| 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 | K | 42.3 | Very low | 49.1 | Very low | 262 Ų | 262 | 151.2 Ų | 151.2 | 100% | 1.139 | 85% | 0.849 | S | S | * | * | 0 | 123 | 0 | -100.5 | 178.7 | 171.4 | 179.1 | 0 | 107 | |||||
| 2 | Q | 45.6 | Very low | 48.7 | Very low | 199 Ų | 199 | 152.9 Ų | 152.9 | 93% | 0.93 | 85% | 0.853 | S | S | * | * | trans | 24.8 | 100.6 | 165 | -72.6 | 165.1 | -22.5 | 0 | 0 | 117.8 | ||||
| 3 | E | 43.6 | Very low | 48.3 | Very low | 194 Ų | 194 | 155.7 Ų | 155.7 | 91% | 0.907 | 86% | 0.856 | S | S | * | * | trans | -105.5 | 123 | 147.6 | -173 | 176.9 | 136.6 | 0 | 0 | 106.8 | ||||
| 4 | A | 50 | Low | 47.8 | Very low | 91 Ų | 91 | 157.7 Ų | 157.7 | 75% | 0.752 | 86% | 0.855 | S | S | * | * | trans | -156.3 | 73.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | V6 | A4-V6 PolarHBondContact O-N 3.2Š| ||
| 5 | A | 56.1 | Low | 47.4 | Very low | 92 Ų | 92 | 155.4 Ų | 155.4 | 76% | 0.76 | 85% | 0.851 | S | S | * | * | trans | -67.1 | 128.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 6 | V | 51 | Low | 47 | Very low | 141 Ų | 141 | 152.4 Ų | 152.4 | 86% | 0.855 | 85% | 0.845 | S | S | * | * | trans | -75.1 | 123.3 | 173.4 | 174.5 | 0 | 0 | 0 | 0 | 108.5 | A4 | A4-V6 PolarHBondContact O-N 3.2Š| ||
| 7 | M | 46.7 | Very low | 46.6 | Very low | 159 Ų | 159 | 157.8 Ų | 157.8 | 78% | 0.783 | 85% | 0.85 | S | S | * | * | trans | -130.5 | 148.1 | 168.1 | -76.1 | -61.8 | -75.1 | 0 | 0 | 110.3 | ||||
| 8 | P | 55.8 | Low | 46.8 | Very low | 101 Ų | 101 | 159.1 Ų | 159.1 | 66% | 0.656 | 85% | 0.849 | S | S | * | * | trans | -84.2 | 154.1 | -161.1 | 33.6 | -36.2 | 0 | 0 | 0 | 113.7 | E10 | P8-E10 PolarHBondContact O-N 2.67Š| ||
| 9 | V | 52 | Low | 46.7 | Very low | 148 Ų | 148 | 157.4 Ų | 157.4 | 90% | 0.897 | 85% | 0.848 | S | S | * | * | trans | -83.1 | 105.6 | 171.3 | 177.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 10 | E | 48.3 | Very low | 46.5 | Very low | 173 Ų | 173 | 158.1 Ų | 158.1 | 81% | 0.808 | 85% | 0.851 | S | S | * | * | trans | -71.3 | 144.1 | 172.7 | -67.9 | -179.1 | 125.1 | 0 | 0 | 111.7 | P8 | P8-E10 PolarHBondContact O-N 2.67Š| ||
| 11 | A | 48.4 | Very low | 46.4 | Very low | 103 Ų | 103 | 160.2 Ų | 160.2 | 85% | 0.851 | 85% | 0.852 | S | S | * | * | trans | -85.9 | 131 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 12 | L | 45 | Very low | 46.4 | Very low | 172 Ų | 172 | 152.3 Ų | 152.3 | 90% | 0.901 | 84% | 0.836 | S | S | * | * | trans | -122.9 | 131.2 | 170.1 | -87.1 | 167.2 | 0 | 0 | 0 | 111.7 | ||||
| 13 | Q | 43.3 | Very low | 46.2 | Very low | 189 Ų | 189 | 147.6 Ų | 147.6 | 88% | 0.883 | 83% | 0.831 | S | S | * | * | trans | -80.7 | 169.1 | -179.3 | -68.2 | 177.9 | 2.8 | 0 | 0 | 112.1 | ||||
| 14 | H | 41 | Very low | 46.5 | Very low | 184 Ų | 184 | 145 Ų | 145 | 85% | 0.852 | 83% | 0.828 | S | S | * | * | trans | -64.4 | 168.6 | -170.2 | -51.8 | -32.8 | 0 | 0 | 0 | 114.9 | ||||
| 15 | P | 42.7 | Very low | 46.1 | Very low | 123 Ų | 123 | 143.6 Ų | 143.6 | 80% | 0.799 | 82% | 0.822 | S | S | * | * | -135.8 | 171.5 | 103.9 | 38.1 | -28.5 | 0 | 0 | 0 | 115.9 | |||||
| 16 | S | 40.3 | Very low | 45.8 | Very low | 107 Ų | 107 | 145.7 Ų | 145.7 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | trans | -52.2 | 139 | -175.2 | 48.9 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 17 | R | 40 | Very low | 45.4 | Very low | 244 Ų | 244 | 143.8 Ų | 143.8 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | trans | -103.1 | 113 | 149.6 | -85.1 | -170.8 | 168.5 | -163.9 | -2.7 | 109.5 | P19 | R17-P19 WeakPolarHBondContact O-CD 3.42Š| ||
| 18 | Q | 50.2 | Low | 46 | Very low | 181 Ų | 181 | 141.3 Ų | 141.3 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 127.8 | 162.9 | -67.9 | -173.8 | -8.7 | 0 | 0 | 109.5 | ||
| 19 | P | 44.1 | Very low | 45.6 | Very low | 127 Ų | 127 | 142.1 Ų | 142.1 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 140.4 | 165.2 | -12.3 | 30.2 | 0 | 0 | 0 | 110.9 | R17 | R17-P19 WeakPolarHBondContact O-CD 3.42Š|
| 20 | L | 42.9 | Very low | 45.9 | Very low | 172 Ų | 172 | 146.7 Ų | 146.7 | 90% | 0.901 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 155 | -175.7 | -71.9 | 151.8 | 0 | 0 | 0 | 113.5 | A22 | L20-A22 PolarHBondContact O-N 3.44Š|
| 21 | K | 45.6 | Very low | 46.4 | Very low | 203 Ų | 203 | 146.3 Ų | 146.3 | 88% | 0.883 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -29.8 | 118.8 | 175 | -67.7 | 169.3 | 175.4 | 175 | 0 | 116 | ||
| 22 | A | 42.2 | Very low | 47.1 | Very low | 96 Ų | 96 | 152 Ų | 152 | 79% | 0.793 | 82% | 0.822 | S | S | * | * | trans | 26.9 | 96.5 | 138.8 | 0 | 0 | 0 | 0 | 0 | 118.7 | L20 | L20-A22 PolarHBondContact O-N 3.44Š| ||
| 23 | A | 40.1 | Very low | 47.6 | Very low | 100 Ų | 100 | 149.9 Ų | 149.9 | 83% | 0.826 | 82% | 0.819 | S | S | * | * | trans | -87.6 | 129.4 | 142.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | G25 | A23-G25 VanDerWaalsContact C-N 3.3Å; A23-G25 PolarHBondContact O-N 3.4Å | ||
| 24 | V | 50.6 | Low | 48.4 | Very low | 139 Ų | 139 | 149.2 Ų | 149.2 | 84% | 0.842 | 81% | 0.813 | S | S | * | * | trans | -74.9 | 83.3 | -179.5 | 179.6 | 0 | 0 | 0 | 0 | 109.9 | V26 | V24-V26 PolarHBondContact O-N 3.46Š| ||
| 25 | G | 41 | Very low | 49.6 | Very low | 61 Ų | 61 | 142.8 Ų | 142.8 | 63% | 0.629 | 80% | 0.796 | S | S | * | * | trans | -72.2 | 114.3 | 166.3 | 0 | 0 | 0 | 0 | 0 | 110 | A23 S27 | A23-G25 VanDerWaalsContact C-N 3.3Å; A23-G25 PolarHBondContact O-N 3.4Å; G25-S27 PolarHBondContact O-N 3.41Å | ||
| 26 | V | 51.1 | Low | 50.4 | Low | 136 Ų | 136 | 143.6 Ų | 143.6 | 82% | 0.824 | 80% | 0.801 | S | S | * | * | trans | -59.5 | 111.2 | 172.8 | 174.9 | 0 | 0 | 0 | 0 | 108.3 | V24 | V24-V26 PolarHBondContact O-N 3.46Š| ||
| 27 | S | 42.5 | Very low | 51.5 | Low | 102 Ų | 102 | 143.8 Ų | 143.8 | 71% | 0.713 | 79% | 0.794 | S | S | * | * | trans | -64.7 | 126.7 | 176.8 | -67.4 | 0 | 0 | 0 | 0 | 109.5 | G25 | G25-S27 PolarHBondContact O-N 3.41Š| ||
| 28 | P | 57.8 | Low | 52.9 | Low | 107 Ų | 107 | 133.8 Ų | 133.8 | 70% | 0.695 | 77% | 0.767 | S | S | * | * | trans | -61.2 | 147.5 | 170.1 | 27.2 | -33.5 | 0 | 0 | 0 | 109 | R30 | P28-R30 PolarHBondContact O-N 3.45Š| ||
| 29 | P | 48.9 | Very low | 53.6 | Low | 118 Ų | 118 | 130.5 Ų | 130.5 | 77% | 0.766 | 76% | 0.761 | S | S | * | * | trans | -60.7 | 113.6 | -178.2 | 24.9 | -33.4 | 0 | 0 | 0 | 109.3 | L31 | P29-L31 PolarHBondContact O-N 3.25Š| ||
| 30 | R | 58.5 | Low | 54.2 | Low | 244 Ų | 244 | 128.9 Ų | 128.9 | 92% | 0.921 | 75% | 0.745 | S | S | * | * | trans | -56.9 | 101.8 | 175.4 | -79.2 | -178.6 | 171.8 | 167.3 | -3 | 108.9 | P28 R32 | P28-R30 PolarHBondContact O-N 3.45Å; R30-R32 PolarHBondContact O-N 3.31Å | ||
| 31 | L | 57.9 | Low | 54.9 | Low | 164 Ų | 164 | 127.4 Ų | 127.4 | 86% | 0.859 | 73% | 0.732 | S | S | * | * | trans | -57.8 | 114.1 | 167.2 | -68.2 | 175.7 | 0 | 0 | 0 | 106.9 | P29 | P29-L31 PolarHBondContact O-N 3.25Š| ||
| 32 | R | 62.5 | Low | 55.5 | Low | 224 Ų | 224 | 127.3 Ų | 127.3 | 85% | 0.845 | 73% | 0.727 | S | S | * | * | trans | -55 | 128.8 | 175.5 | -68.4 | -173 | -179.2 | -174.1 | 0.9 | 107.7 | R30 K34 | R30-R32 PolarHBondContact O-N 3.31Å; R32-K34 PolarHBondContact O-N 3.47Å | ||
| 33 | P | 55.8 | Low | 56.2 | Low | 127 Ų | 127 | 131.4 Ų | 131.4 | 83% | 0.825 | 72% | 0.722 | S | S | * | * | trans | -58.3 | 116.4 | 169.8 | 24.8 | -31.7 | 0 | 0 | 0 | 107.2 | G35 | P33-G35 PolarHBondContact O-N 2.72Å; P33-G35 VanDerWaalsContact O-N 3.11Å | ||
| 34 | K | 59.8 | Low | 56.7 | Low | 175 Ų | 175 | 136.3 Ų | 136.3 | 76% | 0.761 | 72% | 0.719 | S | S | * | * | trans | -65.2 | 112.5 | 167.2 | -71.3 | -75 | -177.7 | 170 | 0 | 105.3 | R32 L37 | R32-K34 PolarHBondContact O-N 3.47Å; K34-L37 HydrophobicContact CB-CD1 4.33Å | ||
| 35 | G | 67.8 | Low | 56.5 | Low | 49 Ų | 49 | 133.9 Ų | 133.9 | 51% | 0.505 | 71% | 0.714 | S | S | . | * | trans | -54.9 | 162.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | P33 L37 | P33-G35 PolarHBondContact O-N 2.72Å; P33-G35 VanDerWaalsContact O-N 3.11Å; G35-L37 PolarHBondContact O-N 3.01Å | ||
| 36 | P | 59.2 | Low | 57 | Low | 139 Ų | 139 | 139.2 Ų | 139.2 | 90% | 0.903 | 72% | 0.722 | S | S | * | * | trans | -54.1 | 106.4 | -168.8 | 21 | -33.1 | 0 | 0 | 0 | 111.8 | G38 | P36-G38 PolarHBondContact O-N 2.89Š| ||
| 37 | L | 62.9 | Low | 57.2 | Low | 112 Ų | 112 | 137 Ų | 137 | 59% | 0.586 | 71% | 0.713 | S | S | * | * | trans | -76.5 | 102.8 | 174.2 | -71.1 | 165.9 | 0 | 0 | 0 | 107.3 | K34 G35 F41 | K34-L37 HydrophobicContact CB-CD1 4.33Å; G35-L37 PolarHBondContact O-N 3.01Å; L37-F41 HydrophobicContact CB-CD2 4.14Å; L37-F41 HydrophobicContact CB-CE2 4.18Å; L37-F41 HydrophobicContact CD2-CD2 3.99Å; L37-F41 HydrophobicContact CD2-CE1 4.17Å; L37-F41 HydrophobicContact CD2-CE2 3.4Å; L37-F41 VanDerWaalsContact CD2-CE2 3.4Å; L37-F41 HydrophobicContact CD2-CZ 3.51Å; L37-F41 HydrophobicContact CG-CE2 4.41Å | ||
| 38 | G | 69 | Low | 57.3 | Low | 34 Ų | 34 | 134.8 Ų | 134.8 | 35% | 0.351 | 71% | 0.706 | S | S | . | * | trans | -64.9 | 170.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | P36 D40 F41 | P36-G38 PolarHBondContact O-N 2.89Å; G38-D40 PolarHBondContact O-N 2.86Å; G38-F41 WeakPolarHBondContact O-CD2 3.13Å | ||
| 39 | P | 64.9 | Low | 57.2 | Low | 111 Ų | 111 | 135.4 Ų | 135.4 | 72% | 0.721 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | -20.3 | -173.6 | -26.1 | 36 | 0 | 0 | 0 | 115.8 | F41 Y42 | P39-F41 VanDerWaalsContact C-N 3.28Å; P39-F41 PolarHBondContact O-N 3.21Å; P39-Y42 PolarHBondContact O-N 2.92Å |
| 40 | D | 56.1 | Low | 57.3 | Low | 93 Ų | 93 | 134 Ų | 134 | 50% | 0.497 | 71% | 0.714 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.3 | -16.2 | -170.3 | -60.5 | -68.1 | 0 | 0 | 0 | 115.3 | G38 Y42 R43 R44 | G38-D40 PolarHBondContact O-N 2.86Å; D40-Y42 PolarHBondContact O-N 2.94Å; D40-R43 WeakPolarHBondContact O-CB 3.26Å; D40-R43 PolarHBondContact O-N 2.93Å; D40-R43 IonicContact OD1-CZ 2.71Å; D40-R43 IonicContact OD1-NH1 3.62Å; D40-R44 PolarHBondContact O-N 3.22Å |
| 41 | F | 58.6 | Low | 57.5 | Low | 142 Ų | 142 | 126.4 Ų | 126.4 | 62% | 0.623 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -60.8 | -33.4 | 176.6 | -77 | -85 | 0 | 0 | 0 | 112.6 | L37 G38 P39 | L37-F41 HydrophobicContact CB-CD2 4.14Å; L37-F41 HydrophobicContact CB-CE2 4.18Å; L37-F41 HydrophobicContact CD2-CD2 3.99Å; L37-F41 HydrophobicContact CD2-CE1 4.17Å; L37-F41 HydrophobicContact CD2-CE2 3.4Å; L37-F41 VanDerWaalsContact CD2-CE2 3.4Å; L37-F41 HydrophobicContact CD2-CZ 3.51Å; L37-F41 HydrophobicContact CG-CE2 4.41Å; G38-F41 WeakPolarHBondContact O-CD2 3.13Å; P39-F41 VanDerWaalsContact C-N 3.28Å; P39-F41 PolarHBondContact O-N 3.21Å |
| 42 | Y | 57.5 | Low | 57.9 | Low | 200 Ų | 200 | 124.3 Ų | 124.3 | 78% | 0.784 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -74.6 | -25.1 | 176.1 | -65.2 | -79.1 | 0 | 0 | 0 | 113.1 | P39 D40 | P39-Y42 PolarHBondContact O-N 2.92Å; D40-Y42 PolarHBondContact O-N 2.94Å |
| 43 | R | 58 | Low | 58.3 | Low | 183 Ų | 183 | 124.6 Ų | 124.6 | 69% | 0.691 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -74.4 | -33.4 | -178.6 | -166.2 | 178.9 | -67.1 | 168.4 | 2.5 | 112.3 | D40 | D40-R43 WeakPolarHBondContact O-CB 3.26Å; D40-R43 PolarHBondContact O-N 2.93Å; D40-R43 IonicContact OD1-CZ 2.71Å; D40-R43 IonicContact OD1-NH1 3.62Å |
| 44 | R | 49.4 | Very low | 59.1 | Low | 202 Ų | 202 | 123 Ų | 123 | 76% | 0.762 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -76.9 | -20 | -175.9 | -172.1 | 146.2 | -74.2 | 163.7 | 0.5 | 114.4 | D40 Q46 S47 | D40-R44 PolarHBondContact O-N 3.22Å; R44-Q46 PolarHBondContact O-N 3Å; R44-Q46 VanDerWaalsContact O-N 3.14Å; R44-S47 PolarHBondContact O-N 2.65Å; R44-S47 PolarHBondContact O-OG 3.24Å |
| 45 | A | 47 | Very low | 60.2 | Low | 88 Ų | 88 | 117.6 Ų | 117.6 | 73% | 0.727 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | -14.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 46 | Q | 52.3 | Low | 60.8 | Low | 173 Ų | 173 | 118.7 Ų | 118.7 | 81% | 0.808 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | -9 | 179.1 | -62.5 | -174.9 | 0.3 | 0 | 0 | 114.1 | R44 G48 | R44-Q46 PolarHBondContact O-N 3Å; R44-Q46 VanDerWaalsContact O-N 3.14Å; Q46-G48 VanDerWaalsContact C-N 3.32Å; Q46-G48 PolarHBondContact O-N 3.49Å |
| 47 | S | 53.9 | Low | 62 | Low | 91 Ų | 91 | 116.8 Ų | 116.8 | 64% | 0.636 | 66% | 0.655 | S | S | * | * | trans | -95.6 | 37.4 | 179.6 | 73.3 | 0 | 0 | 0 | 0 | 113.2 | R44 | R44-S47 PolarHBondContact O-N 2.65Å; R44-S47 PolarHBondContact O-OG 3.24Å | ||
| 48 | G | 45.4 | Very low | 63.2 | Low | 55 Ų | 55 | 115.7 Ų | 115.7 | 57% | 0.567 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -85.1 | 132.7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | Q46 S50 | Q46-G48 VanDerWaalsContact C-N 3.32Å; Q46-G48 PolarHBondContact O-N 3.49Å; G48-S50 VanDerWaalsContact C-N 3.31Å; G48-S50 PolarHBondContact O-N 3.09Å |
| 49 | A | 54.8 | Low | 64.2 | Low | 119 Ų | 119 | 120.3 Ų | 120.3 | 98% | 0.983 | 65% | 0.654 | S | S | * | * | trans | -71.5 | 74 | -171.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 50 | S | 52.2 | Low | 65.2 | Low | 90 Ų | 90 | 121.2 Ų | 121.2 | 63% | 0.629 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -95.7 | 134.6 | 155.2 | 65.9 | 0 | 0 | 0 | 0 | 109 | G48 | G48-S50 VanDerWaalsContact C-N 3.31Å; G48-S50 PolarHBondContact O-N 3.09Å |
| 51 | A | 62.5 | Low | 66.6 | Low | 84 Ų | 84 | 123.7 Ų | 123.7 | 69% | 0.694 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 143.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | R53 | A51-R53 PolarHBondContact O-N 2.74Å; A51-R53 VanDerWaalsContact O-N 3.08Å |
| 52 | P | 66.3 | Low | 67.7 | Low | 119 Ų | 119 | 120.7 Ų | 120.7 | 77% | 0.773 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 122.9 | -177.3 | 22.5 | -33.2 | 0 | 0 | 0 | 109 | Q54 | P52-Q54 PolarHBondContact O-N 3.14Š|
| 53 | R | 70.1 | Confident | 69.2 | Low | 230 Ų | 230 | 115.3 Ų | 115.3 | 87% | 0.868 | 65% | 0.647 | S | S | * | * | trans | -63.9 | 104 | 179.1 | -71.2 | -173.1 | 176.8 | -159 | -0.6 | 107.3 | A51 S55 | A51-R53 PolarHBondContact O-N 2.74Å; A51-R53 VanDerWaalsContact O-N 3.08Å; R53-S55 PolarHBondContact O-N 3.47Å | ||
| 54 | Q | 73.4 | Confident | 70.6 | Confident | 95 Ų | 95 | 112.4 Ų | 112.4 | 44% | 0.444 | 64% | 0.639 | S | S | . | * | trans | -45.9 | 133.5 | -176.7 | -64.3 | -175.2 | -72.7 | 0 | 0 | 111 | P52 E58 R59 | P52-Q54 PolarHBondContact O-N 3.14Å; Q54-E58 WeakPolarHBondContact CA-OE2 3.41Å; Q54-E58 HydrophobicContact CB-CG 4.47Å; Q54-E58 WeakPolarHBondContact CB-OE2 3.5Å; Q54-E58 VanDerWaalsContact CG-OE1 3.31Å; Q54-E58 WeakPolarHBondContact CG-OE1 3.44Å; Q54-E58 PolarHBondContact NE2-OE1 3.33Å; Q54-R59 HydrophobicContact CB-CG 4.27Å; Q54-R59 PolarHBondContact O-NH1 2.93Å | ||
| 55 | S | 83.9 | Confident | 71.8 | Confident | 61 Ų | 61 | 107.2 Ų | 107.2 | 43% | 0.427 | 64% | 0.64 | S | S | . | * | trans | -59.6 | 151.2 | -174.8 | 179.8 | 0 | 0 | 0 | 0 | 110.5 | R53 V57 E58 R59 | R53-S55 PolarHBondContact O-N 3.47Å; S55-V57 PolarHBondContact O-N 3.37Å; S55-V57 PolarHBondContact OG-N 3.2Å; S55-E58 PolarHBondContact N-OE2 3.23Å; S55-E58 WeakPolarHBondContact O-CB 3.42Å; S55-E58 PolarHBondContact O-N 2.99Å; S55-E58 VanDerWaalsContact O-N 3.12Å; S55-R59 PolarHBondContact O-N 3.11Å | ||
| 56 | A | 79.8 | Confident | 73.4 | Confident | 72 Ų | 72 | 110 Ų | 110 | 60% | 0.595 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -56 | -33.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | L60 | A56-L60 WeakPolarHBondContact O-CB 3.39Å; A56-L60 WeakPolarHBondContact O-CD1 3.4Å; A56-L60 VanDerWaalsContact O-CG 3.22Å; A56-L60 WeakPolarHBondContact O-CG 3.31Å; A56-L60 PolarHBondContact O-N 2.88Å |
| 57 | V | 84.4 | Confident | 74.4 | Confident | 98 Ų | 98 | 109.2 Ų | 109.2 | 59% | 0.594 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -67.1 | -46.1 | 175 | -178.8 | 0 | 0 | 0 | 0 | 111.6 | S55 R59 L60 E61 | S55-V57 PolarHBondContact O-N 3.37Å; S55-V57 PolarHBondContact OG-N 3.2Å; V57-R59 VanDerWaalsContact C-N 3.33Å; V57-R59 PolarHBondContact O-N 3.3Å; V57-L60 PolarHBondContact O-N 3.3Å; V57-L60 VanDerWaalsContact O-N 3.17Å; V57-E61 WeakPolarHBondContact O-CB 3.45Å; V57-E61 PolarHBondContact O-N 3.45Å |
| 58 | E | 88.4 | Confident | 75.7 | Confident | 90 Ų | 90 | 108.2 Ų | 108.2 | 42% | 0.421 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -62.4 | -39.8 | 179.6 | -173.2 | -168.9 | 159.9 | 0 | 0 | 111.6 | Q54 S55 E61 A62 | Q54-E58 WeakPolarHBondContact CA-OE2 3.41Å; Q54-E58 HydrophobicContact CB-CG 4.47Å; Q54-E58 WeakPolarHBondContact CB-OE2 3.5Å; Q54-E58 VanDerWaalsContact CG-OE1 3.31Å; Q54-E58 WeakPolarHBondContact CG-OE1 3.44Å; Q54-E58 PolarHBondContact NE2-OE1 3.33Å; S55-E58 PolarHBondContact N-OE2 3.23Å; S55-E58 WeakPolarHBondContact O-CB 3.42Å; S55-E58 PolarHBondContact O-N 2.99Å; S55-E58 VanDerWaalsContact O-N 3.12Å; E58-E61 PolarHBondContact O-N 3.11Å; E58-A62 WeakPolarHBondContact O-CB 3.06Å; E58-A62 PolarHBondContact O-N 3.25Å |
| 59 | R | 90 | Very high | 76.9 | Confident | 131 Ų | 131 | 115 Ų | 115 | 49% | 0.494 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -65.1 | -42.8 | 172.8 | -73 | -178.9 | 154.7 | 105.7 | 1.6 | 112.5 | Q54 S55 V57 E61 A62 D63 | Q54-R59 HydrophobicContact CB-CG 4.27Å; Q54-R59 PolarHBondContact O-NH1 2.93Å; S55-R59 PolarHBondContact O-N 3.11Å; V57-R59 VanDerWaalsContact C-N 3.33Å; V57-R59 PolarHBondContact O-N 3.3Å; R59-E61 VanDerWaalsContact C-N 3.33Å; R59-A62 PolarHBondContact O-N 2.67Å; R59-D63 PolarHBondContact O-N 3.02Å |
| 60 | L | 84.6 | Confident | 77.1 | Confident | 130 Ų | 130 | 112.8 Ų | 112.8 | 68% | 0.681 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -67.2 | -32.9 | 176.9 | -75.5 | 168.3 | 0 | 0 | 0 | 112.6 | A56 V57 K64 | A56-L60 WeakPolarHBondContact O-CB 3.39Å; A56-L60 WeakPolarHBondContact O-CD1 3.4Å; A56-L60 VanDerWaalsContact O-CG 3.22Å; A56-L60 WeakPolarHBondContact O-CG 3.31Å; A56-L60 PolarHBondContact O-N 2.88Å; V57-L60 PolarHBondContact O-N 3.3Å; V57-L60 VanDerWaalsContact O-N 3.17Å; L60-K64 WeakPolarHBondContact O-CB 3.39Å; L60-K64 PolarHBondContact O-N 3.1Å; L60-K64 VanDerWaalsContact O-N 3.16Å |
| 61 | E | 85.1 | Confident | 77.4 | Confident | 145 Ų | 145 | 115.4 Ų | 115.4 | 68% | 0.678 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -70.2 | -44.2 | 175.1 | -173.9 | 164.1 | -160.6 | 0 | 0 | 111.6 | V57 E58 R59 K64 | V57-E61 WeakPolarHBondContact O-CB 3.45Å; V57-E61 PolarHBondContact O-N 3.45Å; E58-E61 PolarHBondContact O-N 3.11Å; R59-E61 VanDerWaalsContact C-N 3.33Å; E61-K64 VanDerWaalsContact O-CB 3.3Å; E61-K64 WeakPolarHBondContact O-CB 3.44Å; E61-K64 PolarHBondContact O-N 3.36Å |
| 62 | A | 83.4 | Confident | 77.2 | Confident | 78 Ų | 78 | 117.2 Ų | 117.2 | 65% | 0.645 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -61.6 | -46.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | E58 R59 K64 | E58-A62 WeakPolarHBondContact O-CB 3.06Å; E58-A62 PolarHBondContact O-N 3.25Å; R59-A62 PolarHBondContact O-N 2.67Å; A62-K64 VanDerWaalsContact C-N 3.3Å; A62-K64 PolarHBondContact O-N 3.27Å |
| 63 | D | 88.6 | Confident | 76.4 | Confident | 87 Ų | 87 | 115 Ų | 115 | 47% | 0.465 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -79.5 | -8.1 | -178.9 | -81.8 | -18 | 0 | 0 | 0 | 113.7 | R59 A65 K66 Y67 | R59-D63 PolarHBondContact O-N 3.02Å; D63-A65 VanDerWaalsContact C-N 3.29Å; D63-A65 PolarHBondContact O-N 3.42Å; D63-K66 WeakPolarHBondContact O-CB 3.4Å; D63-K66 PolarHBondContact O-N 2.92Å; D63-Y67 HydrophobicContact CB-CD2 4.36Å; D63-Y67 HydrophobicContact CB-CE2 4.35Å; D63-Y67 WeakPolarHBondContact O-CD2 3.33Å |
| 64 | K | 86.7 | Confident | 75.7 | Confident | 122 Ų | 122 | 110.4 Ų | 110.4 | 53% | 0.53 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -54.4 | -43.1 | -178.1 | -171.5 | 178.5 | 176.5 | -175.5 | 0 | 112.5 | L60 E61 A62 K66 Y67 V68 | L60-K64 WeakPolarHBondContact O-CB 3.39Å; L60-K64 PolarHBondContact O-N 3.1Å; L60-K64 VanDerWaalsContact O-N 3.16Å; E61-K64 VanDerWaalsContact O-CB 3.3Å; E61-K64 WeakPolarHBondContact O-CB 3.44Å; E61-K64 PolarHBondContact O-N 3.36Å; A62-K64 VanDerWaalsContact C-N 3.3Å; A62-K64 PolarHBondContact O-N 3.27Å; K64-K66 PolarHBondContact O-N 3.28Å; K64-Y67 PolarHBondContact O-N 2.65Å; K64-V68 HydrophobicContact CG-CB 4.41Å; K64-V68 HydrophobicContact CG-CG2 3.6Å; K64-V68 VanDerWaalsContact O-CB 3.3Å; K64-V68 WeakPolarHBondContact O-CB 3.38Å; K64-V68 WeakPolarHBondContact O-CG2 3.21Å; K64-V68 PolarHBondContact O-N 3.01Å |
| 65 | A | 75.6 | Confident | 74.9 | Confident | 94 Ų | 94 | 110.8 Ų | 110.8 | 78% | 0.777 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67.9 | -21.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | D63 | D63-A65 VanDerWaalsContact C-N 3.29Å; D63-A65 PolarHBondContact O-N 3.42Å |
| 66 | K | 80.5 | Confident | 73.5 | Confident | 145 Ų | 145 | 116.8 Ų | 116.8 | 63% | 0.63 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -79.2 | -27.5 | 178.6 | -175.9 | 178 | 174.3 | -164.9 | 0 | 112.8 | D63 K64 | D63-K66 WeakPolarHBondContact O-CB 3.4Å; D63-K66 PolarHBondContact O-N 2.92Å; K64-K66 PolarHBondContact O-N 3.28Å |
| 67 | Y | 73.7 | Confident | 72.5 | Confident | 158 Ų | 158 | 121.3 Ų | 121.3 | 62% | 0.62 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -120 | -17.7 | -172.2 | -60.6 | -72.6 | 0 | 0 | 0 | 114.6 | D63 K64 K69 | D63-Y67 HydrophobicContact CB-CD2 4.36Å; D63-Y67 HydrophobicContact CB-CE2 4.35Å; D63-Y67 WeakPolarHBondContact O-CD2 3.33Å; K64-Y67 PolarHBondContact O-N 2.65Å; Y67-K69 PolarHBondContact O-N 2.99Å; Y67-K69 VanDerWaalsContact O-N 3.11Å |
| 68 | V | 79.8 | Confident | 70.9 | Confident | 70 Ų | 70 | 125.2 Ų | 125.2 | 42% | 0.424 | 65% | 0.648 | S | S | . | * | S | Bend | trans | -81.3 | 89.4 | 170.2 | 179.1 | 0 | 0 | 0 | 0 | 109.5 | K64 S70 | K64-V68 HydrophobicContact CG-CB 4.41Å; K64-V68 HydrophobicContact CG-CG2 3.6Å; K64-V68 VanDerWaalsContact O-CB 3.3Å; K64-V68 WeakPolarHBondContact O-CB 3.38Å; K64-V68 WeakPolarHBondContact O-CG2 3.21Å; K64-V68 PolarHBondContact O-N 3.01Å; V68-S70 PolarHBondContact O-N 2.8Å |
| 69 | K | 70.7 | Confident | 68.8 | Low | 197 Ų | 197 | 127.1 Ų | 127.1 | 86% | 0.857 | 67% | 0.668 | S | S | * | * | trans | -62.8 | 104.5 | 177 | -170.2 | 174.4 | -177.2 | 177.9 | 0 | 110.8 | Y67 | Y67-K69 PolarHBondContact O-N 2.99Å; Y67-K69 VanDerWaalsContact O-N 3.11Å | ||
| 70 | S | 59.4 | Low | 66.4 | Low | 73 Ų | 73 | 127.6 Ų | 127.6 | 51% | 0.51 | 69% | 0.685 | S | S | . | * | trans | 46.3 | 93.2 | 170.9 | 60.9 | 0 | 0 | 0 | 0 | 116.6 | V68 V72 A73 | V68-S70 PolarHBondContact O-N 2.8Å; S70-V72 PolarHBondContact O-N 2.76Å; S70-A73 PolarHBondContact O-N 3.17Å | ||
| 71 | Q | 58.9 | Low | 64.5 | Low | 145 Ų | 145 | 132.8 Ų | 132.8 | 68% | 0.678 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -59.2 | -11.2 | 170.4 | -170.5 | 164.5 | -25 | 0 | 0 | 114.1 | A73 L74 | Q71-A73 VanDerWaalsContact C-N 3.27Å; Q71-A73 PolarHBondContact O-N 2.95Å; Q71-L74 PolarHBondContact O-N 3.48Å |
| 72 | V | 57.8 | Low | 62.5 | Low | 121 Ų | 121 | 132.4 Ų | 132.4 | 73% | 0.733 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -61 | -28.7 | 176 | -177.6 | 0 | 0 | 0 | 0 | 113.2 | S70 | S70-V72 PolarHBondContact O-N 2.76Š|
| 73 | A | 50.8 | Low | 60.5 | Low | 74 Ų | 74 | 134.9 Ų | 134.9 | 61% | 0.612 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -78.3 | -27.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114 | S70 Q71 | S70-A73 PolarHBondContact O-N 3.17Å; Q71-A73 VanDerWaalsContact C-N 3.27Å; Q71-A73 PolarHBondContact O-N 2.95Å |
| 74 | L | 54.1 | Low | 58.3 | Low | 133 Ų | 133 | 135 Ų | 135 | 70% | 0.696 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -86.2 | -14 | -171.2 | -79.9 | 163 | 0 | 0 | 0 | 114.4 | Q71 K76 | Q71-L74 PolarHBondContact O-N 3.48Å; L74-K76 VanDerWaalsContact C-N 3.26Å; L74-K76 PolarHBondContact O-N 2.68Å |
| 75 | S | 57 | Low | 56.1 | Low | 102 Ų | 102 | 136.9 Ų | 136.9 | 71% | 0.713 | 74% | 0.74 | S | S | * | * | G | 310 helix | trans | -78.7 | -3 | -179.4 | 65.8 | 0 | 0 | 0 | 0 | 114.7 | ||
| 76 | K | 55.4 | Low | 54.4 | Low | 188 Ų | 188 | 141.7 Ų | 141.7 | 82% | 0.817 | 74% | 0.744 | S | S | * | * | G | 310 helix | trans | -106.2 | -1.8 | -175 | -72 | -159.1 | 173.2 | -171.1 | 0 | 116.1 | L74 | L74-K76 VanDerWaalsContact C-N 3.26Å; L74-K76 PolarHBondContact O-N 2.68Å |
| 77 | Q | 58.3 | Low | 52.5 | Low | 167 Ų | 167 | 144.6 Ų | 144.6 | 78% | 0.78 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -94.7 | 118 | 174.2 | -72.7 | -172.2 | -19.5 | 0 | 0 | 111 | ||
| 78 | Q | 49.3 | Very low | 51 | Low | 179 Ų | 179 | 142.7 Ų | 142.7 | 84% | 0.836 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 144.8 | 171.4 | -70.7 | -155.1 | 15.9 | 0 | 0 | 111.6 | V80 | Q78-V80 PolarHBondContact O-N 2.83Š|
| 79 | P | 44.3 | Very low | 48.7 | Very low | 131 Ų | 131 | 146.6 Ų | 146.6 | 85% | 0.851 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 122.3 | 177.7 | -18.9 | 32.6 | 0 | 0 | 0 | 113.1 | ||
| 80 | V | 40.9 | Very low | 47.1 | Very low | 140 Ų | 140 | 143.9 Ų | 143.9 | 85% | 0.848 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 129.4 | 174.2 | 178.3 | 0 | 0 | 0 | 0 | 110.4 | Q78 | Q78-V80 PolarHBondContact O-N 2.83Š|
| 81 | R | 43.4 | Very low | 45.8 | Very low | 239 Ų | 239 | 147.4 Ų | 147.4 | 90% | 0.902 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 143.1 | 174.1 | -94.9 | -176.5 | 166.1 | 112.4 | -5.9 | 111.6 | ||
| 82 | V | 43.9 | Very low | 45.2 | Very low | 138 Ų | 138 | 146.5 Ų | 146.5 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | trans | -107.6 | 130.5 | 173.8 | -79.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 83 | P | 41.9 | Very low | 43.9 | Very low | 130 Ų | 130 | 143.9 Ų | 143.9 | 84% | 0.844 | 79% | 0.793 | S | S | * | * | trans | -87.7 | 161.5 | 167.6 | -9.1 | 28.1 | 0 | 0 | 0 | 113.1 | ||||
| 84 | A | 41.8 | Very low | 43.4 | Very low | 89 Ų | 89 | 147.5 Ų | 147.5 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | trans | -123.4 | -169 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 85 | L | 41.3 | Very low | 43 | Very low | 161 Ų | 161 | 146.4 Ų | 146.4 | 84% | 0.843 | 81% | 0.808 | S | S | * | * | trans | 89.2 | 151.8 | 172.6 | -48 | 161.4 | 0 | 0 | 0 | 114.5 | ||||
| 86 | K | 38.9 | Very low | 41.9 | Very low | 196 Ų | 196 | 150.1 Ų | 150.1 | 85% | 0.852 | 82% | 0.819 | S | S | * | * | cis | -142.2 | 168.6 | 18 | -68.4 | 172.7 | -178.7 | 176.1 | 0 | 112.5 | ||||
| 87 | K | 41.4 | Very low | 41.1 | Very low | 206 Ų | 206 | 152.6 Ų | 152.6 | 90% | 0.896 | 82% | 0.823 | S | S | * | * | trans | -121 | 151.4 | 171.6 | -61.6 | 177.4 | -178.7 | 177.7 | 0 | 111.6 | ||||
| 88 | P | 40.9 | Very low | 40 | Very low | 118 Ų | 118 | 150 Ų | 150 | 77% | 0.766 | 82% | 0.821 | S | S | * | * | trans | -147.3 | -177.2 | 131.5 | 32 | -12.3 | 0 | 0 | 0 | 113.5 | ||||
| 89 | L | 32.8 | Very low | 39 | Very low | 152 Ų | 152 | 147.6 Ų | 147.6 | 80% | 0.796 | 82% | 0.819 | S | S | * | * | cis | -162.7 | 162.5 | -44.8 | -101.3 | 170.6 | 0 | 0 | 0 | 110 | ||||
| 90 | L | 35.6 | Very low | 38.3 | Very low | 139 Ų | 139 | 152.1 Ų | 152.1 | 73% | 0.728 | 82% | 0.819 | S | S | * | * | trans | 56 | 102.6 | 152.1 | -63.7 | 160.2 | 0 | 0 | 0 | 122.9 | ||||
| 91 | N | 32.2 | Very low | 38.1 | Very low | 147 Ų | 147 | 155 Ų | 155 | 79% | 0.786 | 82% | 0.82 | S | S | * | * | 31.8 | 165.6 | 113.1 | -67.5 | -25.5 | 0 | 0 | 0 | 123.2 | |||||
| 92 | P | 47.9 | Very low | 38 | Very low | 126 Ų | 126 | 149 Ų | 149 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | cis | -137.2 | -178.4 | -29 | 37.7 | -19.3 | 0 | 0 | 0 | 114.7 | ||||
| 93 | G | 29.8 | Very low | 37.6 | Very low | 67 Ų | 67 | 148.2 Ų | 148.2 | 69% | 0.691 | 81% | 0.808 | S | S | * | * | trans | 151.3 | 90.3 | 155.5 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 94 | T | 39.2 | Very low | 37 | Very low | 149 Ų | 149 | 148.5 Ų | 148.5 | 91% | 0.914 | 81% | 0.807 | S | S | * | * | trans | 53.2 | 157.1 | 141.3 | 40.6 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 95 | P | 45.8 | Very low | 37 | Very low | 111 Ų | 111 | 152.1 Ų | 152.1 | 72% | 0.721 | 81% | 0.809 | S | S | * | * | trans | -126.4 | 158.4 | -150.6 | 42.2 | -28.4 | 0 | 0 | 0 | 117.2 | ||||
| 96 | L | 33.8 | Very low | 36.7 | Very low | 180 Ų | 180 | 149.9 Ų | 149.9 | 94% | 0.942 | 80% | 0.804 | S | S | * | * | trans | -145.1 | 143.3 | 161.3 | -72.1 | 178.4 | 0 | 0 | 0 | 113.2 | ||||
| 97 | R | 39.9 | Very low | 36.4 | Very low | 239 Ų | 239 | 145.4 Ų | 145.4 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | trans | -76.7 | 165.8 | 175.2 | -66.3 | 171.5 | 165 | 168 | -6.3 | 111.2 | ||||
| 98 | P | 35 | Very low | 36.2 | Very low | 112 Ų | 112 | 141.6 Ų | 141.6 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | -152.4 | 137.3 | 105.3 | 37.3 | -18.7 | 0 | 0 | 0 | 118.7 | |||||
| 99 | T | 27.4 | Very low | 35.7 | Very low | 129 Ų | 129 | 145.4 Ų | 145.4 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | 56 | 119.6 | 129.9 | 68.6 | 0 | 0 | 0 | 0 | 124.2 | |||||
| 100 | R | 30.7 | Very low | 36.2 | Very low | 226 Ų | 226 | 144.5 Ų | 144.5 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -56.1 | 141.3 | 160.5 | 177.6 | -175.4 | -171.4 | 166.7 | 3.6 | 114 | ||||
| 101 | K | 37.2 | Very low | 36.1 | Very low | 201 Ų | 201 | 147 Ų | 147 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | trans | -139.9 | 132.2 | 154.2 | -72.9 | -162.7 | 176.4 | -174.2 | 0 | 111.8 | ||||
| 102 | T | 40.4 | Very low | 36.3 | Very low | 114 Ų | 114 | 143.2 Ų | 143.2 | 70% | 0.699 | 81% | 0.805 | S | S | * | * | trans | -92.8 | 154.6 | 177.5 | -32.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 103 | P | 36.5 | Very low | 36.3 | Very low | 120 Ų | 120 | 141.3 Ų | 141.3 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | trans | -137.6 | 121.4 | 139.1 | 25.5 | -6.2 | 0 | 0 | 0 | 115 | ||||
| 104 | T | 29.4 | Very low | 37.1 | Very low | 136 Ų | 136 | 145 Ų | 145 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | trans | 13.6 | 132.8 | 141.9 | -41.1 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 105 | Q | 40.1 | Very low | 37.9 | Very low | 166 Ų | 166 | 140.2 Ų | 140.2 | 78% | 0.776 | 77% | 0.768 | S | S | * | * | trans | -66.2 | 165.6 | 171.1 | -73.2 | -85.4 | -6.1 | 0 | 0 | 115.1 | ||||
| 106 | P | 35 | Very low | 38.8 | Very low | 113 Ų | 113 | 136.6 Ų | 136.6 | 73% | 0.734 | 74% | 0.742 | S | S | * | * | -138.7 | 126.8 | 120.2 | 34.9 | -21.9 | 0 | 0 | 0 | 116.3 | |||||
| 107 | S | 32.7 | Very low | 40.4 | Very low | 103 Ų | 103 | 130.2 Ų | 130.2 | 72% | 0.72 | 71% | 0.711 | S | S | * | * | trans | 33.8 | 122.5 | 149.3 | 62.9 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 108 | P | 38.3 | Very low | 41.8 | Very low | 125 Ų | 125 | 126 Ų | 126 | 81% | 0.812 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 155.8 | 165.5 | 35.9 | -33.4 | 0 | 0 | 0 | 113.5 | ||
| 109 | K | 30.6 | Very low | 43.5 | Very low | 198 Ų | 198 | 123.6 Ų | 123.6 | 86% | 0.861 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 140.8 | 156.3 | -94 | 177 | 173.4 | 175.7 | 0 | 108.6 | ||
| 110 | P | 42.1 | Very low | 45.7 | Very low | 134 Ų | 134 | 118.3 Ų | 118.3 | 87% | 0.87 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 117.5 | 179.1 | 32.5 | -31.3 | 0 | 0 | 0 | 110.4 | ||
| 111 | E | 33.3 | Very low | 47.7 | Very low | 191 Ų | 191 | 110 Ų | 110 | 89% | 0.893 | 62% | 0.621 | S | S | * | * | trans | -132.3 | 129.4 | 167.2 | -169.2 | 158.2 | -161.8 | 0 | 0 | 108.2 | ||||
| 112 | G | 37.5 | Very low | 49.7 | Very low | 68 Ų | 68 | 103.4 Ų | 103.4 | 70% | 0.701 | 60% | 0.6 | S | S | * | * | trans | 30.8 | 106 | 171.6 | 0 | 0 | 0 | 0 | 0 | 119 | E114 | G112-E114 PolarHBondContact O-N 2.71Š| ||
| 113 | A | 47.8 | Very low | 51.4 | Low | 85 Ų | 85 | 99.5 Ų | 99.5 | 70% | 0.702 | 58% | 0.575 | S | S | * | * | trans | -70.1 | 74.6 | 159.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 114 | E | 46.8 | Very low | 53.3 | Low | 144 Ų | 144 | 97.3 Ų | 97.3 | 67% | 0.673 | 56% | 0.556 | S | S | * | * | trans | -84.9 | 132 | 155.2 | -164.4 | 163.8 | 163.7 | 0 | 0 | 106.8 | G112 | G112-E114 PolarHBondContact O-N 2.71Š| ||
| 115 | L | 56.4 | Low | 55.5 | Low | 50 Ų | 50 | 93.3 Ų | 93.3 | 26% | 0.262 | 53% | 0.534 | S | S | . | . | trans | -49.9 | 154.4 | 172.9 | -67.2 | 164.1 | 0 | 0 | 0 | 108.9 | V117 F287 P294 L297 | L115-V117 HydrophobicContact CB-CG2 4.11Å; L115-V117 VanDerWaalsContact O-CG2 3.32Å; L115-V117 WeakPolarHBondContact O-CG2 3.24Å; L115-V117 PolarHBondContact O-N 2.9Å; L115-F287 HydrophobicContact CB-CE2 4.37Å; L115-F287 HydrophobicContact CD1-CD2 4.28Å; L115-F287 HydrophobicContact CD1-CE2 4.49Å; L115-P294 HydrophobicContact CD2-CB 3.94Å; L115-L297 HydrophobicContact CB-CD2 4.32Å; L115-L297 HydrophobicContact CD2-CD2 3.91Å | ||
| 116 | D | 64.3 | Low | 56.4 | Low | 34 Ų | 34 | 89.2 Ų | 89.2 | 18% | 0.182 | 52% | 0.517 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | 37.8 | -170.7 | -157 | 26 | 0 | 0 | 0 | 113.9 | E118 R119 L120 L297 W362 | D116-E118 VanDerWaalsContact C-N 3.33Å; D116-R119 PolarHBondContact O-N 3.13Å; D116-R119 WeakPolarHBondContact OD1-CB 3.3Å; D116-R119 WeakPolarHBondContact OD1-CD 3.42Å; D116-R119 WeakPolarHBondContact OD2-CB 2.95Å; D116-R119 VanDerWaalsContact OD2-CD 3.3Å; D116-R119 WeakPolarHBondContact OD2-CD 3.33Å; D116-R119 IonicContact OD2-CZ 3.75Å; D116-R119 IonicContact OD2-NE 3.84Å; D116-R119 IonicContact OD2-NH1 2.9Å; D116-R119 PolarHBondContact OD2-NH1 3.35Å; D116-L120 WeakPolarHBondContact O-CB 3.44Å; D116-L120 PolarHBondContact O-N 3.5Å; D116-L297 HydrophobicContact CB-CD2 3.73Å; D116-L297 HydrophobicContact CB-CG 4.12Å; D116-W362 HydrophobicContact CB-CZ2 4.09Å; D116-W362 WeakPolarHBondContact OD2-CZ2 3.24Å |
| 117 | V | 66.3 | Low | 57.2 | Low | 47 Ų | 47 | 89.9 Ų | 89.9 | 29% | 0.285 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64 | -35.6 | 177 | -168.7 | 0 | 0 | 0 | 0 | 110.5 | L115 R119 S121 L283 | L115-V117 HydrophobicContact CB-CG2 4.11Å; L115-V117 VanDerWaalsContact O-CG2 3.32Å; L115-V117 WeakPolarHBondContact O-CG2 3.24Å; L115-V117 PolarHBondContact O-N 2.9Å; V117-R119 VanDerWaalsContact C-N 3.34Å; V117-S121 WeakPolarHBondContact O-CB 3.5Å; V117-S121 PolarHBondContact O-N 3.28Å; V117-S121 PolarHBondContact O-OG 2.94Å; V117-L283 HydrophobicContact CB-CD2 4.39Å; V117-L283 HydrophobicContact CG1-CD2 4.12Å; V117-L283 HydrophobicContact CG2-CD2 3.47Å; V117-L283 VanDerWaalsContact CG2-CD2 3.47Å |
| 118 | E | 70.3 | Confident | 57.9 | Low | 149 Ų | 149 | 89 Ų | 89 | 70% | 0.696 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.5 | -40.5 | 173.6 | -63.8 | -158.4 | 146.3 | 0 | 0 | 111.4 | D116 S121 S122 | D116-E118 VanDerWaalsContact C-N 3.33Å; E118-S121 WeakPolarHBondContact CA-OG 3.32Å; E118-S121 PolarHBondContact O-OG 3.3Å; E118-S122 VanDerWaalsContact O-CB 3.24Å; E118-S122 WeakPolarHBondContact O-CB 3.49Å; E118-S122 PolarHBondContact O-N 2.91Å; E118-S122 PolarHBondContact O-OG 3.35Å |
| 119 | R | 69.6 | Low | 58 | Low | 62 Ų | 62 | 90 Ų | 90 | 23% | 0.234 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -78.4 | -36.5 | 176.9 | -171.6 | 154.3 | 161.4 | -135.4 | 19.2 | 112.6 | D116 V117 S122 L123 | D116-R119 PolarHBondContact O-N 3.13Å; D116-R119 WeakPolarHBondContact OD1-CB 3.3Å; D116-R119 WeakPolarHBondContact OD1-CD 3.42Å; D116-R119 WeakPolarHBondContact OD2-CB 2.95Å; D116-R119 VanDerWaalsContact OD2-CD 3.3Å; D116-R119 WeakPolarHBondContact OD2-CD 3.33Å; D116-R119 IonicContact OD2-CZ 3.75Å; D116-R119 IonicContact OD2-NE 3.84Å; D116-R119 IonicContact OD2-NH1 2.9Å; D116-R119 PolarHBondContact OD2-NH1 3.35Å; V117-R119 VanDerWaalsContact C-N 3.34Å; R119-S122 CarbonylContact O-C 3.52Å; R119-S122 PolarHBondContact O-N 3.28Å; R119-L123 HydrophobicContact CG-CD1 4.4Å; R119-L123 WeakPolarHBondContact O-CB 3.47Å; R119-L123 VanDerWaalsContact O-CG 3.25Å; R119-L123 WeakPolarHBondContact O-CG 3.38Å; R119-L123 PolarHBondContact O-N 2.92Å |
| 120 | L | 75.4 | Confident | 58.1 | Low | 19 Ų | 19 | 83.8 Ų | 83.8 | 10% | 0.099 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -63.1 | -43.9 | 172 | -179.6 | 59.1 | 0 | 0 | 0 | 110.8 | D116 L123 I124 L283 F287 V359 W362 | D116-L120 WeakPolarHBondContact O-CB 3.44Å; D116-L120 PolarHBondContact O-N 3.5Å; L120-L123 PolarHBondContact O-N 2.93Å; L120-I124 HydrophobicContact CD1-CD1 3.94Å; L120-I124 HydrophobicContact CD1-CG1 4.45Å; L120-I124 HydrophobicContact CG-CD1 3.85Å; L120-I124 WeakPolarHBondContact O-CB 3.33Å; L120-I124 WeakPolarHBondContact O-CD1 3.43Å; L120-I124 WeakPolarHBondContact O-CG1 3.43Å; L120-I124 PolarHBondContact O-N 3.48Å; L120-L283 HydrophobicContact CD2-CD1 4.24Å; L120-F287 HydrophobicContact CD2-CE1 4.33Å; L120-F287 HydrophobicContact CD2-CZ 3.94Å; L120-V359 HydrophobicContact CD1-CG1 4.24Å; L120-V359 HydrophobicContact CD1-CG2 3.85Å; L120-W362 HydrophobicContact CD1-CZ3 4.38Å |
| 121 | S | 72.2 | Confident | 57.6 | Low | 52 Ų | 52 | 81.4 Ų | 81.4 | 36% | 0.364 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.8 | -31.9 | 174 | 62.3 | 0 | 0 | 0 | 0 | 112.4 | V117 E118 I124 S125 | V117-S121 WeakPolarHBondContact O-CB 3.5Å; V117-S121 PolarHBondContact O-N 3.28Å; V117-S121 PolarHBondContact O-OG 2.94Å; E118-S121 WeakPolarHBondContact CA-OG 3.32Å; E118-S121 PolarHBondContact O-OG 3.3Å; S121-I124 CarbonylContact O-C 3.51Å; S121-I124 PolarHBondContact O-N 3.48Å; S121-S125 WeakPolarHBondContact O-CB 3.38Å; S121-S125 PolarHBondContact O-N 3.14Å; S121-S125 PolarHBondContact O-OG 2.92Å |
| 122 | S | 78 | Confident | 57.7 | Low | 61 Ų | 61 | 80.7 Ų | 80.7 | 43% | 0.427 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -70.5 | -25.2 | 169.2 | -61.3 | 0 | 0 | 0 | 0 | 113.8 | E118 R119 | E118-S122 VanDerWaalsContact O-CB 3.24Å; E118-S122 WeakPolarHBondContact O-CB 3.49Å; E118-S122 PolarHBondContact O-N 2.91Å; E118-S122 PolarHBondContact O-OG 3.35Å; R119-S122 CarbonylContact O-C 3.52Å; R119-S122 PolarHBondContact O-N 3.28Å |
| 123 | L | 77.3 | Confident | 57.4 | Low | 32 Ų | 32 | 82.8 Ų | 82.8 | 17% | 0.168 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -79.8 | -29.7 | 171.8 | -75.4 | 162.4 | 0 | 0 | 0 | 111.9 | R119 L120 R358 W362 | R119-L123 HydrophobicContact CG-CD1 4.4Å; R119-L123 WeakPolarHBondContact O-CB 3.47Å; R119-L123 VanDerWaalsContact O-CG 3.25Å; R119-L123 WeakPolarHBondContact O-CG 3.38Å; R119-L123 PolarHBondContact O-N 2.92Å; L120-L123 PolarHBondContact O-N 2.93Å; L123-R358 HydrophobicContact CD2-CB 4.39Å; L123-W362 HydrophobicContact CD1-CB 3.88Å; L123-W362 HydrophobicContact CD1-CD2 4.15Å; L123-W362 HydrophobicContact CD1-CG 3.66Å |
| 124 | I | 76.3 | Confident | 56.7 | Low | 74 Ų | 74 | 84.1 Ų | 84.1 | 38% | 0.379 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -85.1 | -21.7 | 176.9 | -68.2 | 165.7 | 0 | 0 | 0 | 112.4 | L120 S121 R355 V359 | L120-I124 HydrophobicContact CD1-CD1 3.94Å; L120-I124 HydrophobicContact CD1-CG1 4.45Å; L120-I124 HydrophobicContact CG-CD1 3.85Å; L120-I124 WeakPolarHBondContact O-CB 3.33Å; L120-I124 WeakPolarHBondContact O-CD1 3.43Å; L120-I124 WeakPolarHBondContact O-CG1 3.43Å; L120-I124 PolarHBondContact O-N 3.48Å; S121-I124 CarbonylContact O-C 3.51Å; S121-I124 PolarHBondContact O-N 3.48Å; I124-R355 WeakPolarHBondContact O-CD 3.04Å; I124-V359 HydrophobicContact CG1-CG2 4.16Å |
| 125 | S | 74.4 | Confident | 56.2 | Low | 53 Ų | 53 | 81.7 Ų | 81.7 | 37% | 0.371 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -102.8 | 150.1 | 176.7 | -52.1 | 0 | 0 | 0 | 0 | 110.1 | S121 L127 | S121-S125 WeakPolarHBondContact O-CB 3.38Å; S121-S125 PolarHBondContact O-N 3.14Å; S121-S125 PolarHBondContact O-OG 2.92Å; S125-L127 PolarHBondContact O-N 3.22Å |
| 126 | D | 59.7 | Low | 55.3 | Low | 79 Ų | 79 | 88.6 Ų | 88.6 | 42% | 0.422 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -80 | 24.4 | -163.3 | -64.2 | 2.5 | 0 | 0 | 0 | 114.5 | G349 V350 | D126-G349 WeakPolarHBondContact OD2-CA 3.41Å; D126-V350 HydrophobicContact CB-CG2 3.92Å; D126-V350 VanDerWaalsContact OD1-CB 3.22Å; D126-V350 WeakPolarHBondContact OD1-CB 3.46Å; D126-V350 VanDerWaalsContact OD1-CG2 3.28Å; D126-V350 WeakPolarHBondContact OD1-CG2 3.37Å; D126-V350 PolarHBondContact OD2-N 3.1Å |
| 127 | L | 52.2 | Low | 54.1 | Low | 127 Ų | 127 | 92.1 Ų | 92.1 | 67% | 0.665 | 55% | 0.547 | S | S | * | . | trans | -103.5 | 114.9 | -171.7 | -76.5 | 140.1 | 0 | 0 | 0 | 111.3 | S125 N129 | S125-L127 PolarHBondContact O-N 3.22Å; L127-N129 PolarHBondContact O-N 2.98Å | ||
| 128 | P | 46.8 | Very low | 52.9 | Low | 85 Ų | 85 | 96 Ų | 96 | 55% | 0.552 | 57% | 0.573 | S | S | * | * | trans | -57.9 | 136.9 | 145 | 29.1 | -32.5 | 0 | 0 | 0 | 107.2 | G130 I307 | P128-G130 VanDerWaalsContact C-N 3.3Å; P128-G130 PolarHBondContact O-N 3.22Å; P128-I307 HydrophobicContact CB-CG2 4.09Å | ||
| 129 | N | 40.3 | Very low | 51.3 | Low | 146 Ų | 146 | 93.1 Ų | 93.1 | 78% | 0.781 | 58% | 0.575 | S | S | * | * | trans | -60.3 | 91.3 | 177.7 | -176.1 | 6.2 | 0 | 0 | 0 | 110.1 | L127 A131 | L127-N129 PolarHBondContact O-N 2.98Å; N129-A131 PolarHBondContact O-N 2.65Å; N129-A131 VanDerWaalsContact O-N 3.14Å | ||
| 130 | G | 33.9 | Very low | 49.8 | Very low | 67 Ų | 67 | 95.9 Ų | 95.9 | 69% | 0.691 | 60% | 0.601 | S | S | * | * | trans | -76.4 | 97.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | P128 | P128-G130 VanDerWaalsContact C-N 3.3Å; P128-G130 PolarHBondContact O-N 3.22Å | ||
| 131 | A | 31.7 | Very low | 48 | Very low | 85 Ų | 85 | 105 Ų | 105 | 70% | 0.702 | 64% | 0.64 | S | S | * | * | trans | 17.2 | 113.8 | 167.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | N129 S133 | N129-A131 PolarHBondContact O-N 2.65Å; N129-A131 VanDerWaalsContact O-N 3.14Å; A131-S133 PolarHBondContact O-N 2.81Å; A131-S133 VanDerWaalsContact O-N 3.09Å | ||
| 132 | Q | 35.3 | Very low | 46.2 | Very low | 176 Ų | 176 | 109 Ų | 109 | 82% | 0.822 | 66% | 0.662 | S | S | * | * | trans | -42.5 | 122.4 | 155.3 | -64.1 | 178 | 12.4 | 0 | 0 | 109 | P134 | Q132-P134 WeakPolarHBondContact O-CD 3.09Å; Q132-P134 VanDerWaalsContact O-N 3.16Å | ||
| 133 | S | 29.5 | Very low | 44.3 | Very low | 112 Ų | 112 | 115.1 Ų | 115.1 | 78% | 0.783 | 68% | 0.681 | S | S | * | * | trans | -64.1 | 111.1 | 177.8 | 179 | 0 | 0 | 0 | 0 | 109.5 | A131 | A131-S133 PolarHBondContact O-N 2.81Å; A131-S133 VanDerWaalsContact O-N 3.09Å | ||
| 134 | P | 35 | Very low | 42.2 | Very low | 112 Ų | 112 | 119.9 Ų | 119.9 | 73% | 0.727 | 71% | 0.714 | S | S | * | * | trans | -73.3 | 141.9 | 169 | 33.1 | -31.5 | 0 | 0 | 0 | 108.3 | Q132 K136 | Q132-P134 WeakPolarHBondContact O-CD 3.09Å; Q132-P134 VanDerWaalsContact O-N 3.16Å; P134-K136 PolarHBondContact O-N 3.48Å | ||
| 135 | A | 35.1 | Very low | 40.4 | Very low | 94 Ų | 94 | 127.7 Ų | 127.7 | 78% | 0.777 | 74% | 0.738 | S | S | * | * | trans | -50.9 | 136.4 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 136 | K | 37.3 | Very low | 39 | Very low | 194 Ų | 194 | 130.6 Ų | 130.6 | 84% | 0.843 | 76% | 0.756 | S | S | * | * | trans | -15.8 | 114.4 | 158.7 | -179.8 | -178.8 | -178 | 178.5 | 0 | 114.2 | P134 | P134-K136 PolarHBondContact O-N 3.48Š| ||
| 137 | P | 40.6 | Very low | 38.2 | Very low | 109 Ų | 109 | 132.5 Ų | 132.5 | 71% | 0.708 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 146.9 | 171.2 | 28.6 | -33.6 | 0 | 0 | 0 | 110.9 | ||
| 138 | P | 39.2 | Very low | 37.9 | Very low | 128 Ų | 128 | 131.7 Ų | 131.7 | 83% | 0.831 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 138.4 | 178.9 | 28.7 | -34 | 0 | 0 | 0 | 111.8 | ||
| 139 | A | 37.4 | Very low | 37.3 | Very low | 89 Ų | 89 | 139 Ų | 139 | 74% | 0.736 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 148.3 | 180 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 140 | P | 38 | Very low | 37.4 | Very low | 119 Ų | 119 | 137.5 Ų | 137.5 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 142.1 | 174.8 | 28.3 | -34.2 | 0 | 0 | 0 | 111.7 | V142 | P140-V142 PolarHBondContact O-N 2.79Š|
| 141 | K | 37.9 | Very low | 37.4 | Very low | 212 Ų | 212 | 142.2 Ų | 142.2 | 92% | 0.922 | 80% | 0.799 | S | S | * | * | trans | -67.3 | 110.4 | -177 | -65.2 | 175.2 | 179.5 | 176.3 | 0 | 111.5 | ||||
| 142 | V | 33.5 | Very low | 37.3 | Very low | 135 Ų | 135 | 148.9 Ų | 148.9 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 119.2 | 168.1 | 179.6 | 0 | 0 | 0 | 0 | 109.3 | P140 | P140-V142 PolarHBondContact O-N 2.79Š|
| 143 | K | 39.4 | Very low | 37.1 | Very low | 190 Ų | 190 | 145 Ų | 145 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 141.4 | 169.5 | -77.1 | 179.5 | 173.5 | 179.2 | 0 | 109.9 | ||
| 144 | P | 33.5 | Very low | 37.2 | Very low | 132 Ų | 132 | 145.9 Ų | 145.9 | 86% | 0.857 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 145.3 | 175.9 | -18.1 | 31.4 | 0 | 0 | 0 | 112.2 | ||
| 145 | R | 36.9 | Very low | 37 | Very low | 238 Ų | 238 | 144.8 Ų | 144.8 | 90% | 0.898 | 81% | 0.805 | S | S | * | * | trans | -110.6 | 135.4 | 177.2 | -159.8 | -174.6 | -163.3 | -149.3 | 5.9 | 109.3 | ||||
| 146 | P | 45.1 | Very low | 36.9 | Very low | 114 Ų | 114 | 146.8 Ų | 146.8 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | trans | -85 | 157.3 | 173.2 | 33.8 | -33.7 | 0 | 0 | 0 | 112.4 | ||||
| 147 | P | 43.4 | Very low | 37.1 | Very low | 119 Ų | 119 | 143.5 Ų | 143.5 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -101.3 | -175.8 | 174.8 | 44.6 | -37.7 | 0 | 0 | 0 | 111.4 | ||||
| 148 | P | 47 | Very low | 37.4 | Very low | 109 Ų | 109 | 143.7 Ų | 143.7 | 71% | 0.708 | 81% | 0.806 | S | S | * | * | -135.5 | 172.7 | -81.2 | 39.5 | -21.7 | 0 | 0 | 0 | 116.3 | |||||
| 149 | R | 32.8 | Very low | 37.2 | Very low | 238 Ų | 238 | 149 Ų | 149 | 90% | 0.898 | 81% | 0.809 | S | S | * | * | trans | 75.9 | 163.6 | 165.7 | -58.4 | -176.3 | 176.5 | 178.4 | -1.1 | 117.6 | ||||
| 150 | P | 43.8 | Very low | 37.1 | Very low | 116 Ų | 116 | 152.4 Ų | 152.4 | 75% | 0.753 | 81% | 0.814 | S | S | * | * | cis | -129.2 | 149.4 | -11.2 | 28.4 | -7.7 | 0 | 0 | 0 | 117.2 | ||||
| 151 | D | 33.8 | Very low | 36.8 | Very low | 166 Ų | 166 | 156 Ų | 156 | 89% | 0.888 | 82% | 0.817 | S | S | * | * | trans | 63.6 | 157 | 137.3 | -147.3 | 9.4 | 0 | 0 | 0 | 124.1 | ||||
| 152 | R | 29.1 | Very low | 36.4 | Very low | 224 Ų | 224 | 150 Ų | 150 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | 88.1 | 100.3 | 158.6 | -156.9 | -179 | -167.4 | 114.8 | -1 | 121.6 | ||||
| 153 | A | 31.1 | Very low | 36.2 | Very low | 95 Ų | 95 | 150 Ų | 150 | 79% | 0.785 | 81% | 0.808 | S | S | * | * | trans | 171.1 | 116.4 | 135 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 154 | V | 32.3 | Very low | 35.8 | Very low | 130 Ų | 130 | 145 Ų | 145 | 79% | 0.788 | 80% | 0.802 | S | S | * | * | 70.4 | 103.9 | 58.2 | -176.2 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 155 | A | 29.9 | Very low | 36.4 | Very low | 90 Ų | 90 | 144.5 Ų | 144.5 | 74% | 0.744 | 80% | 0.798 | S | S | * | * | trans | 60 | 157.5 | 157.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 156 | T | 32.1 | Very low | 36.1 | Very low | 135 Ų | 135 | 137.4 Ų | 137.4 | 83% | 0.828 | 79% | 0.791 | S | S | * | * | cis | -139.5 | 158.1 | 17.4 | 43.9 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 157 | T | 42.5 | Very low | 35.4 | Very low | 126 Ų | 126 | 138.1 Ų | 138.1 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -67 | -171.9 | 162.1 | 52.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 158 | P | 47.6 | Very low | 35 | Very low | 113 Ų | 113 | 138.3 Ų | 138.3 | 73% | 0.734 | 79% | 0.792 | S | S | * | * | cis | -130.2 | -168.8 | -40 | 29.2 | -8.7 | 0 | 0 | 0 | 111.5 | ||||
| 159 | R | 33.5 | Very low | 34.3 | Very low | 238 Ų | 238 | 139.9 Ų | 139.9 | 90% | 0.898 | 80% | 0.795 | S | S | * | * | 150.5 | 122.2 | 109.9 | -170.7 | 164 | 178.8 | 166.1 | -2.7 | 113.4 | |||||
| 160 | L | 36.1 | Very low | 34.3 | Very low | 161 Ų | 161 | 134.3 Ų | 134.3 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | trans | -79.1 | 152.7 | 170.1 | -62.7 | 161.1 | 0 | 0 | 0 | 111.1 | ||||
| 161 | K | 31.6 | Very low | 34.5 | Very low | 195 Ų | 195 | 133.8 Ų | 133.8 | 85% | 0.848 | 78% | 0.784 | S | S | * | * | 131.6 | 122.1 | 111.5 | -166 | 153.9 | -176.9 | 171.3 | 0 | 116.4 | |||||
| 162 | A | 29.7 | Very low | 34.2 | Very low | 85 Ų | 85 | 132.3 Ų | 132.3 | 70% | 0.702 | 78% | 0.78 | S | S | * | * | trans | 58 | 159.2 | 152.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 163 | T | 29.5 | Very low | 34.4 | Very low | 137 Ų | 137 | 127.3 Ų | 127.3 | 84% | 0.84 | 78% | 0.778 | S | S | * | * | cis | -158.6 | 161.9 | 30.7 | -47.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 164 | A | 30.8 | Very low | 34.9 | Very low | 84 Ų | 84 | 129 Ų | 129 | 69% | 0.694 | 78% | 0.781 | S | S | * | * | trans | -75.8 | 178.5 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 165 | P | 45.6 | Very low | 34.7 | Very low | 121 Ų | 121 | 126.5 Ų | 126.5 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | -151.2 | 169.8 | 60.4 | 40.2 | -18.5 | 0 | 0 | 0 | 118.9 | |||||
| 166 | A | 29.8 | Very low | 34.8 | Very low | 89 Ų | 89 | 126.9 Ų | 126.9 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | 39.5 | 135.5 | 143.8 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 167 | T | 30.9 | Very low | 35.3 | Very low | 130 Ų | 130 | 126.4 Ų | 126.4 | 80% | 0.798 | 78% | 0.784 | S | S | * | * | -178 | 127.3 | 111.2 | -72.3 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 168 | V | 35.6 | Very low | 34.9 | Very low | 122 Ų | 122 | 124.9 Ų | 124.9 | 74% | 0.739 | 79% | 0.785 | S | S | * | * | trans | 22 | 128.7 | 142.6 | -173.2 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 169 | D | 32.5 | Very low | 34.3 | Very low | 143 Ų | 143 | 124.6 Ų | 124.6 | 77% | 0.765 | 79% | 0.792 | S | S | * | * | -164.1 | -176.4 | 65.4 | -141.2 | -37.9 | 0 | 0 | 0 | 115.1 | |||||
| 170 | T | 32.8 | Very low | 34.5 | Very low | 120 Ų | 120 | 117.1 Ų | 117.1 | 74% | 0.736 | 79% | 0.789 | S | S | * | * | trans | -108.3 | -167.8 | -174.3 | 58.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 171 | P | 47 | Very low | 34.9 | Very low | 106 Ų | 106 | 116 Ų | 116 | 69% | 0.688 | 79% | 0.789 | S | S | * | * | cis | -143.4 | -167.5 | 3 | 36.2 | -11 | 0 | 0 | 0 | 117.4 | ||||
| 172 | V | 28.1 | Very low | 35.5 | Very low | 135 Ų | 135 | 113.5 Ų | 113.5 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | 74.6 | 137.5 | 161.1 | 179.3 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 173 | C | 33.4 | Very low | 36.5 | Very low | 119 Ų | 119 | 120.6 Ų | 120.6 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | cis | 176.3 | 176.5 | -22.4 | -109.8 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 174 | P | 42.1 | Very low | 37.6 | Very low | 129 Ų | 129 | 125.6 Ų | 125.6 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -117.9 | 167.5 | -137.6 | 42.3 | -35.8 | 0 | 0 | 0 | 119 | ||||
| 175 | G | 27.1 | Very low | 38.5 | Very low | 78 Ų | 78 | 127.8 Ų | 127.8 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | 168 | 147.6 | 164.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 176 | A | 32.1 | Very low | 38.5 | Very low | 99 Ų | 99 | 129.4 Ų | 129.4 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | cis | -160.6 | -178.9 | 6.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 177 | P | 43.1 | Very low | 39.6 | Very low | 125 Ų | 125 | 131.2 Ų | 131.2 | 81% | 0.812 | 81% | 0.809 | S | S | * | * | trans | -125.7 | 158.6 | 162 | 38.2 | -27.3 | 0 | 0 | 0 | 116.1 | ||||
| 178 | A | 33.8 | Very low | 40.4 | Very low | 94 Ų | 94 | 131.7 Ų | 131.7 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | trans | 76.5 | 93.4 | 148.7 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 179 | A | 35.4 | Very low | 41 | Very low | 107 Ų | 107 | 131.6 Ų | 131.6 | 88% | 0.884 | 81% | 0.807 | S | S | * | * | 44.3 | 111.2 | 119.4 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 180 | G | 38.4 | Very low | 41 | Very low | 81 Ų | 81 | 133.3 Ų | 133.3 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -105.2 | 133.1 | 164.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 181 | T | 43.3 | Very low | 41.3 | Very low | 138 Ų | 138 | 132 Ų | 132 | 85% | 0.847 | 81% | 0.812 | S | S | * | * | trans | -94.7 | 142.3 | 178.7 | 48.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 182 | V | 43.5 | Very low | 41 | Very low | 141 Ų | 141 | 134.6 Ų | 134.6 | 86% | 0.855 | 82% | 0.82 | S | S | * | * | trans | -72.1 | 140.3 | -176.8 | 179.2 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 183 | R | 52.7 | Low | 42.1 | Very low | 234 Ų | 234 | 133.9 Ų | 133.9 | 88% | 0.883 | 82% | 0.819 | S | S | * | * | trans | -121.6 | 144 | 166.8 | -59.3 | -170.2 | 81.8 | 162.9 | 4.8 | 111.2 | ||||
| 184 | R | 51.6 | Low | 42.5 | Very low | 243 Ų | 243 | 135 Ų | 135 | 92% | 0.917 | 82% | 0.822 | S | S | * | * | trans | -84.3 | 149.2 | -172.1 | -60.3 | 167 | 118.8 | 170.6 | -0.7 | 110.8 | ||||
| 185 | V | 50.4 | Low | 42.5 | Very low | 130 Ų | 130 | 140.4 Ų | 140.4 | 79% | 0.788 | 83% | 0.825 | S | S | * | * | trans | -99.8 | 111.9 | 174.6 | 178.7 | 0 | 0 | 0 | 0 | 109 | V187 | V185-V187 HydrophobicContact CG1-CG2 3.97Š| ||
| 186 | D | 44.3 | Very low | 43 | Very low | 155 Ų | 155 | 144.8 Ų | 144.8 | 83% | 0.829 | 83% | 0.829 | S | S | * | * | trans | -92.1 | 131.7 | 162.9 | -83.9 | -52.5 | 0 | 0 | 0 | 109.2 | ||||
| 187 | V | 53.9 | Low | 43.3 | Very low | 126 Ų | 126 | 144.6 Ų | 144.6 | 76% | 0.764 | 83% | 0.827 | S | S | * | * | trans | -111.6 | 119.6 | 175.5 | -179.8 | 0 | 0 | 0 | 0 | 109 | V185 | V185-V187 HydrophobicContact CG1-CG2 3.97Š| ||
| 188 | I | 48.5 | Very low | 43.1 | Very low | 141 Ų | 141 | 144.6 Ų | 144.6 | 72% | 0.723 | 83% | 0.831 | S | S | * | * | trans | -107.2 | 121.9 | 174.7 | -60.5 | 173.4 | 0 | 0 | 0 | 108.2 | ||||
| 189 | P | 47 | Very low | 43.8 | Very low | 119 Ų | 119 | 151.2 Ų | 151.2 | 77% | 0.773 | 84% | 0.836 | S | S | * | * | trans | -77.4 | 128.1 | 167.3 | 30.8 | -30.9 | 0 | 0 | 0 | 110.3 | ||||
| 190 | Q | 32.5 | Very low | 44.4 | Very low | 179 Ų | 179 | 151.5 Ų | 151.5 | 84% | 0.836 | 83% | 0.828 | S | S | * | * | trans | -85.7 | 147.9 | 171 | -68.6 | -78.9 | 31.7 | 0 | 0 | 110.3 | ||||
| 191 | A | 38.4 | Very low | 44.9 | Very low | 92 Ų | 92 | 153.5 Ų | 153.5 | 76% | 0.76 | 83% | 0.826 | S | S | * | * | trans | -140.7 | 124.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 192 | D | 42.6 | Very low | 45.2 | Very low | 161 Ų | 161 | 156 Ų | 156 | 86% | 0.861 | 83% | 0.828 | S | S | * | * | trans | -85.2 | 145.5 | 178.8 | -71.5 | -53.4 | 0 | 0 | 0 | 112.3 | ||||
| 193 | P | 49.9 | Very low | 45.3 | Very low | 121 Ų | 121 | 160.4 Ų | 160.4 | 79% | 0.786 | 83% | 0.832 | S | S | * | * | trans | -96.8 | 120.9 | 177.2 | 34.6 | -30.4 | 0 | 0 | 0 | 112.8 | ||||
| 194 | V | 41.8 | Very low | 44.7 | Very low | 143 Ų | 143 | 152.8 Ų | 152.8 | 87% | 0.867 | 83% | 0.826 | S | S | * | * | trans | -109.2 | 123.2 | 165.7 | 179.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 195 | R | 41.5 | Very low | 44.5 | Very low | 242 Ų | 242 | 152.6 Ų | 152.6 | 91% | 0.913 | 83% | 0.825 | S | S | * | * | trans | -72.2 | 143 | 177.1 | -71.4 | -176.8 | 178 | -163.5 | 0.7 | 111.6 | ||||
| 196 | L | 38.4 | Very low | 44.4 | Very low | 170 Ų | 170 | 154.5 Ų | 154.5 | 89% | 0.89 | 83% | 0.825 | S | S | * | * | trans | -151.9 | 148.4 | 146.6 | -109.1 | 169.2 | 0 | 0 | 0 | 111.5 | ||||
| 197 | A | 38.1 | Very low | 44.6 | Very low | 94 Ų | 94 | 152.9 Ų | 152.9 | 78% | 0.777 | 82% | 0.823 | S | S | * | * | trans | 54.5 | 101.9 | 165.8 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 198 | S | 38.3 | Very low | 44.4 | Very low | 126 Ų | 126 | 154.6 Ų | 154.6 | 88% | 0.881 | 83% | 0.827 | S | S | * | * | trans | -69.3 | 134.2 | 162.1 | 49.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 199 | R | 49.8 | Very low | 45 | Very low | 233 Ų | 233 | 155.9 Ų | 155.9 | 88% | 0.879 | 83% | 0.83 | S | S | * | * | trans | -132.9 | 135.8 | 163.8 | -166.8 | 178.5 | -168.5 | -169.5 | 4.2 | 108.9 | ||||
| 200 | P | 48.1 | Very low | 45 | Very low | 112 Ų | 112 | 155.7 Ų | 155.7 | 73% | 0.727 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -72 | 138.7 | -175 | 28.1 | -34.9 | 0 | 0 | 0 | 111.8 | ||
| 201 | P | 47.8 | Very low | 46.1 | Very low | 123 Ų | 123 | 152.8 Ų | 152.8 | 80% | 0.799 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 130.5 | 167.4 | 29.7 | -32.1 | 0 | 0 | 0 | 109.4 | ||
| 202 | Q | 50.1 | Low | 46.5 | Very low | 190 Ų | 190 | 154.2 Ų | 154.2 | 89% | 0.888 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 150.8 | 174.6 | -69.1 | -169.4 | -7.5 | 0 | 0 | 111.2 | ||
| 203 | Y | 46.5 | Very low | 46.5 | Very low | 235 Ų | 235 | 154.1 Ų | 154.1 | 92% | 0.922 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 150.8 | -174.9 | -70.1 | -91.9 | 0 | 0 | 0 | 113.6 | ||
| 204 | G | 40 | Very low | 46.6 | Very low | 74 Ų | 74 | 155.4 Ų | 155.4 | 76% | 0.763 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 135.2 | -170.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q206 | G204-Q206 PolarHBondContact O-N 2.8Š|
| 205 | R | 46.2 | Very low | 46.9 | Very low | 239 Ų | 239 | 153.8 Ų | 153.8 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | trans | -68 | 115.1 | 158.8 | -87.2 | -76.7 | -173.1 | 177.7 | 0.1 | 108.6 | ||||
| 206 | Q | 49.4 | Very low | 47.2 | Very low | 170 Ų | 170 | 150.3 Ų | 150.3 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -62 | 144.8 | 166.2 | -62.8 | -170.6 | 23.3 | 0 | 0 | 110.3 | G204 L208 | G204-Q206 PolarHBondContact O-N 2.8Å; Q206-L208 PolarHBondContact O-N 2.63Å |
| 207 | P | 47.1 | Very low | 47.6 | Very low | 121 Ų | 121 | 149.5 Ų | 149.5 | 79% | 0.786 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 120.9 | 161.3 | -12.9 | 28.3 | 0 | 0 | 0 | 108.8 | Q209 | P207-Q209 PolarHBondContact O-N 2.75Š|
| 208 | L | 50.7 | Low | 48.3 | Very low | 161 Ų | 161 | 150.9 Ų | 150.9 | 84% | 0.843 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 125.5 | 170.2 | -76.7 | 164.3 | 0 | 0 | 0 | 108.9 | Q206 | Q206-L208 PolarHBondContact O-N 2.63Š|
| 209 | Q | 60.5 | Low | 48.4 | Very low | 169 Ų | 169 | 152.4 Ų | 152.4 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 137.6 | 173 | -67.5 | -75.4 | -1.9 | 0 | 0 | 110.2 | P207 V211 | P207-Q209 PolarHBondContact O-N 2.75Å; Q209-V211 PolarHBondContact O-N 2.81Å |
| 210 | P | 46.8 | Very low | 47.9 | Very low | 114 Ų | 114 | 147.2 Ų | 147.2 | 74% | 0.74 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 118.5 | 170.1 | -16.6 | 30.3 | 0 | 0 | 0 | 110 | P212 | P210-P212 WeakPolarHBondContact O-CD 3.38Š|
| 211 | V | 56.1 | Low | 47.5 | Very low | 118 Ų | 118 | 149.1 Ų | 149.1 | 72% | 0.715 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 122.4 | 169 | 173.7 | 0 | 0 | 0 | 0 | 108.6 | Q209 L213 | Q209-V211 PolarHBondContact O-N 2.81Å; V211-L213 PolarHBondContact O-N 2.86Å |
| 212 | P | 45.9 | Very low | 47 | Very low | 122 Ų | 122 | 148 Ų | 148 | 79% | 0.792 | 80% | 0.802 | S | S | * | * | trans | -73.3 | 99.8 | 172.5 | -13.3 | 29.8 | 0 | 0 | 0 | 109.7 | P210 H214 | P210-P212 WeakPolarHBondContact O-CD 3.38Å; P212-H214 PolarHBondContact O-N 2.8Å | ||
| 213 | L | 43.3 | Very low | 46.5 | Very low | 159 Ų | 159 | 144.7 Ų | 144.7 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | trans | -76.2 | 103.6 | 167.2 | -77.8 | 178 | 0 | 0 | 0 | 109.4 | V211 P215 | V211-L213 PolarHBondContact O-N 2.86Å; L213-P215 VanDerWaalsContact O-CD 3.22Å; L213-P215 WeakPolarHBondContact O-CD 3.33Å | ||
| 214 | H | 51.6 | Low | 46.2 | Very low | 148 Ų | 148 | 138.1 Ų | 138.1 | 69% | 0.685 | 78% | 0.783 | S | S | * | * | trans | -64.6 | 112.1 | 178.8 | -174.1 | -58.4 | 0 | 0 | 0 | 111.8 | P212 Q216 | P212-H214 PolarHBondContact O-N 2.8Å; H214-Q216 WeakPolarHBondContact ND1-CG 3.15Å; H214-Q216 PolarHBondContact O-N 3Å | ||
| 215 | P | 48.3 | Very low | 46.5 | Very low | 110 Ų | 110 | 140.2 Ų | 140.2 | 71% | 0.714 | 79% | 0.786 | S | S | * | * | trans | -79.3 | 103.6 | 170.2 | -3.9 | 23.5 | 0 | 0 | 0 | 108.3 | L213 L217 | L213-P215 VanDerWaalsContact O-CD 3.22Å; L213-P215 WeakPolarHBondContact O-CD 3.33Å; P215-L217 PolarHBondContact O-N 2.7Å | ||
| 216 | Q | 48.8 | Very low | 46.2 | Very low | 169 Ų | 169 | 136.7 Ų | 136.7 | 79% | 0.79 | 78% | 0.78 | S | S | * | * | trans | -74.4 | 109.6 | 163.7 | -73.8 | -156.9 | 29 | 0 | 0 | 109 | H214 | H214-Q216 WeakPolarHBondContact ND1-CG 3.15Å; H214-Q216 PolarHBondContact O-N 3Å | ||
| 217 | L | 45.7 | Very low | 45.7 | Very low | 152 Ų | 152 | 140.4 Ų | 140.4 | 80% | 0.796 | 79% | 0.787 | S | S | * | * | trans | -123.6 | 119 | 163.3 | -74.1 | 175 | 0 | 0 | 0 | 108 | P215 L219 | P215-L217 PolarHBondContact O-N 2.7Å; L217-L219 PolarHBondContact O-N 2.79Å | ||
| 218 | P | 53.1 | Low | 45.3 | Very low | 124 Ų | 124 | 141.1 Ų | 141.1 | 81% | 0.805 | 78% | 0.783 | S | S | * | * | trans | -62.1 | 135.2 | 178.9 | -24.9 | 35.1 | 0 | 0 | 0 | 112.6 | C220 | P218-C220 PolarHBondContact O-N 3.36Š| ||
| 219 | L | 40.8 | Very low | 44.6 | Very low | 157 Ų | 157 | 143.1 Ų | 143.1 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | trans | -68.1 | 125.7 | 170.3 | -72 | 159.8 | 0 | 0 | 0 | 110.3 | L217 L221 | L217-L219 PolarHBondContact O-N 2.79Å; L219-L221 HydrophobicContact CD2-CD1 4.41Å | ||
| 220 | C | 39.8 | Very low | 43.5 | Very low | 124 Ų | 124 | 141.7 Ų | 141.7 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -114.7 | 89.4 | 158.5 | -76.6 | 0 | 0 | 0 | 0 | 109.1 | P218 A222 | P218-C220 PolarHBondContact O-N 3.36Å; C220-A222 PolarHBondContact O-N 2.95Å | ||
| 221 | L | 39.1 | Very low | 42.9 | Very low | 152 Ų | 152 | 145.4 Ų | 145.4 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | trans | -69.2 | 119.9 | 159.9 | -99.7 | 65 | 0 | 0 | 0 | 108 | L219 | L219-L221 HydrophobicContact CD2-CD1 4.41Š| ||
| 222 | A | 36.4 | Very low | 42 | Very low | 100 Ų | 100 | 147.8 Ų | 147.8 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | trans | -114.2 | 106.8 | 165.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | C220 | C220-A222 PolarHBondContact O-N 2.95Š| ||
| 223 | T | 41 | Very low | 41.9 | Very low | 120 Ų | 120 | 148.1 Ų | 148.1 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | -70.2 | 133.5 | -179.4 | 45.4 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 224 | S | 40 | Very low | 41.9 | Very low | 97 Ų | 97 | 145.5 Ų | 145.5 | 68% | 0.678 | 79% | 0.789 | S | S | * | * | 9.8 | 118.8 | 122.3 | -177.9 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 225 | S | 45.7 | Very low | 42.5 | Very low | 118 Ų | 118 | 143.7 Ų | 143.7 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | trans | -150.6 | 105.8 | 147.2 | -84.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 226 | Q | 39.4 | Very low | 42.9 | Very low | 166 Ų | 166 | 143.8 Ų | 143.8 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | -67.3 | 141 | 169.2 | -57.5 | 176.7 | 57.2 | 0 | 0 | 109.2 | ||||
| 227 | R | 40.7 | Very low | 42.4 | Very low | 248 Ų | 248 | 142.7 Ų | 142.7 | 94% | 0.936 | 80% | 0.795 | S | S | * | * | trans | -116.2 | 111 | 155.4 | -73 | -160.1 | -167.9 | -105.5 | 6.4 | 109.5 | ||||
| 228 | L | 37.8 | Very low | 42.5 | Very low | 135 Ų | 135 | 139.5 Ų | 139.5 | 71% | 0.707 | 79% | 0.791 | S | S | * | * | trans | -74.5 | -175.3 | 158.4 | -74.5 | 159.7 | 0 | 0 | 0 | 109.8 | ||||
| 229 | F | 36.7 | Very low | 42.5 | Very low | 203 Ų | 203 | 139.2 Ų | 139.2 | 89% | 0.89 | 79% | 0.789 | S | S | * | * | trans | 82.2 | 126.6 | -176.1 | -53.3 | -71.1 | 0 | 0 | 0 | 113.3 | ||||
| 230 | V | 37.1 | Very low | 42.4 | Very low | 140 Ų | 140 | 140.2 Ų | 140.2 | 85% | 0.848 | 79% | 0.787 | S | S | * | * | cis | -140.1 | 163.9 | 10.5 | -178.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 231 | Q | 34.5 | Very low | 42.8 | Very low | 192 Ų | 192 | 140.1 Ų | 140.1 | 90% | 0.897 | 78% | 0.784 | S | S | * | * | trans | -86.1 | 174.5 | -178 | -55.5 | -172.2 | 38.2 | 0 | 0 | 115.7 | ||||
| 232 | K | 36.8 | Very low | 42.9 | Very low | 168 Ų | 168 | 140.2 Ų | 140.2 | 73% | 0.73 | 78% | 0.781 | S | S | * | * | trans | -84.2 | 158.8 | 180 | -155.6 | 177.7 | 169.8 | 59.2 | 0 | 111.8 | V234 | K232-V234 HydrophobicContact CD-CG2 4.18Å; K232-V234 HydrophobicContact CG-CG2 4.07Å | ||
| 233 | P | 43.4 | Very low | 43.5 | Very low | 129 Ų | 129 | 141.2 Ų | 141.2 | 84% | 0.838 | 78% | 0.779 | S | S | * | * | -142.8 | -163 | 96.4 | 27.6 | -4.7 | 0 | 0 | 0 | 114.7 | |||||
| 234 | V | 42.9 | Very low | 43.4 | Very low | 103 Ų | 103 | 141.1 Ų | 141.1 | 62% | 0.624 | 78% | 0.783 | S | S | * | * | trans | -136.5 | -159.6 | -159.7 | -156.6 | 0 | 0 | 0 | 0 | 113.4 | K232 | K232-V234 HydrophobicContact CD-CG2 4.18Å; K232-V234 HydrophobicContact CG-CG2 4.07Å | ||
| 235 | P | 65.4 | Low | 43.6 | Very low | 110 Ų | 110 | 140.8 Ų | 140.8 | 71% | 0.714 | 79% | 0.786 | S | S | * | * | -97.5 | -162.9 | -115 | 42.4 | -24.1 | 0 | 0 | 0 | 115.2 | |||||
| 236 | P | 54.9 | Low | 43.8 | Very low | 113 Ų | 113 | 141.6 Ų | 141.6 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | -159.9 | 178.5 | 85.9 | 40.5 | -17.5 | 0 | 0 | 0 | 120 | |||||
| 237 | V | 38.9 | Very low | 44.1 | Very low | 145 Ų | 145 | 137.7 Ų | 137.7 | 88% | 0.879 | 79% | 0.785 | S | S | * | * | trans | 90.8 | 141 | 158.7 | -168.5 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 238 | A | 47.8 | Very low | 43.9 | Very low | 85 Ų | 85 | 131.5 Ų | 131.5 | 70% | 0.702 | 78% | 0.779 | S | S | * | * | trans | -120.8 | -162.4 | -171.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 239 | P | 53.1 | Low | 44.9 | Very low | 119 Ų | 119 | 131.1 Ų | 131.1 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | cis | -142.3 | 172.3 | 3.6 | 43.6 | -23.5 | 0 | 0 | 0 | 119.6 | ||||
| 240 | K | 38.1 | Very low | 44.7 | Very low | 178 Ų | 178 | 126.2 Ų | 126.2 | 77% | 0.774 | 78% | 0.782 | S | S | * | * | trans | 19.3 | 160.3 | 149.9 | -95.1 | -174.5 | 154.7 | 172.8 | 0 | 123.4 | ||||
| 241 | P | 49 | Very low | 45.2 | Very low | 121 Ų | 121 | 127.3 Ų | 127.3 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | cis | -138 | -174 | 18.1 | 38.8 | -16.4 | 0 | 0 | 0 | 119.7 | ||||
| 242 | E | 41.5 | Very low | 45.8 | Very low | 155 Ų | 155 | 124.8 Ų | 124.8 | 72% | 0.724 | 78% | 0.779 | S | S | * | * | trans | -63.1 | -174.6 | -179.5 | -66.8 | -178.9 | 178.7 | 0 | 0 | 117 | ||||
| 243 | P | 49.4 | Very low | 46.1 | Very low | 120 Ų | 120 | 127.1 Ų | 127.1 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | cis | -125.3 | -175.7 | 3.2 | 24.8 | 2 | 0 | 0 | 0 | 114 | ||||
| 244 | S | 38.3 | Very low | 46.2 | Very low | 119 Ų | 119 | 128 Ų | 128 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | cis | -157.6 | 159.8 | 36.4 | 55.1 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 245 | A | 43.3 | Very low | 46 | Very low | 90 Ų | 90 | 129.1 Ų | 129.1 | 74% | 0.744 | 79% | 0.793 | S | S | * | * | trans | -100.1 | -166.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 246 | P | 51.9 | Low | 45.1 | Very low | 134 Ų | 134 | 129.5 Ų | 129.5 | 87% | 0.87 | 80% | 0.798 | S | S | * | * | cis | -138.9 | -160.7 | 2.5 | 42.5 | -21.1 | 0 | 0 | 0 | 115.2 | ||||
| 247 | A | 44.5 | Very low | 44.8 | Very low | 85 Ų | 85 | 129.9 Ų | 129.9 | 70% | 0.702 | 80% | 0.803 | S | S | * | * | trans | -115 | 147.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 248 | S | 37.5 | Very low | 45.1 | Very low | 117 Ų | 117 | 128.7 Ų | 128.7 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | 62.4 | 176.9 | 160.1 | -58.3 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 249 | P | 57.5 | Low | 45.4 | Very low | 128 Ų | 128 | 129.8 Ų | 129.8 | 83% | 0.831 | 80% | 0.804 | S | S | * | * | -122 | 151.2 | -58.4 | 36.2 | -24.5 | 0 | 0 | 0 | 112.1 | |||||
| 250 | A | 32.1 | Very low | 45.6 | Very low | 99 Ų | 99 | 134.1 Ų | 134.1 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -146.1 | 135.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 251 | I | 47.8 | Very low | 46.3 | Very low | 164 Ų | 164 | 134.5 Ų | 134.5 | 84% | 0.841 | 81% | 0.807 | S | S | * | * | trans | -84.5 | 123.8 | 174.9 | -65.3 | 160.4 | 0 | 0 | 0 | 108.9 | ||||
| 252 | T | 47.5 | Very low | 46.7 | Very low | 139 Ų | 139 | 140 Ų | 140 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | trans | -108.2 | 139.2 | 163.1 | 46.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 253 | R | 44.3 | Very low | 47.1 | Very low | 216 Ų | 216 | 138.4 Ų | 138.4 | 82% | 0.815 | 82% | 0.815 | S | S | * | * | trans | -109.5 | 148.9 | -169.5 | -122.6 | -178.5 | 175.9 | -140.4 | 0.2 | 109.8 | ||||
| 254 | L | 44.1 | Very low | 47.3 | Very low | 149 Ų | 149 | 137.6 Ų | 137.6 | 78% | 0.78 | 81% | 0.812 | S | S | * | * | trans | 72.8 | 110.1 | 162.2 | -55.3 | 165.7 | 0 | 0 | 0 | 118.1 | ||||
| 255 | S | 38.2 | Very low | 48.3 | Very low | 125 Ų | 125 | 139.9 Ų | 139.9 | 87% | 0.874 | 81% | 0.814 | S | S | * | * | -163.4 | 123.4 | 118 | -83.1 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 256 | S | 48.2 | Very low | 49.1 | Very low | 119 Ų | 119 | 141.6 Ų | 141.6 | 83% | 0.832 | 82% | 0.815 | S | S | * | * | trans | -87.4 | 120.7 | 177.5 | -65.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 257 | S | 48.9 | Very low | 49.4 | Very low | 120 Ų | 120 | 146.4 Ų | 146.4 | 84% | 0.839 | 82% | 0.816 | S | S | * | * | trans | 164 | 103.9 | 132.1 | 50.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 258 | S | 44.9 | Very low | 50 | Low | 121 Ų | 121 | 147.2 Ų | 147.2 | 85% | 0.846 | 82% | 0.817 | S | S | * | * | trans | -151.4 | 94 | 151.8 | -167.4 | 0 | 0 | 0 | 0 | 110.2 | R260 | S258-R260 PolarHBondContact O-N 3.2Š| ||
| 259 | S | 54.4 | Low | 51 | Low | 108 Ų | 108 | 151.1 Ų | 151.1 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | trans | -72.2 | 105 | 169 | 178.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 260 | R | 55.8 | Low | 51.1 | Low | 209 Ų | 209 | 148.7 Ų | 148.7 | 79% | 0.789 | 81% | 0.805 | S | S | * | * | trans | 174.5 | 143.9 | 132.4 | -95.3 | 166.8 | -74.7 | -165.2 | 0.7 | 111.9 | S258 | S258-R260 PolarHBondContact O-N 3.2Š| ||
| 261 | K | 53.1 | Low | 52.5 | Low | 187 Ų | 187 | 147.1 Ų | 147.1 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | trans | 75.8 | 84.5 | 166.1 | -55 | 135.1 | -178 | 179.7 | 0 | 117.2 | ||||
| 262 | R | 58.2 | Low | 53.2 | Low | 236 Ų | 236 | 143.9 Ų | 143.9 | 89% | 0.891 | 77% | 0.766 | S | S | * | * | -171.5 | 127.7 | 110.7 | -95.8 | 160.6 | -164.6 | -133 | 3.3 | 107.8 | S264 | R262-S264 PolarHBondContact O-N 2.8Š| |||
| 263 | P | 49.1 | Very low | 53.8 | Low | 122 Ų | 122 | 140.4 Ų | 140.4 | 79% | 0.792 | 75% | 0.747 | S | S | * | * | trans | -60.4 | 111.7 | 159.1 | -15.6 | 30.1 | 0 | 0 | 0 | 106.5 | L265 | P263-L265 PolarHBondContact O-N 3.28Š| ||
| 264 | S | 53.9 | Low | 54.7 | Low | 103 Ų | 103 | 134.9 Ų | 134.9 | 72% | 0.72 | 73% | 0.734 | S | S | * | * | trans | -63 | 107.8 | 167.5 | 35.2 | 0 | 0 | 0 | 0 | 106.5 | R262 T266 | R262-S264 PolarHBondContact O-N 2.8Å; S264-T266 PolarHBondContact O-N 2.86Å | ||
| 265 | L | 59.7 | Low | 55.6 | Low | 167 Ų | 167 | 135.2 Ų | 135.2 | 87% | 0.874 | 72% | 0.724 | S | S | * | * | trans | -66.1 | 92.7 | 175.5 | -136 | 81.8 | 0 | 0 | 0 | 107.1 | P263 R267 | P263-L265 PolarHBondContact O-N 3.28Å; L265-R267 PolarHBondContact O-N 2.76Å | ||
| 266 | T | 59.7 | Low | 56.5 | Low | 125 Ų | 125 | 136.5 Ų | 136.5 | 77% | 0.767 | 71% | 0.714 | S | S | * | * | trans | -59.5 | 109.4 | 171 | 38.2 | 0 | 0 | 0 | 0 | 106.8 | S264 S268 | S264-T266 PolarHBondContact O-N 2.86Å; T266-S268 PolarHBondContact O-N 3.27Å; T266-S268 VanDerWaalsContact O-N 3.08Å | ||
| 267 | R | 57.5 | Low | 57.2 | Low | 235 Ų | 235 | 134.8 Ų | 134.8 | 89% | 0.887 | 70% | 0.702 | S | S | * | * | trans | -27 | 111.8 | 177 | 174.8 | -176.3 | 175.3 | -160.2 | 0.7 | 111 | L265 K269 | L265-R267 PolarHBondContact O-N 2.76Å; R267-K269 PolarHBondContact O-N 2.83Å | ||
| 268 | S | 57.5 | Low | 57.7 | Low | 103 Ų | 103 | 137.2 Ų | 137.2 | 72% | 0.72 | 69% | 0.693 | S | S | * | * | trans | -43.7 | 107.9 | -176.3 | -177.5 | 0 | 0 | 0 | 0 | 111.1 | T266 S270 | T266-S268 PolarHBondContact O-N 3.27Å; T266-S268 VanDerWaalsContact O-N 3.08Å; S268-S270 PolarHBondContact O-N 2.64Å | ||
| 269 | K | 58.2 | Low | 58.4 | Low | 199 Ų | 199 | 134 Ų | 134 | 87% | 0.865 | 67% | 0.674 | S | S | * | * | trans | -76.2 | 84.7 | 159.4 | -66.1 | -174.6 | 75.4 | 129.5 | 0 | 104.6 | R267 D271 | R267-K269 PolarHBondContact O-N 2.83Å; K269-D271 PolarHBondContact O-N 3.36Å | ||
| 270 | S | 60.7 | Low | 59 | Low | 77 Ų | 77 | 130.9 Ų | 130.9 | 54% | 0.538 | 66% | 0.659 | S | S | . | * | trans | -53.1 | 117.8 | 173.4 | 45.3 | 0 | 0 | 0 | 0 | 107.8 | S268 M272 | S268-S270 PolarHBondContact O-N 2.64Å; S270-M272 PolarHBondContact O-N 2.88Å; S270-M272 VanDerWaalsContact O-N 3.13Å | ||
| 271 | D | 61.7 | Low | 59.7 | Low | 66 Ų | 66 | 124.3 Ų | 124.3 | 35% | 0.353 | 64% | 0.642 | S | S | . | * | trans | -67.4 | 120.6 | -167.2 | -177.6 | 23.7 | 0 | 0 | 0 | 109.9 | K269 S273 D274 | K269-D271 PolarHBondContact O-N 3.36Å; D271-S273 VanDerWaalsContact C-N 3.25Å; D271-S273 VanDerWaalsContact OD1-CB 3.31Å; D271-S273 WeakPolarHBondContact OD1-CB 3.46Å; D271-S273 PolarHBondContact OD1-N 3.21Å; D271-S273 PolarHBondContact OD1-OG 2.87Å; D271-S273 WeakPolarHBondContact OD2-CB 3.49Å; D271-S273 PolarHBondContact OD2-OG 3.36Å; D271-D274 HydrophobicContact CB-CB 3.94Å; D271-D274 VanDerWaalsContact CG-N 3.35Å; D271-D274 PolarHBondContact OD2-N 2.89Å | ||
| 272 | M | 61.4 | Low | 60.8 | Low | 96 Ų | 96 | 120 Ų | 120 | 47% | 0.473 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -68.4 | -34.9 | 172.8 | -66.5 | -69.1 | 147 | 0 | 0 | 109.2 | S270 R275 F276 | S270-M272 PolarHBondContact O-N 2.88Å; S270-M272 VanDerWaalsContact O-N 3.13Å; M272-R275 PolarHBondContact O-N 3.21Å; M272-R275 PolarHBondContact SD-NH2 2.99Å; M272-F276 HydrophobicContact CB-CE2 4.33Å; M272-F276 WeakPolarHBondContact O-CD2 3.41Å; M272-F276 PolarHBondContact O-N 2.92Å |
| 273 | S | 61.2 | Low | 61.6 | Low | 66 Ų | 66 | 110.7 Ų | 110.7 | 46% | 0.462 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.4 | -45.9 | -179 | 103.5 | 0 | 0 | 0 | 0 | 111.7 | D271 R275 F276 S277 | D271-S273 VanDerWaalsContact C-N 3.25Å; D271-S273 VanDerWaalsContact OD1-CB 3.31Å; D271-S273 WeakPolarHBondContact OD1-CB 3.46Å; D271-S273 PolarHBondContact OD1-N 3.21Å; D271-S273 PolarHBondContact OD1-OG 2.87Å; D271-S273 WeakPolarHBondContact OD2-CB 3.49Å; D271-S273 PolarHBondContact OD2-OG 3.36Å; S273-R275 PolarHBondContact O-N 3.41Å; S273-R275 VanDerWaalsContact O-N 3.11Å; S273-F276 PolarHBondContact O-N 3.35Å; S273-S277 WeakPolarHBondContact O-CB 3.14Å; S273-S277 PolarHBondContact O-N 2.94Å; S273-S277 PolarHBondContact O-OG 3.27Å |
| 274 | D | 62 | Low | 63.1 | Low | 100 Ų | 100 | 109.6 Ų | 109.6 | 54% | 0.535 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -50.6 | -37.5 | 172 | -92.6 | -23.9 | 0 | 0 | 0 | 112.7 | D271 R278 | D271-D274 HydrophobicContact CB-CB 3.94Å; D271-D274 VanDerWaalsContact CG-N 3.35Å; D271-D274 PolarHBondContact OD2-N 2.89Å; D274-R278 VanDerWaalsContact O-CB 3.29Å; D274-R278 WeakPolarHBondContact O-CB 3.16Å; D274-R278 WeakPolarHBondContact O-CG 3.28Å; D274-R278 PolarHBondContact O-N 2.86Å; D274-R278 VanDerWaalsContact O-N 3.12Å |
| 275 | R | 63.1 | Low | 64.5 | Low | 156 Ų | 156 | 111.2 Ų | 111.2 | 59% | 0.589 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -74.3 | -38.4 | 179.3 | -60.8 | -163.9 | -59.2 | 169.9 | 6.9 | 112.1 | M272 S273 A279 | M272-R275 PolarHBondContact O-N 3.21Å; M272-R275 PolarHBondContact SD-NH2 2.99Å; S273-R275 PolarHBondContact O-N 3.41Å; S273-R275 VanDerWaalsContact O-N 3.11Å; R275-A279 WeakPolarHBondContact O-CB 3.22Å; R275-A279 PolarHBondContact O-N 3.05Å |
| 276 | F | 57.4 | Low | 65.5 | Low | 151 Ų | 151 | 107.5 Ų | 107.5 | 66% | 0.662 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -73.6 | -43 | 175.7 | -67.6 | -65.5 | 0 | 0 | 0 | 112.3 | M272 S273 R278 A279 G280 | M272-F276 HydrophobicContact CB-CE2 4.33Å; M272-F276 WeakPolarHBondContact O-CD2 3.41Å; M272-F276 PolarHBondContact O-N 2.92Å; S273-F276 PolarHBondContact O-N 3.35Å; F276-R278 VanDerWaalsContact C-N 3.26Å; F276-R278 PolarHBondContact O-N 3.48Å; F276-A279 WeakPolarHBondContact O-CB 3.41Å; F276-A279 PolarHBondContact O-N 2.91Å; F276-A279 VanDerWaalsContact O-N 3.07Å; F276-G280 PolarHBondContact O-N 3.07Å |
| 277 | S | 62.3 | Low | 66.6 | Low | 83 Ų | 83 | 101.7 Ų | 101.7 | 58% | 0.58 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.5 | -37.6 | 173.2 | -67.2 | 0 | 0 | 0 | 0 | 112.5 | S273 | S273-S277 WeakPolarHBondContact O-CB 3.14Å; S273-S277 PolarHBondContact O-N 2.94Å; S273-S277 PolarHBondContact O-OG 3.27Å |
| 278 | R | 60.7 | Low | 67.7 | Low | 172 Ų | 172 | 95 Ų | 95 | 65% | 0.649 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -77.3 | -31.2 | 174.4 | -71.6 | 178.4 | 63.8 | -172.3 | -2 | 113.4 | D274 F276 G280 T281 E282 | D274-R278 VanDerWaalsContact O-CB 3.29Å; D274-R278 WeakPolarHBondContact O-CB 3.16Å; D274-R278 WeakPolarHBondContact O-CG 3.28Å; D274-R278 PolarHBondContact O-N 2.86Å; D274-R278 VanDerWaalsContact O-N 3.12Å; F276-R278 VanDerWaalsContact C-N 3.26Å; F276-R278 PolarHBondContact O-N 3.48Å; R278-G280 VanDerWaalsContact C-N 3.35Å; R278-G280 PolarHBondContact O-N 3.01Å; R278-T281 PolarHBondContact O-N 3.31Å; R278-T281 PolarHBondContact O-OG1 3.39Å; R278-T281 VanDerWaalsContact O-OG1 3.07Å; R278-E282 WeakPolarHBondContact O-CB 3.42Å; R278-E282 PolarHBondContact O-N 2.74Å |
| 279 | A | 59.1 | Low | 68.8 | Low | 52 Ų | 52 | 97.1 Ų | 97.1 | 43% | 0.43 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.1 | -41.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | R275 F276 E282 L283 | R275-A279 WeakPolarHBondContact O-CB 3.22Å; R275-A279 PolarHBondContact O-N 3.05Å; F276-A279 WeakPolarHBondContact O-CB 3.41Å; F276-A279 PolarHBondContact O-N 2.91Å; F276-A279 VanDerWaalsContact O-N 3.07Å; A279-E282 PolarHBondContact O-N 2.83Å; A279-L283 WeakPolarHBondContact O-CB 3.19Å; A279-L283 PolarHBondContact O-N 2.78Å |
| 280 | G | 66.4 | Low | 69.7 | Low | 44 Ų | 44 | 89.3 Ų | 89.3 | 45% | 0.454 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -57.9 | -52.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | F276 R278 E282 L283 E284 | F276-G280 PolarHBondContact O-N 3.07Å; R278-G280 VanDerWaalsContact C-N 3.35Å; R278-G280 PolarHBondContact O-N 3.01Å; G280-E282 VanDerWaalsContact C-N 3.34Å; G280-E282 PolarHBondContact O-N 3.39Å; G280-L283 PolarHBondContact O-N 2.96Å; G280-E284 WeakPolarHBondContact O-CB 3.25Å; G280-E284 PolarHBondContact O-N 3.39Å |
| 281 | T | 70 | Confident | 70.6 | Confident | 71 Ų | 71 | 87.7 Ų | 87.7 | 44% | 0.436 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -69.7 | -25.5 | -178.8 | 61.3 | 0 | 0 | 0 | 0 | 114.2 | R278 R285 | R278-T281 PolarHBondContact O-N 3.31Å; R278-T281 PolarHBondContact O-OG1 3.39Å; R278-T281 VanDerWaalsContact O-OG1 3.07Å; T281-R285 WeakPolarHBondContact O-CB 3.41Å; T281-R285 PolarHBondContact O-N 3.18Å; T281-R285 VanDerWaalsContact O-N 3.12Å |
| 282 | E | 76.4 | Confident | 71.3 | Confident | 96 Ų | 96 | 84.9 Ų | 84.9 | 45% | 0.449 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -74.2 | -40 | 173.8 | -165.1 | 65.2 | -136.9 | 0 | 0 | 111.4 | R278 A279 G280 R285 F286 | R278-E282 WeakPolarHBondContact O-CB 3.42Å; R278-E282 PolarHBondContact O-N 2.74Å; A279-E282 PolarHBondContact O-N 2.83Å; G280-E282 VanDerWaalsContact C-N 3.34Å; G280-E282 PolarHBondContact O-N 3.39Å; E282-R285 PolarHBondContact O-N 2.93Å; E282-R285 IonicContact OE1-CZ 3.32Å; E282-R285 IonicContact OE1-NH1 3.22Å; E282-R285 PolarHBondContact OE1-NH1 3.21Å; E282-R285 IonicContact OE2-CZ 3.68Å; E282-R285 IonicContact OE2-NH1 3.75Å; E282-R285 PolarHBondContact OE2-NH1 3.12Å; E282-R285 IonicContact OE2-NH2 2.77Å; E282-R285 PolarHBondContact OE2-NH2 3.46Å; E282-F286 PolarHBondContact O-N 3.45Å |
| 283 | L | 76.3 | Confident | 71.8 | Confident | 41 Ų | 41 | 86 Ų | 86 | 22% | 0.215 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -70.1 | -41.9 | 177 | -176.9 | 59.5 | 0 | 0 | 0 | 111.8 | V117 L120 A279 G280 R285 F286 F287 | V117-L283 HydrophobicContact CB-CD2 4.39Å; V117-L283 HydrophobicContact CG1-CD2 4.12Å; V117-L283 HydrophobicContact CG2-CD2 3.47Å; V117-L283 VanDerWaalsContact CG2-CD2 3.47Å; L120-L283 HydrophobicContact CD2-CD1 4.24Å; A279-L283 WeakPolarHBondContact O-CB 3.19Å; A279-L283 PolarHBondContact O-N 2.78Å; G280-L283 PolarHBondContact O-N 2.96Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 2.92Å; L283-F286 HydrophobicContact CD1-CD1 4.41Å; L283-F286 WeakPolarHBondContact O-CB 3.43Å; L283-F286 PolarHBondContact O-N 3.07Å; L283-F286 VanDerWaalsContact O-N 3.12Å; L283-F287 HydrophobicContact CD1-CD2 4.24Å; L283-F287 HydrophobicContact CD1-CE1 4.3Å; L283-F287 HydrophobicContact CD1-CE2 3.64Å; L283-F287 HydrophobicContact CD1-CZ 3.67Å; L283-F287 HydrophobicContact CD2-CE2 3.95Å; L283-F287 HydrophobicContact CD2-CZ 4.41Å; L283-F287 HydrophobicContact CG-CD2 4.01Å; L283-F287 HydrophobicContact CG-CE2 3.48Å; L283-F287 VanDerWaalsContact CG-CE2 3.48Å; L283-F287 HydrophobicContact CG-CZ 4.03Å; L283-F287 WeakPolarHBondContact O-CD2 3.49Å; L283-F287 PolarHBondContact O-N 3.06Å |
| 284 | E | 80.3 | Confident | 72 | Confident | 99 Ų | 99 | 86.4 Ų | 86.4 | 46% | 0.463 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -57.7 | -44.6 | 171.3 | -172.2 | -175.5 | -175.5 | 0 | 0 | 111.1 | G280 F286 F287 N288 | G280-E284 WeakPolarHBondContact O-CB 3.25Å; G280-E284 PolarHBondContact O-N 3.39Å; E284-F286 VanDerWaalsContact C-N 3.32Å; E284-F286 PolarHBondContact O-N 2.98Å; E284-F287 PolarHBondContact O-N 3.07Å; E284-N288 WeakPolarHBondContact O-CB 3.15Å; E284-N288 PolarHBondContact O-N 3.42Å; E284-N288 PolarHBondContact O-ND2 3.35Å; E284-N288 VanDerWaalsContact O-ND2 3.16Å |
| 285 | R | 82.6 | Confident | 72.3 | Confident | 136 Ų | 136 | 83.7 Ų | 83.7 | 51% | 0.513 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.1 | -38.5 | 173.7 | -167.2 | -169.4 | -52 | 132.4 | 18 | 112.5 | T281 E282 L283 L289 | T281-R285 WeakPolarHBondContact O-CB 3.41Å; T281-R285 PolarHBondContact O-N 3.18Å; T281-R285 VanDerWaalsContact O-N 3.12Å; E282-R285 PolarHBondContact O-N 2.93Å; E282-R285 IonicContact OE1-CZ 3.32Å; E282-R285 IonicContact OE1-NH1 3.22Å; E282-R285 PolarHBondContact OE1-NH1 3.21Å; E282-R285 IonicContact OE2-CZ 3.68Å; E282-R285 IonicContact OE2-NH1 3.75Å; E282-R285 PolarHBondContact OE2-NH1 3.12Å; E282-R285 IonicContact OE2-NH2 2.77Å; E282-R285 PolarHBondContact OE2-NH2 3.46Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 2.92Å; R285-L289 VanDerWaalsContact O-CB 3.32Å; R285-L289 WeakPolarHBondContact O-CB 3.39Å; R285-L289 PolarHBondContact O-N 2.98Å |
| 286 | F | 80.9 | Confident | 72.4 | Confident | 89 Ų | 89 | 77.8 Ų | 77.8 | 39% | 0.39 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 176.6 | 172.9 | -96.4 | 0 | 0 | 0 | 111.9 | E282 L283 E284 L289 C290 L363 | E282-F286 PolarHBondContact O-N 3.45Å; L283-F286 HydrophobicContact CD1-CD1 4.41Å; L283-F286 WeakPolarHBondContact O-CB 3.43Å; L283-F286 PolarHBondContact O-N 3.07Å; L283-F286 VanDerWaalsContact O-N 3.12Å; E284-F286 VanDerWaalsContact C-N 3.32Å; E284-F286 PolarHBondContact O-N 2.98Å; F286-L289 WeakPolarHBondContact O-CB 3.32Å; F286-L289 PolarHBondContact O-N 3.37Å; F286-C290 PolarHBondContact O-N 3.4Å; F286-C290 PolarHBondContact O-SG 3.16Å; F286-C290 VanDerWaalsContact O-SG 3.37Å; F286-L363 HydrophobicContact CZ-CD1 4.39Å |
| 287 | F | 82.1 | Confident | 72.9 | Confident | 4 Ų | 4 | 71.1 Ų | 71.1 | 2% | 0.018 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 176.8 | -66.2 | -45 | 0 | 0 | 0 | 112.3 | L115 L120 L283 E284 L289 C290 G291 L292 W362 | L115-F287 HydrophobicContact CB-CE2 4.37Å; L115-F287 HydrophobicContact CD1-CD2 4.28Å; L115-F287 HydrophobicContact CD1-CE2 4.49Å; L120-F287 HydrophobicContact CD2-CE1 4.33Å; L120-F287 HydrophobicContact CD2-CZ 3.94Å; L283-F287 HydrophobicContact CD1-CD2 4.24Å; L283-F287 HydrophobicContact CD1-CE1 4.3Å; L283-F287 HydrophobicContact CD1-CE2 3.64Å; L283-F287 HydrophobicContact CD1-CZ 3.67Å; L283-F287 HydrophobicContact CD2-CE2 3.95Å; L283-F287 HydrophobicContact CD2-CZ 4.41Å; L283-F287 HydrophobicContact CG-CD2 4.01Å; L283-F287 HydrophobicContact CG-CE2 3.48Å; L283-F287 VanDerWaalsContact CG-CE2 3.48Å; L283-F287 HydrophobicContact CG-CZ 4.03Å; L283-F287 WeakPolarHBondContact O-CD2 3.49Å; L283-F287 PolarHBondContact O-N 3.06Å; E284-F287 PolarHBondContact O-N 3.07Å; F287-L289 VanDerWaalsContact C-N 3.31Å; F287-L289 PolarHBondContact O-N 3.47Å; F287-C290 CarbonylContact O-C 3.56Å; F287-C290 WeakPolarHBondContact O-CA 3.32Å; F287-C290 WeakPolarHBondContact O-CB 3.35Å; F287-C290 PolarHBondContact O-N 3.43Å; F287-G291 PolarHBondContact O-N 3.42Å; F287-L292 HydrophobicContact CB-CB 4.31Å; F287-L292 HydrophobicContact CD1-CD1 4.19Å; F287-L292 PolarHBondContact O-N 3.06Å; F287-W362 AromaticContact CE1-CH2 3.96Å; F287-W362 HydrophobicContact CE1-CH2 3.96Å; F287-W362 AromaticContact CE1-CZ3 3.97Å; F287-W362 HydrophobicContact CE1-CZ3 3.97Å; F287-W362 HydrophobicContact CZ-CH2 4.29Å |
| 288 | N | 81.5 | Confident | 72.9 | Confident | 93 Ų | 93 | 72.8 Ų | 72.8 | 50% | 0.497 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.4 | -40.3 | 172.7 | -73.2 | -28.8 | 0 | 0 | 0 | 111.9 | E284 C290 G291 | E284-N288 WeakPolarHBondContact O-CB 3.15Å; E284-N288 PolarHBondContact O-N 3.42Å; E284-N288 PolarHBondContact O-ND2 3.35Å; E284-N288 VanDerWaalsContact O-ND2 3.16Å; N288-C290 VanDerWaalsContact C-N 3.32Å; N288-C290 PolarHBondContact O-N 3.07Å; N288-G291 PolarHBondContact O-N 2.93Å |
| 289 | L | 81 | Confident | 72.7 | Confident | 149 Ų | 149 | 70.5 Ų | 70.5 | 78% | 0.78 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -66.7 | -30.9 | 174.4 | -177.9 | 64 | 0 | 0 | 0 | 112.8 | R285 F286 F287 G291 | R285-L289 VanDerWaalsContact O-CB 3.32Å; R285-L289 WeakPolarHBondContact O-CB 3.39Å; R285-L289 PolarHBondContact O-N 2.98Å; F286-L289 WeakPolarHBondContact O-CB 3.32Å; F286-L289 PolarHBondContact O-N 3.37Å; F287-L289 VanDerWaalsContact C-N 3.31Å; F287-L289 PolarHBondContact O-N 3.47Å; L289-G291 VanDerWaalsContact C-N 3.25Å |
| 290 | C | 77.3 | Confident | 72.6 | Confident | 34 Ų | 34 | 69.1 Ų | 69.1 | 23% | 0.23 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -75.7 | -11 | 171.2 | -66 | 0 | 0 | 0 | 0 | 113.7 | F286 F287 N288 L292 R367 | F286-C290 PolarHBondContact O-N 3.4Å; F286-C290 PolarHBondContact O-SG 3.16Å; F286-C290 VanDerWaalsContact O-SG 3.37Å; F287-C290 CarbonylContact O-C 3.56Å; F287-C290 WeakPolarHBondContact O-CA 3.32Å; F287-C290 WeakPolarHBondContact O-CB 3.35Å; F287-C290 PolarHBondContact O-N 3.43Å; N288-C290 VanDerWaalsContact C-N 3.32Å; N288-C290 PolarHBondContact O-N 3.07Å; C290-L292 HydrophobicContact CB-CD1 4.04Å; C290-L292 HydrophobicContact CB-CG 4.18Å; C290-R367 PolarHBondContact O-NH2 3.31Å |
| 291 | G | 79.1 | Confident | 71.7 | Confident | 43 Ų | 43 | 71.4 Ų | 71.4 | 44% | 0.443 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73 | 37.9 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | F287 N288 L289 K370 | F287-G291 PolarHBondContact O-N 3.42Å; N288-G291 PolarHBondContact O-N 2.93Å; L289-G291 VanDerWaalsContact C-N 3.25Å; G291-K370 PolarHBondContact O-NZ 3.23Å |
| 292 | L | 75.7 | Confident | 70.8 | Confident | 8 Ų | 8 | 73.2 Ų | 73.2 | 4% | 0.042 | 40% | 0.404 | C | S | . | . | trans | -110.1 | 119.3 | 175.7 | -63.7 | 169.5 | 0 | 0 | 0 | 109.5 | F287 C290 D296 L297 L363 L366 | F287-L292 HydrophobicContact CB-CB 4.31Å; F287-L292 HydrophobicContact CD1-CD1 4.19Å; F287-L292 PolarHBondContact O-N 3.06Å; C290-L292 HydrophobicContact CB-CD1 4.04Å; C290-L292 HydrophobicContact CB-CG 4.18Å; L292-D296 WeakPolarHBondContact CA-OD2 3.41Å; L292-L297 HydrophobicContact CB-CD1 4.3Å; L292-L363 HydrophobicContact CD1-CD2 3.54Å; L292-L366 HydrophobicContact CD1-CD1 3.51Å; L292-L366 HydrophobicContact CD2-CB 3.8Å; L292-L366 HydrophobicContact CD2-CD1 3.81Å; L292-L366 HydrophobicContact CD2-CG 4.47Å; L292-L366 HydrophobicContact CG-CD1 4.3Å | ||
| 293 | E | 71.4 | Confident | 69.6 | Low | 120 Ų | 120 | 72.7 Ų | 72.7 | 56% | 0.561 | 41% | 0.411 | S | S | * | . | trans | -86.5 | 150.3 | 173.8 | -168.6 | 177.9 | 162.7 | 0 | 0 | 109.9 | A295 D296 | E293-A295 HydrophobicContact CG-CB 4.23Å; E293-A295 PolarHBondContact O-N 3.39Å; E293-A295 VanDerWaalsContact O-N 3.1Å; E293-D296 PolarHBondContact N-OD2 3.29Å; E293-D296 VanDerWaalsContact O-CB 3.32Å; E293-D296 WeakPolarHBondContact O-CB 3.43Å; E293-D296 PolarHBondContact O-N 3.12Å | ||
| 294 | P | 66.2 | Low | 68.3 | Low | 73 Ų | 73 | 75 Ų | 75 | 47% | 0.474 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -47.5 | -34.4 | 168.1 | 13.9 | -30.5 | 0 | 0 | 0 | 114.2 | L115 D296 L297 Q298 | L115-P294 HydrophobicContact CD2-CB 3.94Å; P294-D296 PolarHBondContact O-N 2.99Å; P294-L297 PolarHBondContact O-N 3.41Å; P294-Q298 WeakPolarHBondContact O-CG 3.48Å; P294-Q298 PolarHBondContact O-N 3.34Å |
| 295 | A | 67.6 | Low | 66.6 | Low | 43 Ų | 43 | 73.5 Ų | 73.5 | 36% | 0.355 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.8 | -39.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | E293 L297 Q298 D299 | E293-A295 HydrophobicContact CG-CB 4.23Å; E293-A295 PolarHBondContact O-N 3.39Å; E293-A295 VanDerWaalsContact O-N 3.1Å; A295-L297 PolarHBondContact O-N 2.92Å; A295-L297 VanDerWaalsContact O-N 3.14Å; A295-Q298 PolarHBondContact O-N 3.47Å; A295-Q298 VanDerWaalsContact O-N 3.13Å; A295-D299 PolarHBondContact O-N 2.82Å |
| 296 | D | 66.8 | Low | 64.8 | Low | 32 Ų | 32 | 72.9 Ų | 72.9 | 17% | 0.171 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -60.8 | -25.9 | 178.5 | -65.3 | -39.8 | 0 | 0 | 0 | 112.5 | L292 E293 P294 L300 K370 | L292-D296 WeakPolarHBondContact CA-OD2 3.41Å; E293-D296 PolarHBondContact N-OD2 3.29Å; E293-D296 VanDerWaalsContact O-CB 3.32Å; E293-D296 WeakPolarHBondContact O-CB 3.43Å; E293-D296 PolarHBondContact O-N 3.12Å; P294-D296 PolarHBondContact O-N 2.99Å; D296-L300 WeakPolarHBondContact O-CD1 3.24Å; D296-K370 WeakPolarHBondContact OD1-CD 3.18Å; D296-K370 IonicContact OD1-NZ 3.48Å; D296-K370 PolarHBondContact OD1-NZ 3.06Å; D296-K370 IonicContact OD2-NZ 2.65Å; D296-K370 PolarHBondContact OD2-NZ 3.39Å |
| 297 | L | 67.2 | Low | 63.3 | Low | 12 Ų | 12 | 74.1 Ų | 74.1 | 6% | 0.063 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -83.9 | -34.8 | 179.3 | -85.4 | 60.9 | 0 | 0 | 0 | 111.8 | L115 D116 L292 P294 A295 L366 | L115-L297 HydrophobicContact CB-CD2 4.32Å; L115-L297 HydrophobicContact CD2-CD2 3.91Å; D116-L297 HydrophobicContact CB-CD2 3.73Å; D116-L297 HydrophobicContact CB-CG 4.12Å; L292-L297 HydrophobicContact CB-CD1 4.3Å; P294-L297 PolarHBondContact O-N 3.41Å; A295-L297 PolarHBondContact O-N 2.92Å; A295-L297 VanDerWaalsContact O-N 3.14Å; L297-L366 HydrophobicContact CD1-CD1 4.49Å |
| 298 | Q | 61.6 | Low | 61.6 | Low | 118 Ų | 118 | 77.4 Ų | 77.4 | 55% | 0.551 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -70.7 | -31.9 | 179.8 | -64.7 | -71.7 | 101.9 | 0 | 0 | 112.5 | P294 A295 L300 | P294-Q298 WeakPolarHBondContact O-CG 3.48Å; P294-Q298 PolarHBondContact O-N 3.34Å; A295-Q298 PolarHBondContact O-N 3.47Å; A295-Q298 VanDerWaalsContact O-N 3.13Å; Q298-L300 VanDerWaalsContact C-N 3.31Å; Q298-L300 PolarHBondContact O-N 3.19Å |
| 299 | D | 57.8 | Low | 59.8 | Low | 124 Ų | 124 | 76 Ų | 76 | 66% | 0.663 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | -7.6 | -178.7 | -84.3 | -9.3 | 0 | 0 | 0 | 114.1 | A295 P301 | A295-D299 PolarHBondContact O-N 2.82Å; D299-P301 WeakPolarHBondContact O-CD 3.49Å |
| 300 | L | 55.8 | Low | 58.1 | Low | 23 Ų | 23 | 76 Ų | 76 | 12% | 0.12 | 47% | 0.466 | C | S | . | . | S | Bend | trans | -74.8 | 124.9 | 166.6 | -73.5 | 106.1 | 0 | 0 | 0 | 109.6 | D296 Q298 A302 L366 V369 | D296-L300 WeakPolarHBondContact O-CD1 3.24Å; Q298-L300 VanDerWaalsContact C-N 3.31Å; Q298-L300 PolarHBondContact O-N 3.19Å; L300-A302 PolarHBondContact O-N 3.01Å; L300-L366 HydrophobicContact CD1-CD2 3.24Å; L300-L366 HydrophobicContact CD2-CD2 3.82Å; L300-L366 HydrophobicContact CG-CD2 4.16Å; L300-V369 HydrophobicContact CD2-CG2 4.39Å |
| 301 | P | 47.4 | Very low | 56.7 | Low | 92 Ų | 92 | 78.2 Ų | 78.2 | 60% | 0.597 | 49% | 0.486 | S | S | * | . | trans | -56.9 | 138.7 | 162.4 | 26.5 | -33.1 | 0 | 0 | 0 | 108.1 | D299 S303 | D299-P301 WeakPolarHBondContact O-CD 3.49Å; P301-S303 PolarHBondContact O-N 3.2Å | ||
| 302 | A | 51.6 | Low | 55.1 | Low | 108 Ų | 108 | 84.3 Ų | 84.3 | 89% | 0.893 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -63.7 | 16.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | L300 | L300-A302 PolarHBondContact O-N 3.01Š|
| 303 | S | 52.4 | Low | 53.3 | Low | 86 Ų | 86 | 92.4 Ų | 92.4 | 60% | 0.601 | 53% | 0.531 | S | S | * | . | trans | -150.2 | 102.6 | -179.9 | -173.6 | 0 | 0 | 0 | 0 | 111.2 | P301 | P301-S303 PolarHBondContact O-N 3.2Š| ||
| 304 | S | 47.5 | Very low | 52.2 | Low | 89 Ų | 89 | 97 Ų | 97 | 62% | 0.622 | 54% | 0.543 | S | S | * | . | trans | -124.1 | 69.4 | 146.2 | 51.6 | 0 | 0 | 0 | 0 | 107.8 | D306 | S304-D306 PolarHBondContact O-N 3.22Š| ||
| 305 | S | 44.8 | Very low | 51 | Low | 68 Ų | 68 | 99.2 Ų | 99.2 | 48% | 0.476 | 56% | 0.56 | S | S | . | * | trans | -77.8 | 83.2 | -171.3 | -169.4 | 0 | 0 | 0 | 0 | 112.9 | I307 V308 | S305-I307 VanDerWaalsContact C-N 3.3Å; S305-V308 WeakPolarHBondContact OG-CG2 3.33Å | ||
| 306 | D | 44.5 | Very low | 49.5 | Very low | 123 Ų | 123 | 103.9 Ų | 103.9 | 66% | 0.658 | 58% | 0.584 | S | S | * | * | trans | -81.6 | -9.6 | 166.1 | -79.4 | -20.9 | 0 | 0 | 0 | 112.8 | S304 V308 S309 | S304-D306 PolarHBondContact O-N 3.22Å; D306-V308 PolarHBondContact O-N 2.78Å; D306-S309 WeakPolarHBondContact O-CB 3.43Å; D306-S309 PolarHBondContact O-N 3.11Å | ||
| 307 | I | 50.9 | Low | 48.1 | Very low | 114 Ų | 114 | 107 Ų | 107 | 59% | 0.585 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | -28.9 | -173.5 | -62.2 | 169.5 | 0 | 0 | 0 | 111.8 | P128 S305 S309 L310 | P128-I307 HydrophobicContact CB-CG2 4.09Å; S305-I307 VanDerWaalsContact C-N 3.3Å; I307-S309 PolarHBondContact O-N 3.03Å; I307-L310 PolarHBondContact O-N 3Å |
| 308 | V | 46.4 | Very low | 46.3 | Very low | 74 Ų | 74 | 111.5 Ų | 111.5 | 45% | 0.448 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.7 | -18.6 | 177 | 177.9 | 0 | 0 | 0 | 0 | 112.3 | S305 D306 L310 A311 | S305-V308 WeakPolarHBondContact OG-CG2 3.33Å; D306-V308 PolarHBondContact O-N 2.78Å; V308-L310 VanDerWaalsContact C-N 3.32Å; V308-L310 PolarHBondContact O-N 3.07Å; V308-A311 PolarHBondContact O-N 3.36Å |
| 309 | S | 42.7 | Very low | 45.3 | Very low | 62 Ų | 62 | 111.3 Ų | 111.3 | 43% | 0.434 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -72.7 | -19.4 | -179.4 | -64.6 | 0 | 0 | 0 | 0 | 114.2 | D306 I307 F313 | D306-S309 WeakPolarHBondContact O-CB 3.43Å; D306-S309 PolarHBondContact O-N 3.11Å; I307-S309 PolarHBondContact O-N 3.03Å; S309-F313 WeakPolarHBondContact O-CD2 3.37Å |
| 310 | L | 45.6 | Very low | 44.2 | Very low | 151 Ų | 151 | 109.2 Ų | 109.2 | 79% | 0.791 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -82.8 | -28.5 | 176.4 | -166.5 | 60.4 | 0 | 0 | 0 | 112.6 | I307 V308 | I307-L310 PolarHBondContact O-N 3Å; V308-L310 VanDerWaalsContact C-N 3.32Å; V308-L310 PolarHBondContact O-N 3.07Å |
| 311 | A | 47.8 | Very low | 43.3 | Very low | 79 Ų | 79 | 113.7 Ų | 113.7 | 65% | 0.653 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -76.1 | -20.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | V308 F313 | V308-A311 PolarHBondContact O-N 3.36Å; A311-F313 VanDerWaalsContact C-N 3.3Å; A311-F313 PolarHBondContact O-N 3.12Å |
| 312 | R | 45.3 | Very low | 43 | Very low | 171 Ų | 171 | 118.6 Ų | 118.6 | 65% | 0.645 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.3 | -0.4 | -178.5 | -162.3 | 173.3 | -75.2 | 116.7 | -5.1 | 114.3 | ||
| 313 | F | 38.7 | Very low | 42.2 | Very low | 178 Ų | 178 | 119.1 Ų | 119.1 | 78% | 0.781 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | 18.1 | 174.8 | -74.6 | -72.9 | 0 | 0 | 0 | 114.4 | S309 A311 | S309-F313 WeakPolarHBondContact O-CD2 3.37Å; A311-F313 VanDerWaalsContact C-N 3.3Å; A311-F313 PolarHBondContact O-N 3.12Å |
| 314 | R | 48.7 | Very low | 41.5 | Very low | 218 Ų | 218 | 118.2 Ų | 118.2 | 82% | 0.823 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -125.1 | 126.2 | 160.2 | -64.6 | -68.3 | 175.6 | 161.7 | -3.9 | 107.5 | ||
| 315 | S | 40.7 | Very low | 40.6 | Very low | 118 Ų | 118 | 119 Ų | 119 | 83% | 0.825 | 72% | 0.723 | S | S | * | * | trans | 82 | 80.3 | -178 | -48 | 0 | 0 | 0 | 0 | 117 | ||||
| 316 | V | 35.7 | Very low | 40.1 | Very low | 142 Ų | 142 | 121.2 Ų | 121.2 | 86% | 0.861 | 74% | 0.739 | S | S | * | * | trans | -126.7 | 133.5 | 132.5 | -170.8 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 317 | S | 36 | Very low | 40.2 | Very low | 98 Ų | 98 | 124.6 Ų | 124.6 | 69% | 0.685 | 75% | 0.751 | S | S | * | * | trans | -82.6 | 164.9 | -160.6 | -42.5 | 0 | 0 | 0 | 0 | 114.6 | P319 | S317-P319 WeakPolarHBondContact O-CD 2.96Š| ||
| 318 | A | 30.9 | Very low | 39.5 | Very low | 105 Ų | 105 | 130.6 Ų | 130.6 | 87% | 0.868 | 77% | 0.766 | S | S | * | * | trans | -95.5 | 103.5 | 141.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 319 | P | 39.8 | Very low | 39 | Very low | 114 Ų | 114 | 130.8 Ų | 130.8 | 74% | 0.74 | 78% | 0.784 | S | S | * | * | trans | -88.2 | 136.2 | 173.1 | 33.8 | -30 | 0 | 0 | 0 | 110.6 | S317 | S317-P319 WeakPolarHBondContact O-CD 2.96Š| ||
| 320 | G | 34.8 | Very low | 38.5 | Very low | 80 Ų | 80 | 131.2 Ų | 131.2 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | trans | 81.8 | 93.2 | 161.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 321 | S | 37.2 | Very low | 38.1 | Very low | 117 Ų | 117 | 132.1 Ų | 132.1 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -150.8 | 96.7 | 135 | -167.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 322 | E | 40.8 | Very low | 37.5 | Very low | 195 Ų | 195 | 137.1 Ų | 137.1 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | trans | -78.2 | 123.5 | 159.6 | 61.9 | -167.2 | 112.7 | 0 | 0 | 108.1 | ||||
| 323 | C | 35.1 | Very low | 37.4 | Very low | 119 Ų | 119 | 137.7 Ų | 137.7 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | -147.5 | 114.8 | 162.5 | -159.8 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 324 | G | 36.6 | Very low | 37.6 | Very low | 67 Ų | 67 | 138.8 Ų | 138.8 | 69% | 0.691 | 83% | 0.825 | S | S | * | * | trans | -90.7 | 160 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 325 | A | 30 | Very low | 37.2 | Very low | 105 Ų | 105 | 137 Ų | 137 | 87% | 0.868 | 83% | 0.826 | S | S | * | * | trans | 66.9 | 145.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 326 | S | 34.8 | Very low | 37.4 | Very low | 116 Ų | 116 | 140.7 Ų | 140.7 | 81% | 0.811 | 83% | 0.83 | S | S | * | * | cis | -137.6 | 151.9 | 22.3 | -169.5 | 0 | 0 | 0 | 0 | 114 | ||||
| 327 | Q | 45.2 | Very low | 37.9 | Very low | 193 Ų | 193 | 141.9 Ų | 141.9 | 90% | 0.902 | 83% | 0.827 | S | S | * | * | trans | -81 | 115.1 | 175.7 | -175.5 | 178.1 | 30.9 | 0 | 0 | 110.6 | ||||
| 328 | R | 37.5 | Very low | 38.3 | Very low | 240 Ų | 240 | 142.7 Ų | 142.7 | 91% | 0.906 | 82% | 0.819 | S | S | * | * | trans | -163.9 | 121.5 | 161.9 | -127.5 | 174.3 | -176.4 | -117.4 | 0.9 | 105 | ||||
| 329 | G | 34.2 | Very low | 38.9 | Very low | 79 Ų | 79 | 141.3 Ų | 141.3 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | cis | 105.8 | 89.8 | 40.9 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 330 | G | 33 | Very low | 39.3 | Very low | 71 Ų | 71 | 141.5 Ų | 141.5 | 73% | 0.732 | 81% | 0.809 | S | S | * | * | trans | 170.2 | 111.4 | -170.3 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 331 | E | 36.7 | Very low | 39.4 | Very low | 169 Ų | 169 | 144.9 Ų | 144.9 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -90.8 | 175.7 | -174.2 | -66.7 | 136.7 | -119.9 | 0 | 0 | 110.9 | ||||
| 332 | E | 36.4 | Very low | 39.6 | Very low | 184 Ų | 184 | 143 Ų | 143 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | trans | 74.5 | 131.9 | 172.7 | -52.3 | 159.8 | -140.2 | 0 | 0 | 113.7 | ||||
| 333 | E | 42.3 | Very low | 39.7 | Very low | 183 Ų | 183 | 137.4 Ų | 137.4 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | cis | -134.5 | 150.2 | 11.5 | -63.8 | 173 | 133.4 | 0 | 0 | 111.4 | E335 | E333-E335 PolarHBondContact O-N 3.22Š| ||
| 334 | E | 42.5 | Very low | 40.1 | Very low | 202 Ų | 202 | 138.7 Ų | 138.7 | 94% | 0.944 | 79% | 0.786 | S | S | * | * | trans | -81.7 | 107.1 | 165.6 | -69.3 | 179.9 | 153.4 | 0 | 0 | 109.6 | ||||
| 335 | E | 41.2 | Very low | 40.5 | Very low | 181 Ų | 181 | 146.4 Ų | 146.4 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | trans | -132.5 | 103.5 | 156 | -156.2 | 168.9 | -142.1 | 0 | 0 | 110.6 | E333 E337 | E333-E335 PolarHBondContact O-N 3.22Å; E335-E337 PolarHBondContact O-N 3.11Å | ||
| 336 | E | 45.6 | Very low | 41.4 | Very low | 194 Ų | 194 | 146.4 Ų | 146.4 | 91% | 0.907 | 78% | 0.784 | S | S | * | * | trans | -80.1 | 59.3 | -177.4 | -164.3 | 179.1 | -150.4 | 0 | 0 | 111.3 | E338 | E336-E338 VanDerWaalsContact C-N 3.26Å; E336-E338 PolarHBondContact O-N 2.71Å | ||
| 337 | E | 46.3 | Very low | 42.8 | Very low | 168 Ų | 168 | 146.5 Ų | 146.5 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | -76.1 | 86.4 | 161.9 | -102.1 | -86.6 | 131 | 0 | 0 | 108 | E335 A339 | E335-E337 PolarHBondContact O-N 3.11Å; E337-A339 VanDerWaalsContact C-N 3.33Å; E337-A339 PolarHBondContact O-N 2.77Å | ||
| 338 | E | 42.8 | Very low | 43.3 | Very low | 114 Ų | 114 | 147.5 Ų | 147.5 | 53% | 0.533 | 78% | 0.778 | S | S | . | * | trans | -53.5 | 96.1 | 170.3 | -175.8 | -172.6 | 146.4 | 0 | 0 | 109.4 | E336 K341 | E336-E338 VanDerWaalsContact C-N 3.26Å; E336-E338 PolarHBondContact O-N 2.71Å; E338-K341 VanDerWaalsContact OE1-CD 3.24Å; E338-K341 WeakPolarHBondContact OE1-CD 3.39Å; E338-K341 WeakPolarHBondContact OE1-CE 3.44Å; E338-K341 WeakPolarHBondContact OE1-CG 3.37Å; E338-K341 IonicContact OE1-NZ 2.65Å; E338-K341 PolarHBondContact OE1-NZ 3.33Å; E338-K341 IonicContact OE2-NZ 3.28Å; E338-K341 PolarHBondContact OE2-NZ 3.46Å | ||
| 339 | A | 45.2 | Very low | 45 | Very low | 77 Ų | 77 | 137.8 Ų | 137.8 | 64% | 0.636 | 75% | 0.753 | S | S | * | * | trans | -46.1 | 120.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | E337 K341 | E337-A339 VanDerWaalsContact C-N 3.33Å; E337-A339 PolarHBondContact O-N 2.77Å; A339-K341 PolarHBondContact O-N 3.3Å | ||
| 340 | P | 46.2 | Very low | 47.2 | Very low | 117 Ų | 117 | 134.8 Ų | 134.8 | 76% | 0.76 | 72% | 0.719 | S | S | * | * | trans | -58.9 | 103.6 | -162.1 | 18.9 | -32.3 | 0 | 0 | 0 | 109.5 | G342 | P340-G342 WeakPolarHBondContact O-CA 3.38Å; P340-G342 PolarHBondContact O-N 3.07Å | ||
| 341 | K | 38.4 | Very low | 49.7 | Very low | 152 Ų | 152 | 133.4 Ų | 133.4 | 66% | 0.661 | 70% | 0.698 | S | S | * | * | trans | -42.9 | 112.1 | -172.6 | -81 | 176 | 179.7 | 117.8 | 0 | 107.8 | E338 A339 A343 | E338-K341 VanDerWaalsContact OE1-CD 3.24Å; E338-K341 WeakPolarHBondContact OE1-CD 3.39Å; E338-K341 WeakPolarHBondContact OE1-CE 3.44Å; E338-K341 WeakPolarHBondContact OE1-CG 3.37Å; E338-K341 IonicContact OE1-NZ 2.65Å; E338-K341 PolarHBondContact OE1-NZ 3.33Å; E338-K341 IonicContact OE2-NZ 3.28Å; E338-K341 PolarHBondContact OE2-NZ 3.46Å; A339-K341 PolarHBondContact O-N 3.3Å; K341-A343 WeakPolarHBondContact O-CA 3.42Å; K341-A343 PolarHBondContact O-N 2.97Å | ||
| 342 | G | 41.4 | Very low | 52.1 | Low | 77 Ų | 77 | 129.7 Ų | 129.7 | 79% | 0.794 | 69% | 0.687 | S | S | * | * | trans | -40.7 | 100.9 | -160 | 0 | 0 | 0 | 0 | 0 | 110.6 | P340 D344 | P340-G342 WeakPolarHBondContact O-CA 3.38Å; P340-G342 PolarHBondContact O-N 3.07Å; G342-D344 PolarHBondContact O-N 3.13Å | ||
| 343 | A | 42.1 | Very low | 54.5 | Low | 78 Ų | 78 | 127.5 Ų | 127.5 | 65% | 0.645 | 68% | 0.679 | S | S | * | * | trans | -46 | 123.8 | -153.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | K341 R345 | K341-A343 WeakPolarHBondContact O-CA 3.42Å; K341-A343 PolarHBondContact O-N 2.97Å; A343-R345 WeakPolarHBondContact O-CA 3.46Å; A343-R345 WeakPolarHBondContact O-CG 3.48Å; A343-R345 PolarHBondContact O-N 2.6Å | ||
| 344 | D | 44.6 | Very low | 56.9 | Low | 145 Ų | 145 | 122.9 Ų | 122.9 | 78% | 0.775 | 66% | 0.658 | S | S | * | * | trans | -50 | 91.2 | -175.2 | -178 | 21.6 | 0 | 0 | 0 | 108.5 | G342 V346 | G342-D344 PolarHBondContact O-N 3.13Å; D344-V346 PolarHBondContact O-N 3.31Å | ||
| 345 | R | 44.5 | Very low | 59.2 | Low | 229 Ų | 229 | 116.9 Ų | 116.9 | 86% | 0.864 | 63% | 0.627 | S | S | * | * | trans | -81.4 | 75 | -178 | -90.8 | -172.1 | 174.1 | -174.3 | -0.5 | 103.5 | A343 P347 | A343-R345 WeakPolarHBondContact O-CA 3.46Å; A343-R345 WeakPolarHBondContact O-CG 3.48Å; A343-R345 PolarHBondContact O-N 2.6Å; R345-P347 WeakPolarHBondContact O-CA 3.33Å; R345-P347 WeakPolarHBondContact O-CD 3.42Å | ||
| 346 | V | 49.3 | Very low | 61.5 | Low | 105 Ų | 105 | 112.8 Ų | 112.8 | 64% | 0.636 | 61% | 0.61 | S | S | * | * | trans | -26.1 | 106.8 | 158 | 175.4 | 0 | 0 | 0 | 0 | 105.2 | D344 Y348 | D344-V346 PolarHBondContact O-N 3.31Å; V346-Y348 PolarHBondContact O-N 3.33Å | ||
| 347 | P | 63.6 | Low | 63.8 | Low | 118 Ų | 118 | 106.2 Ų | 106.2 | 77% | 0.766 | 59% | 0.589 | S | S | * | * | trans | -55.7 | 107.1 | -166.1 | -30.5 | 35.8 | 0 | 0 | 0 | 107.8 | R345 G349 | R345-P347 WeakPolarHBondContact O-CA 3.33Å; R345-P347 WeakPolarHBondContact O-CD 3.42Å; P347-G349 VanDerWaalsContact C-N 3.33Å; P347-G349 PolarHBondContact O-N 2.8Å | ||
| 348 | Y | 55.9 | Low | 65.9 | Low | 214 Ų | 214 | 102 Ų | 102 | 84% | 0.839 | 57% | 0.566 | S | S | * | * | trans | -69.3 | 102.9 | -171.2 | -166.8 | -84.3 | 0 | 0 | 0 | 105.1 | V346 | V346-Y348 PolarHBondContact O-N 3.33Š| ||
| 349 | G | 71.7 | Confident | 68.2 | Low | 36 Ų | 36 | 97.8 Ų | 97.8 | 37% | 0.371 | 55% | 0.548 | S | S | . | . | P | Polyproline II helix | trans | -49.9 | 145.5 | -171.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | D126 P347 S351 | D126-G349 WeakPolarHBondContact OD2-CA 3.41Å; P347-G349 VanDerWaalsContact C-N 3.33Å; P347-G349 PolarHBondContact O-N 2.8Å; G349-S351 PolarHBondContact O-N 3.02Å |
| 350 | V | 81.5 | Confident | 70.2 | Confident | 17 Ų | 17 | 98.6 Ų | 98.6 | 10% | 0.103 | 54% | 0.541 | C | S | . | . | P | Polyproline II helix | trans | -46.3 | 119.6 | -166.2 | -179.5 | 0 | 0 | 0 | 0 | 108.4 | D126 E354 R355 | D126-V350 HydrophobicContact CB-CG2 3.92Å; D126-V350 VanDerWaalsContact OD1-CB 3.22Å; D126-V350 WeakPolarHBondContact OD1-CB 3.46Å; D126-V350 VanDerWaalsContact OD1-CG2 3.28Å; D126-V350 WeakPolarHBondContact OD1-CG2 3.37Å; D126-V350 PolarHBondContact OD2-N 3.1Å; V350-E354 HydrophobicContact CG1-CB 3.76Å; V350-E354 VanDerWaalsContact CG1-CD 3.49Å; V350-E354 HydrophobicContact CG1-CG 3.71Å; V350-R355 HydrophobicContact CB-CG 4.16Å; V350-R355 HydrophobicContact CG1-CG 3.64Å; V350-R355 PolarHBondContact O-NE 3.33Å; V350-R355 PolarHBondContact O-NH2 3.06Å |
| 351 | S | 85.2 | Confident | 72.3 | Confident | 41 Ų | 41 | 100.3 Ų | 100.3 | 29% | 0.287 | 54% | 0.536 | S | S | . | . | P | Polyproline II helix | trans | -61.1 | 153.7 | -172 | 72.4 | 0 | 0 | 0 | 0 | 110.5 | G349 I353 E354 R355 | G349-S351 PolarHBondContact O-N 3.02Å; S351-I353 PolarHBondContact O-N 3.42Å; S351-E354 PolarHBondContact O-N 3.36Å; S351-E354 WeakPolarHBondContact OG-CB 3.32Å; S351-E354 PolarHBondContact OG-N 3.23Å; S351-R355 PolarHBondContact O-N 2.86Å |
| 352 | V | 86.3 | Confident | 74.7 | Confident | 91 Ų | 91 | 94.1 Ų | 94.1 | 55% | 0.552 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -56.9 | -34.4 | 176 | 177.5 | 0 | 0 | 0 | 0 | 111 | N356 | V352-N356 WeakPolarHBondContact O-CB 3.38Å; V352-N356 PolarHBondContact O-N 3.03Å; V352-N356 PolarHBondContact O-OD1 2.87Å |
| 353 | I | 88.4 | Confident | 76.9 | Confident | 138 Ų | 138 | 92.1 Ų | 92.1 | 71% | 0.708 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.9 | -43.7 | 176.2 | -56.2 | 174.7 | 0 | 0 | 0 | 110.6 | S351 N356 A357 | S351-I353 PolarHBondContact O-N 3.42Å; I353-N356 PolarHBondContact O-N 3.06Å; I353-A357 WeakPolarHBondContact O-CB 3.29Å; I353-A357 PolarHBondContact O-N 3.3Å |
| 354 | E | 91.4 | Very high | 78.9 | Confident | 86 Ų | 86 | 95.3 Ų | 95.3 | 40% | 0.402 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -69.8 | -39.8 | 178.1 | -172.1 | -173.7 | 154.2 | 0 | 0 | 112.1 | V350 S351 A357 R358 | V350-E354 HydrophobicContact CG1-CB 3.76Å; V350-E354 VanDerWaalsContact CG1-CD 3.49Å; V350-E354 HydrophobicContact CG1-CG 3.71Å; S351-E354 PolarHBondContact O-N 3.36Å; S351-E354 WeakPolarHBondContact OG-CB 3.32Å; S351-E354 PolarHBondContact OG-N 3.23Å; E354-A357 PolarHBondContact O-N 3.16Å; E354-R358 WeakPolarHBondContact O-CG 3.41Å; E354-R358 PolarHBondContact O-N 3.44Å; E354-R358 IonicContact OE1-CZ 3.42Å; E354-R358 IonicContact OE1-NE 3.36Å; E354-R358 PolarHBondContact OE1-NE 3.46Å; E354-R358 IonicContact OE1-NH2 2.71Å; E354-R358 PolarHBondContact OE1-NH2 3.03Å |
| 355 | R | 92.3 | Very high | 80.8 | Confident | 77 Ų | 77 | 89.9 Ų | 89.9 | 29% | 0.291 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.5 | -46.6 | 171.7 | -77.6 | 177.8 | -82.6 | 173.3 | -23.2 | 111.4 | I124 V350 S351 A357 R358 V359 | I124-R355 WeakPolarHBondContact O-CD 3.04Å; V350-R355 HydrophobicContact CB-CG 4.16Å; V350-R355 HydrophobicContact CG1-CG 3.64Å; V350-R355 PolarHBondContact O-NE 3.33Å; V350-R355 PolarHBondContact O-NH2 3.06Å; S351-R355 PolarHBondContact O-N 2.86Å; R355-A357 VanDerWaalsContact C-N 3.33Å; R355-A357 PolarHBondContact O-N 3.17Å; R355-R358 WeakPolarHBondContact O-CB 3.33Å; R355-R358 PolarHBondContact O-N 3.06Å; R355-V359 WeakPolarHBondContact O-CG2 3.31Å; R355-V359 PolarHBondContact O-N 3.28Å |
| 356 | N | 89.6 | Confident | 82.6 | Confident | 94 Ų | 94 | 79.2 Ų | 79.2 | 50% | 0.503 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.2 | -42 | 174.5 | -70.4 | -5.6 | 0 | 0 | 0 | 111.8 | V352 I353 R358 V359 I360 | V352-N356 WeakPolarHBondContact O-CB 3.38Å; V352-N356 PolarHBondContact O-N 3.03Å; V352-N356 PolarHBondContact O-OD1 2.87Å; I353-N356 PolarHBondContact O-N 3.06Å; N356-R358 PolarHBondContact O-N 3.03Å; N356-V359 PolarHBondContact O-N 2.99Å; N356-I360 WeakPolarHBondContact O-CB 3.41Å; N356-I360 WeakPolarHBondContact O-CD1 3.46Å; N356-I360 VanDerWaalsContact O-CG1 3.24Å; N356-I360 WeakPolarHBondContact O-CG1 3.18Å; N356-I360 PolarHBondContact O-N 3.43Å |
| 357 | A | 93.8 | Very high | 84 | Confident | 56 Ų | 56 | 79.3 Ų | 79.3 | 46% | 0.463 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.7 | -38.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | I353 E354 R355 K361 | I353-A357 WeakPolarHBondContact O-CB 3.29Å; I353-A357 PolarHBondContact O-N 3.3Å; E354-A357 PolarHBondContact O-N 3.16Å; R355-A357 VanDerWaalsContact C-N 3.33Å; R355-A357 PolarHBondContact O-N 3.17Å; A357-K361 WeakPolarHBondContact O-CB 3.45Å; A357-K361 PolarHBondContact O-N 3.12Å |
| 358 | R | 90.2 | Very high | 84.5 | Confident | 81 Ų | 81 | 79 Ų | 79 | 31% | 0.306 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.7 | -46 | 174 | -70.7 | 171.6 | -174.9 | -160.6 | 2.2 | 111.6 | L123 E354 R355 N356 K361 W362 | L123-R358 HydrophobicContact CD2-CB 4.39Å; E354-R358 WeakPolarHBondContact O-CG 3.41Å; E354-R358 PolarHBondContact O-N 3.44Å; E354-R358 IonicContact OE1-CZ 3.42Å; E354-R358 IonicContact OE1-NE 3.36Å; E354-R358 PolarHBondContact OE1-NE 3.46Å; E354-R358 IonicContact OE1-NH2 2.71Å; E354-R358 PolarHBondContact OE1-NH2 3.03Å; R355-R358 WeakPolarHBondContact O-CB 3.33Å; R355-R358 PolarHBondContact O-N 3.06Å; N356-R358 PolarHBondContact O-N 3.03Å; R358-K361 PolarHBondContact O-N 3.22Å; R358-W362 WeakPolarHBondContact O-CB 3.38Å; R358-W362 PolarHBondContact O-N 3.36Å |
| 359 | V | 89.8 | Confident | 85.3 | Confident | 25 Ų | 25 | 70.8 Ų | 70.8 | 15% | 0.152 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -61.2 | -46.8 | 176.4 | 174.5 | 0 | 0 | 0 | 0 | 110.8 | L120 I124 R355 N356 W362 L363 | L120-V359 HydrophobicContact CD1-CG1 4.24Å; L120-V359 HydrophobicContact CD1-CG2 3.85Å; I124-V359 HydrophobicContact CG1-CG2 4.16Å; R355-V359 WeakPolarHBondContact O-CG2 3.31Å; R355-V359 PolarHBondContact O-N 3.28Å; N356-V359 PolarHBondContact O-N 2.99Å; V359-W362 PolarHBondContact O-N 2.79Å; V359-L363 HydrophobicContact CG1-CD1 4.05Å; V359-L363 HydrophobicContact CG1-CG 4.42Å; V359-L363 WeakPolarHBondContact O-CG 3.3Å; V359-L363 PolarHBondContact O-N 3.08Å |
| 360 | I | 88.1 | Confident | 85.4 | Confident | 94 Ų | 94 | 72 Ų | 72 | 48% | 0.482 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.3 | -48.4 | 176.6 | -67.6 | 164 | 0 | 0 | 0 | 110.6 | N356 W362 L363 Y364 | N356-I360 WeakPolarHBondContact O-CB 3.41Å; N356-I360 WeakPolarHBondContact O-CD1 3.46Å; N356-I360 VanDerWaalsContact O-CG1 3.24Å; N356-I360 WeakPolarHBondContact O-CG1 3.18Å; N356-I360 PolarHBondContact O-N 3.43Å; I360-W362 VanDerWaalsContact C-N 3.29Å; I360-W362 PolarHBondContact O-N 3.39Å; I360-L363 PolarHBondContact O-N 2.78Å; I360-Y364 HydrophobicContact CG2-CD2 3.73Å; I360-Y364 HydrophobicContact CG2-CE2 3.83Å; I360-Y364 WeakPolarHBondContact O-CD2 3.22Å; I360-Y364 PolarHBondContact O-N 2.87Å |
| 361 | K | 90.4 | Very high | 84.9 | Confident | 153 Ų | 153 | 75.4 Ų | 75.4 | 67% | 0.665 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -58.9 | -40.3 | 178 | -175.8 | 179.9 | 177.3 | -174.1 | 0 | 112 | A357 R358 G365 | A357-K361 WeakPolarHBondContact O-CB 3.45Å; A357-K361 PolarHBondContact O-N 3.12Å; R358-K361 PolarHBondContact O-N 3.22Å; K361-G365 PolarHBondContact O-N 3.04Å |
| 362 | W | 87.8 | Confident | 84.1 | Confident | 22 Ų | 22 | 77.5 Ų | 77.5 | 8% | 0.083 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.2 | -51.3 | 175.8 | 176.1 | 78.6 | 0 | 0 | 0 | 111.2 | D116 L120 L123 F287 R358 V359 I360 Y364 G365 L366 | D116-W362 HydrophobicContact CB-CZ2 4.09Å; D116-W362 WeakPolarHBondContact OD2-CZ2 3.24Å; L120-W362 HydrophobicContact CD1-CZ3 4.38Å; L123-W362 HydrophobicContact CD1-CB 3.88Å; L123-W362 HydrophobicContact CD1-CD2 4.15Å; L123-W362 HydrophobicContact CD1-CG 3.66Å; F287-W362 AromaticContact CE1-CH2 3.96Å; F287-W362 HydrophobicContact CE1-CH2 3.96Å; F287-W362 AromaticContact CE1-CZ3 3.97Å; F287-W362 HydrophobicContact CE1-CZ3 3.97Å; F287-W362 HydrophobicContact CZ-CH2 4.29Å; R358-W362 WeakPolarHBondContact O-CB 3.38Å; R358-W362 PolarHBondContact O-N 3.36Å; V359-W362 PolarHBondContact O-N 2.79Å; I360-W362 VanDerWaalsContact C-N 3.29Å; I360-W362 PolarHBondContact O-N 3.39Å; W362-Y364 VanDerWaalsContact C-N 3.33Å; W362-Y364 PolarHBondContact O-N 3.34Å; W362-G365 CarbonylContact O-C 3.57Å; W362-G365 WeakPolarHBondContact O-CA 3.43Å; W362-G365 PolarHBondContact O-N 2.94Å; W362-L366 HydrophobicContact CD2-CD1 4.08Å; W362-L366 HydrophobicContact CD2-CG 4.37Å; W362-L366 HydrophobicContact CE3-CD1 4.05Å; W362-L366 HydrophobicContact CH2-CD1 3.76Å; W362-L366 HydrophobicContact CZ2-CD1 3.78Å; W362-L366 HydrophobicContact CZ2-CD2 4.23Å; W362-L366 HydrophobicContact CZ2-CG 4.45Å; W362-L366 HydrophobicContact CZ3-CD1 3.89Å; W362-L366 WeakPolarHBondContact O-CG 3.3Å; W362-L366 PolarHBondContact O-N 2.97Å |
| 363 | L | 88.5 | Confident | 83.2 | Confident | 34 Ų | 34 | 75.8 Ų | 75.8 | 18% | 0.178 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -55.9 | -42.1 | 177.3 | -68.9 | 171.3 | 0 | 0 | 0 | 113.1 | F286 L292 V359 I360 L366 R367 | F286-L363 HydrophobicContact CZ-CD1 4.39Å; L292-L363 HydrophobicContact CD1-CD2 3.54Å; V359-L363 HydrophobicContact CG1-CD1 4.05Å; V359-L363 HydrophobicContact CG1-CG 4.42Å; V359-L363 WeakPolarHBondContact O-CG 3.3Å; V359-L363 PolarHBondContact O-N 3.08Å; I360-L363 PolarHBondContact O-N 2.78Å; L363-L366 HydrophobicContact CD2-CD1 4.39Å; L363-L366 PolarHBondContact O-N 3.06Å; L363-R367 PolarHBondContact O-N 3.44Å |
| 364 | Y | 84.9 | Confident | 81.8 | Confident | 146 Ų | 146 | 73.1 Ų | 73.1 | 57% | 0.573 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -68.4 | -37 | 173.3 | -85.3 | -81.5 | 0 | 0 | 0 | 112.2 | I360 W362 L366 R367 Q368 | I360-Y364 HydrophobicContact CG2-CD2 3.73Å; I360-Y364 HydrophobicContact CG2-CE2 3.83Å; I360-Y364 WeakPolarHBondContact O-CD2 3.22Å; I360-Y364 PolarHBondContact O-N 2.87Å; W362-Y364 VanDerWaalsContact C-N 3.33Å; W362-Y364 PolarHBondContact O-N 3.34Å; Y364-L366 PolarHBondContact O-N 3.3Å; Y364-R367 WeakPolarHBondContact O-CB 3.44Å; Y364-R367 PolarHBondContact O-N 3.08Å; Y364-Q368 WeakPolarHBondContact O-CG 3.47Å; Y364-Q368 PolarHBondContact O-N 2.79Å |
| 365 | G | 84.6 | Confident | 80.5 | Confident | 31 Ų | 31 | 73.3 Ų | 73.3 | 32% | 0.32 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -57.6 | -45 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | K361 W362 R367 Q368 V369 | K361-G365 PolarHBondContact O-N 3.04Å; W362-G365 CarbonylContact O-C 3.57Å; W362-G365 WeakPolarHBondContact O-CA 3.43Å; W362-G365 PolarHBondContact O-N 2.94Å; G365-R367 VanDerWaalsContact C-N 3.33Å; G365-R367 PolarHBondContact O-N 3.14Å; G365-Q368 PolarHBondContact O-N 3.02Å; G365-V369 WeakPolarHBondContact O-CG2 3.48Å; G365-V369 PolarHBondContact O-N 3.38Å |
| 366 | L | 80.4 | Confident | 78.8 | Confident | 5 Ų | 5 | 73.4 Ų | 73.4 | 3% | 0.026 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -57.5 | -46.1 | 174.2 | -58 | 176.6 | 0 | 0 | 0 | 111.4 | L292 L297 L300 W362 L363 Y364 V369 K370 | L292-L366 HydrophobicContact CD1-CD1 3.51Å; L292-L366 HydrophobicContact CD2-CB 3.8Å; L292-L366 HydrophobicContact CD2-CD1 3.81Å; L292-L366 HydrophobicContact CD2-CG 4.47Å; L292-L366 HydrophobicContact CG-CD1 4.3Å; L297-L366 HydrophobicContact CD1-CD1 4.49Å; L300-L366 HydrophobicContact CD1-CD2 3.24Å; L300-L366 HydrophobicContact CD2-CD2 3.82Å; L300-L366 HydrophobicContact CG-CD2 4.16Å; W362-L366 HydrophobicContact CD2-CD1 4.08Å; W362-L366 HydrophobicContact CD2-CG 4.37Å; W362-L366 HydrophobicContact CE3-CD1 4.05Å; W362-L366 HydrophobicContact CH2-CD1 3.76Å; W362-L366 HydrophobicContact CZ2-CD1 3.78Å; W362-L366 HydrophobicContact CZ2-CD2 4.23Å; W362-L366 HydrophobicContact CZ2-CG 4.45Å; W362-L366 HydrophobicContact CZ3-CD1 3.89Å; W362-L366 WeakPolarHBondContact O-CG 3.3Å; W362-L366 PolarHBondContact O-N 2.97Å; L363-L366 HydrophobicContact CD2-CD1 4.39Å; L363-L366 PolarHBondContact O-N 3.06Å; Y364-L366 PolarHBondContact O-N 3.3Å; L366-V369 PolarHBondContact O-N 2.98Å; L366-K370 PolarHBondContact O-N 3.24Å |
| 367 | R | 78.8 | Confident | 77.2 | Confident | 107 Ų | 107 | 74.4 Ų | 74.4 | 40% | 0.404 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60.7 | -46.1 | 177.3 | -177.8 | 177.5 | -59.2 | -78.8 | -8.2 | 112.1 | C290 L363 Y364 G365 V369 K370 E371 | C290-R367 PolarHBondContact O-NH2 3.31Å; L363-R367 PolarHBondContact O-N 3.44Å; Y364-R367 WeakPolarHBondContact O-CB 3.44Å; Y364-R367 PolarHBondContact O-N 3.08Å; G365-R367 VanDerWaalsContact C-N 3.33Å; G365-R367 PolarHBondContact O-N 3.14Å; R367-V369 VanDerWaalsContact C-N 3.27Å; R367-V369 PolarHBondContact O-N 3.24Å; R367-K370 PolarHBondContact O-N 3.02Å; R367-E371 WeakPolarHBondContact CD-OE1 3.45Å; R367-E371 HydrophobicContact CG-CG 4.42Å; R367-E371 WeakPolarHBondContact CG-OE1 3.49Å; R367-E371 WeakPolarHBondContact O-CB 3.47Å; R367-E371 WeakPolarHBondContact O-CG 3.5Å; R367-E371 PolarHBondContact O-N 3.4Å |
| 368 | Q | 75.6 | Confident | 75.2 | Confident | 111 Ų | 111 | 78.7 Ų | 78.7 | 52% | 0.519 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.8 | -33.1 | 176.2 | -66.3 | -56.2 | 126.4 | 0 | 0 | 112.6 | Y364 G365 N372 | Y364-Q368 WeakPolarHBondContact O-CG 3.47Å; Y364-Q368 PolarHBondContact O-N 2.79Å; G365-Q368 PolarHBondContact O-N 3.02Å; Q368-N372 WeakPolarHBondContact O-CB 3.34Å; Q368-N372 VanDerWaalsContact O-CG 3.31Å; Q368-N372 PolarHBondContact O-N 2.8Å; Q368-N372 VanDerWaalsContact O-N 3.11Å; Q368-N372 PolarHBondContact O-ND2 2.88Å |
| 369 | V | 72.3 | Confident | 73.1 | Confident | 42 Ų | 42 | 84.7 Ų | 84.7 | 26% | 0.255 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -68.3 | -51.2 | 173.8 | 174.1 | 0 | 0 | 0 | 0 | 110.4 | L300 G365 L366 R367 E371 N372 T373 | L300-V369 HydrophobicContact CD2-CG2 4.39Å; G365-V369 WeakPolarHBondContact O-CG2 3.48Å; G365-V369 PolarHBondContact O-N 3.38Å; L366-V369 PolarHBondContact O-N 2.98Å; R367-V369 VanDerWaalsContact C-N 3.27Å; R367-V369 PolarHBondContact O-N 3.24Å; V369-E371 VanDerWaalsContact C-N 3.34Å; V369-E371 PolarHBondContact O-N 3.26Å; V369-N372 WeakPolarHBondContact CA-ND2 3.44Å; V369-N372 VanDerWaalsContact O-CG 3.31Å; V369-N372 PolarHBondContact O-N 3.43Å; V369-N372 VanDerWaalsContact O-N 3.1Å; V369-N372 PolarHBondContact O-OD1 2.85Å; V369-T373 HydrophobicContact CG1-CG2 4.24Å; V369-T373 PolarHBondContact O-N 2.98Å; V369-T373 PolarHBondContact O-OG1 3.06Å |
| 370 | K | 73 | Confident | 72.2 | Confident | 60 Ų | 60 | 87.7 Ų | 87.7 | 26% | 0.261 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -56.2 | -45.6 | 175.6 | 168.9 | 153.6 | 55.5 | -169.1 | 0 | 112.8 | G291 D296 L366 R367 N372 T373 T374 | G291-K370 PolarHBondContact O-NZ 3.23Å; D296-K370 WeakPolarHBondContact OD1-CD 3.18Å; D296-K370 IonicContact OD1-NZ 3.48Å; D296-K370 PolarHBondContact OD1-NZ 3.06Å; D296-K370 IonicContact OD2-NZ 2.65Å; D296-K370 PolarHBondContact OD2-NZ 3.39Å; L366-K370 PolarHBondContact O-N 3.24Å; R367-K370 PolarHBondContact O-N 3.02Å; K370-N372 VanDerWaalsContact C-N 3.3Å; K370-N372 PolarHBondContact O-N 2.89Å; K370-T373 PolarHBondContact O-OG1 3.19Å; K370-T373 VanDerWaalsContact O-OG1 3.11Å; K370-T374 HydrophobicContact CG-CG2 4.33Å; K370-T374 WeakPolarHBondContact O-CB 3.31Å; K370-T374 WeakPolarHBondContact O-CG2 3.33Å; K370-T374 PolarHBondContact O-N 3.11Å; K370-T374 PolarHBondContact O-OG1 3.2Å |
| 371 | E | 71.9 | Confident | 71.4 | Confident | 90 Ų | 90 | 87.4 Ų | 87.4 | 42% | 0.421 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66 | -31.9 | 178.9 | -72 | 172.4 | -163 | 0 | 0 | 111.9 | R367 V369 T374 T375 | R367-E371 WeakPolarHBondContact CD-OE1 3.45Å; R367-E371 HydrophobicContact CG-CG 4.42Å; R367-E371 WeakPolarHBondContact CG-OE1 3.49Å; R367-E371 WeakPolarHBondContact O-CB 3.47Å; R367-E371 WeakPolarHBondContact O-CG 3.5Å; R367-E371 PolarHBondContact O-N 3.4Å; V369-E371 VanDerWaalsContact C-N 3.34Å; V369-E371 PolarHBondContact O-N 3.26Å; E371-T374 PolarHBondContact O-OG1 3.21Å; E371-T375 VanDerWaalsContact O-CB 3.31Å; E371-T375 WeakPolarHBondContact O-CB 3.22Å; E371-T375 PolarHBondContact O-N 3.18Å; E371-T375 PolarHBondContact O-OG1 3.29Å |
| 372 | N | 69 | Low | 70.4 | Confident | 85 Ų | 85 | 83.7 Ų | 83.7 | 46% | 0.455 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -82.2 | -32.5 | 176.8 | 80.3 | 50.4 | 0 | 0 | 0 | 114.1 | Q368 V369 K370 S376 | Q368-N372 WeakPolarHBondContact O-CB 3.34Å; Q368-N372 VanDerWaalsContact O-CG 3.31Å; Q368-N372 PolarHBondContact O-N 2.8Å; Q368-N372 VanDerWaalsContact O-N 3.11Å; Q368-N372 PolarHBondContact O-ND2 2.88Å; V369-N372 WeakPolarHBondContact CA-ND2 3.44Å; V369-N372 VanDerWaalsContact O-CG 3.31Å; V369-N372 PolarHBondContact O-N 3.43Å; V369-N372 VanDerWaalsContact O-N 3.1Å; V369-N372 PolarHBondContact O-OD1 2.85Å; K370-N372 VanDerWaalsContact C-N 3.3Å; K370-N372 PolarHBondContact O-N 2.89Å; N372-S376 VanDerWaalsContact O-CB 3.26Å; N372-S376 WeakPolarHBondContact O-CB 3.48Å; N372-S376 PolarHBondContact O-N 3.44Å; N372-S376 PolarHBondContact O-OG 3.5Å |
| 373 | T | 66.1 | Low | 69.3 | Low | 54 Ų | 54 | 87.4 Ų | 87.4 | 33% | 0.331 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.3 | -52.9 | 173.5 | 55 | 0 | 0 | 0 | 0 | 109.9 | V369 K370 T375 S376 T377 | V369-T373 HydrophobicContact CG1-CG2 4.24Å; V369-T373 PolarHBondContact O-N 2.98Å; V369-T373 PolarHBondContact O-OG1 3.06Å; K370-T373 PolarHBondContact O-OG1 3.19Å; K370-T373 VanDerWaalsContact O-OG1 3.11Å; T373-T375 VanDerWaalsContact C-N 3.27Å; T373-T375 PolarHBondContact O-N 3.02Å; T373-S376 PolarHBondContact O-N 3.43Å; T373-T377 PolarHBondContact O-N 3.05Å; T373-T377 PolarHBondContact O-OG1 3.49Å |
| 374 | T | 60 | Low | 68.1 | Low | 82 Ų | 82 | 90.7 Ų | 90.7 | 50% | 0.503 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -56 | -37.5 | 177.3 | 52.1 | 0 | 0 | 0 | 0 | 113.4 | K370 E371 | K370-T374 HydrophobicContact CG-CG2 4.33Å; K370-T374 WeakPolarHBondContact O-CB 3.31Å; K370-T374 WeakPolarHBondContact O-CG2 3.33Å; K370-T374 PolarHBondContact O-N 3.11Å; K370-T374 PolarHBondContact O-OG1 3.2Å; E371-T374 PolarHBondContact O-OG1 3.21Å |
| 375 | T | 63.2 | Low | 67 | Low | 91 Ų | 91 | 87 Ų | 87 | 56% | 0.558 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -70.3 | -35.7 | 173.7 | -55.2 | 0 | 0 | 0 | 0 | 112.5 | E371 T373 | E371-T375 VanDerWaalsContact O-CB 3.31Å; E371-T375 WeakPolarHBondContact O-CB 3.22Å; E371-T375 PolarHBondContact O-N 3.18Å; E371-T375 PolarHBondContact O-OG1 3.29Å; T373-T375 VanDerWaalsContact C-N 3.27Å; T373-T375 PolarHBondContact O-N 3.02Å |
| 376 | S | 56.8 | Low | 65.8 | Low | 79 Ų | 79 | 91 Ų | 91 | 55% | 0.552 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -78.9 | -24.5 | -177.7 | -57.5 | 0 | 0 | 0 | 0 | 113.9 | N372 T373 N378 | N372-S376 VanDerWaalsContact O-CB 3.26Å; N372-S376 WeakPolarHBondContact O-CB 3.48Å; N372-S376 PolarHBondContact O-N 3.44Å; N372-S376 PolarHBondContact O-OG 3.5Å; T373-S376 PolarHBondContact O-N 3.43Å; S376-N378 VanDerWaalsContact C-N 3.28Å |
| 377 | T | 56.3 | Low | 64.6 | Low | 115 Ų | 115 | 97.6 Ų | 97.6 | 71% | 0.706 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.8 | 2.9 | 176.2 | -31.9 | 0 | 0 | 0 | 0 | 112.9 | T373 | T373-T377 PolarHBondContact O-N 3.05Å; T373-T377 PolarHBondContact O-OG1 3.49Å |
| 378 | N | 52.3 | Low | 63.5 | Low | 145 Ų | 145 | 96.8 Ų | 96.8 | 78% | 0.775 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.4 | 15.5 | 178.3 | -131.8 | -108.5 | 0 | 0 | 0 | 113.2 | S376 | S376-N378 VanDerWaalsContact C-N 3.28Š|
| 379 | L | 44.9 | Very low | 62.4 | Low | 208 Ų | 208 | 95.5 Ų | 95.5 | 100% | 1.089 | 54% | 0.537 | S | S | * | . | trans | -125.1 | 0 | 175.6 | -73.9 | 169.3 | 0 | 0 | 0 | 110.1 |
Retrieved 379 of 379 residues in 244.3 ms
(Link to these results)