydrophobicContact CD-CG2 3.69Å; K135-V149 HydrophobicContact CG-CG2 3.9Å; S147-V149 PolarHBondContact O-N 2.89Å; V149-K151 WeakPolarHBondContact CG1-O 3.34Å | ||
| 150 | A | 62.4 | Low | 82.2 | Confident | 116 Ų | 116 | 111.1 Ų | 111.1 | 96% | 0.959 | 58% | 0.581 | S | S | * | * | S | Bend | trans | -86.7 | 0.8 | 166.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 151 | K | 66.1 | Low | 82.3 | Confident | 185 Ų | 185 | 103.6 Ų | 103.6 | 80% | 0.804 | 55% | 0.546 | S | S | * | . | trans | -140.7 | 104.2 | -177.4 | -138.4 | 146.2 | -170.5 | 160.5 | 0 | 112.8 | K135 V149 | K135-K151 PolarHBondContact NZ-O 3.3Å; V149-K151 WeakPolarHBondContact CG1-O 3.34Å | ||
| 152 | Q | 68.4 | Low | 82.5 | Confident | 163 Ų | 163 | 106.1 Ų | 106.1 | 76% | 0.762 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73 | -40.3 | -167.5 | -160.4 | 173.6 | 8.4 | 0 | 0 | 113.7 | K135 K154 | K135-Q152 PolarHBondContact NZ-O 3.39Å; Q152-K154 VanDerWaalsContact C-N 3.28Å; Q152-K154 PolarHBondContact O-N 3.41Å |
| 153 | R | 72.6 | Confident | 82.7 | Confident | 248 Ų | 248 | 109.5 Ų | 109.5 | 94% | 0.936 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | 11.4 | -166.1 | -72.6 | -170.3 | 169.3 | -149.3 | -2.9 | 118.2 | ||
| 154 | K | 81.8 | Confident | 83 | Confident | 169 Ų | 169 | 108.7 Ų | 108.7 | 74% | 0.735 | 53% | 0.532 | S | S | * | . | S | Bend | trans | -129.8 | 129.8 | 176.5 | -68.6 | -176 | 178.3 | -178.9 | 0 | 110.8 | K135 Q152 | K135-K154 PolarHBondContact NZ-O 3.21Å; Q152-K154 VanDerWaalsContact C-N 3.28Å; Q152-K154 PolarHBondContact O-N 3.41Å |
| 155 | P | 85.8 | Confident | 83.2 | Confident | 110 Ų | 110 | 108.8 Ų | 108.8 | 71% | 0.714 | 53% | 0.533 | S | S | * | . | trans | -55.9 | 150.6 | 166.8 | -23.1 | 33.8 | 0 | 0 | 0 | 110.9 | T138 | T138-P155 HydrophobicContact CG2-CB 4.48Š| ||
| 156 | W | 87.4 | Confident | 83.5 | Confident | 73 Ų | 73 | 110.4 Ų | 110.4 | 28% | 0.277 | 53% | 0.531 | S | S | . | . | trans | -110.2 | 134 | 178.8 | -179.6 | 82.6 | 0 | 0 | 0 | 110.2 | K135 C137 T138 T146 C158 | K135-W156 HydrophobicContact CB-CB 4.2Å; K135-W156 HydrophobicContact CD-CB 3.9Å; C137-W156 WeakPolarHBondContact CA-O 3.39Å; C137-W156 HydrophobicContact CB-CE3 4.17Å; C137-W156 HydrophobicContact CB-CZ3 3.93Å; T138-W156 PolarHBondContact N-O 2.81Å; T138-W156 PolarHBondContact OG1-O 3.06Å; T146-W156 HydrophobicContact CG2-CD2 3.42Å; T146-W156 VanDerWaalsContact CG2-CD2 3.42Å; T146-W156 HydrophobicContact CG2-CE3 3.82Å; T146-W156 HydrophobicContact CG2-CG 3.78Å; T146-W156 HydrophobicContact CG2-CH2 4.09Å; T146-W156 HydrophobicContact CG2-CZ2 3.74Å; T146-W156 HydrophobicContact CG2-CZ3 4.13Å; W156-C158 HydrophobicContact CH2-CB 3.53Å; W156-C158 HydrophobicContact CZ2-CB 4.05Å; W156-C158 HydrophobicContact CZ3-CB 3.87Å | ||
| 157 | M | 90.5 | Very high | 83.9 | Confident | 69 Ų | 69 | 115.6 Ų | 115.6 | 34% | 0.34 | 55% | 0.55 | S | S | . | * | trans | -115 | 135 | 165.8 | -68.5 | -175.9 | -70.5 | 0 | 0 | 107.7 | R162 M165 | M157-R162 HydrophobicContact CB-CB 4.35Å; M157-M165 HydrophobicContact CE-CE 4.13Å; M157-M165 HydrophobicContact CE-SD 3.95Å | ||
| 158 | C | 91.7 | Very high | 84.8 | Confident | 0 Ų | 0 | 115 Ų | 115 | 0% | 0 | 54% | 0.54 | C | S | . | . | trans | -60.7 | 160.5 | 177.3 | 69.6 | 0 | 0 | 0 | 0 | 112 | C137 E144 W156 K160 H161 R162 | C137-C158 HydrophobicContact CB-CB 4.07Å; C137-C158 PolarHBondContact SG-N 2.91Å; E144-C158 HydrophobicContact CB-CB 3.87Å; E144-C158 HydrophobicContact CG-CB 4.39Å; E144-C158 PolarHBondContact OE1-SG 3.12Å; E144-C158 WeakPolarHBondContact OE2-CB 3.3Å; E144-C158 PolarHBondContact OE2-SG 2.87Å; W156-C158 HydrophobicContact CH2-CB 3.53Å; W156-C158 HydrophobicContact CZ2-CB 4.05Å; W156-C158 HydrophobicContact CZ3-CB 3.87Å; C158-K160 PolarHBondContact O-N 3.29Å; C158-H161 PolarHBondContact O-N 3.44Å; C158-H161 PolarHBondContact SG-N 3.22Å; C158-H161 PolarHBondContact SG-ND1 2.89Å; C158-R162 WeakPolarHBondContact O-CB 3.47Å; C158-R162 PolarHBondContact O-N 3.44Å | ||
| 159 | K | 93.6 | Very high | 86 | Confident | 168 Ų | 168 | 113.2 Ų | 113.2 | 73% | 0.73 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -59 | -34.1 | -178.9 | -164 | 170.5 | -178.1 | 178.1 | 0 | 111.5 | N163 | K159-N163 WeakPolarHBondContact O-CB 3.27Å; K159-N163 PolarHBondContact O-N 3.39Å; K159-N163 PolarHBondContact O-OD1 2.86Å |
| 160 | K | 94.4 | Very high | 87.7 | Confident | 140 Ų | 140 | 117.9 Ų | 117.9 | 61% | 0.609 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.3 | -58.1 | 174.9 | -176 | -174.3 | -178.2 | -179.4 | 0 | 112.3 | E144 C158 N163 K164 | E144-K160 VanDerWaalsContact OE1-CD 3.3Å; E144-K160 WeakPolarHBondContact OE1-CD 3.35Å; C158-K160 PolarHBondContact O-N 3.29Å; K160-N163 PolarHBondContact O-N 3.24Å; K160-K164 WeakPolarHBondContact O-CB 3.43Å; K160-K164 PolarHBondContact O-N 3.48Å |
| 161 | H | 95.3 | Very high | 89.2 | Confident | 20 Ų | 20 | 118.5 Ų | 118.5 | 9% | 0.093 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -72.2 | -32.2 | -177.5 | -70.7 | 111.9 | 0 | 0 | 0 | 113.2 | Y139 C142 E144 C158 K164 M165 | Y139-H161 AromaticContact CD1-CD2 3.3Å; Y139-H161 WeakPolarHBondContact CD1-CD2 3.39Å; Y139-H161 AromaticContact CD1-CE1 3.63Å; Y139-H161 AromaticContact CD1-CG 3.63Å; Y139-H161 AromaticContact CD1-ND1 3.81Å; Y139-H161 AromaticContact CD1-NE2 3.36Å; Y139-H161 WeakPolarHBondContact CD1-NE2 3.27Å; Y139-H161 HydrophobicContact CD2-CB 4.41Å; Y139-H161 AromaticContact CE1-CD2 3.5Å; Y139-H161 VanDerWaalsContact CE1-CD2 3.5Å; Y139-H161 WeakPolarHBondContact CE1-CD2 3.36Å; Y139-H161 AromaticContact CE1-NE2 3.49Å; Y139-H161 WeakPolarHBondContact CE1-NE2 3.32Å; Y139-H161 HydrophobicContact CG-CB 4.08Å; Y139-H161 AromaticContact CG-CD2 3.63Å; Y139-H161 AromaticContact CG-CG 3.59Å; C142-H161 PolarHBondContact SG-CE1 2.87Å; C142-H161 PolarHBondContact SG-ND1 3.44Å; E144-H161 IonicContact OE1-CE1 3.97Å; E144-H161 IonicContact OE1-ND1 3.98Å; C158-H161 PolarHBondContact O-N 3.44Å; C158-H161 PolarHBondContact SG-N 3.22Å; C158-H161 PolarHBondContact SG-ND1 2.89Å; H161-K164 PolarHBondContact O-N 3.38Å; H161-M165 WeakPolarHBondContact O-CB 3.37Å; H161-M165 PolarHBondContact O-N 2.96Å |
| 162 | R | 93.8 | Very high | 90.5 | Very high | 129 Ų | 129 | 115.8 Ų | 115.8 | 49% | 0.487 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.6 | -43.1 | 171.8 | -169.5 | 171.1 | 177.4 | -173.9 | -5.1 | 111.7 | M157 C158 M165 Y166 | M157-R162 HydrophobicContact CB-CB 4.35Å; C158-R162 WeakPolarHBondContact O-CB 3.47Å; C158-R162 PolarHBondContact O-N 3.44Å; R162-M165 HydrophobicContact CG-CE 4.24Å; R162-Y166 HydrophobicContact CG-CD2 4.17Å; R162-Y166 HydrophobicContact CG-CE2 3.55Å; R162-Y166 PolarHBondContact NE-OH 2.9Å; R162-Y166 VanDerWaalsContact NE-OH 3.11Å; R162-Y166 PolarHBondContact NH2-OH 3.4Å; R162-Y166 WeakPolarHBondContact O-CD2 3.42Å; R162-Y166 PolarHBondContact O-N 3.01Å; R162-Y166 VanDerWaalsContact O-N 3.07Å |
| 163 | N | 94.8 | Very high | 91.6 | Very high | 89 Ų | 89 | 115.5 Ų | 115.5 | 48% | 0.476 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.7 | -39 | 173.8 | -74.5 | 1.6 | 0 | 0 | 0 | 112.6 | K159 K160 Y166 K167 | K159-N163 WeakPolarHBondContact O-CB 3.27Å; K159-N163 PolarHBondContact O-N 3.39Å; K159-N163 PolarHBondContact O-OD1 2.86Å; K160-N163 PolarHBondContact O-N 3.24Å; N163-Y166 PolarHBondContact O-N 3.5Å; N163-K167 WeakPolarHBondContact O-CB 3.3Å; N163-K167 PolarHBondContact O-N 3.36Å |
| 164 | K | 94.8 | Very high | 92.5 | Very high | 92 Ų | 92 | 110.1 Ų | 110.1 | 40% | 0.4 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -56.4 | -54.7 | 172.9 | 179.5 | -178.3 | 177.1 | -174.4 | 0 | 110.3 | Y139 K160 H161 Y166 K167 D168 | Y139-K164 PolarHBondContact OH-NZ 3Å; K160-K164 WeakPolarHBondContact O-CB 3.43Å; K160-K164 PolarHBondContact O-N 3.48Å; H161-K164 PolarHBondContact O-N 3.38Å; K164-Y166 VanDerWaalsContact C-N 3.32Å; K164-Y166 PolarHBondContact O-N 2.83Å; K164-K167 PolarHBondContact O-N 3.34Å; K164-K167 VanDerWaalsContact O-N 3.11Å; K164-D168 WeakPolarHBondContact CE-OD2 3.46Å; K164-D168 WeakPolarHBondContact CG-OD2 3.38Å; K164-D168 WeakPolarHBondContact O-CB 3.48Å; K164-D168 VanDerWaalsContact O-CG 3.26Å; K164-D168 PolarHBondContact O-N 2.84Å |
| 165 | M | 94.3 | Very high | 92.8 | Very high | 68 Ų | 68 | 106.3 Ų | 106.3 | 34% | 0.335 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -54 | -43.5 | 176.1 | 176.8 | -159 | 60.9 | 0 | 0 | 112.5 | M157 H161 R162 K169 | M157-M165 HydrophobicContact CE-CE 4.13Å; M157-M165 HydrophobicContact CE-SD 3.95Å; H161-M165 WeakPolarHBondContact O-CB 3.37Å; H161-M165 PolarHBondContact O-N 2.96Å; R162-M165 HydrophobicContact CG-CE 4.24Å; M165-K169 WeakPolarHBondContact O-CB 3.47Å; M165-K169 PolarHBondContact O-N 3.47Å |
| 166 | Y | 95.1 | Very high | 92.9 | Very high | 117 Ų | 117 | 104.6 Ų | 104.6 | 46% | 0.459 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -66.6 | -43.8 | 176.3 | -68.1 | -44.3 | 0 | 0 | 0 | 112.4 | R162 N163 K164 K169 Y170 | R162-Y166 HydrophobicContact CG-CD2 4.17Å; R162-Y166 HydrophobicContact CG-CE2 3.55Å; R162-Y166 PolarHBondContact NE-OH 2.9Å; R162-Y166 VanDerWaalsContact NE-OH 3.11Å; R162-Y166 PolarHBondContact NH2-OH 3.4Å; R162-Y166 WeakPolarHBondContact O-CD2 3.42Å; R162-Y166 PolarHBondContact O-N 3.01Å; R162-Y166 VanDerWaalsContact O-N 3.07Å; N163-Y166 PolarHBondContact O-N 3.5Å; K164-Y166 VanDerWaalsContact C-N 3.32Å; K164-Y166 PolarHBondContact O-N 2.83Å; Y166-K169 PolarHBondContact O-N 2.95Å; Y166-Y170 WeakPolarHBondContact O-CB 3.3Å; Y166-Y170 PolarHBondContact O-N 2.88Å |
| 167 | K | 95.5 | Very high | 92.7 | Very high | 145 Ų | 145 | 107.1 Ų | 107.1 | 63% | 0.63 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -68.7 | -37.4 | -179.9 | -164.6 | 168.9 | -171.9 | 172.5 | 0 | 112.1 | N163 K164 Y170 K171 | N163-K167 WeakPolarHBondContact O-CB 3.3Å; N163-K167 PolarHBondContact O-N 3.36Å; K164-K167 PolarHBondContact O-N 3.34Å; K164-K167 VanDerWaalsContact O-N 3.11Å; K167-Y170 PolarHBondContact O-N 2.86Å; K167-K171 WeakPolarHBondContact O-CB 3.27Å; K167-K171 WeakPolarHBondContact O-CG 3.31Å; K167-K171 PolarHBondContact O-N 3.18Å |
| 168 | D | 94.9 | Very high | 92.1 | Very high | 70 Ų | 70 | 106.8 Ų | 106.8 | 37% | 0.374 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -72.2 | -38.8 | 176.2 | -67 | -16.2 | 0 | 0 | 0 | 111 | K164 Y170 K171 K172 | K164-D168 WeakPolarHBondContact CE-OD2 3.46Å; K164-D168 WeakPolarHBondContact CG-OD2 3.38Å; K164-D168 WeakPolarHBondContact O-CB 3.48Å; K164-D168 VanDerWaalsContact O-CG 3.26Å; K164-D168 PolarHBondContact O-N 2.84Å; D168-Y170 VanDerWaalsContact C-N 3.35Å; D168-Y170 PolarHBondContact O-N 3.14Å; D168-K171 PolarHBondContact O-N 3.36Å; D168-K172 VanDerWaalsContact O-CB 3.28Å; D168-K172 WeakPolarHBondContact O-CB 3.4Å; D168-K172 PolarHBondContact O-N 3.09Å |
| 169 | K | 93.8 | Very high | 91 | Very high | 146 Ų | 146 | 111.9 Ų | 111.9 | 64% | 0.635 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.5 | -39.7 | 170.3 | -179.2 | 172.8 | -69.3 | -168.8 | 0 | 112.1 | M165 Y166 K173 | M165-K169 WeakPolarHBondContact O-CB 3.47Å; M165-K169 PolarHBondContact O-N 3.47Å; Y166-K169 PolarHBondContact O-N 2.95Å; K169-K173 WeakPolarHBondContact O-CB 3.37Å; K169-K173 PolarHBondContact O-N 3.45Å |
| 170 | Y | 94.8 | Very high | 89.7 | Confident | 158 Ų | 158 | 110.7 Ų | 110.7 | 62% | 0.62 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -68 | -47.8 | 175.4 | 178.7 | -91.8 | 0 | 0 | 0 | 112 | Y166 K167 D168 K172 K173 K174 | Y166-Y170 WeakPolarHBondContact O-CB 3.3Å; Y166-Y170 PolarHBondContact O-N 2.88Å; K167-Y170 PolarHBondContact O-N 2.86Å; D168-Y170 VanDerWaalsContact C-N 3.35Å; D168-Y170 PolarHBondContact O-N 3.14Å; Y170-K172 VanDerWaalsContact C-N 3.33Å; Y170-K172 PolarHBondContact O-N 2.89Å; Y170-K173 PolarHBondContact O-N 2.88Å; Y170-K174 PolarHBondContact O-N 2.91Å |
| 171 | K | 93.6 | Very high | 87.9 | Confident | 129 Ų | 129 | 109.5 Ų | 109.5 | 56% | 0.561 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -55.5 | -47.9 | 173.6 | -81.9 | -178.9 | 170.9 | -172.3 | 0 | 111.3 | K167 D168 K174 N175 | K167-K171 WeakPolarHBondContact O-CB 3.27Å; K167-K171 WeakPolarHBondContact O-CG 3.31Å; K167-K171 PolarHBondContact O-N 3.18Å; D168-K171 PolarHBondContact O-N 3.36Å; K171-K174 PolarHBondContact O-N 3.02Å; K171-N175 WeakPolarHBondContact O-CB 3.24Å; K171-N175 PolarHBondContact O-N 3.45Å |
| 172 | K | 93.4 | Very high | 86.1 | Confident | 129 Ų | 129 | 111.4 Ų | 111.4 | 56% | 0.561 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.8 | -48.3 | 177.1 | 177.7 | 146.6 | -175.8 | 159.2 | 0 | 110.9 | D168 Y170 K174 N175 D176 | D168-K172 VanDerWaalsContact O-CB 3.28Å; D168-K172 WeakPolarHBondContact O-CB 3.4Å; D168-K172 PolarHBondContact O-N 3.09Å; Y170-K172 VanDerWaalsContact C-N 3.33Å; Y170-K172 PolarHBondContact O-N 2.89Å; K172-K174 VanDerWaalsContact C-N 3.27Å; K172-K174 PolarHBondContact O-N 3.19Å; K172-N175 CarbonylContact O-C 3.54Å; K172-N175 PolarHBondContact O-N 3.32Å; K172-D176 WeakPolarHBondContact CE-OD2 3.34Å; K172-D176 WeakPolarHBondContact CG-OD2 3.5Å; K172-D176 WeakPolarHBondContact O-CB 3.38Å; K172-D176 PolarHBondContact O-N 3.17Å |
| 173 | K | 92.2 | Very high | 84 | Confident | 157 Ų | 157 | 107.8 Ų | 107.8 | 68% | 0.683 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -55.3 | -39.2 | 174.3 | -174.4 | 177.1 | 178.1 | -177.3 | 0 | 112.9 | K169 Y170 Q177 | K169-K173 WeakPolarHBondContact O-CB 3.37Å; K169-K173 PolarHBondContact O-N 3.45Å; Y170-K173 PolarHBondContact O-N 2.88Å; K173-Q177 VanDerWaalsContact O-CB 3.24Å; K173-Q177 WeakPolarHBondContact O-CB 3.29Å; K173-Q177 PolarHBondContact O-N 3.26Å |
| 174 | K | 90 | Very high | 81.6 | Confident | 135 Ų | 135 | 110.9 Ų | 110.9 | 59% | 0.587 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -70.6 | -34.2 | 176.1 | -174 | 170.7 | -179.9 | 174.3 | 0 | 112.8 | Y170 K171 K172 A178 | Y170-K174 PolarHBondContact O-N 2.91Å; K171-K174 PolarHBondContact O-N 3.02Å; K172-K174 VanDerWaalsContact C-N 3.27Å; K172-K174 PolarHBondContact O-N 3.19Å; K174-A178 PolarHBondContact O-N 3.11Å |
| 175 | N | 89 | Confident | 79.5 | Confident | 89 Ų | 89 | 110.3 Ų | 110.3 | 48% | 0.476 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -75.1 | -45.8 | 175.6 | 173.9 | -122.3 | 0 | 0 | 0 | 112.2 | K171 K172 Q177 A178 L179 | K171-N175 WeakPolarHBondContact O-CB 3.24Å; K171-N175 PolarHBondContact O-N 3.45Å; K172-N175 CarbonylContact O-C 3.54Å; K172-N175 PolarHBondContact O-N 3.32Å; N175-Q177 VanDerWaalsContact C-N 3.25Å; N175-Q177 PolarHBondContact O-N 3.13Å; N175-A178 PolarHBondContact O-N 3.05Å; N175-A178 VanDerWaalsContact O-N 3.12Å; N175-L179 WeakPolarHBondContact O-CG 3.3Å; N175-L179 PolarHBondContact O-N 2.92Å |
| 176 | D | 87.4 | Confident | 76.8 | Confident | 73 Ų | 73 | 112.6 Ų | 112.6 | 39% | 0.39 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -56.6 | -40.1 | 170.8 | -74.6 | -55.1 | 0 | 0 | 0 | 110.6 | K172 L179 N180 | K172-D176 WeakPolarHBondContact CE-OD2 3.34Å; K172-D176 WeakPolarHBondContact CG-OD2 3.5Å; K172-D176 WeakPolarHBondContact O-CB 3.38Å; K172-D176 PolarHBondContact O-N 3.17Å; D176-L179 PolarHBondContact O-N 2.9Å; D176-N180 VanDerWaalsContact O-CB 3.25Å; D176-N180 WeakPolarHBondContact O-CB 3.33Å; D176-N180 PolarHBondContact O-N 3.2Å |
| 177 | Q | 84.8 | Confident | 74.7 | Confident | 127 Ų | 127 | 114.5 Ų | 114.5 | 59% | 0.593 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -59.8 | -46.8 | 173.7 | -179.3 | 175.6 | 39.2 | 0 | 0 | 112.2 | K173 N175 N180 C181 | K173-Q177 VanDerWaalsContact O-CB 3.24Å; K173-Q177 WeakPolarHBondContact O-CB 3.29Å; K173-Q177 PolarHBondContact O-N 3.26Å; N175-Q177 VanDerWaalsContact C-N 3.25Å; N175-Q177 PolarHBondContact O-N 3.13Å; Q177-N180 PolarHBondContact O-N 2.99Å; Q177-C181 PolarHBondContact O-N 3.3Å; Q177-C181 VanDerWaalsContact O-N 3.1Å; Q177-C181 PolarHBondContact O-SG 3.41Å; Q177-C181 VanDerWaalsContact O-SG 3.41Å |
| 178 | A | 76.9 | Confident | 72.6 | Confident | 62 Ų | 62 | 110.9 Ų | 110.9 | 51% | 0.512 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -64.3 | -41 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | K174 N175 G182 | K174-A178 PolarHBondContact O-N 3.11Å; N175-A178 PolarHBondContact O-N 3.05Å; N175-A178 VanDerWaalsContact O-N 3.12Å; A178-G182 PolarHBondContact O-N 2.87Å; A178-G182 VanDerWaalsContact O-N 3.1Å |
| 179 | L | 69.5 | Low | 70.1 | Confident | 106 Ų | 106 | 113.6 Ų | 113.6 | 56% | 0.555 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -69.8 | -35.8 | 178.2 | -68.1 | 171.9 | 0 | 0 | 0 | 112.5 | N175 D176 G182 G183 | N175-L179 WeakPolarHBondContact O-CG 3.3Å; N175-L179 PolarHBondContact O-N 2.92Å; D176-L179 PolarHBondContact O-N 2.9Å; L179-G182 PolarHBondContact O-N 3.42Å; L179-G183 VanDerWaalsContact O-CA 3.28Å; L179-G183 WeakPolarHBondContact O-CA 3.48Å; L179-G183 PolarHBondContact O-N 3.45Å; L179-G183 VanDerWaalsContact O-N 3.14Å |
| 180 | N | 64.3 | Low | 67.9 | Low | 143 Ų | 143 | 111.6 Ų | 111.6 | 77% | 0.765 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -71.2 | -34.8 | 177.5 | -149.7 | -96.8 | 0 | 0 | 0 | 111.6 | D176 Q177 | D176-N180 VanDerWaalsContact O-CB 3.25Å; D176-N180 WeakPolarHBondContact O-CB 3.33Å; D176-N180 PolarHBondContact O-N 3.2Å; Q177-N180 PolarHBondContact O-N 2.99Å |
| 181 | C | 58.5 | Low | 65.3 | Low | 115 Ų | 115 | 107.6 Ų | 107.6 | 78% | 0.777 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -76.6 | -20 | 174.2 | -67.9 | 0 | 0 | 0 | 0 | 114.3 | Q177 | Q177-C181 PolarHBondContact O-N 3.3Å; Q177-C181 VanDerWaalsContact O-N 3.1Å; Q177-C181 PolarHBondContact O-SG 3.41Å; Q177-C181 VanDerWaalsContact O-SG 3.41Å |
| 182 | G | 57.2 | Low | 63.1 | Low | 61 Ų | 61 | 108.6 Ų | 108.6 | 63% | 0.629 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.4 | 7.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | A178 L179 T184 | A178-G182 PolarHBondContact O-N 2.87Å; A178-G182 VanDerWaalsContact O-N 3.1Å; L179-G182 PolarHBondContact O-N 3.42Å; G182-T184 PolarHBondContact O-N 2.84Å |
| 183 | G | 48.8 | Very low | 60.8 | Low | 52 Ų | 52 | 108.5 Ų | 108.5 | 54% | 0.536 | 70% | 0.7 | S | S | . | * | trans | -95.6 | 20.3 | -153.3 | 0 | 0 | 0 | 0 | 0 | 118.5 | L179 A185 | L179-G183 VanDerWaalsContact O-CA 3.28Å; L179-G183 WeakPolarHBondContact O-CA 3.48Å; L179-G183 PolarHBondContact O-N 3.45Å; L179-G183 VanDerWaalsContact O-N 3.14Å; G183-A185 VanDerWaalsContact C-N 3.34Å | ||
| 184 | T | 45.1 | Very low | 58.8 | Low | 155 Ų | 155 | 109.6 Ų | 109.6 | 95% | 0.951 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -95.9 | 28.1 | 176.2 | 57.4 | 0 | 0 | 0 | 0 | 114 | G182 | G182-T184 PolarHBondContact O-N 2.84Š|
| 185 | A | 49.9 | Very low | 56.5 | Low | 80 Ų | 80 | 109.3 Ų | 109.3 | 66% | 0.661 | 71% | 0.709 | S | S | * | * | trans | -151.5 | 102.7 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | G183 | G183-A185 VanDerWaalsContact C-N 3.34Š| ||
| 186 | S | 38.8 | Very low | 54.8 | Low | 116 Ų | 116 | 113.8 Ų | 113.8 | 81% | 0.811 | 73% | 0.726 | S | S | * | * | trans | 174 | 82.6 | 150.7 | -83.9 | 0 | 0 | 0 | 0 | 110.6 | G188 | S186-G188 PolarHBondContact O-N 2.86Š| ||
| 187 | T | 49.7 | Very low | 53.1 | Low | 156 Ų | 156 | 115.4 Ų | 115.4 | 96% | 0.957 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -71.3 | 107.2 | 162.6 | -24.4 | 0 | 0 | 0 | 0 | 108.3 | ||
| 188 | G | 51.7 | Low | 51.5 | Low | 70 Ų | 70 | 112.3 Ų | 112.3 | 72% | 0.722 | 72% | 0.724 | S | S | * | * | trans | 83.2 | 127.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | S186 | S186-G188 PolarHBondContact O-N 2.86Š| ||
| 189 | S | 41.9 | Very low | 50.6 | Low | 127 Ų | 127 | 112.7 Ų | 112.7 | 89% | 0.888 | 73% | 0.727 | S | S | * | * | trans | -146.2 | 130.5 | 156.5 | -173.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 190 | A | 48.4 | Very low | 50 | Low | 103 Ų | 103 | 113.6 Ų | 113.6 | 85% | 0.851 | 73% | 0.733 | S | S | * | * | trans | -85.2 | 124 | -165.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 191 | G | 40.3 | Very low | 49.8 | Very low | 75 Ų | 75 | 109.2 Ų | 109.2 | 77% | 0.773 | 71% | 0.709 | S | S | * | * | trans | -85.2 | 117.1 | 162 | 0 | 0 | 0 | 0 | 0 | 110 | V193 | G191-V193 PolarHBondContact O-N 2.93Å; G191-V193 VanDerWaalsContact O-N 3.14Å | ||
| 192 | N | 47.8 | Very low | 49.9 | Very low | 149 Ų | 149 | 108.5 Ų | 108.5 | 80% | 0.797 | 70% | 0.697 | S | S | * | * | trans | -61.1 | 111.6 | 178 | 173.2 | -2.6 | 0 | 0 | 0 | 111.5 | K194 | N192-K194 PolarHBondContact OD1-N 2.84Š| ||
| 193 | V | 45.5 | Very low | 50.1 | Low | 128 Ų | 128 | 111.8 Ų | 111.8 | 78% | 0.776 | 70% | 0.699 | S | S | * | * | trans | -131.6 | 114.2 | 149.3 | -173.9 | 0 | 0 | 0 | 0 | 108.3 | G191 L195 | G191-V193 PolarHBondContact O-N 2.93Å; G191-V193 VanDerWaalsContact O-N 3.14Å; V193-L195 PolarHBondContact O-N 2.91Å | ||
| 194 | K | 49 | Very low | 50.5 | Low | 179 Ų | 179 | 112 Ų | 112 | 78% | 0.778 | 69% | 0.692 | S | S | * | * | trans | -28.7 | 98.1 | 171.3 | -179.7 | 178.9 | 173.5 | 177.9 | 0 | 114.2 | N192 E196 | N192-K194 PolarHBondContact OD1-N 2.84Å; K194-E196 PolarHBondContact O-N 3.19Å | ||
| 195 | L | 42.9 | Very low | 51.1 | Low | 130 Ų | 130 | 109.3 Ų | 109.3 | 68% | 0.681 | 67% | 0.671 | S | S | * | * | trans | -93.7 | 81.1 | -179 | -171.4 | 115.4 | 0 | 0 | 0 | 112 | V193 E197 | V193-L195 PolarHBondContact O-N 2.91Å; L195-E197 HydrophobicContact CD1-CB 4.05Å; L195-E197 HydrophobicContact CG-CB 3.87Å; L195-E197 PolarHBondContact O-N 3.07Å | ||
| 196 | E | 52.3 | Low | 51.5 | Low | 182 Ų | 182 | 110.5 Ų | 110.5 | 85% | 0.85 | 67% | 0.67 | S | S | * | * | trans | -90.2 | 51.5 | 160.2 | -76.7 | -99.4 | 101.4 | 0 | 0 | 109 | K194 | K194-E196 PolarHBondContact O-N 3.19Š| ||
| 197 | E | 51.7 | Low | 52.3 | Low | 107 Ų | 107 | 113.7 Ų | 113.7 | 50% | 0.5 | 67% | 0.669 | S | S | . | * | trans | -119.3 | 96.7 | -167.2 | -158.3 | 164.5 | 57.7 | 0 | 0 | 112.6 | L195 N201 | L195-E197 HydrophobicContact CD1-CB 4.05Å; L195-E197 HydrophobicContact CG-CB 3.87Å; L195-E197 PolarHBondContact O-N 3.07Å; E197-N201 HydrophobicContact CG-CB 4.04Å; E197-N201 PolarHBondContact OE1-ND2 3.41Å | ||
| 198 | S | 50.5 | Low | 52.5 | Low | 62 Ų | 62 | 112.7 Ų | 112.7 | 43% | 0.434 | 65% | 0.654 | S | S | . | * | trans | 17.3 | 123.5 | 145.2 | 154.7 | 0 | 0 | 0 | 0 | 117.4 | D200 N201 | S198-D200 PolarHBondContact O-N 3.41Å; S198-D200 VanDerWaalsContact OG-CB 3.25Å; S198-D200 WeakPolarHBondContact OG-CB 3.33Å; S198-D200 PolarHBondContact OG-N 3.12Å; S198-D200 PolarHBondContact OG-OD2 3.45Å; S198-N201 WeakPolarHBondContact O-CB 3.38Å; S198-N201 PolarHBondContact O-N 3.27Å | ||
| 199 | A | 58.8 | Low | 52.4 | Low | 70 Ų | 70 | 119.2 Ų | 119.2 | 58% | 0.579 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -57.7 | -22.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | N201 I202 L203 | A199-N201 VanDerWaalsContact C-N 3.28Å; A199-N201 PolarHBondContact O-N 3.29Å; A199-I202 WeakPolarHBondContact O-CB 3.37Å; A199-I202 PolarHBondContact O-N 2.83Å; A199-I202 VanDerWaalsContact O-N 3.08Å; A199-L203 PolarHBondContact O-N 3.09Å |
| 200 | D | 57.4 | Low | 52.9 | Low | 125 Ų | 125 | 118.5 Ų | 118.5 | 67% | 0.668 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -63.5 | -32.7 | 174.8 | -43.1 | -91.6 | 0 | 0 | 0 | 111.9 | S198 L203 S204 | S198-D200 PolarHBondContact O-N 3.41Å; S198-D200 VanDerWaalsContact OG-CB 3.25Å; S198-D200 WeakPolarHBondContact OG-CB 3.33Å; S198-D200 PolarHBondContact OG-N 3.12Å; S198-D200 PolarHBondContact OG-OD2 3.45Å; D200-L203 PolarHBondContact O-N 3.42Å; D200-S204 PolarHBondContact O-N 2.99Å; D200-S204 VanDerWaalsContact O-N 3.08Å |
| 201 | N | 59 | Low | 53.2 | Low | 51 Ų | 51 | 116.3 Ų | 116.3 | 27% | 0.273 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -64.7 | -40.4 | 171.1 | -170.1 | 20.7 | 0 | 0 | 0 | 110.9 | E197 S198 A199 L203 S204 I205 | E197-N201 HydrophobicContact CG-CB 4.04Å; E197-N201 PolarHBondContact OE1-ND2 3.41Å; S198-N201 WeakPolarHBondContact O-CB 3.38Å; S198-N201 PolarHBondContact O-N 3.27Å; A199-N201 VanDerWaalsContact C-N 3.28Å; A199-N201 PolarHBondContact O-N 3.29Å; N201-L203 VanDerWaalsContact C-N 3.3Å; N201-L203 PolarHBondContact O-N 3.41Å; N201-S204 CarbonylContact O-C 3.52Å; N201-S204 WeakPolarHBondContact O-CA 3.3Å; N201-S204 WeakPolarHBondContact O-CB 3.49Å; N201-S204 PolarHBondContact O-N 3.18Å; N201-I205 WeakPolarHBondContact O-CG1 3.44Å; N201-I205 PolarHBondContact O-N 2.98Å |
| 202 | I | 61.6 | Low | 53.6 | Low | 101 Ų | 101 | 117.8 Ų | 117.8 | 52% | 0.518 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -60.1 | -40.2 | -179.5 | -59.9 | -176.6 | 0 | 0 | 0 | 111.4 | A199 V206 | A199-I202 WeakPolarHBondContact O-CB 3.37Å; A199-I202 PolarHBondContact O-N 2.83Å; A199-I202 VanDerWaalsContact O-N 3.08Å; I202-V206 WeakPolarHBondContact O-CG2 3.36Å; I202-V206 PolarHBondContact O-N 3.1Å |
| 203 | L | 61.1 | Low | 53.9 | Low | 129 Ų | 129 | 119.1 Ų | 119.1 | 68% | 0.675 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -67.6 | -35.9 | 171.9 | -86.1 | 71.8 | 0 | 0 | 0 | 112.1 | A199 D200 N201 V206 K207 | A199-L203 PolarHBondContact O-N 3.09Å; D200-L203 PolarHBondContact O-N 3.42Å; N201-L203 VanDerWaalsContact C-N 3.3Å; N201-L203 PolarHBondContact O-N 3.41Å; L203-V206 PolarHBondContact O-N 3.1Å; L203-K207 WeakPolarHBondContact O-CB 3.37Å; L203-K207 PolarHBondContact O-N 2.83Å; L203-K207 VanDerWaalsContact O-N 3.12Å |
| 204 | S | 56.8 | Low | 54.3 | Low | 56 Ų | 56 | 116.3 Ų | 116.3 | 39% | 0.392 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -61.1 | -50.3 | 174.7 | -168.1 | 0 | 0 | 0 | 0 | 112.2 | D200 N201 V206 K207 Q208 | D200-S204 PolarHBondContact O-N 2.99Å; D200-S204 VanDerWaalsContact O-N 3.08Å; N201-S204 CarbonylContact O-C 3.52Å; N201-S204 WeakPolarHBondContact O-CA 3.3Å; N201-S204 WeakPolarHBondContact O-CB 3.49Å; N201-S204 PolarHBondContact O-N 3.18Å; S204-V206 VanDerWaalsContact C-N 3.34Å; S204-V206 PolarHBondContact O-N 3.46Å; S204-K207 CarbonylContact O-C 3.48Å; S204-K207 PolarHBondContact O-N 3.14Å; S204-K207 VanDerWaalsContact O-N 3.08Å; S204-Q208 WeakPolarHBondContact O-CB 3.33Å; S204-Q208 WeakPolarHBondContact O-CG 3.16Å; S204-Q208 PolarHBondContact O-N 3.12Å |
| 205 | I | 58.3 | Low | 54.3 | Low | 99 Ų | 99 | 114.8 Ų | 114.8 | 51% | 0.508 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -62.9 | -38.8 | 178.4 | 4.5 | 171.2 | 0 | 0 | 0 | 111.9 | N201 K207 Q208 R209 | N201-I205 WeakPolarHBondContact O-CG1 3.44Å; N201-I205 PolarHBondContact O-N 2.98Å; I205-K207 VanDerWaalsContact C-N 3.26Å; I205-K207 PolarHBondContact O-N 3.17Å; I205-Q208 PolarHBondContact O-N 3.36Å; I205-R209 VanDerWaalsContact O-CB 3.3Å; I205-R209 WeakPolarHBondContact O-CB 3.46Å; I205-R209 PolarHBondContact O-N 3.41Å |
| 206 | V | 57.2 | Low | 55.2 | Low | 105 Ų | 105 | 117.9 Ų | 117.9 | 64% | 0.636 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -60.1 | -38.3 | 174.5 | 169.4 | 0 | 0 | 0 | 0 | 111.3 | I202 L203 S204 | I202-V206 WeakPolarHBondContact O-CG2 3.36Å; I202-V206 PolarHBondContact O-N 3.1Å; L203-V206 PolarHBondContact O-N 3.1Å; S204-V206 VanDerWaalsContact C-N 3.34Å; S204-V206 PolarHBondContact O-N 3.46Å |
| 207 | K | 55.8 | Low | 55.6 | Low | 183 Ų | 183 | 112.1 Ų | 112.1 | 80% | 0.796 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -77.6 | -33.1 | 179.1 | -141.3 | 162.9 | -174.6 | 173 | 0 | 113 | L203 S204 I205 | L203-K207 WeakPolarHBondContact O-CB 3.37Å; L203-K207 PolarHBondContact O-N 2.83Å; L203-K207 VanDerWaalsContact O-N 3.12Å; S204-K207 CarbonylContact O-C 3.48Å; S204-K207 PolarHBondContact O-N 3.14Å; S204-K207 VanDerWaalsContact O-N 3.08Å; I205-K207 VanDerWaalsContact C-N 3.26Å; I205-K207 PolarHBondContact O-N 3.17Å |
| 208 | Q | 54.7 | Low | 56.4 | Low | 135 Ų | 135 | 112.6 Ų | 112.6 | 63% | 0.631 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -77.5 | -25.1 | 175.9 | -72.5 | -71 | -27.3 | 0 | 0 | 113.3 | S204 I205 T210 G211 | S204-Q208 WeakPolarHBondContact O-CB 3.33Å; S204-Q208 WeakPolarHBondContact O-CG 3.16Å; S204-Q208 PolarHBondContact O-N 3.12Å; I205-Q208 PolarHBondContact O-N 3.36Å; Q208-T210 PolarHBondContact O-N 3.47Å; Q208-T210 VanDerWaalsContact O-N 3.12Å; Q208-G211 PolarHBondContact O-N 3.46Å |
| 209 | R | 48.4 | Very low | 57.5 | Low | 208 Ų | 208 | 119.7 Ų | 119.7 | 79% | 0.785 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -62.3 | -21.9 | -176.6 | -165.7 | 168 | -171.8 | 170.4 | 2.8 | 114 | I205 G211 | I205-R209 VanDerWaalsContact O-CB 3.3Å; I205-R209 WeakPolarHBondContact O-CB 3.46Å; I205-R209 PolarHBondContact O-N 3.41Å; R209-G211 VanDerWaalsContact C-N 3.27Å; R209-G211 PolarHBondContact O-N 3.15Å |
| 210 | T | 52.6 | Low | 58.5 | Low | 111 Ų | 111 | 119.5 Ų | 119.5 | 68% | 0.681 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -71.3 | -18.7 | 171.6 | -47.9 | 0 | 0 | 0 | 0 | 112.9 | Q208 | Q208-T210 PolarHBondContact O-N 3.47Å; Q208-T210 VanDerWaalsContact O-N 3.12Å |
| 211 | G | 55.2 | Low | 60.2 | Low | 58 Ų | 58 | 116.8 Ų | 116.8 | 60% | 0.598 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -84.5 | -11.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | Q208 R209 F213 | Q208-G211 PolarHBondContact O-N 3.46Å; R209-G211 VanDerWaalsContact C-N 3.27Å; R209-G211 PolarHBondContact O-N 3.15Å; G211-F213 VanDerWaalsContact C-N 3.31Å; G211-F213 PolarHBondContact O-N 2.85Å |
| 212 | S | 49.4 | Very low | 61.9 | Low | 105 Ų | 105 | 120.5 Ų | 120.5 | 73% | 0.734 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -86.5 | 14.8 | -172.9 | -165.9 | 0 | 0 | 0 | 0 | 115.4 | G214 | S212-G214 PolarHBondContact O-N 2.91Š|
| 213 | F | 52.8 | Low | 63.5 | Low | 178 Ų | 178 | 121.4 Ų | 121.4 | 78% | 0.781 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -82.2 | 3.1 | 170.7 | -70 | -84.8 | 0 | 0 | 0 | 113.5 | G211 | G211-F213 VanDerWaalsContact C-N 3.31Å; G211-F213 PolarHBondContact O-N 2.85Å |
| 214 | G | 55 | Low | 65.1 | Low | 69 Ų | 69 | 118 Ų | 118 | 71% | 0.711 | 64% | 0.635 | S | S | * | * | trans | -73 | -28.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | S212 R216 | S212-G214 PolarHBondContact O-N 2.91Å; G214-R216 PolarHBondContact O-N 3.01Å | ||
| 215 | D | 49.5 | Very low | 66.9 | Low | 146 Ų | 146 | 120 Ų | 120 | 78% | 0.781 | 64% | 0.639 | S | S | * | * | trans | -80 | 66.7 | 173.7 | -168.7 | 44 | 0 | 0 | 0 | 110.6 | P217 | D215-P217 VanDerWaalsContact O-CD 3.22Å; D215-P217 WeakPolarHBondContact O-CD 3.26Å | ||
| 216 | R | 61.5 | Low | 68.8 | Low | 196 Ų | 196 | 118.2 Ų | 118.2 | 74% | 0.74 | 63% | 0.632 | S | S | * | * | trans | -80.2 | 107.8 | 163 | -175 | 177.7 | -175.1 | -153.9 | -1.1 | 107.1 | G214 A218 | G214-R216 PolarHBondContact O-N 3.01Å; R216-A218 PolarHBondContact O-N 3.25Å; R216-A218 VanDerWaalsContact O-N 3.17Å | ||
| 217 | P | 60.5 | Low | 70.7 | Confident | 60 Ų | 60 | 118.2 Ų | 118.2 | 39% | 0.39 | 63% | 0.628 | S | S | . | * | trans | -58.8 | 127.3 | 176.3 | 25 | -34 | 0 | 0 | 0 | 108.7 | D215 R219 T221 | D215-P217 VanDerWaalsContact O-CD 3.22Å; D215-P217 WeakPolarHBondContact O-CD 3.26Å; P217-R219 PolarHBondContact O-N 2.93Å; P217-T221 HydrophobicContact CG-CG2 4.26Å | ||
| 218 | A | 68.1 | Low | 72.6 | Confident | 117 Ų | 117 | 112.5 Ų | 112.5 | 97% | 0.967 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -65 | 5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114 | R216 | R216-A218 PolarHBondContact O-N 3.25Å; R216-A218 VanDerWaalsContact O-N 3.17Å |
| 219 | R | 73.7 | Confident | 74.7 | Confident | 212 Ų | 212 | 112.2 Ų | 112.2 | 80% | 0.8 | 61% | 0.605 | S | S | * | * | S | Bend | trans | -134.8 | 121.1 | 177.2 | -141.9 | 176.9 | -174.7 | -164.9 | -0.6 | 107.5 | P217 T221 | P217-R219 PolarHBondContact O-N 2.93Å; R219-T221 PolarHBondContact O-N 3.22Å |
| 220 | P | 80.1 | Confident | 77 | Confident | 65 Ų | 65 | 109.3 Ų | 109.3 | 42% | 0.422 | 60% | 0.598 | S | S | . | * | trans | -64.9 | 135.8 | -175.1 | 26.5 | -34.7 | 0 | 0 | 0 | 110.6 | E224 Q225 | P220-E224 VanDerWaalsContact CA-OE2 3.23Å; P220-E224 WeakPolarHBondContact CA-OE2 3.49Å; P220-E224 HydrophobicContact CB-CB 4.49Å; P220-E224 HydrophobicContact CB-CG 4.18Å; P220-E224 WeakPolarHBondContact CB-OE2 3.24Å; P220-Q225 HydrophobicContact CB-CG 4.27Å; P220-Q225 HydrophobicContact CG-CG 4.31Å; P220-Q225 PolarHBondContact O-NE2 3.42Å | ||
| 221 | T | 92.1 | Very high | 79.2 | Confident | 68 Ų | 68 | 111.7 Ų | 111.7 | 42% | 0.417 | 59% | 0.594 | S | S | . | * | trans | -68.8 | 160.1 | -178 | 67.7 | 0 | 0 | 0 | 0 | 111.4 | P217 R219 L223 E224 Q225 | P217-T221 HydrophobicContact CG-CG2 4.26Å; R219-T221 PolarHBondContact O-N 3.22Å; T221-L223 PolarHBondContact O-N 2.81Å; T221-E224 PolarHBondContact N-OE2 3.37Å; T221-E224 WeakPolarHBondContact O-CB 3.23Å; T221-E224 PolarHBondContact O-N 2.76Å; T221-E224 VanDerWaalsContact O-N 3.12Å; T221-E224 VanDerWaalsContact OG1-CB 3.32Å; T221-E224 WeakPolarHBondContact OG1-CB 3.32Å; T221-E224 PolarHBondContact OG1-N 2.9Å; T221-E224 VanDerWaalsContact OG1-N 3.09Å; T221-Q225 VanDerWaalsContact O-CG 3.3Å; T221-Q225 WeakPolarHBondContact O-CG 3.25Å; T221-Q225 PolarHBondContact O-N 3.11Å | ||
| 222 | L | 95 | Very high | 81.2 | Confident | 130 Ų | 130 | 113.5 Ų | 113.5 | 68% | 0.681 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -58.2 | -36.6 | 175.9 | -179.2 | 61 | 0 | 0 | 0 | 111.9 | Q225 V226 | L222-Q225 PolarHBondContact O-N 3.43Å; L222-V226 HydrophobicContact CD1-CG2 4.41Å; L222-V226 WeakPolarHBondContact O-CG2 3.4Å; L222-V226 PolarHBondContact O-N 2.93Å |
| 223 | L | 95.3 | Very high | 83.5 | Confident | 120 Ų | 120 | 111 Ų | 111 | 63% | 0.628 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.9 | -47.4 | 174.2 | 179 | 60.3 | 0 | 0 | 0 | 111.5 | T221 Q225 V226 L227 | T221-L223 PolarHBondContact O-N 2.81Å; L223-Q225 VanDerWaalsContact C-N 3.31Å; L223-Q225 PolarHBondContact O-N 3.26Å; L223-V226 PolarHBondContact O-N 3.49Å; L223-L227 HydrophobicContact CD1-CD1 3.96Å; L223-L227 HydrophobicContact CD1-CG 4.08Å; L223-L227 HydrophobicContact CG-CD1 3.89Å; L223-L227 HydrophobicContact CG-CG 4.42Å; L223-L227 WeakPolarHBondContact O-CB 3.22Å; L223-L227 VanDerWaalsContact O-CG 3.26Å; L223-L227 WeakPolarHBondContact O-CG 3.49Å; L223-L227 PolarHBondContact O-N 2.94Å |
| 224 | E | 94.1 | Very high | 85.7 | Confident | 56 Ų | 56 | 107.6 Ų | 107.6 | 26% | 0.262 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.1 | -38.2 | 176 | -177.5 | -178 | 177.5 | 0 | 0 | 112.1 | P220 T221 N228 | P220-E224 VanDerWaalsContact CA-OE2 3.23Å; P220-E224 WeakPolarHBondContact CA-OE2 3.49Å; P220-E224 HydrophobicContact CB-CB 4.49Å; P220-E224 HydrophobicContact CB-CG 4.18Å; P220-E224 WeakPolarHBondContact CB-OE2 3.24Å; T221-E224 PolarHBondContact N-OE2 3.37Å; T221-E224 WeakPolarHBondContact O-CB 3.23Å; T221-E224 PolarHBondContact O-N 2.76Å; T221-E224 VanDerWaalsContact O-N 3.12Å; T221-E224 VanDerWaalsContact OG1-CB 3.32Å; T221-E224 WeakPolarHBondContact OG1-CB 3.32Å; T221-E224 PolarHBondContact OG1-N 2.9Å; T221-E224 VanDerWaalsContact OG1-N 3.09Å; E224-N228 WeakPolarHBondContact CG-ND2 3.28Å; E224-N228 WeakPolarHBondContact O-CB 3.4Å; E224-N228 PolarHBondContact O-N 2.91Å; E224-N228 PolarHBondContact O-ND2 3.07Å |
| 225 | Q | 96.3 | Very high | 87.7 | Confident | 100 Ų | 100 | 108.5 Ų | 108.5 | 47% | 0.467 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.1 | -48.2 | 174.9 | -69.2 | 170.7 | 37.3 | 0 | 0 | 111.5 | P220 T221 L222 L223 N228 Q229 | P220-Q225 HydrophobicContact CB-CG 4.27Å; P220-Q225 HydrophobicContact CG-CG 4.31Å; P220-Q225 PolarHBondContact O-NE2 3.42Å; T221-Q225 VanDerWaalsContact O-CG 3.3Å; T221-Q225 WeakPolarHBondContact O-CG 3.25Å; T221-Q225 PolarHBondContact O-N 3.11Å; L222-Q225 PolarHBondContact O-N 3.43Å; L223-Q225 VanDerWaalsContact C-N 3.31Å; L223-Q225 PolarHBondContact O-N 3.26Å; Q225-N228 PolarHBondContact O-N 2.87Å; Q225-Q229 VanDerWaalsContact O-CB 3.27Å; Q225-Q229 WeakPolarHBondContact O-CB 3.36Å; Q225-Q229 PolarHBondContact O-N 3.24Å |
| 226 | V | 97.6 | Very high | 90 | Very high | 61 Ų | 61 | 109 Ų | 109 | 37% | 0.37 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.8 | -39.5 | 178.8 | 172.6 | 0 | 0 | 0 | 0 | 111.7 | L222 L223 Q229 K230 | L222-V226 HydrophobicContact CD1-CG2 4.41Å; L222-V226 WeakPolarHBondContact O-CG2 3.4Å; L222-V226 PolarHBondContact O-N 2.93Å; L223-V226 PolarHBondContact O-N 3.49Å; V226-Q229 PolarHBondContact O-N 3.44Å; V226-K230 WeakPolarHBondContact O-CB 3.46Å; V226-K230 WeakPolarHBondContact O-CG 3.48Å; V226-K230 PolarHBondContact O-N 3.38Å |
| 227 | L | 97.4 | Very high | 91.7 | Very high | 104 Ų | 104 | 100.9 Ų | 100.9 | 55% | 0.545 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.3 | -44.6 | 176.1 | -71.8 | 173.3 | 0 | 0 | 0 | 111.7 | L223 K230 R231 | L223-L227 HydrophobicContact CD1-CD1 3.96Å; L223-L227 HydrophobicContact CD1-CG 4.08Å; L223-L227 HydrophobicContact CG-CD1 3.89Å; L223-L227 HydrophobicContact CG-CG 4.42Å; L223-L227 WeakPolarHBondContact O-CB 3.22Å; L223-L227 VanDerWaalsContact O-CG 3.26Å; L223-L227 WeakPolarHBondContact O-CG 3.49Å; L223-L227 PolarHBondContact O-N 2.94Å; L227-K230 PolarHBondContact O-N 3.47Å; L227-R231 WeakPolarHBondContact O-CB 3.38Å; L227-R231 PolarHBondContact O-N 3.36Å |
| 228 | N | 95.9 | Very high | 93.5 | Very high | 64 Ų | 64 | 101.7 Ų | 101.7 | 34% | 0.342 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -67.7 | -37.4 | 174.9 | -79.2 | -68.6 | 0 | 0 | 0 | 112.2 | E224 Q225 R231 L232 | E224-N228 WeakPolarHBondContact CG-ND2 3.28Å; E224-N228 WeakPolarHBondContact O-CB 3.4Å; E224-N228 PolarHBondContact O-N 2.91Å; E224-N228 PolarHBondContact O-ND2 3.07Å; Q225-N228 PolarHBondContact O-N 2.87Å; N228-R231 PolarHBondContact O-N 2.84Å; N228-L232 VanDerWaalsContact O-CB 3.31Å; N228-L232 WeakPolarHBondContact O-CB 3.48Å; N228-L232 VanDerWaalsContact O-CG 3.24Å; N228-L232 WeakPolarHBondContact O-CG 3.36Å; N228-L232 PolarHBondContact O-N 3.45Å |
| 229 | Q | 97.6 | Very high | 94.9 | Very high | 128 Ų | 128 | 102 Ų | 102 | 60% | 0.598 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.2 | -47.6 | 173.7 | -173.4 | -172.1 | 71.8 | 0 | 0 | 111 | Q225 V226 L232 S233 | Q225-Q229 VanDerWaalsContact O-CB 3.27Å; Q225-Q229 WeakPolarHBondContact O-CB 3.36Å; Q225-Q229 PolarHBondContact O-N 3.24Å; V226-Q229 PolarHBondContact O-N 3.44Å; Q229-L232 PolarHBondContact O-N 3.11Å; Q229-S233 WeakPolarHBondContact O-CB 2.98Å; Q229-S233 PolarHBondContact O-N 2.89Å; Q229-S233 PolarHBondContact O-OG 3.29Å |
| 230 | K | 97.9 | Very high | 96.1 | Very high | 148 Ų | 148 | 93.7 Ų | 93.7 | 64% | 0.643 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -61.8 | -44.9 | 175.6 | -75.8 | -168.9 | 175.6 | -169 | 0 | 111.9 | V226 L227 L232 S233 L234 | V226-K230 WeakPolarHBondContact O-CB 3.46Å; V226-K230 WeakPolarHBondContact O-CG 3.48Å; V226-K230 PolarHBondContact O-N 3.38Å; L227-K230 PolarHBondContact O-N 3.47Å; K230-L232 PolarHBondContact O-N 3.2Å; K230-S233 PolarHBondContact O-N 3.25Å; K230-L234 VanDerWaalsContact O-CB 3.3Å; K230-L234 WeakPolarHBondContact O-CB 3.14Å; K230-L234 PolarHBondContact O-N 3.41Å |
| 231 | R | 97.8 | Very high | 97 | Very high | 161 Ų | 161 | 93.8 Ų | 93.8 | 61% | 0.608 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -57.4 | -49.1 | 174.7 | 179.2 | -175.3 | 176.4 | -166.8 | 1 | 112 | L227 N228 L234 L235 | L227-R231 WeakPolarHBondContact O-CB 3.38Å; L227-R231 PolarHBondContact O-N 3.36Å; N228-R231 PolarHBondContact O-N 2.84Å; R231-L234 PolarHBondContact O-N 3.31Å; R231-L235 HydrophobicContact CG-CD1 4.13Å; R231-L235 WeakPolarHBondContact O-CG 3.03Å; R231-L235 PolarHBondContact O-N 2.89Å |
| 232 | L | 97.5 | Very high | 97.3 | Very high | 95 Ų | 95 | 96.4 Ų | 96.4 | 50% | 0.497 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.5 | -34.8 | -178.7 | -71 | 171 | 0 | 0 | 0 | 112.1 | N228 Q229 K230 R236 | N228-L232 VanDerWaalsContact O-CB 3.31Å; N228-L232 WeakPolarHBondContact O-CB 3.48Å; N228-L232 VanDerWaalsContact O-CG 3.24Å; N228-L232 WeakPolarHBondContact O-CG 3.36Å; N228-L232 PolarHBondContact O-N 3.45Å; Q229-L232 PolarHBondContact O-N 3.11Å; K230-L232 PolarHBondContact O-N 3.2Å; L232-R236 VanDerWaalsContact C-NH2 3.34Å; L232-R236 WeakPolarHBondContact O-CB 3.2Å; L232-R236 VanDerWaalsContact O-CG 3.27Å; L232-R236 WeakPolarHBondContact O-CG 3.16Å; L232-R236 VanDerWaalsContact O-CZ 3.32Å; L232-R236 PolarHBondContact O-N 3.29Å; L232-R236 VanDerWaalsContact O-N 3.12Å; L232-R236 PolarHBondContact O-NE 3.29Å; L232-R236 PolarHBondContact O-NH2 3.21Å |
| 233 | S | 97.9 | Very high | 97.4 | Very high | 54 Ų | 54 | 95.9 Ų | 95.9 | 38% | 0.378 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -73.6 | -34.6 | 175.3 | -69.2 | 0 | 0 | 0 | 0 | 112.2 | Q229 K230 R236 S237 | Q229-S233 WeakPolarHBondContact O-CB 2.98Å; Q229-S233 PolarHBondContact O-N 2.89Å; Q229-S233 PolarHBondContact O-OG 3.29Å; K230-S233 PolarHBondContact O-N 3.25Å; S233-R236 CarbonylContact O-C 3.53Å; S233-R236 PolarHBondContact O-N 2.89Å; S233-R236 PolarHBondContact OG-NH2 2.79Å; S233-S237 PolarHBondContact O-N 3.47Å |
| 234 | L | 97.9 | Very high | 97.6 | Very high | 106 Ų | 106 | 94.4 Ų | 94.4 | 56% | 0.555 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.7 | -47 | 171.1 | -171.6 | 74.5 | 0 | 0 | 0 | 111 | K230 R231 R236 S237 V240 | K230-L234 VanDerWaalsContact O-CB 3.3Å; K230-L234 WeakPolarHBondContact O-CB 3.14Å; K230-L234 PolarHBondContact O-N 3.41Å; R231-L234 PolarHBondContact O-N 3.31Å; L234-R236 PolarHBondContact O-N 2.94Å; L234-S237 PolarHBondContact O-N 3.48Å; L234-V240 HydrophobicContact CD1-CG2 3.81Å; L234-V240 HydrophobicContact CG-CG1 4.48Å; L234-V240 HydrophobicContact CG-CG2 4.21Å; L234-V240 VanDerWaalsContact O-CB 3.31Å; L234-V240 WeakPolarHBondContact O-CB 3.46Å; L234-V240 WeakPolarHBondContact O-CG1 3.21Å |
| 235 | L | 97.4 | Very high | 97.7 | Very high | 87 Ų | 87 | 98 Ų | 98 | 46% | 0.455 | 48% | 0.482 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -8.9 | 177.4 | -67.5 | 173 | 0 | 0 | 0 | 114.3 | R231 V241 L244 | R231-L235 HydrophobicContact CG-CD1 4.13Å; R231-L235 WeakPolarHBondContact O-CG 3.03Å; R231-L235 PolarHBondContact O-N 2.89Å; L235-V241 WeakPolarHBondContact O-CG2 3.49Å; L235-L244 HydrophobicContact CD2-CD1 4.38Å |
| 236 | R | 97.4 | Very high | 97.8 | Very high | 158 Ų | 158 | 99.5 Ų | 99.5 | 60% | 0.596 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.8 | 0.2 | 173.1 | -73.9 | -177.9 | -72 | 92.5 | 3.5 | 113.3 | L232 S233 L234 | L232-R236 VanDerWaalsContact C-NH2 3.34Å; L232-R236 WeakPolarHBondContact O-CB 3.2Å; L232-R236 VanDerWaalsContact O-CG 3.27Å; L232-R236 WeakPolarHBondContact O-CG 3.16Å; L232-R236 VanDerWaalsContact O-CZ 3.32Å; L232-R236 PolarHBondContact O-N 3.29Å; L232-R236 VanDerWaalsContact O-N 3.12Å; L232-R236 PolarHBondContact O-NE 3.29Å; L232-R236 PolarHBondContact O-NH2 3.21Å; S233-R236 CarbonylContact O-C 3.53Å; S233-R236 PolarHBondContact O-N 2.89Å; S233-R236 PolarHBondContact OG-NH2 2.79Å; L234-R236 PolarHBondContact O-N 2.94Å |
| 237 | S | 98.4 | Very high | 97.8 | Very high | 24 Ų | 24 | 100.4 Ų | 100.4 | 17% | 0.168 | 49% | 0.487 | C | S | . | . | trans | -70.4 | 127.4 | 173.6 | 137 | 0 | 0 | 0 | 0 | 108.5 | S233 L234 E239 V240 V241 | S233-S237 PolarHBondContact O-N 3.47Å; L234-S237 PolarHBondContact O-N 3.48Å; S237-E239 WeakPolarHBondContact CB-OE2 3.34Å; S237-E239 PolarHBondContact O-N 3.22Å; S237-E239 PolarHBondContact OG-N 2.82Å; S237-E239 PolarHBondContact OG-OE2 3.36Å; S237-V240 PolarHBondContact O-N 2.99Å; S237-V240 WeakPolarHBondContact OG-CG2 3.33Å; S237-V240 PolarHBondContact OG-N 2.94Å; S237-V240 VanDerWaalsContact OG-N 3.13Å; S237-V241 WeakPolarHBondContact O-CG2 3.42Å; S237-V241 PolarHBondContact O-N 3.3Å | ||
| 238 | P | 98.1 | Very high | 97.8 | Very high | 77 Ų | 77 | 100.6 Ų | 100.6 | 50% | 0.5 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.9 | -27.2 | -179.3 | 25.4 | -32.8 | 0 | 0 | 0 | 111.8 | Q242 | P238-Q242 VanDerWaalsContact O-CB 3.31Å; P238-Q242 WeakPolarHBondContact O-CB 3.36Å; P238-Q242 WeakPolarHBondContact O-CG 3.3Å; P238-Q242 PolarHBondContact O-N 3.43Å; P238-Q242 PolarHBondContact O-NE2 3.24Å |
| 239 | E | 98.1 | Very high | 97.9 | Very high | 125 Ų | 125 | 103.9 Ų | 103.9 | 58% | 0.584 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.9 | -48.1 | 174.9 | -52.2 | 73.5 | -159.2 | 0 | 0 | 111.1 | S237 Q242 F243 | S237-E239 WeakPolarHBondContact CB-OE2 3.34Å; S237-E239 PolarHBondContact O-N 3.22Å; S237-E239 PolarHBondContact OG-N 2.82Å; S237-E239 PolarHBondContact OG-OE2 3.36Å; E239-Q242 PolarHBondContact O-N 3.29Å; E239-F243 WeakPolarHBondContact O-CB 3.06Å; E239-F243 PolarHBondContact O-N 2.85Å |
| 240 | V | 98.4 | Very high | 97.9 | Very high | 36 Ų | 36 | 101.7 Ų | 101.7 | 22% | 0.218 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -67.6 | -40.3 | 178 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | L234 S237 F243 L244 | L234-V240 HydrophobicContact CD1-CG2 3.81Å; L234-V240 HydrophobicContact CG-CG1 4.48Å; L234-V240 HydrophobicContact CG-CG2 4.21Å; L234-V240 VanDerWaalsContact O-CB 3.31Å; L234-V240 WeakPolarHBondContact O-CB 3.46Å; L234-V240 WeakPolarHBondContact O-CG1 3.21Å; S237-V240 PolarHBondContact O-N 2.99Å; S237-V240 WeakPolarHBondContact OG-CG2 3.33Å; S237-V240 PolarHBondContact OG-N 2.94Å; S237-V240 VanDerWaalsContact OG-N 3.13Å; V240-F243 PolarHBondContact O-N 3.31Å; V240-L244 HydrophobicContact CG1-CD1 3.86Å; V240-L244 HydrophobicContact CG1-CG 4.3Å; V240-L244 WeakPolarHBondContact O-CB 3.2Å; V240-L244 VanDerWaalsContact O-CG 3.3Å; V240-L244 WeakPolarHBondContact O-CG 3.28Å; V240-L244 PolarHBondContact O-N 3.12Å |
| 241 | V | 98.3 | Very high | 97.9 | Very high | 67 Ų | 67 | 99 Ų | 99 | 41% | 0.406 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.3 | -48.1 | 176 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | L235 S237 F243 L244 Q245 | L235-V241 WeakPolarHBondContact O-CG2 3.49Å; S237-V241 WeakPolarHBondContact O-CG2 3.42Å; S237-V241 PolarHBondContact O-N 3.3Å; V241-F243 VanDerWaalsContact C-N 3.35Å; V241-F243 PolarHBondContact O-N 2.89Å; V241-L244 PolarHBondContact O-N 2.87Å; V241-Q245 VanDerWaalsContact O-CB 3.27Å; V241-Q245 WeakPolarHBondContact O-CB 3.41Å; V241-Q245 PolarHBondContact O-N 3.15Å |
| 242 | Q | 98.3 | Very high | 97.8 | Very high | 124 Ų | 124 | 95.3 Ų | 95.3 | 58% | 0.579 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.2 | -41.2 | 175.6 | -76.6 | 170.1 | 93.4 | 0 | 0 | 112.3 | P238 E239 Q245 K246 | P238-Q242 VanDerWaalsContact O-CB 3.31Å; P238-Q242 WeakPolarHBondContact O-CB 3.36Å; P238-Q242 WeakPolarHBondContact O-CG 3.3Å; P238-Q242 PolarHBondContact O-N 3.43Å; P238-Q242 PolarHBondContact O-NE2 3.24Å; E239-Q242 PolarHBondContact O-N 3.29Å; Q242-Q245 PolarHBondContact O-N 3.4Å; Q242-K246 WeakPolarHBondContact O-CB 3.42Å; Q242-K246 PolarHBondContact O-N 3.26Å |
| 243 | F | 98.5 | Very high | 97.7 | Very high | 118 Ų | 118 | 95.8 Ų | 95.8 | 52% | 0.518 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61 | -51.6 | 175.7 | 175 | -95.6 | 0 | 0 | 0 | 111.6 | E239 V240 V241 Q245 K246 Q247 | E239-F243 WeakPolarHBondContact O-CB 3.06Å; E239-F243 PolarHBondContact O-N 2.85Å; V240-F243 PolarHBondContact O-N 3.31Å; V241-F243 VanDerWaalsContact C-N 3.35Å; V241-F243 PolarHBondContact O-N 2.89Å; F243-Q245 VanDerWaalsContact C-N 3.34Å; F243-Q245 PolarHBondContact O-N 3.01Å; F243-K246 PolarHBondContact O-N 2.83Å; F243-Q247 HydrophobicContact CD1-CG 4.22Å; F243-Q247 HydrophobicContact CE1-CG 3.77Å; F243-Q247 HydrophobicContact CE2-CG 4.15Å; F243-Q247 HydrophobicContact CZ-CG 3.73Å; F243-Q247 WeakPolarHBondContact O-CG 3.5Å; F243-Q247 PolarHBondContact O-N 3.33Å |
| 244 | L | 98 | Very high | 97.6 | Very high | 89 Ų | 89 | 99.1 Ų | 99.1 | 47% | 0.466 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.2 | -39.4 | 179.7 | -69.8 | 173.3 | 0 | 0 | 0 | 111.8 | L235 V240 V241 Q247 Q248 | L235-L244 HydrophobicContact CD2-CD1 4.38Å; V240-L244 HydrophobicContact CG1-CD1 3.86Å; V240-L244 HydrophobicContact CG1-CG 4.3Å; V240-L244 WeakPolarHBondContact O-CB 3.2Å; V240-L244 VanDerWaalsContact O-CG 3.3Å; V240-L244 WeakPolarHBondContact O-CG 3.28Å; V240-L244 PolarHBondContact O-N 3.12Å; V241-L244 PolarHBondContact O-N 2.87Å; L244-Q247 PolarHBondContact O-N 3.03Å; L244-Q248 WeakPolarHBondContact O-CB 3.3Å; L244-Q248 PolarHBondContact O-N 3.14Å |
| 245 | Q | 97.8 | Very high | 97.4 | Very high | 133 Ų | 133 | 98.1 Ų | 98.1 | 62% | 0.621 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.8 | -43.7 | 174.3 | -173.4 | 177.2 | 11.3 | 0 | 0 | 111.6 | V241 Q242 F243 Q248 Q249 | V241-Q245 VanDerWaalsContact O-CB 3.27Å; V241-Q245 WeakPolarHBondContact O-CB 3.41Å; V241-Q245 PolarHBondContact O-N 3.15Å; Q242-Q245 PolarHBondContact O-N 3.4Å; F243-Q245 VanDerWaalsContact C-N 3.34Å; F243-Q245 PolarHBondContact O-N 3.01Å; Q245-Q248 PolarHBondContact O-N 3.27Å; Q245-Q249 WeakPolarHBondContact O-CB 3.26Å; Q245-Q249 PolarHBondContact O-N 2.82Å |
| 246 | K | 98.1 | Very high | 97.2 | Very high | 131 Ų | 131 | 98.8 Ų | 98.8 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.7 | -42.4 | 176.2 | -174.5 | 175.2 | -178.7 | 176.9 | 0 | 112.2 | Q242 F243 Q249 L250 | Q242-K246 WeakPolarHBondContact O-CB 3.42Å; Q242-K246 PolarHBondContact O-N 3.26Å; F243-K246 PolarHBondContact O-N 2.83Å; K246-Q249 PolarHBondContact O-N 2.84Å; K246-L250 HydrophobicContact CG-CD1 4.36Å; K246-L250 WeakPolarHBondContact O-CG 3.3Å; K246-L250 PolarHBondContact O-N 3.49Å |
| 247 | Q | 97.9 | Very high | 96.8 | Very high | 79 Ų | 79 | 96.5 Ų | 96.5 | 37% | 0.369 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.8 | -44.2 | 173.8 | -65.7 | -57.3 | -30.3 | 0 | 0 | 111.2 | F243 L244 Q249 L250 L251 | F243-Q247 HydrophobicContact CD1-CG 4.22Å; F243-Q247 HydrophobicContact CE1-CG 3.77Å; F243-Q247 HydrophobicContact CE2-CG 4.15Å; F243-Q247 HydrophobicContact CZ-CG 3.73Å; F243-Q247 WeakPolarHBondContact O-CG 3.5Å; F243-Q247 PolarHBondContact O-N 3.33Å; L244-Q247 PolarHBondContact O-N 3.03Å; Q247-Q249 VanDerWaalsContact C-N 3.32Å; Q247-Q249 PolarHBondContact O-N 2.87Å; Q247-L250 PolarHBondContact O-N 3.12Å; Q247-L251 WeakPolarHBondContact O-CG 3.17Å; Q247-L251 PolarHBondContact O-N 3.4Å |
| 248 | Q | 97.4 | Very high | 96.3 | Very high | 108 Ų | 108 | 101.2 Ų | 101.2 | 51% | 0.505 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.4 | -33.6 | 177.7 | -175.4 | 61 | 92.7 | 0 | 0 | 112.6 | L244 Q245 N252 | L244-Q248 WeakPolarHBondContact O-CB 3.3Å; L244-Q248 PolarHBondContact O-N 3.14Å; Q245-Q248 PolarHBondContact O-N 3.27Å; Q248-N252 PolarHBondContact NE2-ND2 3.34Å; Q248-N252 PolarHBondContact O-N 3.44Å; Q248-N252 PolarHBondContact O-ND2 3.21Å |
| 249 | Q | 97.5 | Very high | 95.7 | Very high | 134 Ų | 134 | 105.7 Ų | 105.7 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.3 | -47.8 | 173.2 | -175.7 | -179.3 | 4.5 | 0 | 0 | 111.3 | Q245 K246 Q247 L251 N252 Q253 | Q245-Q249 WeakPolarHBondContact O-CB 3.26Å; Q245-Q249 PolarHBondContact O-N 2.82Å; K246-Q249 PolarHBondContact O-N 2.84Å; Q247-Q249 VanDerWaalsContact C-N 3.32Å; Q247-Q249 PolarHBondContact O-N 2.87Å; Q249-L251 PolarHBondContact O-N 3.37Å; Q249-N252 PolarHBondContact O-N 3.08Å; Q249-Q253 PolarHBondContact O-N 2.86Å |
| 250 | L | 97.6 | Very high | 94.9 | Very high | 82 Ų | 82 | 106.6 Ų | 106.6 | 43% | 0.429 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.3 | -41.7 | 178.4 | -69.5 | 168.1 | 0 | 0 | 0 | 111.9 | K246 Q247 Q253 Q254 | K246-L250 HydrophobicContact CG-CD1 4.36Å; K246-L250 WeakPolarHBondContact O-CG 3.3Å; K246-L250 PolarHBondContact O-N 3.49Å; Q247-L250 PolarHBondContact O-N 3.12Å; L250-Q253 PolarHBondContact O-N 2.82Å; L250-Q254 PolarHBondContact O-N 3.12Å |
| 251 | L | 97.1 | Very high | 93.6 | Very high | 91 Ų | 91 | 112 Ų | 112 | 48% | 0.476 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64 | -40.3 | 174.8 | -71.3 | 170.1 | 0 | 0 | 0 | 112.3 | Q247 Q249 Q254 V255 | Q247-L251 WeakPolarHBondContact O-CG 3.17Å; Q247-L251 PolarHBondContact O-N 3.4Å; Q249-L251 PolarHBondContact O-N 3.37Å; L251-Q254 PolarHBondContact O-N 3.41Å; L251-V255 WeakPolarHBondContact O-CB 3.35Å; L251-V255 VanDerWaalsContact O-CG2 3.3Å; L251-V255 WeakPolarHBondContact O-CG2 3.36Å; L251-V255 PolarHBondContact O-N 3.14Å |
| 252 | N | 96.9 | Very high | 91.9 | Very high | 83 Ų | 83 | 115.6 Ų | 115.6 | 44% | 0.444 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -66 | -38.9 | 174.3 | -83.4 | -68.2 | 0 | 0 | 0 | 112.1 | Q248 Q249 V255 L256 | Q248-N252 PolarHBondContact NE2-ND2 3.34Å; Q248-N252 PolarHBondContact O-N 3.44Å; Q248-N252 PolarHBondContact O-ND2 3.21Å; Q249-N252 PolarHBondContact O-N 3.08Å; N252-V255 PolarHBondContact O-N 3.02Å; N252-L256 WeakPolarHBondContact O-CB 3Å; N252-L256 VanDerWaalsContact O-CG 3.3Å; N252-L256 WeakPolarHBondContact O-CG 3.37Å; N252-L256 PolarHBondContact O-N 3.5Å |
| 253 | Q | 95.8 | Very high | 89.8 | Confident | 106 Ų | 106 | 117 Ų | 117 | 50% | 0.495 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -60.9 | -49.1 | 175.2 | -176.7 | 162.9 | 43.6 | 0 | 0 | 110.8 | Q249 L250 V255 L256 E257 | Q249-Q253 PolarHBondContact O-N 2.86Å; L250-Q253 PolarHBondContact O-N 2.82Å; Q253-V255 VanDerWaalsContact C-N 3.32Å; Q253-V255 PolarHBondContact O-N 2.72Å; Q253-L256 PolarHBondContact O-N 3.03Å; Q253-L256 VanDerWaalsContact O-N 3.14Å; Q253-E257 WeakPolarHBondContact O-CG 3.46Å; Q253-E257 PolarHBondContact O-N 3.33Å |
| 254 | Q | 94 | Very high | 87.7 | Confident | 124 Ų | 124 | 115.9 Ų | 115.9 | 58% | 0.579 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -59.9 | -39 | 176.3 | -171.2 | 180 | 39.2 | 0 | 0 | 112.9 | L250 L251 Q258 | L250-Q254 PolarHBondContact O-N 3.12Å; L251-Q254 PolarHBondContact O-N 3.41Å; Q254-Q258 WeakPolarHBondContact O-CB 3.22Å; Q254-Q258 PolarHBondContact O-N 3.3Å |
| 255 | V | 94.7 | Very high | 85.7 | Confident | 85 Ų | 85 | 115.2 Ų | 115.2 | 52% | 0.515 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -69.3 | -37.7 | 176 | 168.5 | 0 | 0 | 0 | 0 | 111.8 | L251 N252 Q253 R259 | L251-V255 WeakPolarHBondContact O-CB 3.35Å; L251-V255 VanDerWaalsContact O-CG2 3.3Å; L251-V255 WeakPolarHBondContact O-CG2 3.36Å; L251-V255 PolarHBondContact O-N 3.14Å; N252-V255 PolarHBondContact O-N 3.02Å; Q253-V255 VanDerWaalsContact C-N 3.32Å; Q253-V255 PolarHBondContact O-N 2.72Å; V255-R259 WeakPolarHBondContact O-CB 3.35Å; V255-R259 PolarHBondContact O-N 3.49Å |
| 256 | L | 92.4 | Very high | 83.5 | Confident | 101 Ų | 101 | 113.3 Ų | 113.3 | 53% | 0.529 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -67.1 | -40.9 | 174.4 | -76.9 | 163.6 | 0 | 0 | 0 | 111.9 | N252 Q253 R259 Q260 | N252-L256 WeakPolarHBondContact O-CB 3Å; N252-L256 VanDerWaalsContact O-CG 3.3Å; N252-L256 WeakPolarHBondContact O-CG 3.37Å; N252-L256 PolarHBondContact O-N 3.5Å; Q253-L256 PolarHBondContact O-N 3.03Å; Q253-L256 VanDerWaalsContact O-N 3.14Å; L256-R259 PolarHBondContact O-N 3.47Å; L256-Q260 WeakPolarHBondContact O-CG 3.42Å; L256-Q260 PolarHBondContact O-N 3.08Å; L256-Q260 PolarHBondContact O-NE2 3.07Å |
| 257 | E | 89 | Confident | 81.3 | Confident | 109 Ų | 109 | 112.6 Ų | 112.6 | 51% | 0.509 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.5 | -47.6 | 173.4 | -71.8 | 178 | 105.1 | 0 | 0 | 111.2 | Q253 R259 Q260 Q261 | Q253-E257 WeakPolarHBondContact O-CG 3.46Å; Q253-E257 PolarHBondContact O-N 3.33Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.43Å; E257-Q260 PolarHBondContact O-N 2.91Å; E257-Q261 WeakPolarHBondContact O-CB 3.47Å; E257-Q261 VanDerWaalsContact O-CG 3.29Å; E257-Q261 WeakPolarHBondContact O-CG 3.32Å; E257-Q261 PolarHBondContact O-N 3.08Å |
| 258 | Q | 87.6 | Confident | 78.6 | Confident | 124 Ų | 124 | 120.9 Ų | 120.9 | 58% | 0.579 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -56.4 | -45.1 | 174.3 | -176.3 | -172.5 | 99.9 | 0 | 0 | 111.4 | Q254 Q260 Q261 Q262 | Q254-Q258 WeakPolarHBondContact O-CB 3.22Å; Q254-Q258 PolarHBondContact O-N 3.3Å; Q258-Q260 VanDerWaalsContact C-N 3.34Å; Q258-Q260 PolarHBondContact O-N 3.47Å; Q258-Q261 CarbonylContact O-C 3.46Å; Q258-Q261 PolarHBondContact O-N 2.97Å; Q258-Q262 WeakPolarHBondContact O-CB 3.48Å; Q258-Q262 PolarHBondContact O-N 2.63Å |
| 259 | R | 86.3 | Confident | 77.7 | Confident | 170 Ų | 170 | 121.6 Ų | 121.6 | 64% | 0.642 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -64.1 | -37.9 | 179.1 | -174.5 | 178.1 | 177.1 | -170.3 | -1.2 | 112.4 | V255 L256 E257 Q262 | V255-R259 WeakPolarHBondContact O-CB 3.35Å; V255-R259 PolarHBondContact O-N 3.49Å; L256-R259 PolarHBondContact O-N 3.47Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.43Å; R259-Q262 PolarHBondContact O-N 3.18Å |
| 260 | Q | 80.9 | Confident | 76.6 | Confident | 144 Ų | 144 | 120.9 Ų | 120.9 | 67% | 0.673 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -67.1 | -41.3 | 173.2 | -72.8 | 177.8 | 108.9 | 0 | 0 | 111.3 | L256 E257 Q258 Q262 F263 P264 | L256-Q260 WeakPolarHBondContact O-CG 3.42Å; L256-Q260 PolarHBondContact O-N 3.08Å; L256-Q260 PolarHBondContact O-NE2 3.07Å; E257-Q260 PolarHBondContact O-N 2.91Å; Q258-Q260 VanDerWaalsContact C-N 3.34Å; Q258-Q260 PolarHBondContact O-N 3.47Å; Q260-Q262 PolarHBondContact O-N 3.37Å; Q260-F263 PolarHBondContact O-N 3.39Å; Q260-F263 VanDerWaalsContact O-N 3.17Å; Q260-P264 WeakPolarHBondContact O-CD 3.25Å |
| 261 | Q | 71.8 | Confident | 75.5 | Confident | 149 Ų | 149 | 123.1 Ų | 123.1 | 70% | 0.696 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -72.7 | -4.2 | 174.7 | -61.7 | -68.9 | 12 | 0 | 0 | 114.1 | E257 Q258 P264 | E257-Q261 WeakPolarHBondContact O-CB 3.47Å; E257-Q261 VanDerWaalsContact O-CG 3.29Å; E257-Q261 WeakPolarHBondContact O-CG 3.32Å; E257-Q261 PolarHBondContact O-N 3.08Å; Q258-Q261 CarbonylContact O-C 3.46Å; Q258-Q261 PolarHBondContact O-N 2.97Å; Q261-P264 WeakPolarHBondContact O-CD 3.2Å; Q261-P264 WeakPolarHBondContact O-CG 3.46Å |
| 262 | Q | 61.7 | Low | 74.2 | Confident | 143 Ų | 143 | 124.9 Ų | 124.9 | 67% | 0.668 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | -6.2 | 170.7 | -162.6 | 166.6 | 13.4 | 0 | 0 | 113.3 | Q258 R259 Q260 P264 | Q258-Q262 WeakPolarHBondContact O-CB 3.48Å; Q258-Q262 PolarHBondContact O-N 2.63Å; R259-Q262 PolarHBondContact O-N 3.18Å; Q260-Q262 PolarHBondContact O-N 3.37Å; Q262-P264 VanDerWaalsContact C-CD 3.42Å |
| 263 | F | 54.7 | Low | 72.8 | Confident | 154 Ų | 154 | 127.6 Ų | 127.6 | 68% | 0.675 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -116.6 | 17.2 | 171.4 | -79.6 | -84.7 | 0 | 0 | 0 | 117.3 | Q260 G265 | Q260-F263 PolarHBondContact O-N 3.39Å; Q260-F263 VanDerWaalsContact O-N 3.17Å; F263-G265 PolarHBondContact O-N 3.21Å |
| 264 | P | 54.3 | Low | 71.3 | Confident | 94 Ų | 94 | 129 Ų | 129 | 61% | 0.61 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -82.7 | 59.5 | 179.4 | 38.7 | -36.7 | 0 | 0 | 0 | 111.4 | Q260 Q261 Q262 | Q260-P264 WeakPolarHBondContact O-CD 3.25Å; Q261-P264 WeakPolarHBondContact O-CD 3.2Å; Q261-P264 WeakPolarHBondContact O-CG 3.46Å; Q262-P264 VanDerWaalsContact C-CD 3.42Å |
| 265 | G | 55.8 | Low | 69.6 | Low | 75 Ų | 75 | 129.4 Ų | 129.4 | 77% | 0.773 | 69% | 0.693 | S | S | * | * | trans | 169.6 | 52.3 | -174.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | F263 | F263-G265 PolarHBondContact O-N 3.21Š| ||
| 266 | A | 51.7 | Low | 67.7 | Low | 94 Ų | 94 | 132.8 Ų | 132.8 | 78% | 0.777 | 71% | 0.707 | S | S | * | * | trans | -135.7 | 37.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 267 | S | 51.5 | Low | 65.6 | Low | 116 Ų | 116 | 135.4 Ų | 135.4 | 81% | 0.811 | 72% | 0.722 | S | S | * | * | trans | -155.8 | 84.4 | 175.9 | -172.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 268 | M | 42.5 | Very low | 63.5 | Low | 253 Ų | 253 | 137.8 Ų | 137.8 | 100% | 1.246 | 74% | 0.741 | S | S | * | * | trans | -166.1 | 0 | 143.4 | -89.9 | -52.6 | -68.9 | 0 | 0 | 107.3 |
Retrieved 268 of 268 residues in 83.9 ms
(Link to these results)