| 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 | 39.3 | Very low | 49.9 | Very low | 252 Ų | 252 | 156.2 Ų | 156.2 | 100% | 1.241 | 81% | 0.806 | S | S | * | * | 0 | 123 | 0 | -64.6 | 171.1 | -177.8 | 0 | 0 | 105.8 | |||||
| 2 | A | 44.4 | Very low | 50.4 | Low | 78 Ų | 78 | 156.8 Ų | 156.8 | 65% | 0.645 | 81% | 0.808 | S | S | * | * | cis | -154.1 | 134.3 | 4 | 0 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 3 | E | 47 | Very low | 50.2 | Low | 181 Ų | 181 | 153.9 Ų | 153.9 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | 85.2 | 102.2 | 113.3 | -73.2 | -173.6 | 97.9 | 0 | 0 | 115 | |||||
| 4 | K | 50.6 | Low | 50.1 | Low | 201 Ų | 201 | 150 Ų | 150 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | trans | -75.8 | 129.3 | 155.2 | -83.6 | 173.6 | 164.6 | 176.9 | 0 | 108.8 | ||||
| 5 | Q | 43.8 | Very low | 50.3 | Low | 153 Ų | 153 | 152.5 Ų | 152.5 | 72% | 0.715 | 81% | 0.811 | S | S | * | * | trans | -141.4 | 108.7 | 153.6 | -77.8 | -65.4 | -27.6 | 0 | 0 | 105.2 | ||||
| 6 | L | 61.7 | Low | 50.3 | Low | 115 Ų | 115 | 154.3 Ų | 154.3 | 60% | 0.602 | 81% | 0.814 | S | S | * | * | 87.8 | 106.5 | 86.1 | -178.2 | 71.9 | 0 | 0 | 0 | 109.5 | |||||
| 7 | E | 50.2 | Low | 50.4 | Low | 182 Ų | 182 | 152.9 Ų | 152.9 | 85% | 0.85 | 81% | 0.813 | S | S | * | * | trans | -150.9 | 131.7 | 138.2 | -86.3 | -53.4 | 108.1 | 0 | 0 | 107.4 | ||||
| 8 | D | 52.3 | Low | 50.7 | Low | 133 Ų | 133 | 156.1 Ų | 156.1 | 71% | 0.711 | 82% | 0.818 | S | S | * | * | trans | -70 | 159.9 | -171.5 | -90.8 | -49.9 | 0 | 0 | 0 | 114.6 | K10 | D8-K10 PolarHBondContact O-N 3.49Š| ||
| 9 | P | 56.8 | Low | 50.8 | Low | 121 Ų | 121 | 157.4 Ų | 157.4 | 79% | 0.786 | 82% | 0.822 | S | S | * | * | trans | -82.6 | 119.6 | -173.5 | 32.5 | -32.4 | 0 | 0 | 0 | 111.4 | ||||
| 10 | K | 54 | Low | 50.7 | Low | 197 Ų | 197 | 160.6 Ų | 160.6 | 86% | 0.857 | 83% | 0.825 | S | S | * | * | trans | -136 | 124.6 | 164.4 | -137 | 171.9 | -170.9 | 164 | 0 | 111.6 | D8 | D8-K10 PolarHBondContact O-N 3.49Š| ||
| 11 | S | 49.2 | Very low | 50.8 | Low | 105 Ų | 105 | 157.6 Ų | 157.6 | 73% | 0.734 | 82% | 0.818 | S | S | * | * | trans | 86.4 | 88.5 | 152.8 | -20.7 | 0 | 0 | 0 | 0 | 116.1 | P13 | S11-P13 WeakPolarHBondContact O-CD 3.45Š| ||
| 12 | I | 56.1 | Low | 51.5 | Low | 164 Ų | 164 | 155 Ų | 155 | 84% | 0.841 | 80% | 0.802 | S | S | * | * | trans | -83 | 118.6 | 154.7 | -60.3 | 171.8 | 0 | 0 | 0 | 107 | ||||
| 13 | P | 47.9 | Very low | 51.9 | Low | 119 Ų | 119 | 157.6 Ų | 157.6 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -87.1 | 105.5 | 162.9 | 29.9 | -21.8 | 0 | 0 | 0 | 108.6 | S11 E15 | S11-P13 WeakPolarHBondContact O-CD 3.45Å; P13-E15 PolarHBondContact O-N 3.22Å | ||
| 14 | A | 48.8 | Very low | 51.9 | Low | 99 Ų | 99 | 157 Ų | 157 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -79.8 | 92.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 15 | E | 52.7 | Low | 51.6 | Low | 187 Ų | 187 | 156 Ų | 156 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | trans | -100.5 | 54.2 | 172.9 | -154.8 | -151.9 | 150.7 | 0 | 0 | 112.1 | P13 | P13-E15 PolarHBondContact O-N 3.22Š| ||
| 16 | Q | 50.7 | Low | 51.6 | Low | 182 Ų | 182 | 152.9 Ų | 152.9 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | -158.2 | 75.9 | 172 | -128.7 | 160.5 | 27.2 | 0 | 0 | 114.1 | ||||
| 17 | T | 51.2 | Low | 51.2 | Low | 131 Ų | 131 | 155.7 Ų | 155.7 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | -160.4 | 70.2 | 145.8 | -36.3 | 0 | 0 | 0 | 0 | 111 | M19 | T17-M19 PolarHBondContact O-N 3.47Š| ||
| 18 | K | 56.8 | Low | 50.9 | Low | 209 Ų | 209 | 157.5 Ų | 157.5 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | -87.6 | 96 | 153.2 | -93.1 | -177.5 | 179.1 | 175.8 | 0 | 106.6 | ||||
| 19 | M | 51.2 | Low | 51.1 | Low | 182 Ų | 182 | 156.9 Ų | 156.9 | 90% | 0.897 | 81% | 0.809 | S | S | * | * | S | Bend | trans | 162.4 | 51.7 | 152.5 | -83.4 | -83.2 | -105.9 | 0 | 0 | 110.5 | T17 | T17-M19 PolarHBondContact O-N 3.47Š|
| 20 | Y | 49.5 | Very low | 50.6 | Low | 221 Ų | 221 | 156.8 Ų | 156.8 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | trans | -166.5 | 76.1 | 154.3 | -153.5 | -98.2 | 0 | 0 | 0 | 110.4 | ||||
| 21 | S | 51.9 | Low | 50.3 | Low | 97 Ų | 97 | 155.5 Ų | 155.5 | 68% | 0.678 | 81% | 0.806 | S | S | * | * | trans | -160.5 | 75.2 | 162.3 | -162.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 22 | Q | 54.9 | Low | 50.3 | Low | 197 Ų | 197 | 156.4 Ų | 156.4 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | trans | -112.2 | 72.7 | 158.3 | -172.6 | 161.2 | -43.2 | 0 | 0 | 107.7 | ||||
| 23 | N | 53.8 | Low | 49.4 | Very low | 134 Ų | 134 | 151.8 Ų | 151.8 | 72% | 0.717 | 80% | 0.802 | S | S | * | * | trans | -164.3 | 59.3 | 154.2 | -123 | -24.5 | 0 | 0 | 0 | 111.4 | F25 | N23-F25 VanDerWaalsContact C-N 3.25Å; N23-F25 PolarHBondContact O-N 2.93Å; N23-F25 VanDerWaalsContact O-N 3.14Å | ||
| 24 | Q | 46.9 | Very low | 49.9 | Very low | 167 Ų | 167 | 155.4 Ų | 155.4 | 78% | 0.78 | 81% | 0.808 | S | S | * | * | trans | -81.2 | 78.6 | 162.6 | -74.2 | -77.7 | 18.5 | 0 | 0 | 108.3 | S26 | Q24-S26 PolarHBondContact O-N 3.15Š| ||
| 25 | F | 43.3 | Very low | 49.8 | Very low | 180 Ų | 180 | 162 Ų | 162 | 79% | 0.789 | 81% | 0.812 | S | S | * | * | trans | -62.5 | 106.1 | 159.7 | -116 | -92 | 0 | 0 | 0 | 106.6 | N23 L27 | N23-F25 VanDerWaalsContact C-N 3.25Å; N23-F25 PolarHBondContact O-N 2.93Å; N23-F25 VanDerWaalsContact O-N 3.14Å; F25-L27 PolarHBondContact O-N 3.05Å; F25-L27 VanDerWaalsContact O-N 3.15Å | ||
| 26 | S | 44.8 | Very low | 49.5 | Very low | 89 Ų | 89 | 161.6 Ų | 161.6 | 62% | 0.622 | 81% | 0.81 | S | S | * | * | trans | -50.3 | 120.7 | 178.1 | -58.3 | 0 | 0 | 0 | 0 | 110.5 | Q24 R28 | Q24-S26 PolarHBondContact O-N 3.15Å; S26-R28 PolarHBondContact O-N 3.14Å | ||
| 27 | L | 53.4 | Low | 49.1 | Very low | 173 Ų | 173 | 158 Ų | 158 | 91% | 0.906 | 81% | 0.805 | S | S | * | * | trans | -64.6 | 85.4 | 157.6 | -70.5 | 167.3 | 0 | 0 | 0 | 107.7 | F25 T29 | F25-L27 PolarHBondContact O-N 3.05Å; F25-L27 VanDerWaalsContact O-N 3.15Å; L27-T29 PolarHBondContact O-N 3.32Å | ||
| 28 | R | 42.3 | Very low | 49.3 | Very low | 221 Ų | 221 | 157.7 Ų | 157.7 | 83% | 0.834 | 80% | 0.803 | S | S | * | * | trans | -88.6 | 94.3 | 164.1 | -77 | -167.6 | -179.4 | -136.8 | 1.8 | 108.2 | S26 P30 | S26-R28 PolarHBondContact O-N 3.14Å; R28-P30 WeakPolarHBondContact O-CD 3.38Å | ||
| 29 | T | 58 | Low | 49.2 | Very low | 119 Ų | 119 | 158.7 Ų | 158.7 | 73% | 0.73 | 80% | 0.801 | S | S | * | * | trans | -55.1 | 123.8 | 160 | -31.6 | 0 | 0 | 0 | 0 | 109 | L27 Q31 | L27-T29 PolarHBondContact O-N 3.32Å; T29-Q31 PolarHBondContact O-N 3.06Å | ||
| 30 | P | 45.4 | Very low | 49.4 | Very low | 120 Ų | 120 | 161 Ų | 161 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | trans | -74.9 | 110 | 170.8 | -13.3 | 29 | 0 | 0 | 0 | 109.4 | R28 | R28-P30 WeakPolarHBondContact O-CD 3.38Š| ||
| 31 | Q | 48.6 | Very low | 49.6 | Very low | 170 Ų | 170 | 157.3 Ų | 157.3 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | trans | -64 | 135.3 | 165.9 | -69.1 | -83.7 | 54.3 | 0 | 0 | 109.7 | T29 G33 | T29-Q31 PolarHBondContact O-N 3.06Å; Q31-G33 PolarHBondContact O-N 3.22Å | ||
| 32 | P | 47.7 | Very low | 49.5 | Very low | 124 Ų | 124 | 158.3 Ų | 158.3 | 81% | 0.805 | 80% | 0.799 | S | S | * | * | trans | -74.4 | 93.8 | 170.2 | 29.4 | -29.7 | 0 | 0 | 0 | 109.2 | H34 | P32-H34 PolarHBondContact O-N 3.37Š| ||
| 33 | G | 38.2 | Very low | 49.3 | Very low | 67 Ų | 67 | 158.4 Ų | 158.4 | 69% | 0.691 | 80% | 0.796 | S | S | * | * | trans | -73 | 110.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | Q31 R35 | Q31-G33 PolarHBondContact O-N 3.22Å; G33-R35 VanDerWaalsContact C-N 3.31Å; G33-R35 PolarHBondContact O-N 3.45Å | ||
| 34 | H | 57.5 | Low | 48.7 | Very low | 195 Ų | 195 | 160.2 Ų | 160.2 | 90% | 0.903 | 80% | 0.798 | S | S | * | * | trans | -65.1 | 88 | 170.7 | -146 | -84.8 | 0 | 0 | 0 | 109.1 | P32 | P32-H34 PolarHBondContact O-N 3.37Š| ||
| 35 | R | 47.6 | Very low | 48.3 | Very low | 238 Ų | 238 | 164.1 Ų | 164.1 | 90% | 0.898 | 81% | 0.806 | S | S | * | * | trans | -94.5 | 110.9 | 179.9 | -150.7 | 172.7 | -168.2 | -105.2 | 2.1 | 108.9 | G33 S37 | G33-R35 VanDerWaalsContact C-N 3.31Å; G33-R35 PolarHBondContact O-N 3.45Å; R35-S37 PolarHBondContact O-N 3.43Å | ||
| 36 | Q | 44.8 | Very low | 48.4 | Very low | 177 Ų | 177 | 160.8 Ų | 160.8 | 83% | 0.827 | 80% | 0.8 | S | S | * | * | trans | -53.4 | 128.8 | 177.6 | -74.8 | 168.9 | 3.3 | 0 | 0 | 110.9 | T38 | Q36-T38 PolarHBondContact O-N 2.76Š| ||
| 37 | S | 44.1 | Very low | 48.7 | Very low | 108 Ų | 108 | 168 Ų | 168 | 76% | 0.755 | 81% | 0.813 | S | S | * | * | trans | -69 | 99.7 | 175.8 | 179.3 | 0 | 0 | 0 | 0 | 109.8 | R35 | R35-S37 PolarHBondContact O-N 3.43Š| ||
| 38 | T | 55 | Low | 48.5 | Very low | 123 Ų | 123 | 164.6 Ų | 164.6 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | trans | -89.3 | 103.6 | 152.4 | 59 | 0 | 0 | 0 | 0 | 106.8 | Q36 R40 | Q36-T38 PolarHBondContact O-N 2.76Å; T38-R40 PolarHBondContact O-N 3.46Å | ||
| 39 | R | 55 | Low | 48.5 | Very low | 230 Ų | 230 | 157 Ų | 157 | 87% | 0.868 | 80% | 0.795 | S | S | * | * | trans | -37.4 | 109.2 | 168.6 | -79.7 | 176.7 | 168.6 | -115.3 | 1.5 | 110 | ||||
| 40 | R | 54.9 | Low | 47.4 | Very low | 232 Ų | 232 | 157.9 Ų | 157.9 | 88% | 0.875 | 80% | 0.804 | S | S | * | * | trans | -102.8 | 118.3 | 152.9 | -82.6 | -162.3 | -80 | -143.3 | -1 | 106.9 | T38 | T38-R40 PolarHBondContact O-N 3.46Š| ||
| 41 | D | 53.9 | Low | 47.4 | Very low | 143 Ų | 143 | 158.7 Ų | 158.7 | 77% | 0.765 | 81% | 0.807 | S | S | * | * | trans | -39.7 | 130 | -178.6 | -67.1 | -91.8 | 0 | 0 | 0 | 113.1 | K43 | D41-K43 PolarHBondContact O-N 3.31Å; D41-K43 VanDerWaalsContact O-N 3.13Å | ||
| 42 | P | 50.1 | Low | 47.4 | Very low | 118 Ų | 118 | 158.8 Ų | 158.8 | 77% | 0.766 | 81% | 0.813 | S | S | * | * | trans | -66.6 | 117.8 | 162.5 | 28.8 | -29.3 | 0 | 0 | 0 | 106.7 | K44 | P42-K44 PolarHBondContact O-N 3.07Š| ||
| 43 | K | 50.2 | Low | 47.4 | Very low | 199 Ų | 199 | 156.1 Ų | 156.1 | 87% | 0.865 | 81% | 0.808 | S | S | * | * | trans | -63.3 | 89.1 | 171.6 | -152.2 | 148.2 | -179.7 | 169.1 | 0 | 107.6 | D41 W45 | D41-K43 PolarHBondContact O-N 3.31Å; D41-K43 VanDerWaalsContact O-N 3.13Å; K43-W45 PolarHBondContact O-N 3.16Å; K43-W45 VanDerWaalsContact O-N 3.09Å | ||
| 44 | K | 41.3 | Very low | 48 | Very low | 172 Ų | 172 | 159.8 Ų | 159.8 | 75% | 0.748 | 82% | 0.816 | S | S | * | * | trans | -47.2 | 108.9 | 171.4 | 51.2 | -176.5 | -176.8 | -75.8 | 0 | 109.3 | P42 V46 | P42-K44 PolarHBondContact O-N 3.07Å; K44-V46 VanDerWaalsContact C-N 3.29Å; K44-V46 HydrophobicContact CD-CG2 4.37Å; K44-V46 HydrophobicContact CG-CG2 4.33Å; K44-V46 PolarHBondContact O-N 3.32Å | ||
| 45 | W | 39.3 | Very low | 47.8 | Very low | 248 Ų | 248 | 158.7 Ų | 158.7 | 94% | 0.939 | 81% | 0.812 | S | S | * | * | trans | -68.6 | 99.8 | 155.7 | -84.5 | 76.4 | 0 | 0 | 0 | 105.7 | K43 R47 | K43-W45 PolarHBondContact O-N 3.16Å; K43-W45 VanDerWaalsContact O-N 3.09Å; W45-R47 PolarHBondContact O-N 3.41Å | ||
| 46 | V | 45.3 | Very low | 47.7 | Very low | 110 Ų | 110 | 152.8 Ų | 152.8 | 67% | 0.667 | 80% | 0.804 | S | S | * | * | trans | -64.2 | 103.2 | 169.9 | 176.3 | 0 | 0 | 0 | 0 | 106 | K44 S48 | K44-V46 VanDerWaalsContact C-N 3.29Å; K44-V46 HydrophobicContact CD-CG2 4.37Å; K44-V46 HydrophobicContact CG-CG2 4.33Å; K44-V46 PolarHBondContact O-N 3.32Å; V46-S48 PolarHBondContact O-N 3Å | ||
| 47 | R | 50 | Low | 48.2 | Very low | 240 Ų | 240 | 149 Ų | 149 | 91% | 0.906 | 80% | 0.797 | S | S | * | * | trans | -69.7 | 87 | 164.8 | -173.1 | -179.5 | -67.3 | -131.9 | 1.2 | 106.2 | W45 | W45-R47 PolarHBondContact O-N 3.41Š| ||
| 48 | S | 49.6 | Very low | 48.8 | Very low | 102 Ų | 102 | 154.2 Ų | 154.2 | 71% | 0.713 | 80% | 0.8 | S | S | * | * | trans | -61.1 | 133.8 | 172.2 | -163.5 | 0 | 0 | 0 | 0 | 108.7 | V46 | V46-S48 PolarHBondContact O-N 3Š| ||
| 49 | G | 41.7 | Very low | 48.6 | Very low | 63 Ų | 63 | 152.4 Ų | 152.4 | 65% | 0.649 | 80% | 0.798 | S | S | * | * | trans | -59.6 | 148.4 | -169.3 | 0 | 0 | 0 | 0 | 0 | 114 | V51 | G49-V51 PolarHBondContact O-N 3.02Š| ||
| 50 | C | 35.9 | Very low | 48.8 | Very low | 136 Ų | 136 | 149.9 Ų | 149.9 | 92% | 0.919 | 80% | 0.798 | S | S | * | * | trans | -74.7 | 105.8 | 165.5 | -47.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 51 | V | 45.1 | Very low | 49 | Very low | 137 Ų | 137 | 147.8 Ų | 147.8 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | trans | -111 | 139.6 | 155.4 | -67.1 | 0 | 0 | 0 | 0 | 107.7 | G49 | G49-V51 PolarHBondContact O-N 3.02Š| ||
| 52 | N | 48 | Very low | 49.2 | Very low | 173 Ų | 173 | 145.1 Ų | 145.1 | 93% | 0.925 | 79% | 0.788 | S | S | * | * | trans | -49.3 | 138.3 | -169 | -58 | -47.2 | 0 | 0 | 0 | 114.1 | ||||
| 53 | G | 48.9 | Very low | 49.8 | Very low | 68 Ų | 68 | 146.2 Ų | 146.2 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | trans | 154.5 | 106.9 | 162.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 54 | V | 50.5 | Low | 50.4 | Low | 143 Ų | 143 | 144.7 Ų | 144.7 | 87% | 0.867 | 78% | 0.778 | S | S | * | * | trans | 62.5 | 112.7 | 152 | -171 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 55 | Q | 52.5 | Low | 52.3 | Low | 172 Ų | 172 | 138.8 Ų | 138.8 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | trans | -47.4 | 132.8 | 168.8 | -68.7 | -87.1 | 29.9 | 0 | 0 | 113.6 | ||||
| 56 | P | 46.7 | Very low | 54.3 | Low | 115 Ų | 115 | 132.2 Ų | 132.2 | 75% | 0.747 | 75% | 0.748 | S | S | * | * | trans | -97 | 101.5 | 148.6 | 25.4 | -11.1 | 0 | 0 | 0 | 108.3 | ||||
| 57 | S | 54.7 | Low | 56.4 | Low | 97 Ų | 97 | 134.1 Ų | 134.1 | 68% | 0.678 | 75% | 0.749 | S | S | * | * | trans | -65.6 | 134.5 | 172 | 71.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 58 | R | 56.1 | Low | 58.4 | Low | 218 Ų | 218 | 125.9 Ų | 125.9 | 82% | 0.823 | 72% | 0.723 | S | S | * | * | trans | 74.2 | 55.3 | 166.5 | -46.2 | -177 | -153.5 | -179.1 | 5.7 | 117.4 | M60 | R58-M60 PolarHBondContact O-N 3.48Å; R58-M60 VanDerWaalsContact O-N 3.16Å | ||
| 59 | A | 52 | Low | 60.5 | Low | 84 Ų | 84 | 123 Ų | 123 | 69% | 0.694 | 71% | 0.706 | S | S | * | * | trans | -65 | 109.9 | 145.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | K61 | A59-K61 PolarHBondContact O-N 2.99Š| ||
| 60 | M | 59 | Low | 63.1 | Low | 178 Ų | 178 | 122.3 Ų | 122.3 | 88% | 0.877 | 69% | 0.694 | S | S | * | * | trans | -56.2 | 89.8 | 168.8 | -66 | -68.2 | -175.5 | 0 | 0 | 108.2 | R58 S62 | R58-M60 PolarHBondContact O-N 3.48Å; R58-M60 VanDerWaalsContact O-N 3.16Å; M60-S62 PolarHBondContact O-N 3.4Å | ||
| 61 | K | 57.9 | Low | 66 | Low | 187 Ų | 187 | 125.3 Ų | 125.3 | 81% | 0.813 | 69% | 0.686 | S | S | * | * | trans | -65.3 | 105.3 | 173.9 | -89.3 | 154.8 | 177.1 | 176.9 | 0 | 106.1 | A59 H63 | A59-K61 PolarHBondContact O-N 2.99Å; K61-H63 PolarHBondContact O-N 2.91Å | ||
| 62 | S | 59.4 | Low | 68.4 | Low | 88 Ų | 88 | 123 Ų | 123 | 62% | 0.615 | 67% | 0.666 | S | S | * | * | trans | -38.4 | 112.9 | 161.5 | 175.1 | 0 | 0 | 0 | 0 | 107.4 | M60 H64 | M60-S62 PolarHBondContact O-N 3.4Å; S62-H64 PolarHBondContact O-N 3.12Å | ||
| 63 | H | 61.2 | Low | 70.8 | Confident | 141 Ų | 141 | 122.5 Ų | 122.5 | 65% | 0.653 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -72 | 24.8 | -168.3 | -156.3 | -78.1 | 0 | 0 | 0 | 112.2 | K61 S65 N68 | K61-H63 PolarHBondContact O-N 2.91Å; H63-S65 PolarHBondContact O-N 3.43Å; H63-S65 VanDerWaalsContact O-N 3.13Å; H63-N68 PolarHBondContact CE1-ND2 2.84Å; H63-N68 VanDerWaalsContact CE1-ND2 3.29Å; H63-N68 PolarHBondContact ND1-ND2 3.38Å; H63-N68 VanDerWaalsContact ND1-ND2 3.14Å |
| 64 | H | 63.2 | Low | 73.1 | Confident | 166 Ų | 166 | 122.5 Ų | 122.5 | 77% | 0.769 | 64% | 0.641 | S | S | * | * | trans | -88.2 | 57.8 | 173.9 | -58.6 | -5 | 0 | 0 | 0 | 108.3 | S62 | S62-H64 PolarHBondContact O-N 3.12Š| ||
| 65 | S | 80.6 | Confident | 75.4 | Confident | 48 Ų | 48 | 122 Ų | 122 | 34% | 0.336 | 62% | 0.623 | S | S | . | * | trans | -61.1 | 136.5 | 162.6 | 178.5 | 0 | 0 | 0 | 0 | 107.9 | H63 E67 N68 A69 | H63-S65 PolarHBondContact O-N 3.43Å; H63-S65 VanDerWaalsContact O-N 3.13Å; S65-E67 PolarHBondContact O-N 2.97Å; S65-E67 PolarHBondContact OG-N 3.47Å; S65-N68 WeakPolarHBondContact O-CB 3.33Å; S65-N68 PolarHBondContact O-N 2.99Å; S65-A69 PolarHBondContact O-N 3.07Å | ||
| 66 | P | 82.8 | Confident | 77.6 | Confident | 111 Ų | 111 | 115.6 Ų | 115.6 | 72% | 0.721 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -53.3 | -27.1 | 175 | 20.8 | -32.8 | 0 | 0 | 0 | 112.6 | A69 A70 | P66-A69 PolarHBondContact O-N 2.93Å; P66-A70 PolarHBondContact O-N 3.46Å |
| 67 | E | 88.9 | Confident | 80 | Confident | 149 Ų | 149 | 118.3 Ų | 118.3 | 70% | 0.696 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -67.1 | -41.6 | 174.3 | -172.7 | 164.4 | -161.7 | 0 | 0 | 113.2 | S65 A69 A70 R71 | S65-E67 PolarHBondContact O-N 2.97Å; S65-E67 PolarHBondContact OG-N 3.47Å; E67-A69 VanDerWaalsContact C-N 3.3Å; E67-A69 PolarHBondContact O-N 3.3Å; E67-A70 PolarHBondContact O-N 3.1Å; E67-R71 PolarHBondContact O-N 3.1Å |
| 68 | N | 92.1 | Very high | 82.1 | Confident | 67 Ų | 67 | 119.4 Ų | 119.4 | 36% | 0.358 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.1 | -39.5 | 174.3 | -80 | 56.4 | 0 | 0 | 0 | 111.5 | H63 S65 R71 E72 | H63-N68 PolarHBondContact CE1-ND2 2.84Å; H63-N68 VanDerWaalsContact CE1-ND2 3.29Å; H63-N68 PolarHBondContact ND1-ND2 3.38Å; H63-N68 VanDerWaalsContact ND1-ND2 3.14Å; S65-N68 WeakPolarHBondContact O-CB 3.33Å; S65-N68 PolarHBondContact O-N 2.99Å; N68-R71 PolarHBondContact O-N 2.74Å; N68-E72 WeakPolarHBondContact O-CB 3.48Å; N68-E72 PolarHBondContact O-N 3.46Å |
| 69 | A | 93.6 | Very high | 84.1 | Confident | 43 Ų | 43 | 113.6 Ų | 113.6 | 36% | 0.355 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.1 | -39.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S65 P66 E67 E72 R73 | S65-A69 PolarHBondContact O-N 3.07Å; P66-A69 PolarHBondContact O-N 2.93Å; E67-A69 VanDerWaalsContact C-N 3.3Å; E67-A69 PolarHBondContact O-N 3.3Å; A69-E72 PolarHBondContact O-N 3.26Å; A69-R73 VanDerWaalsContact O-CG 3.29Å; A69-R73 WeakPolarHBondContact O-CG 3.39Å; A69-R73 PolarHBondContact O-N 3.18Å; A69-R73 VanDerWaalsContact O-N 3.13Å |
| 70 | A | 95.8 | Very high | 86.2 | Confident | 48 Ų | 48 | 117.4 Ų | 117.4 | 40% | 0.397 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.1 | -45.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | P66 E67 E72 R73 S74 | P66-A70 PolarHBondContact O-N 3.46Å; E67-A70 PolarHBondContact O-N 3.1Å; A70-E72 VanDerWaalsContact C-N 3.34Å; A70-E72 PolarHBondContact O-N 3.39Å; A70-R73 PolarHBondContact O-N 3.38Å; A70-S74 PolarHBondContact O-N 2.95Å; A70-S74 VanDerWaalsContact O-N 3.12Å; A70-S74 PolarHBondContact O-OG 3.27Å |
| 71 | R | 96.9 | Very high | 88.1 | Confident | 199 Ų | 199 | 114.8 Ų | 114.8 | 75% | 0.751 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -59.6 | -43.6 | 177 | -172.5 | 177 | 176.8 | -171.2 | -0.6 | 112.1 | E67 N68 R73 S74 R75 | E67-R71 PolarHBondContact O-N 3.1Å; N68-R71 PolarHBondContact O-N 2.74Å; R71-R73 PolarHBondContact O-N 3.45Å; R71-S74 WeakPolarHBondContact O-CB 3.38Å; R71-S74 PolarHBondContact O-N 3.35Å; R71-R75 PolarHBondContact O-N 2.92Å |
| 72 | E | 96.5 | Very high | 89.9 | Confident | 88 Ų | 88 | 108.5 Ų | 108.5 | 41% | 0.411 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.5 | -37.4 | -179.7 | -178.1 | 55.9 | -164.7 | 0 | 0 | 112.2 | N68 A69 A70 S74 R75 V76 | N68-E72 WeakPolarHBondContact O-CB 3.48Å; N68-E72 PolarHBondContact O-N 3.46Å; A69-E72 PolarHBondContact O-N 3.26Å; A70-E72 VanDerWaalsContact C-N 3.34Å; A70-E72 PolarHBondContact O-N 3.39Å; E72-S74 VanDerWaalsContact C-N 3.34Å; E72-S74 PolarHBondContact O-N 3.18Å; E72-R75 VanDerWaalsContact CD-NE 3.35Å; E72-R75 PolarHBondContact O-N 3.4Å; E72-R75 IonicContact OE1-CZ 3.31Å; E72-R75 VanDerWaalsContact OE1-CZ 3.31Å; E72-R75 IonicContact OE1-NE 3.17Å; E72-R75 PolarHBondContact OE1-NE 3.19Å; E72-R75 IonicContact OE1-NH2 2.65Å; E72-R75 PolarHBondContact OE1-NH2 3.02Å; E72-R75 IonicContact OE2-CZ 3.72Å; E72-R75 IonicContact OE2-NE 2.79Å; E72-R75 PolarHBondContact OE2-NE 3.04Å; E72-R75 IonicContact OE2-NH2 3.8Å; E72-V76 WeakPolarHBondContact O-CG2 3.43Å; E72-V76 PolarHBondContact O-N 3.37Å |
| 73 | R | 97.4 | Very high | 91.7 | Very high | 163 Ų | 163 | 106.2 Ų | 106.2 | 62% | 0.615 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.7 | -43.8 | 172.1 | -69.3 | 168.2 | -170.4 | 167.5 | 2.9 | 111.5 | A69 A70 R71 V76 R77 | A69-R73 VanDerWaalsContact O-CG 3.29Å; A69-R73 WeakPolarHBondContact O-CG 3.39Å; A69-R73 PolarHBondContact O-N 3.18Å; A69-R73 VanDerWaalsContact O-N 3.13Å; A70-R73 PolarHBondContact O-N 3.38Å; R71-R73 PolarHBondContact O-N 3.45Å; R73-V76 PolarHBondContact O-N 3.43Å; R73-R77 WeakPolarHBondContact O-CB 3.24Å; R73-R77 VanDerWaalsContact O-CG 3.26Å; R73-R77 WeakPolarHBondContact O-CG 3.4Å; R73-R77 PolarHBondContact O-N 3.47Å |
| 74 | S | 97.9 | Very high | 93.3 | Very high | 68 Ų | 68 | 104.7 Ų | 104.7 | 48% | 0.476 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 177 | -63.7 | 0 | 0 | 0 | 0 | 112.2 | A70 R71 E72 V76 R77 N78 | A70-S74 PolarHBondContact O-N 2.95Å; A70-S74 VanDerWaalsContact O-N 3.12Å; A70-S74 PolarHBondContact O-OG 3.27Å; R71-S74 WeakPolarHBondContact O-CB 3.38Å; R71-S74 PolarHBondContact O-N 3.35Å; E72-S74 VanDerWaalsContact C-N 3.34Å; E72-S74 PolarHBondContact O-N 3.18Å; S74-V76 PolarHBondContact O-N 3.36Å; S74-R77 PolarHBondContact O-N 3.26Å; S74-N78 PolarHBondContact O-N 3.5Å |
| 75 | R | 98.4 | Very high | 94.9 | Very high | 131 Ų | 131 | 100 Ų | 100 | 49% | 0.494 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.3 | -48 | 175.2 | -168.9 | -166.3 | 70.2 | 78 | -1.2 | 111.6 | R71 E72 N78 L79 | R71-R75 PolarHBondContact O-N 2.92Å; E72-R75 VanDerWaalsContact CD-NE 3.35Å; E72-R75 PolarHBondContact O-N 3.4Å; E72-R75 IonicContact OE1-CZ 3.31Å; E72-R75 VanDerWaalsContact OE1-CZ 3.31Å; E72-R75 IonicContact OE1-NE 3.17Å; E72-R75 PolarHBondContact OE1-NE 3.19Å; E72-R75 IonicContact OE1-NH2 2.65Å; E72-R75 PolarHBondContact OE1-NH2 3.02Å; E72-R75 IonicContact OE2-CZ 3.72Å; E72-R75 IonicContact OE2-NE 2.79Å; E72-R75 PolarHBondContact OE2-NE 3.04Å; E72-R75 IonicContact OE2-NH2 3.8Å; R75-N78 PolarHBondContact O-N 3.11Å; R75-L79 PolarHBondContact O-N 2.92Å |
| 76 | V | 98.1 | Very high | 95.6 | Very high | 39 Ų | 39 | 100.8 Ų | 100.8 | 24% | 0.236 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -66 | -38.8 | 178.9 | 172.6 | 0 | 0 | 0 | 0 | 111.6 | E72 R73 S74 L79 R80 | E72-V76 WeakPolarHBondContact O-CG2 3.43Å; E72-V76 PolarHBondContact O-N 3.37Å; R73-V76 PolarHBondContact O-N 3.43Å; S74-V76 PolarHBondContact O-N 3.36Å; V76-L79 PolarHBondContact O-N 3.46Å; V76-R80 VanDerWaalsContact O-CG 3.32Å; V76-R80 WeakPolarHBondContact O-CG 3.49Å; V76-R80 PolarHBondContact O-N 2.95Å |
| 77 | R | 98.1 | Very high | 96.2 | Very high | 171 Ų | 171 | 96 Ų | 96 | 65% | 0.645 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -61.1 | -46.8 | 174.3 | -75.6 | 171.7 | -179.6 | 170.3 | -2.3 | 111.6 | R73 S74 L79 R80 Q81 | R73-R77 WeakPolarHBondContact O-CB 3.24Å; R73-R77 VanDerWaalsContact O-CG 3.26Å; R73-R77 WeakPolarHBondContact O-CG 3.4Å; R73-R77 PolarHBondContact O-N 3.47Å; S74-R77 PolarHBondContact O-N 3.26Å; R77-L79 VanDerWaalsContact C-N 3.35Å; R77-L79 PolarHBondContact O-N 3.15Å; R77-R80 PolarHBondContact O-N 2.71Å; R77-Q81 PolarHBondContact O-N 2.99Å |
| 78 | N | 98.4 | Very high | 96.5 | Very high | 121 Ų | 121 | 90.9 Ų | 90.9 | 65% | 0.647 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -60.7 | -44 | 177.4 | -179.3 | -90.9 | 0 | 0 | 0 | 111.8 | S74 R75 R80 Q81 A82 | S74-N78 PolarHBondContact O-N 3.5Å; R75-N78 PolarHBondContact O-N 3.11Å; N78-R80 PolarHBondContact O-N 2.61Å; N78-Q81 WeakPolarHBondContact O-CB 3.48Å; N78-Q81 PolarHBondContact O-N 3.49Å; N78-A82 PolarHBondContact O-N 3.28Å |
| 79 | L | 98.1 | Very high | 96.6 | Very high | 95 Ų | 95 | 90.7 Ų | 90.7 | 50% | 0.497 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.3 | -44.2 | 175.7 | 177.5 | 61.6 | 0 | 0 | 0 | 112.4 | R75 V76 R77 Q81 A82 F83 | R75-L79 PolarHBondContact O-N 2.92Å; V76-L79 PolarHBondContact O-N 3.46Å; R77-L79 VanDerWaalsContact C-N 3.35Å; R77-L79 PolarHBondContact O-N 3.15Å; L79-Q81 VanDerWaalsContact C-N 3.34Å; L79-A82 PolarHBondContact O-N 2.88Å; L79-F83 WeakPolarHBondContact O-CB 3.45Å; L79-F83 PolarHBondContact O-N 2.71Å |
| 80 | R | 96.6 | Very high | 96.7 | Very high | 165 Ų | 165 | 89.2 Ų | 89.2 | 62% | 0.623 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62 | -44 | 176.1 | -71.3 | 174.2 | -171.2 | -174.1 | 1.7 | 110.9 | V76 R77 N78 A82 F83 H84 | V76-R80 VanDerWaalsContact O-CG 3.32Å; V76-R80 WeakPolarHBondContact O-CG 3.49Å; V76-R80 PolarHBondContact O-N 2.95Å; R77-R80 PolarHBondContact O-N 2.71Å; N78-R80 PolarHBondContact O-N 2.61Å; R80-A82 PolarHBondContact O-N 3.02Å; R80-F83 WeakPolarHBondContact O-CB 3.47Å; R80-F83 PolarHBondContact O-N 3.24Å; R80-H84 PolarHBondContact O-CD2 3.08Å; R80-H84 PolarHBondContact O-N 3.33Å |
| 81 | Q | 97.1 | Very high | 96.3 | Very high | 122 Ų | 122 | 91.3 Ų | 91.3 | 57% | 0.57 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -59.4 | -48.1 | 177.9 | -174.3 | 62 | 28.1 | 0 | 0 | 111.5 | R77 N78 L79 F83 H84 S85 | R77-Q81 PolarHBondContact O-N 2.99Å; N78-Q81 WeakPolarHBondContact O-CB 3.48Å; N78-Q81 PolarHBondContact O-N 3.49Å; L79-Q81 VanDerWaalsContact C-N 3.34Å; Q81-F83 VanDerWaalsContact C-N 3.27Å; Q81-F83 PolarHBondContact O-N 3.11Å; Q81-H84 PolarHBondContact O-N 3.39Å; Q81-S85 PolarHBondContact O-N 2.96Å; Q81-S85 PolarHBondContact O-OG 2.84Å |
| 82 | A | 97.4 | Very high | 95.4 | Very high | 55 Ų | 55 | 86.6 Ų | 86.6 | 46% | 0.455 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.5 | -39.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | N78 L79 R80 S85 L86 | N78-A82 PolarHBondContact O-N 3.28Å; L79-A82 PolarHBondContact O-N 2.88Å; R80-A82 PolarHBondContact O-N 3.02Å; A82-S85 PolarHBondContact O-N 3.03Å; A82-L86 PolarHBondContact O-N 3.33Å |
| 83 | F | 96.9 | Very high | 94.8 | Very high | 41 Ų | 41 | 83.3 Ų | 83.3 | 18% | 0.18 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 176.9 | -171.4 | -91.8 | 0 | 0 | 0 | 112.6 | L79 R80 Q81 L86 Q87 K101 V104 | L79-F83 WeakPolarHBondContact O-CB 3.45Å; L79-F83 PolarHBondContact O-N 2.71Å; R80-F83 WeakPolarHBondContact O-CB 3.47Å; R80-F83 PolarHBondContact O-N 3.24Å; Q81-F83 VanDerWaalsContact C-N 3.27Å; Q81-F83 PolarHBondContact O-N 3.11Å; F83-L86 WeakPolarHBondContact O-CB 3.4Å; F83-L86 PolarHBondContact O-N 3.22Å; F83-Q87 PolarHBondContact O-N 2.93Å; F83-K101 HydrophobicContact CE1-CG 4.43Å; F83-K101 HydrophobicContact CE2-CB 4.23Å; F83-K101 HydrophobicContact CE2-CG 4.12Å; F83-K101 VanDerWaalsContact CZ-CA 3.5Å; F83-K101 HydrophobicContact CZ-CB 4.18Å; F83-K101 HydrophobicContact CZ-CG 3.99Å; F83-V104 HydrophobicContact CE1-CB 4.2Å; F83-V104 HydrophobicContact CE1-CG1 4.38Å; F83-V104 HydrophobicContact CE1-CG2 3.8Å; F83-V104 HydrophobicContact CE2-CB 3.91Å; F83-V104 HydrophobicContact CE2-CG1 3.98Å; F83-V104 HydrophobicContact CE2-CG2 4.41Å; F83-V104 HydrophobicContact CZ-CB 3.4Å; F83-V104 VanDerWaalsContact CZ-CB 3.4Å; F83-V104 HydrophobicContact CZ-CG1 3.77Å; F83-V104 HydrophobicContact CZ-CG2 3.44Å; F83-V104 VanDerWaalsContact CZ-CG2 3.44Å |
| 84 | H | 94.7 | Very high | 93.9 | Very high | 108 Ų | 108 | 79.6 Ų | 79.6 | 50% | 0.5 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -66.8 | -38.1 | 174 | -77 | -127.7 | 0 | 0 | 0 | 111.9 | R80 Q81 L86 Q87 A88 | R80-H84 PolarHBondContact O-CD2 3.08Å; R80-H84 PolarHBondContact O-N 3.33Å; Q81-H84 PolarHBondContact O-N 3.39Å; H84-L86 VanDerWaalsContact C-N 3.31Å; H84-L86 PolarHBondContact O-N 3.28Å; H84-Q87 PolarHBondContact O-N 3.47Å; H84-A88 WeakPolarHBondContact O-CB 3.18Å; H84-A88 PolarHBondContact O-N 2.98Å |
| 85 | S | 95.6 | Very high | 92.7 | Very high | 67 Ų | 67 | 85.4 Ų | 85.4 | 47% | 0.469 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.6 | -40.2 | 173.7 | -63.6 | 0 | 0 | 0 | 0 | 111.9 | Q81 A82 A88 A89 | Q81-S85 PolarHBondContact O-N 2.96Å; Q81-S85 PolarHBondContact O-OG 2.84Å; A82-S85 PolarHBondContact O-N 3.03Å; S85-A88 PolarHBondContact O-N 3.38Å; S85-A89 PolarHBondContact O-N 3.45Å |
| 86 | L | 96.6 | Very high | 91.7 | Very high | 65 Ų | 65 | 86.7 Ų | 86.7 | 34% | 0.34 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.2 | -46.5 | 174.2 | 178.5 | 61.4 | 0 | 0 | 0 | 111.2 | A82 F83 H84 A88 A89 V104 L105 A108 | A82-L86 PolarHBondContact O-N 3.33Å; F83-L86 WeakPolarHBondContact O-CB 3.4Å; F83-L86 PolarHBondContact O-N 3.22Å; H84-L86 VanDerWaalsContact C-N 3.31Å; H84-L86 PolarHBondContact O-N 3.28Å; L86-A88 VanDerWaalsContact C-N 3.3Å; L86-A88 PolarHBondContact O-N 3.03Å; L86-A89 WeakPolarHBondContact O-CB 3.41Å; L86-A89 PolarHBondContact O-N 2.68Å; L86-A89 VanDerWaalsContact O-N 3.1Å; L86-V104 HydrophobicContact CD2-CG1 3.91Å; L86-V104 HydrophobicContact CG-CG1 3.96Å; L86-L105 HydrophobicContact CD2-CD2 4.27Å; L86-A108 HydrophobicContact CD1-CB 3.95Å; L86-A108 HydrophobicContact CD2-CB 4.29Å; L86-A108 HydrophobicContact CG-CB 4.34Å |
| 87 | Q | 95.6 | Very high | 91.2 | Very high | 11 Ų | 11 | 87.5 Ų | 87.5 | 5% | 0.051 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -59.1 | -41.5 | 177.4 | -175.4 | -179.3 | -36.1 | 0 | 0 | 112.1 | F83 H84 A89 L90 V93 P94 T97 L99 V104 | F83-Q87 PolarHBondContact O-N 2.93Å; H84-Q87 PolarHBondContact O-N 3.47Å; Q87-A89 PolarHBondContact O-N 3.14Å; Q87-L90 WeakPolarHBondContact O-CB 3.49Å; Q87-L90 PolarHBondContact O-N 2.64Å; Q87-V93 HydrophobicContact CG-CG1 3.68Å; Q87-P94 PolarHBondContact NE2-O 3.31Å; Q87-T97 PolarHBondContact NE2-O 3.2Å; Q87-L99 HydrophobicContact CG-CD1 4.49Å; Q87-V104 HydrophobicContact CB-CG1 4.38Å; Q87-V104 HydrophobicContact CB-CG2 4.47Å; Q87-V104 HydrophobicContact CG-CG2 4.41Å |
| 88 | A | 94 | Very high | 90.8 | Very high | 42 Ų | 42 | 89.1 Ų | 89.1 | 35% | 0.347 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -68 | -16 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114 | H84 S85 L86 R95 | H84-A88 WeakPolarHBondContact O-CB 3.18Å; H84-A88 PolarHBondContact O-N 2.98Å; S85-A88 PolarHBondContact O-N 3.38Å; L86-A88 VanDerWaalsContact C-N 3.3Å; L86-A88 PolarHBondContact O-N 3.03Å; A88-R95 HydrophobicContact CB-CG 3.98Å |
| 89 | A | 94.4 | Very high | 90.4 | Very high | 62 Ų | 62 | 85.6 Ų | 85.6 | 51% | 0.512 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | -7.1 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | S85 L86 Q87 | S85-A89 PolarHBondContact O-N 3.45Å; L86-A89 WeakPolarHBondContact O-CB 3.41Å; L86-A89 PolarHBondContact O-N 2.68Å; L86-A89 VanDerWaalsContact O-N 3.1Å; Q87-A89 PolarHBondContact O-N 3.14Å |
| 90 | L | 95.3 | Very high | 90.2 | Very high | 12 Ų | 12 | 83.6 Ų | 83.6 | 6% | 0.063 | 45% | 0.452 | C | S | . | . | S | Bend | trans | -81.3 | 133.7 | 178.4 | -61.8 | 176.7 | 0 | 0 | 0 | 110.7 | Q87 S92 V93 V104 L107 A108 | Q87-L90 WeakPolarHBondContact O-CB 3.49Å; Q87-L90 PolarHBondContact O-N 2.64Å; L90-S92 VanDerWaalsContact C-N 3.3Å; L90-S92 PolarHBondContact O-N 2.97Å; L90-V93 HydrophobicContact CB-CB 4.01Å; L90-V93 HydrophobicContact CB-CG2 3.75Å; L90-V93 HydrophobicContact CD1-CG2 3.92Å; L90-V104 HydrophobicContact CD1-CG1 4.28Å; L90-L107 HydrophobicContact CD1-CB 3.8Å; L90-L107 HydrophobicContact CD1-CD1 4.23Å; L90-L107 HydrophobicContact CD2-CB 4.3Å; L90-A108 HydrophobicContact CD2-CB 4.16Å |
| 91 | P | 89.1 | Confident | 90.2 | Very high | 92 Ų | 92 | 83 Ų | 83 | 60% | 0.597 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.1 | -21.4 | -167.8 | 25.7 | -36.3 | 0 | 0 | 0 | 115.2 | Y111 | P91-Y111 HydrophobicContact CB-CE2 4.29Å; P91-Y111 HydrophobicContact CG-CD2 3.75Å; P91-Y111 HydrophobicContact CG-CE2 3.64Å; P91-Y111 HydrophobicContact CG-CG 4.32Å |
| 92 | S | 78.3 | Confident | 90.2 | Very high | 101 Ų | 101 | 82.8 Ų | 82.8 | 71% | 0.706 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122 | 9.8 | -173.1 | 44.2 | 0 | 0 | 0 | 0 | 113.5 | L90 P94 | L90-S92 VanDerWaalsContact C-N 3.3Å; L90-S92 PolarHBondContact O-N 2.97Å; S92-P94 WeakPolarHBondContact O-CD 3.33Å |
| 93 | V | 83.7 | Confident | 90.1 | Very high | 19 Ų | 19 | 83.8 Ų | 83.8 | 12% | 0.115 | 45% | 0.453 | C | S | . | . | trans | -112.3 | 108 | -175.4 | -174.5 | 0 | 0 | 0 | 0 | 110.2 | Q87 L90 L99 L107 | Q87-V93 HydrophobicContact CG-CG1 3.68Å; L90-V93 HydrophobicContact CB-CB 4.01Å; L90-V93 HydrophobicContact CB-CG2 3.75Å; L90-V93 HydrophobicContact CD1-CG2 3.92Å; V93-L99 HydrophobicContact CB-CD1 4.21Å; V93-L99 HydrophobicContact CG1-CD1 3.41Å; V93-L99 VanDerWaalsContact CG1-CD1 3.41Å; V93-L99 HydrophobicContact CG1-CG 4.05Å; V93-L99 HydrophobicContact CG2-CD1 3.72Å; V93-L107 HydrophobicContact CG2-CD1 4.2Å | ||
| 94 | P | 78 | Confident | 90.1 | Very high | 84 Ų | 84 | 81.8 Ų | 81.8 | 55% | 0.545 | 45% | 0.445 | S | S | . | . | trans | -56.9 | 144.3 | 168.1 | -22.8 | 31.1 | 0 | 0 | 0 | 111.6 | Q87 S92 D96 T97 | Q87-P94 PolarHBondContact NE2-O 3.31Å; S92-P94 WeakPolarHBondContact O-CD 3.33Å; P94-D96 PolarHBondContact O-N 3Å; P94-T97 WeakPolarHBondContact CB-OG1 3.19Å; P94-T97 WeakPolarHBondContact CD-OG1 3.3Å; P94-T97 WeakPolarHBondContact O-CB 3.36Å; P94-T97 PolarHBondContact O-N 3.35Å; P94-T97 PolarHBondContact O-OG1 2.98Å | ||
| 95 | R | 73 | Confident | 90.2 | Very high | 191 Ų | 191 | 81.1 Ų | 81.1 | 72% | 0.721 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -21.3 | -174.5 | -62.8 | -177 | -178.6 | -175.8 | 0.6 | 113.9 | A88 | A88-R95 HydrophobicContact CB-CG 3.98Š|
| 96 | D | 76.2 | Confident | 90.2 | Very high | 157 Ų | 157 | 81.6 Ų | 81.6 | 84% | 0.84 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102 | 2.6 | -177.1 | -51.9 | -46.1 | 0 | 0 | 0 | 113 | P94 | P94-D96 PolarHBondContact O-N 3Š|
| 97 | T | 87.8 | Confident | 90.2 | Very high | 56 Ų | 56 | 81.6 Ų | 81.6 | 34% | 0.344 | 44% | 0.444 | S | S | . | . | trans | -72.6 | 133 | 177.1 | -59.2 | 0 | 0 | 0 | 0 | 110.3 | Q87 P94 L99 | Q87-T97 PolarHBondContact NE2-O 3.2Å; P94-T97 WeakPolarHBondContact CB-OG1 3.19Å; P94-T97 WeakPolarHBondContact CD-OG1 3.3Å; P94-T97 WeakPolarHBondContact O-CB 3.36Å; P94-T97 PolarHBondContact O-N 3.35Å; P94-T97 PolarHBondContact O-OG1 2.98Å; T97-L99 HydrophobicContact CG2-CD2 4.18Å; T97-L99 HydrophobicContact CG2-CG 4.23Å; T97-L99 PolarHBondContact O-N 3.23Å; T97-L99 VanDerWaalsContact O-N 3.1Å | ||
| 98 | K | 89.7 | Confident | 90.3 | Very high | 206 Ų | 206 | 81.5 Ų | 81.5 | 90% | 0.896 | 45% | 0.446 | S | S | * | . | trans | -83.3 | 87.7 | 177.1 | -65.2 | -179.6 | 66.1 | -172.6 | 0 | 110.3 | ||||
| 99 | L | 90.3 | Very high | 90.5 | Very high | 47 Ų | 47 | 84 Ų | 84 | 25% | 0.246 | 46% | 0.457 | C | S | . | . | trans | -89.3 | 147.4 | 168.6 | -66.5 | -175.8 | 0 | 0 | 0 | 111.1 | Q87 V93 T97 V104 L107 | Q87-L99 HydrophobicContact CG-CD1 4.49Å; V93-L99 HydrophobicContact CB-CD1 4.21Å; V93-L99 HydrophobicContact CG1-CD1 3.41Å; V93-L99 VanDerWaalsContact CG1-CD1 3.41Å; V93-L99 HydrophobicContact CG1-CG 4.05Å; V93-L99 HydrophobicContact CG2-CD1 3.72Å; T97-L99 HydrophobicContact CG2-CD2 4.18Å; T97-L99 HydrophobicContact CG2-CG 4.23Å; T97-L99 PolarHBondContact O-N 3.23Å; T97-L99 VanDerWaalsContact O-N 3.1Å; L99-V104 HydrophobicContact CB-CG2 3.5Å; L99-V104 VanDerWaalsContact CB-CG2 3.5Å; L99-V104 HydrophobicContact CD1-CG2 3.86Å; L99-V104 HydrophobicContact CG-CG2 4.35Å; L99-L107 HydrophobicContact CD1-CD1 3.79Å | ||
| 100 | S | 95.3 | Very high | 90.6 | Very high | 53 Ų | 53 | 86.3 Ų | 86.3 | 37% | 0.371 | 46% | 0.46 | S | S | . | . | trans | -71 | 161 | 171.9 | 85 | 0 | 0 | 0 | 0 | 110.5 | L102 D103 V104 | S100-L102 PolarHBondContact O-N 3.19Å; S100-L102 PolarHBondContact OG-N 3.47Å; S100-D103 WeakPolarHBondContact CB-OD2 3.43Å; S100-D103 PolarHBondContact N-OD2 3.45Å; S100-D103 PolarHBondContact O-N 3.03Å; S100-D103 PolarHBondContact OG-N 3.43Å; S100-D103 VanDerWaalsContact OG-N 3.11Å; S100-D103 PolarHBondContact OG-OD1 2.94Å; S100-D103 PolarHBondContact OG-OD2 3.22Å; S100-V104 WeakPolarHBondContact O-CG2 3.43Å; S100-V104 PolarHBondContact O-N 3.48Å | ||
| 101 | K | 95.6 | Very high | 90.7 | Very high | 153 Ų | 153 | 89.3 Ų | 89.3 | 67% | 0.665 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -57.3 | -36.2 | 175.1 | -73.1 | -175.3 | -176.5 | 176.1 | 0 | 112.9 | F83 L105 | F83-K101 HydrophobicContact CE1-CG 4.43Å; F83-K101 HydrophobicContact CE2-CB 4.23Å; F83-K101 HydrophobicContact CE2-CG 4.12Å; F83-K101 VanDerWaalsContact CZ-CA 3.5Å; F83-K101 HydrophobicContact CZ-CB 4.18Å; F83-K101 HydrophobicContact CZ-CG 3.99Å; K101-L105 WeakPolarHBondContact O-CD1 3.19Å; K101-L105 WeakPolarHBondContact O-CG 3.44Å; K101-L105 PolarHBondContact O-N 2.89Å |
| 102 | L | 97.3 | Very high | 91.1 | Very high | 117 Ų | 117 | 90.1 Ų | 90.1 | 61% | 0.613 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -71.2 | -48 | 179.6 | -178.5 | 60.8 | 0 | 0 | 0 | 110.4 | S100 V104 L105 V106 | S100-L102 PolarHBondContact O-N 3.19Å; S100-L102 PolarHBondContact OG-N 3.47Å; L102-V104 VanDerWaalsContact C-N 3.34Å; L102-V104 PolarHBondContact O-N 3.16Å; L102-L105 WeakPolarHBondContact O-CB 3.4Å; L102-L105 PolarHBondContact O-N 2.93Å; L102-V106 HydrophobicContact CD1-CG2 4.11Å; L102-V106 HydrophobicContact CG-CG2 4.24Å; L102-V106 WeakPolarHBondContact O-CG2 3.43Å; L102-V106 PolarHBondContact O-N 3.26Å |
| 103 | D | 95.5 | Very high | 91.9 | Very high | 75 Ų | 75 | 87.9 Ų | 87.9 | 40% | 0.401 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.4 | -43.6 | -176.1 | -56.1 | -36.4 | 0 | 0 | 0 | 111.7 | S100 L105 V106 L107 | S100-D103 WeakPolarHBondContact CB-OD2 3.43Å; S100-D103 PolarHBondContact N-OD2 3.45Å; S100-D103 PolarHBondContact O-N 3.03Å; S100-D103 PolarHBondContact OG-N 3.43Å; S100-D103 VanDerWaalsContact OG-N 3.11Å; S100-D103 PolarHBondContact OG-OD1 2.94Å; S100-D103 PolarHBondContact OG-OD2 3.22Å; D103-L105 VanDerWaalsContact C-N 3.29Å; D103-L105 PolarHBondContact O-N 3.36Å; D103-V106 PolarHBondContact O-N 3.47Å; D103-L107 WeakPolarHBondContact O-CB 3.2Å; D103-L107 VanDerWaalsContact O-CG 3.24Å; D103-L107 WeakPolarHBondContact O-CG 3.46Å; D103-L107 PolarHBondContact O-N 2.93Å |
| 104 | V | 96.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 91.9 Ų | 91.9 | 0% | 0 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -60.3 | -41 | 175.8 | 176.3 | 0 | 0 | 0 | 0 | 111.4 | F83 L86 Q87 L90 L99 S100 L102 A108 | F83-V104 HydrophobicContact CE1-CB 4.2Å; F83-V104 HydrophobicContact CE1-CG1 4.38Å; F83-V104 HydrophobicContact CE1-CG2 3.8Å; F83-V104 HydrophobicContact CE2-CB 3.91Å; F83-V104 HydrophobicContact CE2-CG1 3.98Å; F83-V104 HydrophobicContact CE2-CG2 4.41Å; F83-V104 HydrophobicContact CZ-CB 3.4Å; F83-V104 VanDerWaalsContact CZ-CB 3.4Å; F83-V104 HydrophobicContact CZ-CG1 3.77Å; F83-V104 HydrophobicContact CZ-CG2 3.44Å; F83-V104 VanDerWaalsContact CZ-CG2 3.44Å; L86-V104 HydrophobicContact CD2-CG1 3.91Å; L86-V104 HydrophobicContact CG-CG1 3.96Å; Q87-V104 HydrophobicContact CB-CG1 4.38Å; Q87-V104 HydrophobicContact CB-CG2 4.47Å; Q87-V104 HydrophobicContact CG-CG2 4.41Å; L90-V104 HydrophobicContact CD1-CG1 4.28Å; L99-V104 HydrophobicContact CB-CG2 3.5Å; L99-V104 VanDerWaalsContact CB-CG2 3.5Å; L99-V104 HydrophobicContact CD1-CG2 3.86Å; L99-V104 HydrophobicContact CG-CG2 4.35Å; S100-V104 WeakPolarHBondContact O-CG2 3.43Å; S100-V104 PolarHBondContact O-N 3.48Å; L102-V104 VanDerWaalsContact C-N 3.34Å; L102-V104 PolarHBondContact O-N 3.16Å; V104-A108 WeakPolarHBondContact O-CB 3.46Å; V104-A108 PolarHBondContact O-N 2.82Å |
| 105 | L | 97.6 | Very high | 93.4 | Very high | 93 Ų | 93 | 91.2 Ų | 91.2 | 49% | 0.487 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -67.3 | -42.4 | 179.1 | -68.3 | 172.9 | 0 | 0 | 0 | 111.3 | L86 K101 L102 D103 A108 T109 | L86-L105 HydrophobicContact CD2-CD2 4.27Å; K101-L105 WeakPolarHBondContact O-CD1 3.19Å; K101-L105 WeakPolarHBondContact O-CG 3.44Å; K101-L105 PolarHBondContact O-N 2.89Å; L102-L105 WeakPolarHBondContact O-CB 3.4Å; L102-L105 PolarHBondContact O-N 2.93Å; D103-L105 VanDerWaalsContact C-N 3.29Å; D103-L105 PolarHBondContact O-N 3.36Å; L105-A108 PolarHBondContact O-N 3.42Å; L105-T109 WeakPolarHBondContact O-CG2 3.49Å; L105-T109 PolarHBondContact O-N 3.34Å; L105-T109 PolarHBondContact O-OG1 3.47Å |
| 106 | V | 96.1 | Very high | 94.5 | Very high | 78 Ų | 78 | 86.4 Ų | 86.4 | 47% | 0.473 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.1 | -50.2 | 177 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | L102 D103 A108 T109 D110 | L102-V106 HydrophobicContact CD1-CG2 4.11Å; L102-V106 HydrophobicContact CG-CG2 4.24Å; L102-V106 WeakPolarHBondContact O-CG2 3.43Å; L102-V106 PolarHBondContact O-N 3.26Å; D103-V106 PolarHBondContact O-N 3.47Å; V106-A108 VanDerWaalsContact C-N 3.3Å; V106-A108 PolarHBondContact O-N 3Å; V106-T109 PolarHBondContact O-N 3.37Å; V106-T109 PolarHBondContact O-OG1 3.29Å; V106-D110 PolarHBondContact O-N 3.19Å |
| 107 | L | 96.3 | Very high | 95.3 | Very high | 64 Ų | 64 | 84.3 Ų | 84.3 | 34% | 0.335 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.3 | -38.1 | 177.9 | -71.1 | 170.9 | 0 | 0 | 0 | 112.1 | L90 V93 L99 D103 D110 Y111 | L90-L107 HydrophobicContact CD1-CB 3.8Å; L90-L107 HydrophobicContact CD1-CD1 4.23Å; L90-L107 HydrophobicContact CD2-CB 4.3Å; V93-L107 HydrophobicContact CG2-CD1 4.2Å; L99-L107 HydrophobicContact CD1-CD1 3.79Å; D103-L107 WeakPolarHBondContact O-CB 3.2Å; D103-L107 VanDerWaalsContact O-CG 3.24Å; D103-L107 WeakPolarHBondContact O-CG 3.46Å; D103-L107 PolarHBondContact O-N 2.93Å; L107-D110 PolarHBondContact O-N 2.92Å; L107-Y111 WeakPolarHBondContact O-CB 3.47Å; L107-Y111 PolarHBondContact O-N 3.41Å |
| 108 | A | 97.5 | Very high | 95.7 | Very high | 10 Ų | 10 | 85 Ų | 85 | 8% | 0.083 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -64.9 | -42.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L86 L90 V104 L105 V106 D110 Y111 I112 | L86-A108 HydrophobicContact CD1-CB 3.95Å; L86-A108 HydrophobicContact CD2-CB 4.29Å; L86-A108 HydrophobicContact CG-CB 4.34Å; L90-A108 HydrophobicContact CD2-CB 4.16Å; V104-A108 WeakPolarHBondContact O-CB 3.46Å; V104-A108 PolarHBondContact O-N 2.82Å; L105-A108 PolarHBondContact O-N 3.42Å; V106-A108 VanDerWaalsContact C-N 3.3Å; V106-A108 PolarHBondContact O-N 3Å; A108-D110 VanDerWaalsContact C-N 3.35Å; A108-Y111 PolarHBondContact O-N 2.98Å; A108-I112 VanDerWaalsContact O-CG1 3.3Å; A108-I112 WeakPolarHBondContact O-CG1 3.49Å; A108-I112 PolarHBondContact O-N 2.75Å |
| 109 | T | 97.6 | Very high | 95.9 | Very high | 94 Ų | 94 | 81.8 Ų | 81.8 | 58% | 0.577 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -64.5 | -40.3 | 177.2 | 49.2 | 0 | 0 | 0 | 0 | 112.4 | L105 V106 I112 A113 | L105-T109 WeakPolarHBondContact O-CG2 3.49Å; L105-T109 PolarHBondContact O-N 3.34Å; L105-T109 PolarHBondContact O-OG1 3.47Å; V106-T109 PolarHBondContact O-N 3.37Å; V106-T109 PolarHBondContact O-OG1 3.29Å; T109-I112 PolarHBondContact O-N 3.33Å; T109-A113 PolarHBondContact O-N 3.21Å; T109-A113 VanDerWaalsContact O-N 3.15Å |
| 110 | D | 96.6 | Very high | 95.8 | Very high | 111 Ų | 111 | 85.1 Ų | 85.1 | 59% | 0.594 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -64.2 | -44.2 | 175.9 | -173.6 | 64.4 | 0 | 0 | 0 | 111.4 | V106 L107 A108 I112 A113 H114 | V106-D110 PolarHBondContact O-N 3.19Å; L107-D110 PolarHBondContact O-N 2.92Å; A108-D110 VanDerWaalsContact C-N 3.35Å; D110-I112 PolarHBondContact O-N 3.13Å; D110-A113 WeakPolarHBondContact O-CB 3.32Å; D110-A113 PolarHBondContact O-N 3.48Å; D110-A113 VanDerWaalsContact O-N 3.12Å; D110-H114 PolarHBondContact O-N 2.79Å |
| 111 | Y | 97.3 | Very high | 95 | Very high | 74 Ų | 74 | 89.4 Ų | 89.4 | 29% | 0.29 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.8 | -39.5 | 178.8 | -175.3 | -129.6 | 0 | 0 | 0 | 113.1 | P91 L107 A108 A113 H114 L115 | P91-Y111 HydrophobicContact CB-CE2 4.29Å; P91-Y111 HydrophobicContact CG-CD2 3.75Å; P91-Y111 HydrophobicContact CG-CE2 3.64Å; P91-Y111 HydrophobicContact CG-CG 4.32Å; L107-Y111 WeakPolarHBondContact O-CB 3.47Å; L107-Y111 PolarHBondContact O-N 3.41Å; A108-Y111 PolarHBondContact O-N 2.98Å; Y111-A113 VanDerWaalsContact C-N 3.31Å; Y111-A113 PolarHBondContact O-N 2.65Å; Y111-H114 PolarHBondContact O-N 3.17Å; Y111-L115 HydrophobicContact CD1-CD1 4.17Å; Y111-L115 HydrophobicContact CD2-CG 4.23Å; Y111-L115 HydrophobicContact CE1-CD1 3.69Å; Y111-L115 HydrophobicContact CE1-CG 4.37Å; Y111-L115 HydrophobicContact CE2-CD1 4.05Å; Y111-L115 HydrophobicContact CE2-CD2 3.92Å; Y111-L115 HydrophobicContact CE2-CG 3.83Å; Y111-L115 WeakPolarHBondContact O-CG 3.26Å; Y111-L115 PolarHBondContact O-N 2.84Å |
| 112 | I | 96.9 | Very high | 93.6 | Very high | 109 Ų | 109 | 85.4 Ų | 85.4 | 56% | 0.559 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -60.4 | -42.9 | 173 | -68.4 | 165.2 | 0 | 0 | 0 | 110.5 | A108 T109 D110 L115 T116 | A108-I112 VanDerWaalsContact O-CG1 3.3Å; A108-I112 WeakPolarHBondContact O-CG1 3.49Å; A108-I112 PolarHBondContact O-N 2.75Å; T109-I112 PolarHBondContact O-N 3.33Å; D110-I112 PolarHBondContact O-N 3.13Å; I112-L115 PolarHBondContact O-N 3.29Å; I112-T116 WeakPolarHBondContact O-CB 3.44Å; I112-T116 PolarHBondContact O-N 2.95Å; I112-T116 PolarHBondContact O-OG1 3.46Å |
| 113 | A | 96.3 | Very high | 91.9 | Very high | 54 Ų | 54 | 81.6 Ų | 81.6 | 45% | 0.446 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.3 | -48 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | T109 D110 Y111 L115 T116 E117 | T109-A113 PolarHBondContact O-N 3.21Å; T109-A113 VanDerWaalsContact O-N 3.15Å; D110-A113 WeakPolarHBondContact O-CB 3.32Å; D110-A113 PolarHBondContact O-N 3.48Å; D110-A113 VanDerWaalsContact O-N 3.12Å; Y111-A113 VanDerWaalsContact C-N 3.31Å; Y111-A113 PolarHBondContact O-N 2.65Å; A113-L115 PolarHBondContact O-N 3.43Å; A113-T116 WeakPolarHBondContact O-CB 3.46Å; A113-T116 PolarHBondContact O-N 3.02Å; A113-T116 VanDerWaalsContact O-N 3.11Å; A113-E117 PolarHBondContact O-N 3.06Å |
| 114 | H | 96.1 | Very high | 89.8 | Confident | 104 Ų | 104 | 84.3 Ų | 84.3 | 48% | 0.481 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -56.9 | -46.7 | 177.1 | 174.8 | -83.5 | 0 | 0 | 0 | 112.5 | D110 Y111 T116 E117 T118 | D110-H114 PolarHBondContact O-N 2.79Å; Y111-H114 PolarHBondContact O-N 3.17Å; H114-T116 VanDerWaalsContact C-N 3.32Å; H114-T116 PolarHBondContact O-N 2.69Å; H114-E117 PolarHBondContact O-N 3.43Å; H114-T118 PolarHBondContact CE1-OG1 3.42Å; H114-T118 WeakPolarHBondContact O-CB 3.23Å; H114-T118 PolarHBondContact O-N 3.42Å; H114-T118 PolarHBondContact O-OG1 2.93Å |
| 115 | L | 96.1 | Very high | 88 | Confident | 70 Ų | 70 | 92.5 Ų | 92.5 | 37% | 0.366 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.8 | -37.1 | 177.1 | -69.3 | 179.2 | 0 | 0 | 0 | 112 | Y111 I112 A113 T118 L119 | Y111-L115 HydrophobicContact CD1-CD1 4.17Å; Y111-L115 HydrophobicContact CD2-CG 4.23Å; Y111-L115 HydrophobicContact CE1-CD1 3.69Å; Y111-L115 HydrophobicContact CE1-CG 4.37Å; Y111-L115 HydrophobicContact CE2-CD1 4.05Å; Y111-L115 HydrophobicContact CE2-CD2 3.92Å; Y111-L115 HydrophobicContact CE2-CG 3.83Å; Y111-L115 WeakPolarHBondContact O-CG 3.26Å; Y111-L115 PolarHBondContact O-N 2.84Å; I112-L115 PolarHBondContact O-N 3.29Å; A113-L115 PolarHBondContact O-N 3.43Å; L115-T118 PolarHBondContact O-N 3.12Å; L115-L119 WeakPolarHBondContact O-CB 3.38Å; L115-L119 WeakPolarHBondContact O-CG 3.5Å; L115-L119 PolarHBondContact O-N 3.23Å |
| 116 | T | 95.9 | Very high | 85.8 | Confident | 89 Ų | 89 | 91.8 Ų | 91.8 | 55% | 0.546 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64 | -46.3 | 178.4 | -55.5 | 0 | 0 | 0 | 0 | 110.9 | I112 A113 H114 L119 D120 | I112-T116 WeakPolarHBondContact O-CB 3.44Å; I112-T116 PolarHBondContact O-N 2.95Å; I112-T116 PolarHBondContact O-OG1 3.46Å; A113-T116 WeakPolarHBondContact O-CB 3.46Å; A113-T116 PolarHBondContact O-N 3.02Å; A113-T116 VanDerWaalsContact O-N 3.11Å; H114-T116 VanDerWaalsContact C-N 3.32Å; H114-T116 PolarHBondContact O-N 2.69Å; T116-L119 PolarHBondContact O-N 3.48Å; T116-D120 WeakPolarHBondContact O-CB 3.29Å; T116-D120 PolarHBondContact O-N 3.31Å |
| 117 | E | 94 | Very high | 83.4 | Confident | 114 Ų | 114 | 97.4 Ų | 97.4 | 53% | 0.533 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64 | -44.5 | 175.9 | 174.8 | 176.5 | -165.6 | 0 | 0 | 111.8 | A113 H114 L119 D120 Q121 | A113-E117 PolarHBondContact O-N 3.06Å; H114-E117 PolarHBondContact O-N 3.43Å; E117-L119 VanDerWaalsContact C-N 3.26Å; E117-L119 PolarHBondContact O-N 3.41Å; E117-D120 PolarHBondContact O-N 2.98Å; E117-D120 VanDerWaalsContact O-N 3.16Å; E117-Q121 HydrophobicContact CG-CG 4.41Å; E117-Q121 WeakPolarHBondContact O-CG 3.37Å; E117-Q121 PolarHBondContact O-N 3.13Å; E117-Q121 PolarHBondContact OE1-NE2 2.95Å |
| 118 | T | 95.2 | Very high | 81.4 | Confident | 71 Ų | 71 | 100.2 Ų | 100.2 | 44% | 0.436 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -59.9 | -38.5 | 178.5 | -56.8 | 0 | 0 | 0 | 0 | 111.6 | H114 L115 G122 | H114-T118 PolarHBondContact CE1-OG1 3.42Å; H114-T118 WeakPolarHBondContact O-CB 3.23Å; H114-T118 PolarHBondContact O-N 3.42Å; H114-T118 PolarHBondContact O-OG1 2.93Å; L115-T118 PolarHBondContact O-N 3.12Å; T118-G122 PolarHBondContact O-N 3.05Å |
| 119 | L | 94.4 | Very high | 79 | Confident | 137 Ų | 137 | 105.5 Ų | 105.5 | 72% | 0.717 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -73 | -33.9 | 177.8 | -69.9 | 171.7 | 0 | 0 | 0 | 112.5 | L115 T116 E117 G122 | L115-L119 WeakPolarHBondContact O-CB 3.38Å; L115-L119 WeakPolarHBondContact O-CG 3.5Å; L115-L119 PolarHBondContact O-N 3.23Å; T116-L119 PolarHBondContact O-N 3.48Å; E117-L119 VanDerWaalsContact C-N 3.26Å; E117-L119 PolarHBondContact O-N 3.41Å; L119-G122 PolarHBondContact O-N 3.49Å |
| 120 | D | 88.6 | Confident | 77.1 | Confident | 117 Ų | 117 | 107.3 Ų | 107.3 | 63% | 0.626 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.3 | -39.6 | 177.9 | -167.9 | 57.2 | 0 | 0 | 0 | 112.2 | T116 E117 G122 | T116-D120 WeakPolarHBondContact O-CB 3.29Å; T116-D120 PolarHBondContact O-N 3.31Å; E117-D120 PolarHBondContact O-N 2.98Å; E117-D120 VanDerWaalsContact O-N 3.16Å; D120-G122 PolarHBondContact O-N 3.13Å |
| 121 | Q | 78.8 | Confident | 74.9 | Confident | 143 Ų | 143 | 106.8 Ų | 106.8 | 67% | 0.668 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.5 | -20.9 | 175.7 | -66 | 175.8 | 15.9 | 0 | 0 | 113.3 | E117 | E117-Q121 HydrophobicContact CG-CG 4.41Å; E117-Q121 WeakPolarHBondContact O-CG 3.37Å; E117-Q121 PolarHBondContact O-N 3.13Å; E117-Q121 PolarHBondContact OE1-NE2 2.95Å |
| 122 | G | 65.9 | Low | 72.8 | Confident | 69 Ų | 69 | 109 Ų | 109 | 71% | 0.711 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 0.3 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | T118 L119 D120 | T118-G122 PolarHBondContact O-N 3.05Å; L119-G122 PolarHBondContact O-N 3.49Å; D120-G122 PolarHBondContact O-N 3.13Å |
| 123 | G | 61.7 | Low | 70.8 | Confident | 37 Ų | 37 | 113.4 Ų | 113.4 | 38% | 0.381 | 64% | 0.64 | S | S | . | * | trans | -158.6 | 130.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | L125 | G123-L125 VanDerWaalsContact C-N 3.28Å; G123-L125 PolarHBondContact O-N 2.78Å | ||
| 124 | P | 51.7 | Low | 68.5 | Low | 132 Ų | 132 | 114.8 Ų | 114.8 | 86% | 0.857 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -81.8 | 71.5 | 170.9 | 34.7 | -33.6 | 0 | 0 | 0 | 109.9 | ||
| 125 | L | 57.1 | Low | 66.4 | Low | 172 Ų | 172 | 114.2 Ų | 114.2 | 90% | 0.901 | 67% | 0.674 | S | S | * | * | trans | -153.5 | 64.6 | 166.3 | -79.5 | -166.3 | 0 | 0 | 0 | 112 | G123 | G123-L125 VanDerWaalsContact C-N 3.28Å; G123-L125 PolarHBondContact O-N 2.78Å | ||
| 126 | S | 51 | Low | 64.3 | Low | 78 Ų | 78 | 113.4 Ų | 113.4 | 55% | 0.545 | 68% | 0.683 | S | S | . | * | trans | -146.7 | 56.5 | 154 | -141.3 | 0 | 0 | 0 | 0 | 111.3 | L128 | S126-L128 PolarHBondContact O-N 3.14Š| ||
| 127 | E | 46.2 | Very low | 62.5 | Low | 196 Ų | 196 | 118.4 Ų | 118.4 | 92% | 0.916 | 69% | 0.693 | S | S | * | * | trans | -75.1 | 61.6 | 154.1 | -164.3 | 175.4 | -179.5 | 0 | 0 | 108.7 | ||||
| 128 | L | 54.8 | Low | 60.6 | Low | 123 Ų | 123 | 120.5 Ų | 120.5 | 64% | 0.644 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -119.3 | 114.8 | 154.7 | -139.3 | 94.6 | 0 | 0 | 0 | 104.1 | S126 L130 | S126-L128 PolarHBondContact O-N 3.14Å; L128-L130 PolarHBondContact O-N 3.29Å |
| 129 | P | 47.4 | Very low | 58.8 | Low | 122 Ų | 122 | 123.6 Ų | 123.6 | 79% | 0.792 | 72% | 0.717 | S | S | * | * | trans | -59 | 91.1 | 176 | -23 | 33.1 | 0 | 0 | 0 | 109.4 | P131 | P129-P131 WeakPolarHBondContact O-CD 3.15Š| ||
| 130 | L | 56.4 | Low | 57.1 | Low | 131 Ų | 131 | 122 Ų | 122 | 69% | 0.686 | 72% | 0.715 | S | S | * | * | trans | -65.5 | 118.1 | 166.7 | -64.6 | -176.4 | 0 | 0 | 0 | 104.7 | L128 | L128-L130 PolarHBondContact O-N 3.29Š| ||
| 131 | P | 51.6 | Low | 55.5 | Low | 100 Ų | 100 | 120.3 Ų | 120.3 | 65% | 0.649 | 71% | 0.708 | S | S | * | * | trans | -56.2 | 146.6 | -178.8 | 23.2 | -32.3 | 0 | 0 | 0 | 108.5 | P129 R133 | P129-P131 WeakPolarHBondContact O-CD 3.15Å; P131-R133 PolarHBondContact O-N 2.99Å | ||
| 132 | P | 53.1 | Low | 54.6 | Low | 122 Ų | 122 | 121.2 Ų | 121.2 | 79% | 0.792 | 71% | 0.71 | S | S | * | * | trans | -45.8 | 119.9 | 178.3 | -23.9 | 30.5 | 0 | 0 | 0 | 107.5 | A134 | P132-A134 PolarHBondContact O-N 3.45Š| ||
| 133 | R | 55.2 | Low | 54.5 | Low | 200 Ų | 200 | 126.6 Ų | 126.6 | 76% | 0.755 | 71% | 0.713 | S | S | * | * | trans | -64.8 | 76.8 | 173.5 | -81.4 | -78.5 | -179 | 141.4 | -2.7 | 107.1 | P131 G135 Y137 | P131-R133 PolarHBondContact O-N 2.99Å; R133-G135 PolarHBondContact O-N 3.48Å; R133-G135 VanDerWaalsContact O-N 3.14Å; R133-Y137 VanDerWaalsContact NH1-CE2 3.27Å; R133-Y137 PolarHBondContact NH1-OH 3.09Å | ||
| 134 | A | 47.6 | Very low | 54.3 | Low | 84 Ų | 84 | 132.6 Ų | 132.6 | 69% | 0.694 | 73% | 0.725 | S | S | * | * | trans | -57.8 | 117.5 | 170.2 | 0 | 0 | 0 | 0 | 0 | 106.3 | P132 G136 | P132-A134 PolarHBondContact O-N 3.45Å; A134-G136 PolarHBondContact O-N 2.75Å | ||
| 135 | G | 52.7 | Low | 54.9 | Low | 91 Ų | 91 | 130.9 Ų | 130.9 | 94% | 0.938 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -53.6 | 94.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | R133 | R133-G135 PolarHBondContact O-N 3.48Å; R133-G135 VanDerWaalsContact O-N 3.14Å |
| 136 | G | 51.1 | Low | 55 | Low | 54 Ų | 54 | 129.3 Ų | 129.3 | 56% | 0.557 | 70% | 0.703 | S | S | * | * | trans | -161.9 | 33.1 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | A134 L138 | A134-G136 PolarHBondContact O-N 2.75Å; G136-L138 PolarHBondContact O-N 2.94Å; G136-L138 VanDerWaalsContact O-N 3.16Å | ||
| 137 | Y | 58.2 | Low | 55.4 | Low | 193 Ų | 193 | 134.8 Ų | 134.8 | 76% | 0.757 | 71% | 0.712 | S | S | * | * | trans | -84.3 | 38.4 | 170.8 | -87.3 | -82.5 | 0 | 0 | 0 | 113.5 | R133 | R133-Y137 VanDerWaalsContact NH1-CE2 3.27Å; R133-Y137 PolarHBondContact NH1-OH 3.09Å | ||
| 138 | L | 54.8 | Low | 56.1 | Low | 159 Ų | 159 | 129.7 Ų | 129.7 | 83% | 0.832 | 70% | 0.698 | S | S | * | * | trans | -144.9 | 74.4 | 159.8 | -82.1 | 176.3 | 0 | 0 | 0 | 107.8 | G136 P140 | G136-L138 PolarHBondContact O-N 2.94Å; G136-L138 VanDerWaalsContact O-N 3.16Å; L138-P140 VanDerWaalsContact O-CD 3.23Å; L138-P140 WeakPolarHBondContact O-CD 3.08Å | ||
| 139 | H | 56.2 | Low | 56.5 | Low | 136 Ų | 136 | 129.7 Ų | 129.7 | 63% | 0.63 | 70% | 0.698 | S | S | * | * | trans | -67.8 | 113.3 | 155.2 | -155 | -106.8 | 0 | 0 | 0 | 105.4 | V141 | H139-V141 VanDerWaalsContact C-N 3.32Å; H139-V141 PolarHBondContact O-N 2.97Å | ||
| 140 | P | 58.7 | Low | 57.4 | Low | 104 Ų | 104 | 131.2 Ų | 131.2 | 68% | 0.675 | 70% | 0.698 | S | S | * | * | trans | -63.7 | 99.4 | -176.4 | 25.2 | -32.3 | 0 | 0 | 0 | 106.8 | L138 K142 | L138-P140 VanDerWaalsContact O-CD 3.23Å; L138-P140 WeakPolarHBondContact O-CD 3.08Å; P140-K142 WeakPolarHBondContact O-CA 3.48Å; P140-K142 WeakPolarHBondContact O-CB 3.45Å; P140-K142 PolarHBondContact O-N 2.87Å | ||
| 141 | V | 54.3 | Low | 57.7 | Low | 80 Ų | 80 | 135.3 Ų | 135.3 | 49% | 0.485 | 71% | 0.706 | S | S | . | * | trans | -8.9 | 81 | -177.3 | -174.3 | 0 | 0 | 0 | 0 | 111.3 | H139 K143 W144 | H139-V141 VanDerWaalsContact C-N 3.32Å; H139-V141 PolarHBondContact O-N 2.97Å; V141-K143 VanDerWaalsContact C-N 3.3Å; V141-K143 PolarHBondContact O-N 3.22Å; V141-W144 VanDerWaalsContact CB-CD1 3.42Å; V141-W144 HydrophobicContact CB-CG 4.28Å; V141-W144 HydrophobicContact CG1-CD2 3.76Å; V141-W144 VanDerWaalsContact CG1-CE2 3.48Å; V141-W144 HydrophobicContact CG1-CG 3.64Å; V141-W144 HydrophobicContact CG1-CZ2 4.16Å; V141-W144 HydrophobicContact CG2-CZ2 4.1Å; V141-W144 PolarHBondContact O-N 3.38Å | ||
| 142 | K | 59.8 | Low | 57.8 | Low | 162 Ų | 162 | 135.4 Ų | 135.4 | 70% | 0.704 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | 95.6 | -163.8 | -169 | 149.3 | 162.5 | 170.6 | 0 | 105.1 | P140 | P140-K142 WeakPolarHBondContact O-CA 3.48Å; P140-K142 WeakPolarHBondContact O-CB 3.45Å; P140-K142 PolarHBondContact O-N 2.87Å |
| 143 | K | 64.5 | Low | 57.6 | Low | 182 Ų | 182 | 132 Ų | 132 | 79% | 0.791 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 83 | 77.8 | -169.2 | -52.7 | -175.3 | 172.4 | -172.1 | 0 | 113.5 | V141 P145 | V141-K143 VanDerWaalsContact C-N 3.3Å; V141-K143 PolarHBondContact O-N 3.22Å; K143-P145 WeakPolarHBondContact O-CD 3.44Å; K143-P145 VanDerWaalsContact O-N 3.14Å |
| 144 | W | 58.8 | Low | 57.7 | Low | 164 Ų | 164 | 128.2 Ų | 128.2 | 62% | 0.621 | 70% | 0.699 | S | S | * | * | trans | -57.8 | 104.8 | 139 | -72.6 | 95.8 | 0 | 0 | 0 | 106.9 | V141 M146 R147 | V141-W144 VanDerWaalsContact CB-CD1 3.42Å; V141-W144 HydrophobicContact CB-CG 4.28Å; V141-W144 HydrophobicContact CG1-CD2 3.76Å; V141-W144 VanDerWaalsContact CG1-CE2 3.48Å; V141-W144 HydrophobicContact CG1-CG 3.64Å; V141-W144 HydrophobicContact CG1-CZ2 4.16Å; V141-W144 HydrophobicContact CG2-CZ2 4.1Å; V141-W144 PolarHBondContact O-N 3.38Å; W144-M146 PolarHBondContact O-N 2.9Å; W144-R147 HydrophobicContact CB-CG 4.27Å; W144-R147 PolarHBondContact O-N 3.05Å | ||
| 145 | P | 63.2 | Low | 58 | Low | 95 Ų | 95 | 130.8 Ų | 130.8 | 62% | 0.617 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.3 | -14.5 | -175.9 | -8.8 | 23.4 | 0 | 0 | 0 | 111.8 | K143 | K143-P145 WeakPolarHBondContact O-CD 3.44Å; K143-P145 VanDerWaalsContact O-N 3.14Å |
| 146 | M | 60.2 | Low | 57.9 | Low | 139 Ų | 139 | 130.6 Ų | 130.6 | 69% | 0.685 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -82.7 | -15.9 | -172 | -68.2 | -69.5 | -72.5 | 0 | 0 | 114.9 | W144 | W144-M146 PolarHBondContact O-N 2.9Å |
| 147 | R | 59.4 | Low | 58.1 | Low | 194 Ų | 194 | 131.2 Ų | 131.2 | 73% | 0.732 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -80.9 | -29.6 | -175.6 | -68.1 | -177.1 | 70.6 | 125.3 | -1.3 | 113.7 | W144 L150 | W144-R147 HydrophobicContact CB-CG 4.27Å; W144-R147 PolarHBondContact O-N 3.05Å; R147-L150 PolarHBondContact O-N 2.97Å |
| 148 | S | 60 | Low | 57.7 | Low | 88 Ų | 88 | 130 Ų | 130 | 62% | 0.615 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -72.5 | -37.5 | 177.2 | 65.2 | 0 | 0 | 0 | 0 | 111.9 | L150 Y151 C152 | S148-L150 VanDerWaalsContact C-N 3.26Å; S148-L150 PolarHBondContact O-N 3.16Å; S148-Y151 PolarHBondContact O-N 3.1Å; S148-C152 WeakPolarHBondContact O-CB 3.45Å; S148-C152 PolarHBondContact O-N 2.76Å |
| 149 | L | 63.7 | Low | 57.5 | Low | 124 Ų | 124 | 130.2 Ų | 130.2 | 65% | 0.649 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -64.4 | -29.4 | 174.8 | -81.3 | 142.7 | 0 | 0 | 0 | 112.8 | ||
| 150 | L | 65.6 | Low | 57 | Low | 153 Ų | 153 | 129.3 Ų | 129.3 | 80% | 0.801 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -73.6 | -27.2 | 177 | -167.1 | 64.1 | 0 | 0 | 0 | 112.7 | R147 S148 | R147-L150 PolarHBondContact O-N 2.97Å; S148-L150 VanDerWaalsContact C-N 3.26Å; S148-L150 PolarHBondContact O-N 3.16Å |
| 151 | Y | 62 | Low | 56.5 | Low | 218 Ų | 218 | 128.6 Ų | 128.6 | 86% | 0.855 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -97.6 | -14.4 | 175.8 | -160.5 | -97.6 | 0 | 0 | 0 | 113.1 | S148 G153 | S148-Y151 PolarHBondContact O-N 3.1Å; Y151-G153 PolarHBondContact O-N 2.92Å |
| 152 | C | 55.4 | Low | 56.3 | Low | 101 Ų | 101 | 132.1 Ų | 132.1 | 68% | 0.682 | 75% | 0.745 | S | S | * | * | trans | -77.3 | 59.1 | 165.7 | -163.4 | 0 | 0 | 0 | 0 | 109.8 | S148 S154 | S148-C152 WeakPolarHBondContact O-CB 3.45Å; S148-C152 PolarHBondContact O-N 2.76Å; C152-S154 PolarHBondContact O-N 2.89Å; C152-S154 VanDerWaalsContact O-N 3.1Å | ||
| 153 | G | 48.5 | Very low | 55.5 | Low | 50 Ų | 50 | 132.9 Ų | 132.9 | 52% | 0.515 | 75% | 0.751 | S | S | . | * | trans | -65.8 | 105.5 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | Y151 V155 | Y151-G153 PolarHBondContact O-N 2.92Å; G153-V155 PolarHBondContact O-N 3.28Å | ||
| 154 | S | 56.1 | Low | 54.8 | Low | 121 Ų | 121 | 129.8 Ų | 129.8 | 85% | 0.846 | 75% | 0.748 | S | S | * | * | S | Bend | trans | 32.7 | 55.1 | 138.2 | -166.2 | 0 | 0 | 0 | 0 | 118.1 | C152 | C152-S154 PolarHBondContact O-N 2.89Å; C152-S154 VanDerWaalsContact O-N 3.1Å |
| 155 | V | 54.4 | Low | 54 | Low | 139 Ų | 139 | 127.9 Ų | 127.9 | 84% | 0.842 | 76% | 0.757 | S | S | * | * | trans | -130.7 | 41.1 | 159.3 | -62.1 | 0 | 0 | 0 | 0 | 110.4 | G153 | G153-V155 PolarHBondContact O-N 3.28Š| ||
| 156 | G | 51.6 | Low | 52.6 | Low | 86 Ų | 86 | 131.3 Ų | 131.3 | 89% | 0.887 | 77% | 0.766 | S | S | * | * | trans | -105.8 | 25.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 157 | G | 53.6 | Low | 51.5 | Low | 67 Ų | 67 | 130.1 Ų | 130.1 | 69% | 0.691 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -159.4 | 72.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 158 | L | 50.3 | Low | 50.3 | Low | 169 Ų | 169 | 124.9 Ų | 124.9 | 89% | 0.885 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -167.1 | 16.3 | 154 | -108.2 | 168.9 | 0 | 0 | 0 | 116.2 | ||
| 159 | L | 52 | Low | 49.3 | Very low | 163 Ų | 163 | 128.4 Ų | 128.4 | 85% | 0.853 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -151.2 | 68.9 | 173.7 | 60.4 | 169.4 | 0 | 0 | 0 | 112.8 | ||
| 160 | S | 44.8 | Very low | 48 | Very low | 117 Ų | 117 | 131.6 Ų | 131.6 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -148 | 54.5 | 152.8 | -150.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 161 | A | 48 | Very low | 46.6 | Very low | 89 Ų | 89 | 128.2 Ų | 128.2 | 74% | 0.736 | 79% | 0.787 | S | S | * | * | trans | -116.4 | 88.7 | 161.6 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 162 | N | 50.1 | Low | 45.5 | Very low | 153 Ų | 153 | 124 Ų | 124 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | 161.4 | 82.4 | 154.5 | -83.8 | -15.4 | 0 | 0 | 0 | 109.2 | ||||
| 163 | Q | 43.7 | Very low | 45.2 | Very low | 179 Ų | 179 | 127.4 Ų | 127.4 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -130.8 | 90.2 | 150.6 | -67.8 | -164.9 | 100 | 0 | 0 | 107.1 | P165 | Q163-P165 WeakPolarHBondContact O-CD 3.19Š| ||
| 164 | T | 50 | Low | 45.3 | Very low | 117 Ų | 117 | 130.2 Ų | 130.2 | 72% | 0.718 | 80% | 0.799 | S | S | * | * | trans | -77.8 | 111.6 | 154.9 | 40.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 165 | P | 41.4 | Very low | 44.4 | Very low | 124 Ų | 124 | 131.8 Ų | 131.8 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | trans | -83.4 | 129.7 | 154.7 | 30.1 | -29.1 | 0 | 0 | 0 | 109 | Q163 | Q163-P165 WeakPolarHBondContact O-CD 3.19Š| ||
| 166 | M | 33.8 | Very low | 44 | Very low | 167 Ų | 167 | 131.1 Ų | 131.1 | 82% | 0.823 | 79% | 0.794 | S | S | * | * | trans | -84.8 | 141 | -173.7 | -42.3 | -154.2 | 76.3 | 0 | 0 | 110.3 | ||||
| 167 | S | 36 | Very low | 43.8 | Very low | 114 Ų | 114 | 132.6 Ų | 132.6 | 80% | 0.797 | 79% | 0.787 | S | S | * | * | trans | 46.3 | 115.6 | 136.9 | -164.3 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 168 | G | 36.2 | Very low | 43.2 | Very low | 83 Ų | 83 | 134.7 Ų | 134.7 | 86% | 0.856 | 79% | 0.792 | S | S | * | * | trans | -170.6 | 67.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 169 | E | 37.4 | Very low | 43.5 | Very low | 162 Ų | 162 | 131.9 Ų | 131.9 | 76% | 0.757 | 78% | 0.783 | S | S | * | * | trans | -80.4 | 148.7 | 169.2 | 58.9 | -168.3 | 84.2 | 0 | 0 | 112.1 | ||||
| 170 | K | 36.7 | Very low | 43.4 | Very low | 192 Ų | 192 | 132 Ų | 132 | 84% | 0.835 | 78% | 0.78 | S | S | * | * | trans | 117.3 | 125.5 | 147 | 89.7 | -145.7 | -80.2 | -75.1 | 0 | 118.6 | ||||
| 171 | A | 36.7 | Very low | 43.9 | Very low | 81 Ų | 81 | 131.6 Ų | 131.6 | 67% | 0.669 | 77% | 0.772 | S | S | * | * | trans | 98.8 | 101.3 | 144.2 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 172 | T | 39.5 | Very low | 43.8 | Very low | 130 Ų | 130 | 133.6 Ų | 133.6 | 80% | 0.798 | 77% | 0.77 | S | S | * | * | 81.3 | 106.9 | 114.1 | -52.8 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 173 | H | 48.1 | Very low | 44 | Very low | 172 Ų | 172 | 134.3 Ų | 134.3 | 80% | 0.796 | 77% | 0.771 | S | S | * | * | trans | -60.7 | 175.4 | 155.6 | -24.3 | -87.4 | 0 | 0 | 0 | 111.6 | ||||
| 174 | P | 51 | Low | 44.3 | Very low | 109 Ų | 109 | 131.9 Ų | 131.9 | 71% | 0.708 | 76% | 0.763 | S | S | * | * | cis | -148.3 | -167.5 | 5.9 | 38.9 | -14.5 | 0 | 0 | 0 | 116.2 | ||||
| 175 | L | 37.1 | Very low | 44.1 | Very low | 155 Ų | 155 | 136.6 Ų | 136.6 | 81% | 0.812 | 77% | 0.768 | S | S | * | * | trans | 85.4 | 120.3 | 152.6 | -65.4 | 165.4 | 0 | 0 | 0 | 122.4 | ||||
| 176 | T | 45.3 | Very low | 44.8 | Very low | 125 Ų | 125 | 135.5 Ų | 135.5 | 77% | 0.767 | 76% | 0.763 | S | S | * | * | trans | -46 | 167.3 | 151.4 | -3.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 177 | P | 48.8 | Very low | 45.9 | Very low | 117 Ų | 117 | 138.9 Ų | 138.9 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | cis | -142.4 | 174.2 | 33.7 | 37 | -13.8 | 0 | 0 | 0 | 118.5 | ||||
| 178 | S | 41.3 | Very low | 46.4 | Very low | 111 Ų | 111 | 140.1 Ų | 140.1 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | trans | -23.5 | 162.4 | 154.6 | -103 | 0 | 0 | 0 | 0 | 117 | ||||
| 179 | P | 56.6 | Low | 46.9 | Very low | 110 Ų | 110 | 143.1 Ų | 143.1 | 71% | 0.714 | 78% | 0.777 | S | S | * | * | cis | -141.5 | -177.5 | 45 | 41.3 | -19.6 | 0 | 0 | 0 | 112.6 | ||||
| 180 | E | 49.6 | Very low | 47.4 | Very low | 166 Ų | 166 | 142.1 Ų | 142.1 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | cis | 178.3 | 147.3 | 50 | -131.4 | -147.5 | 138.4 | 0 | 0 | 108.7 | ||||
| 181 | V | 53.7 | Low | 48.1 | Very low | 108 Ų | 108 | 139.1 Ų | 139.1 | 66% | 0.655 | 78% | 0.775 | S | S | * | * | trans | 53 | 144.9 | 153.3 | -109.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 182 | N | 47.7 | Very low | 48.8 | Very low | 131 Ų | 131 | 142.8 Ų | 142.8 | 70% | 0.701 | 78% | 0.782 | S | S | * | * | cis | -167.4 | 126.7 | 28.6 | -164.5 | -98.1 | 0 | 0 | 0 | 105.9 | ||||
| 183 | M | 54.5 | Low | 49.4 | Very low | 168 Ų | 168 | 143.6 Ų | 143.6 | 83% | 0.828 | 78% | 0.781 | S | S | * | * | 61.7 | 116.2 | 104.5 | -129.1 | 96.6 | 151.8 | 0 | 0 | 115.8 | |||||
| 184 | D | 48.4 | Very low | 49.5 | Very low | 128 Ų | 128 | 141.6 Ų | 141.6 | 68% | 0.684 | 78% | 0.78 | S | S | * | * | 164.7 | 105.8 | 127.3 | -158.1 | -115.9 | 0 | 0 | 0 | 106.8 | |||||
| 185 | R | 46.4 | Very low | 49.4 | Very low | 216 Ų | 216 | 144.1 Ų | 144.1 | 82% | 0.815 | 79% | 0.785 | S | S | * | * | 79.5 | 131.9 | 101.4 | -157.3 | 173.5 | 178.8 | -170.6 | 1.7 | 110.9 | |||||
| 186 | S | 55.8 | Low | 50.4 | Low | 101 Ų | 101 | 143.2 Ų | 143.2 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | cis | -162 | 157.7 | 39.7 | -153.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 187 | I | 56.6 | Low | 50.9 | Low | 237 Ų | 237 | 144.8 Ų | 144.8 | 100% | 1.215 | 79% | 0.785 | S | S | * | * | trans | -39.7 | 0 | 172 | -72.5 | 159.8 | 0 | 0 | 0 | 114.5 |
Retrieved 187 of 187 residues in 575.1 ms
(Link to these results)