| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.9 | Very low | 38.9 | Very low | 244 Ų | 244 | 180.3 Ų | 180.3 | 100% | 1.202 | 89% | 0.891 | S | S | * | * | 0 | 102.5 | 0 | -67.9 | -165.4 | -175.2 | 0 | 0 | 107.9 | |||||
| 2 | L | 31.8 | Very low | 38.8 | Very low | 178 Ų | 178 | 185.1 Ų | 185.1 | 93% | 0.932 | 89% | 0.891 | S | S | * | * | trans | -114.2 | 119.3 | -172.4 | -69.3 | 164.3 | 0 | 0 | 0 | 108.3 | ||||
| 3 | R | 38.6 | Very low | 38.7 | Very low | 251 Ų | 251 | 180.4 Ų | 180.4 | 95% | 0.947 | 89% | 0.885 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 125.9 | 176.2 | -76.6 | -170.6 | 174.3 | -155.4 | -0.2 | 109.7 | ||
| 4 | R | 36.8 | Very low | 38.5 | Very low | 246 Ų | 246 | 182.4 Ų | 182.4 | 93% | 0.928 | 89% | 0.887 | S | S | * | * | P | Polyproline II helix | trans | -66 | 134.6 | 178.8 | -80 | 177.5 | 175.1 | 170.6 | -2.3 | 111.6 | ||
| 5 | I | 42.5 | Very low | 38.5 | Very low | 159 Ų | 159 | 178.2 Ų | 178.2 | 82% | 0.815 | 88% | 0.883 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 135.8 | 165.2 | -59.2 | 167.5 | 0 | 0 | 0 | 107.5 | ||
| 6 | P | 40.7 | Very low | 38.4 | Very low | 119 Ų | 119 | 171.4 Ų | 171.4 | 77% | 0.773 | 87% | 0.873 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 137.5 | 175.2 | 30.7 | -30.3 | 0 | 0 | 0 | 111.3 | ||
| 7 | A | 37.9 | Very low | 38.2 | Very low | 95 Ų | 95 | 171.3 Ų | 171.3 | 79% | 0.785 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 137.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 8 | L | 40.1 | Very low | 38.1 | Very low | 176 Ų | 176 | 168 Ų | 168 | 92% | 0.921 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -63 | 127.1 | 166 | -77.6 | 155.6 | 0 | 0 | 0 | 110.1 | R10 | L8-R10 PolarHBondContact O-N 3.3Š|
| 9 | I | 40.8 | Very low | 37.9 | Very low | 165 Ų | 165 | 168.6 Ų | 168.6 | 85% | 0.846 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 121.2 | 174.4 | -65.6 | 170.3 | 0 | 0 | 0 | 108.4 | ||
| 10 | R | 37.5 | Very low | 37.5 | Very low | 230 Ų | 230 | 166 Ų | 166 | 87% | 0.868 | 87% | 0.866 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 129 | 175 | -149.8 | -176.9 | -159.1 | -176.6 | 4.8 | 109 | L8 | L8-R10 PolarHBondContact O-N 3.3Š|
| 11 | P | 37.6 | Very low | 37.5 | Very low | 120 Ų | 120 | 163.7 Ų | 163.7 | 78% | 0.779 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -70 | 136.2 | 170.9 | 26.5 | -30 | 0 | 0 | 0 | 110.2 | ||
| 12 | R | 37.5 | Very low | 36.7 | Very low | 238 Ų | 238 | 155.7 Ų | 155.7 | 90% | 0.898 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 148.9 | 176 | -79 | -171.4 | -175.8 | -166.3 | 2.5 | 110.8 | ||
| 13 | P | 37.2 | Very low | 36.6 | Very low | 124 Ų | 124 | 154.6 Ų | 154.6 | 81% | 0.805 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 141.3 | -178.5 | 30.6 | -32.9 | 0 | 0 | 0 | 111.5 | S15 | P13-S15 PolarHBondContact O-N 3.13Š|
| 14 | F | 35.8 | Very low | 36.1 | Very low | 209 Ų | 209 | 153.9 Ų | 153.9 | 92% | 0.917 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 127.9 | 168.5 | -81.3 | -90.3 | 0 | 0 | 0 | 110.2 | G16 | F14-G16 PolarHBondContact O-N 3.25Š|
| 15 | S | 38.7 | Very low | 35.7 | Very low | 119 Ų | 119 | 148.5 Ų | 148.5 | 83% | 0.832 | 83% | 0.827 | S | S | * | * | trans | -68.1 | 112.2 | 171.2 | 50.6 | 0 | 0 | 0 | 0 | 109.9 | P13 | P13-S15 PolarHBondContact O-N 3.13Š| ||
| 16 | G | 36.7 | Very low | 35.1 | Very low | 69 Ų | 69 | 146.7 Ų | 146.7 | 71% | 0.711 | 82% | 0.823 | S | S | * | * | trans | -76.5 | 141.1 | 168.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | F14 | F14-G16 PolarHBondContact O-N 3.25Š| ||
| 17 | L | 34.6 | Very low | 34.5 | Very low | 170 Ų | 170 | 146.8 Ų | 146.8 | 89% | 0.89 | 83% | 0.826 | S | S | * | * | trans | -141.5 | 154 | 155.9 | -85.5 | 176.6 | 0 | 0 | 0 | 108.9 | ||||
| 18 | P | 37.6 | Very low | 34.2 | Very low | 112 Ų | 112 | 148.6 Ų | 148.6 | 73% | 0.727 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -96.4 | 156.2 | -133 | 35.2 | -36.1 | 0 | 0 | 0 | 115 | S20 | P18-S20 PolarHBondContact O-N 3.34Š|
| 19 | L | 34.3 | Very low | 33.6 | Very low | 179 Ų | 179 | 144.7 Ų | 144.7 | 94% | 0.937 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 121.4 | 159.2 | -75.2 | 155.9 | 0 | 0 | 0 | 110 | ||
| 20 | S | 28.5 | Very low | 33 | Very low | 116 Ų | 116 | 142.4 Ų | 142.4 | 81% | 0.811 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -95 | 118.4 | 164.9 | 179.4 | 0 | 0 | 0 | 0 | 108.5 | P18 | P18-S20 PolarHBondContact O-N 3.34Š|
| 21 | S | 37.5 | Very low | 32.4 | Very low | 119 Ų | 119 | 137.4 Ų | 137.4 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 131.6 | 165.8 | 46.8 | 0 | 0 | 0 | 0 | 109.9 | ||
| 22 | G | 27.7 | Very low | 32.2 | Very low | 75 Ų | 75 | 137.2 Ų | 137.2 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | -161.1 | 90.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 23 | N | 30.5 | Very low | 31.9 | Very low | 155 Ų | 155 | 130.9 Ų | 130.9 | 83% | 0.829 | 80% | 0.799 | S | S | * | * | trans | -71.5 | 140.4 | 164 | -83.1 | -27 | 0 | 0 | 0 | 109.5 | ||||
| 24 | W | 28.4 | Very low | 31.6 | Very low | 237 Ų | 237 | 131 Ų | 131 | 90% | 0.898 | 80% | 0.8 | S | S | * | * | -169 | 121 | 120.3 | -88.8 | -28.1 | 0 | 0 | 0 | 112.1 | |||||
| 25 | D | 27.4 | Very low | 31.2 | Very low | 133 Ų | 133 | 127.9 Ų | 127.9 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | trans | 48.4 | 115.6 | 131.8 | -65.6 | -39.4 | 0 | 0 | 0 | 122.3 | ||||
| 26 | V | 30.9 | Very low | 30.7 | Very low | 121 Ų | 121 | 127.1 Ų | 127.1 | 73% | 0.733 | 80% | 0.798 | S | S | * | * | 53.2 | 110.3 | 127.7 | -169.5 | 0 | 0 | 0 | 0 | 118.6 | |||||
| 27 | S | 28 | Very low | 30.3 | Very low | 120 Ų | 120 | 135.6 Ų | 135.6 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | -159.1 | 101.6 | 122.9 | -82.5 | 0 | 0 | 0 | 0 | 109.8 | A29 | S27-A29 PolarHBondContact O-N 2.88Š| |||
| 28 | V | 31.4 | Very low | 30.1 | Very low | 134 Ų | 134 | 133.2 Ų | 133.2 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | trans | -78.2 | 104 | 169.5 | 175.9 | 0 | 0 | 0 | 0 | 107.4 | V30 | V28-V30 HydrophobicContact CG1-CG2 4.03Š| ||
| 29 | A | 26.4 | Very low | 29.6 | Very low | 94 Ų | 94 | 131.5 Ų | 131.5 | 78% | 0.777 | 81% | 0.81 | S | S | * | * | trans | -99.4 | 102.7 | 165 | 0 | 0 | 0 | 0 | 0 | 108.5 | S27 C31 | S27-A29 PolarHBondContact O-N 2.88Å; A29-C31 PolarHBondContact O-N 2.91Å | ||
| 30 | V | 28 | Very low | 29.5 | Very low | 116 Ų | 116 | 130.4 Ų | 130.4 | 70% | 0.703 | 81% | 0.81 | S | S | * | * | trans | -69.3 | 107 | 168.8 | 175.7 | 0 | 0 | 0 | 0 | 107.9 | V28 V32 | V28-V30 HydrophobicContact CG1-CG2 4.03Å; V30-V32 HydrophobicContact CG1-CG2 3.96Å | ||
| 31 | C | 26.5 | Very low | 29.5 | Very low | 125 Ų | 125 | 128.1 Ų | 128.1 | 85% | 0.845 | 81% | 0.805 | S | S | * | * | trans | -90.8 | 100.2 | 164.4 | -99.5 | 0 | 0 | 0 | 0 | 109 | A29 | A29-C31 PolarHBondContact O-N 2.91Š| ||
| 32 | V | 32.6 | Very low | 29.6 | Very low | 117 Ų | 117 | 134.5 Ų | 134.5 | 71% | 0.709 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 126.9 | 165.5 | 176.4 | 0 | 0 | 0 | 0 | 108.7 | V30 | V30-V32 HydrophobicContact CG1-CG2 3.96Š|
| 33 | P | 31.2 | Very low | 29.8 | Very low | 105 Ų | 105 | 136.2 Ų | 136.2 | 68% | 0.682 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 142.9 | 167.9 | 30.4 | -30.1 | 0 | 0 | 0 | 110.1 | T35 | P33-T35 PolarHBondContact O-N 3.36Š|
| 34 | P | 30.6 | Very low | 30.4 | Very low | 127 Ų | 127 | 138.4 Ų | 138.4 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 130.7 | -177.6 | 28.3 | -31.7 | 0 | 0 | 0 | 111.3 | A36 | P34-A36 PolarHBondContact O-N 3.26Š|
| 35 | T | 28 | Very low | 31.2 | Very low | 142 Ų | 142 | 133.5 Ų | 133.5 | 87% | 0.871 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 116.9 | 170.3 | 45.5 | 0 | 0 | 0 | 0 | 110.9 | P33 | P33-T35 PolarHBondContact O-N 3.36Š|
| 36 | A | 28.2 | Very low | 31.6 | Very low | 103 Ų | 103 | 135 Ų | 135 | 85% | 0.851 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 131.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | P34 | P34-A36 PolarHBondContact O-N 3.26Š|
| 37 | R | 28.8 | Very low | 32.3 | Very low | 247 Ų | 247 | 135 Ų | 135 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 129.9 | -178.1 | -157.6 | 173.3 | -179.7 | -174.2 | -0.3 | 110.2 | ||
| 38 | S | 29.6 | Very low | 32.8 | Very low | 121 Ų | 121 | 137.8 Ų | 137.8 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 127 | 174.2 | 54.6 | 0 | 0 | 0 | 0 | 110.9 | ||
| 39 | G | 27.8 | Very low | 33.2 | Very low | 76 Ų | 76 | 141.7 Ų | 141.7 | 78% | 0.784 | 81% | 0.806 | S | S | * | * | trans | -136.4 | 109.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | G41 | G39-G41 PolarHBondContact O-N 2.8Š| ||
| 40 | T | 30.8 | Very low | 33.7 | Very low | 156 Ų | 156 | 145.8 Ų | 145.8 | 96% | 0.957 | 81% | 0.808 | S | S | * | * | trans | -70.2 | 117.2 | 179.9 | -28 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 41 | G | 29.8 | Very low | 34 | Very low | 67 Ų | 67 | 150.5 Ų | 150.5 | 69% | 0.691 | 82% | 0.82 | S | S | * | * | trans | -145.4 | 104.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | G39 T43 | G39-G41 PolarHBondContact O-N 2.8Å; G41-T43 PolarHBondContact O-N 3.1Å | ||
| 42 | R | 38.2 | Very low | 34.2 | Very low | 253 Ų | 253 | 147.8 Ų | 147.8 | 96% | 0.955 | 81% | 0.813 | S | S | * | * | trans | -69.5 | 117.8 | 170.4 | -85.9 | 179.8 | 165.3 | -177.8 | -4.7 | 108.8 | ||||
| 43 | T | 32 | Very low | 34.5 | Very low | 111 Ų | 111 | 149.5 Ų | 149.5 | 68% | 0.681 | 82% | 0.824 | S | S | * | * | trans | -142.1 | 116.4 | 159.2 | 46.2 | 0 | 0 | 0 | 0 | 108.8 | G41 N45 | G41-T43 PolarHBondContact O-N 3.1Å; T43-N45 PolarHBondContact O-N 3.45Å | ||
| 44 | E | 44.6 | Very low | 34.5 | Very low | 202 Ų | 202 | 147.9 Ų | 147.9 | 94% | 0.944 | 83% | 0.826 | S | S | * | * | trans | -73 | 103.8 | 176.7 | -68.1 | 177.9 | 157.5 | 0 | 0 | 110 | ||||
| 45 | N | 43.8 | Very low | 35 | Very low | 133 Ų | 133 | 147.3 Ų | 147.3 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | trans | -126 | 121.4 | 179.4 | -57.1 | -0.1 | 0 | 0 | 0 | 110.1 | T43 | T43-N45 PolarHBondContact O-N 3.45Š| ||
| 46 | N | 36.9 | Very low | 35.2 | Very low | 165 Ų | 165 | 145.6 Ų | 145.6 | 88% | 0.882 | 82% | 0.818 | S | S | * | * | trans | -62.5 | 143.6 | -174.4 | -161.6 | -17.3 | 0 | 0 | 0 | 112.9 | ||||
| 47 | I | 45 | Very low | 35.6 | Very low | 122 Ų | 122 | 148.2 Ų | 148.2 | 63% | 0.626 | 82% | 0.816 | S | S | * | * | trans | -73.5 | 139.1 | -169 | -63.7 | 161.8 | 0 | 0 | 0 | 112.1 | R49 | I47-R49 HydrophobicContact CG2-CB 4.44Å; I47-R49 HydrophobicContact CG2-CG 3.58Å | ||
| 48 | Q | 39.1 | Very low | 35.7 | Very low | 178 Ų | 178 | 145.1 Ų | 145.1 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | trans | -119 | 108.7 | 147.3 | -75.5 | -165.4 | -36.1 | 0 | 0 | 108.7 | H50 | Q48-H50 PolarHBondContact O-N 3.49Š| ||
| 49 | R | 40.3 | Very low | 36.3 | Very low | 216 Ų | 216 | 144.5 Ų | 144.5 | 82% | 0.815 | 80% | 0.802 | S | S | * | * | trans | -71 | 117 | 176.2 | -70.3 | -174.4 | 177.5 | -177.1 | -2.6 | 108.7 | I47 | I47-R49 HydrophobicContact CG2-CB 4.44Å; I47-R49 HydrophobicContact CG2-CG 3.58Å | ||
| 50 | H | 35.1 | Very low | 36.6 | Very low | 179 Ų | 179 | 148.6 Ų | 148.6 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | trans | -77.2 | 128.7 | 162.5 | -69.8 | -84.6 | 0 | 0 | 0 | 108.4 | Q48 G52 | Q48-H50 PolarHBondContact O-N 3.49Å; H50-G52 PolarHBondContact O-N 2.82Å | ||
| 51 | F | 34.3 | Very low | 37.1 | Very low | 215 Ų | 215 | 150.2 Ų | 150.2 | 94% | 0.943 | 79% | 0.791 | S | S | * | * | trans | -70.6 | 98.5 | 168.7 | -71.9 | -85.8 | 0 | 0 | 0 | 108.3 | ||||
| 52 | G | 32.3 | Very low | 37.3 | Very low | 69 Ų | 69 | 153.4 Ų | 153.4 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | -103.5 | 120.2 | 163.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | H50 G54 | H50-G52 PolarHBondContact O-N 2.82Å; G52-G54 PolarHBondContact O-N 3.38Å; G52-G54 VanDerWaalsContact O-N 3.13Å | ||
| 53 | T | 38.1 | Very low | 37.1 | Very low | 153 Ų | 153 | 146 Ų | 146 | 94% | 0.939 | 78% | 0.78 | S | S | * | * | trans | -69.9 | 100 | 168.1 | 12.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 54 | G | 32.1 | Very low | 37.1 | Very low | 71 Ų | 71 | 150 Ų | 150 | 73% | 0.732 | 79% | 0.791 | S | S | * | * | trans | -76.9 | 119.3 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | G52 C56 | G52-G54 PolarHBondContact O-N 3.38Å; G52-G54 VanDerWaalsContact O-N 3.13Å; G54-C56 PolarHBondContact O-N 3.39Å; G54-C56 VanDerWaalsContact O-N 3.16Å | ||
| 55 | S | 39.5 | Very low | 36.7 | Very low | 114 Ų | 114 | 145.3 Ų | 145.3 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -72.6 | 99 | 163 | 59.6 | 0 | 0 | 0 | 0 | 108.3 | I57 | S55-I57 PolarHBondContact O-N 3.2Š| ||
| 56 | C | 32.6 | Very low | 36.2 | Very low | 107 Ų | 107 | 145 Ų | 145 | 72% | 0.723 | 78% | 0.783 | S | S | * | * | trans | -78.7 | 105 | 166.5 | -173 | 0 | 0 | 0 | 0 | 107.9 | G54 Y58 | G54-C56 PolarHBondContact O-N 3.39Å; G54-C56 VanDerWaalsContact O-N 3.16Å; C56-Y58 PolarHBondContact O-N 2.87Å | ||
| 57 | I | 37.2 | Very low | 36.2 | Very low | 157 Ų | 157 | 142.5 Ų | 142.5 | 81% | 0.805 | 78% | 0.775 | S | S | * | * | trans | -79.7 | 104.3 | 160.7 | -61.9 | -173.9 | 0 | 0 | 0 | 105.7 | S55 | S55-I57 PolarHBondContact O-N 3.2Š| ||
| 58 | Y | 31.4 | Very low | 35.3 | Very low | 182 Ų | 182 | 141.7 Ų | 141.7 | 71% | 0.714 | 79% | 0.787 | S | S | * | * | trans | -104.3 | 106 | 167.1 | -147.6 | -93.2 | 0 | 0 | 0 | 108.2 | C56 K60 | C56-Y58 PolarHBondContact O-N 2.87Å; Y58-K60 HydrophobicContact CD1-CG 4.02Å; Y58-K60 HydrophobicContact CE1-CD 4.28Å; Y58-K60 HydrophobicContact CE1-CG 3.89Å; Y58-K60 PolarHBondContact O-N 3.36Å | ||
| 59 | S | 41.4 | Very low | 35 | Very low | 109 Ų | 109 | 140.7 Ų | 140.7 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -75.3 | 110.7 | 166.6 | 53.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 60 | K | 33.7 | Very low | 34.5 | Very low | 161 Ų | 161 | 138.8 Ų | 138.8 | 70% | 0.7 | 79% | 0.788 | S | S | * | * | trans | -115.7 | 114.2 | 157.2 | -97.6 | -173.2 | 173.3 | -169.1 | 0 | 108.9 | Y58 | Y58-K60 HydrophobicContact CD1-CG 4.02Å; Y58-K60 HydrophobicContact CE1-CD 4.28Å; Y58-K60 HydrophobicContact CE1-CG 3.89Å; Y58-K60 PolarHBondContact O-N 3.36Å | ||
| 61 | K | 42.7 | Very low | 34.3 | Very low | 190 Ų | 190 | 138.5 Ų | 138.5 | 83% | 0.826 | 79% | 0.79 | S | S | * | * | trans | -70.2 | 131.4 | 151.5 | -78.5 | 176.6 | 171.1 | -175.5 | 0 | 107.1 | ||||
| 62 | D | 32.2 | Very low | 34.3 | Very low | 134 Ų | 134 | 132.9 Ų | 132.9 | 72% | 0.717 | 78% | 0.778 | S | S | * | * | trans | -161.7 | 112.7 | 150.6 | -75.9 | -41.5 | 0 | 0 | 0 | 103.4 | ||||
| 63 | S | 35.7 | Very low | 34.4 | Very low | 98 Ų | 98 | 138 Ų | 138 | 69% | 0.685 | 78% | 0.784 | S | S | * | * | cis | 60.7 | 59.2 | 48 | -43.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 64 | Q | 30.8 | Very low | 33.8 | Very low | 196 Ų | 196 | 140.1 Ų | 140.1 | 92% | 0.916 | 78% | 0.78 | S | S | * | * | trans | -170.7 | 137.6 | 135.5 | -116.5 | 161.7 | -19.2 | 0 | 0 | 114.5 | ||||
| 65 | S | 36.9 | Very low | 33.5 | Very low | 102 Ų | 102 | 143.4 Ų | 143.4 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | trans | -98.6 | -171.6 | -178.3 | 47.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 66 | V | 33.5 | Very low | 33.2 | Very low | 127 Ų | 127 | 142 Ų | 142 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | trans | 106.9 | 143.5 | 158.8 | -167.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 67 | P | 36.3 | Very low | 33.1 | Very low | 112 Ų | 112 | 145.8 Ų | 145.8 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | -131.9 | 170.7 | -53.6 | 37 | -18.3 | 0 | 0 | 0 | 111.5 | |||||
| 68 | A | 26.5 | Very low | 32.9 | Very low | 106 Ų | 106 | 145 Ų | 145 | 88% | 0.876 | 79% | 0.791 | S | S | * | * | trans | -122.3 | 113.1 | 164.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 69 | N | 32.3 | Very low | 33.2 | Very low | 156 Ų | 156 | 145.7 Ų | 145.7 | 83% | 0.834 | 80% | 0.801 | S | S | * | * | trans | -65.7 | 150.6 | 175.2 | -99.4 | -7.9 | 0 | 0 | 0 | 112.6 | ||||
| 70 | E | 29.4 | Very low | 32.9 | Very low | 177 Ų | 177 | 143.6 Ų | 143.6 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | trans | -49.5 | 138 | 166.3 | -60.9 | 173.2 | 126.1 | 0 | 0 | 113.7 | ||||
| 71 | I | 31.7 | Very low | 33.4 | Very low | 172 Ų | 172 | 142.8 Ų | 142.8 | 88% | 0.882 | 80% | 0.8 | S | S | * | * | trans | -134.4 | 124 | 142.2 | -61.6 | -178.6 | 0 | 0 | 0 | 108.6 | ||||
| 72 | S | 35 | Very low | 33.4 | Very low | 98 Ų | 98 | 142.8 Ų | 142.8 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | -73.1 | 144.5 | 177.3 | -83.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 73 | Q | 32.4 | Very low | 34.4 | Very low | 177 Ų | 177 | 142.8 Ų | 142.8 | 83% | 0.827 | 79% | 0.79 | S | S | * | * | trans | 15 | 125.5 | 143.4 | -60.8 | -178.7 | -7.6 | 0 | 0 | 120.2 | ||||
| 74 | K | 26.8 | Very low | 35.4 | Very low | 197 Ų | 197 | 143.9 Ų | 143.9 | 86% | 0.857 | 78% | 0.784 | S | S | * | * | -179.5 | 145.2 | 107.4 | -106.1 | 179.6 | 179.3 | 177.2 | 0 | 114.5 | |||||
| 75 | T | 25.4 | Very low | 36.6 | Very low | 139 Ų | 139 | 138.1 Ų | 138.1 | 85% | 0.853 | 76% | 0.763 | S | S | * | * | trans | 100 | 115 | 151.8 | -19 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 76 | A | 33.5 | Very low | 37.7 | Very low | 85 Ų | 85 | 139 Ų | 139 | 70% | 0.702 | 76% | 0.756 | S | S | * | * | trans | -86.6 | 167.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 77 | E | 29.7 | Very low | 39.4 | Very low | 187 Ų | 187 | 139.4 Ų | 139.4 | 87% | 0.874 | 75% | 0.747 | S | S | * | * | trans | 118.6 | 131.5 | 154.1 | -62.1 | -172.1 | 177.7 | 0 | 0 | 117 | ||||
| 78 | T | 33.2 | Very low | 40.9 | Very low | 141 Ų | 141 | 139.9 Ų | 139.9 | 87% | 0.865 | 74% | 0.737 | S | S | * | * | trans | 97.1 | 81.2 | 170.5 | -26.7 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 79 | Q | 37.3 | Very low | 43 | Very low | 196 Ų | 196 | 139.5 Ų | 139.5 | 92% | 0.916 | 72% | 0.721 | S | S | * | * | trans | -144.9 | 99.3 | 158.5 | -138.7 | 163.2 | -19.3 | 0 | 0 | 109.2 | ||||
| 80 | G | 35.9 | Very low | 45 | Very low | 65 Ų | 65 | 137.3 Ų | 137.3 | 67% | 0.67 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -140.8 | -34.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 81 | D | 44 | Very low | 47.2 | Very low | 144 Ų | 144 | 134.5 Ų | 134.5 | 77% | 0.77 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -102.2 | -2.8 | -166.7 | -78.1 | -28.3 | 0 | 0 | 0 | 116.4 | ||
| 82 | R | 42.5 | Very low | 49.2 | Very low | 189 Ų | 189 | 130.9 Ų | 130.9 | 71% | 0.713 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -86.6 | -21.8 | -170.5 | -156.8 | 168.5 | 174.9 | 163 | -2.6 | 114.5 | T85 | R82-T85 PolarHBondContact O-OG1 3.32Å |
| 83 | E | 53.3 | Low | 51.2 | Low | 135 Ų | 135 | 131.3 Ų | 131.3 | 63% | 0.631 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -83.2 | -25.8 | -177 | -70.9 | -166.9 | 175.3 | 0 | 0 | 114.2 | K87 | E83-K87 PolarHBondContact O-N 2.93Å |
| 84 | E | 55.9 | Low | 53.3 | Low | 121 Ų | 121 | 127.8 Ų | 127.8 | 57% | 0.565 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -73 | -34.5 | -179.7 | -78.2 | -157.8 | 175.7 | 0 | 0 | 113.2 | Q86 K87 K88 | E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-K87 PolarHBondContact O-N 3.18Å; E84-K88 VanDerWaalsContact O-CG 3.3Å; E84-K88 WeakPolarHBondContact O-CG 3.34Å; E84-K88 PolarHBondContact O-N 3.17Å; E84-K88 VanDerWaalsContact O-N 3.12Å; E84-K88 IonicContact OE2-NZ 2.85Å; E84-K88 PolarHBondContact OE2-NZ 3.22Å |
| 85 | T | 56.3 | Low | 55.6 | Low | 75 Ų | 75 | 125.8 Ų | 125.8 | 46% | 0.46 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -68.9 | -35.3 | -179 | 54.1 | 0 | 0 | 0 | 0 | 111.5 | R82 K88 N89 | R82-T85 PolarHBondContact O-OG1 3.32Å; T85-K88 PolarHBondContact O-N 3.31Å; T85-N89 PolarHBondContact O-N 3.49Å; T85-N89 PolarHBondContact O-ND2 3.33Å |
| 86 | Q | 61.3 | Low | 57.6 | Low | 120 Ų | 120 | 125.9 Ų | 125.9 | 56% | 0.561 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -69 | -37.7 | 177.1 | -66.1 | -177 | -12.4 | 0 | 0 | 112.6 | E84 N89 L90 | E84-Q86 VanDerWaalsContact C-N 3.34Å; Q86-N89 PolarHBondContact O-N 3.13Å; Q86-L90 PolarHBondContact O-N 2.73Å |
| 87 | K | 67.4 | Low | 59.2 | Low | 136 Ų | 136 | 128.6 Ų | 128.6 | 59% | 0.591 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -70.1 | -36 | 176.1 | -68 | 174.7 | -174.1 | 167.1 | 0 | 112.1 | E83 E84 L91 | E83-K87 PolarHBondContact O-N 2.93Å; E84-K87 PolarHBondContact O-N 3.18Å; K87-L91 WeakPolarHBondContact O-CG 3.45Å; K87-L91 PolarHBondContact O-N 3.46Å |
| 88 | K | 68.6 | Low | 60.7 | Low | 121 Ų | 121 | 127.7 Ų | 127.7 | 53% | 0.526 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -66.6 | -40 | 174.9 | -70.3 | 167.9 | -169.9 | 164.9 | 0 | 111.6 | E84 T85 L90 L91 D92 | E84-K88 VanDerWaalsContact O-CG 3.3Å; E84-K88 WeakPolarHBondContact O-CG 3.34Å; E84-K88 PolarHBondContact O-N 3.17Å; E84-K88 VanDerWaalsContact O-N 3.12Å; E84-K88 IonicContact OE2-NZ 2.85Å; E84-K88 PolarHBondContact OE2-NZ 3.22Å; T85-K88 PolarHBondContact O-N 3.31Å; K88-L90 PolarHBondContact O-N 3.39Å; K88-L91 PolarHBondContact O-N 2.91Å; K88-D92 PolarHBondContact O-N 2.87Å; K88-D92 VanDerWaalsContact O-N 3.16Å |
| 89 | N | 70.7 | Confident | 61.8 | Low | 99 Ų | 99 | 126.8 Ų | 126.8 | 53% | 0.529 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -63.6 | -36.7 | 176.9 | -70.2 | -22.2 | 0 | 0 | 0 | 113.2 | T85 Q86 I93 | T85-N89 PolarHBondContact O-N 3.49Å; T85-N89 PolarHBondContact O-ND2 3.33Å; Q86-N89 PolarHBondContact O-N 3.13Å; N89-I93 WeakPolarHBondContact O-CD1 3.5Å; N89-I93 WeakPolarHBondContact O-CG1 3.28Å; N89-I93 PolarHBondContact O-N 2.96Å |
| 90 | L | 74.5 | Confident | 62.1 | Low | 109 Ų | 109 | 125.3 Ų | 125.3 | 57% | 0.571 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73.3 | -33.1 | -179.7 | -140.2 | 157 | 0 | 0 | 0 | 112 | Q86 K88 L94 | Q86-L90 PolarHBondContact O-N 2.73Å; K88-L90 PolarHBondContact O-N 3.39Å; L90-L94 HydrophobicContact CD2-CD1 3.76Å; L90-L94 HydrophobicContact CD2-CG 4.43Å; L90-L94 PolarHBondContact O-N 3.49Å |
| 91 | L | 75.1 | Confident | 62.6 | Low | 118 Ų | 118 | 130 Ų | 130 | 62% | 0.618 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -72.3 | -33 | 176 | -70.9 | 171.2 | 0 | 0 | 0 | 112.9 | K87 K88 K95 | K87-L91 WeakPolarHBondContact O-CG 3.45Å; K87-L91 PolarHBondContact O-N 3.46Å; K88-L91 PolarHBondContact O-N 2.91Å; L91-K95 PolarHBondContact O-N 3.45Å; L91-K95 VanDerWaalsContact O-N 3.11Å |
| 92 | D | 73.8 | Confident | 62.3 | Low | 97 Ų | 97 | 127.8 Ų | 127.8 | 52% | 0.519 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -68.9 | -41.8 | 171.8 | -97.1 | -4.7 | 0 | 0 | 0 | 111.5 | K88 L94 K95 D96 | K88-D92 PolarHBondContact O-N 2.87Å; K88-D92 VanDerWaalsContact O-N 3.16Å; D92-L94 VanDerWaalsContact C-N 3.33Å; D92-L94 PolarHBondContact O-N 3.37Å; D92-K95 WeakPolarHBondContact O-CB 3.31Å; D92-K95 PolarHBondContact O-N 3.15Å; D92-K95 VanDerWaalsContact O-N 3.17Å; D92-D96 PolarHBondContact O-N 3.13Å |
| 93 | I | 77.7 | Confident | 62.5 | Low | 106 Ų | 106 | 125.7 Ų | 125.7 | 54% | 0.544 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -63.6 | -38 | 176.4 | -66 | 163.5 | 0 | 0 | 0 | 111.8 | N89 D96 M97 | N89-I93 WeakPolarHBondContact O-CD1 3.5Å; N89-I93 WeakPolarHBondContact O-CG1 3.28Å; N89-I93 PolarHBondContact O-N 2.96Å; I93-D96 PolarHBondContact O-N 2.95Å; I93-M97 PolarHBondContact O-N 3.21Å |
| 94 | L | 76.1 | Confident | 61.6 | Low | 104 Ų | 104 | 124.9 Ų | 124.9 | 55% | 0.545 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -71 | -29.9 | 175.7 | -87.5 | 161 | 0 | 0 | 0 | 113.3 | L90 D92 | L90-L94 HydrophobicContact CD2-CD1 3.76Å; L90-L94 HydrophobicContact CD2-CG 4.43Å; L90-L94 PolarHBondContact O-N 3.49Å; D92-L94 VanDerWaalsContact C-N 3.33Å; D92-L94 PolarHBondContact O-N 3.37Å |
| 95 | K | 74.9 | Confident | 61.1 | Low | 155 Ų | 155 | 126.4 Ų | 126.4 | 67% | 0.674 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -68.2 | -36.8 | 172.2 | -98 | 179.1 | 174.4 | 176.9 | 0 | 112 | L91 D92 M97 | L91-K95 PolarHBondContact O-N 3.45Å; L91-K95 VanDerWaalsContact O-N 3.11Å; D92-K95 WeakPolarHBondContact O-CB 3.31Å; D92-K95 PolarHBondContact O-N 3.15Å; D92-K95 VanDerWaalsContact O-N 3.17Å; K95-M97 VanDerWaalsContact C-N 3.31Å |
| 96 | D | 67.1 | Low | 60 | Low | 141 Ų | 141 | 128.5 Ų | 128.5 | 75% | 0.754 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -75 | -19.5 | 179.7 | -72.6 | -12.1 | 0 | 0 | 0 | 113 | D92 I93 K98 | D92-D96 PolarHBondContact O-N 3.13Å; I93-D96 PolarHBondContact O-N 2.95Å; D96-K98 PolarHBondContact O-N 2.91Å |
| 97 | M | 67.4 | Low | 59 | Low | 141 Ų | 141 | 131.2 Ų | 131.2 | 70% | 0.695 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | 22.3 | 173.7 | -82.4 | -173.5 | 61.2 | 0 | 0 | 114.6 | I93 K95 V99 | I93-M97 PolarHBondContact O-N 3.21Å; K95-M97 VanDerWaalsContact C-N 3.31Å; M97-V99 PolarHBondContact O-N 3.39Å |
| 98 | K | 60.6 | Low | 57.5 | Low | 169 Ų | 169 | 131 Ų | 131 | 74% | 0.735 | 69% | 0.692 | S | S | * | * | trans | -79.5 | 99.9 | 175.7 | -170 | 174.1 | 176.7 | -167.6 | 0 | 110.8 | D96 E100 | D96-K98 PolarHBondContact O-N 2.91Å; K98-E100 PolarHBondContact O-N 2.94Å | ||
| 99 | V | 57.8 | Low | 55.9 | Low | 122 Ų | 122 | 131.8 Ų | 131.8 | 74% | 0.739 | 71% | 0.707 | S | S | * | * | trans | -74.7 | 112.2 | 174.6 | 177.9 | 0 | 0 | 0 | 0 | 110.1 | M97 L101 | M97-V99 PolarHBondContact O-N 3.39Å; V99-L101 PolarHBondContact O-N 2.92Å | ||
| 100 | E | 43.3 | Very low | 54.4 | Low | 165 Ų | 165 | 136.5 Ų | 136.5 | 77% | 0.771 | 72% | 0.723 | S | S | * | * | trans | -78.8 | 112.5 | 165.5 | -66.6 | -163.6 | 164.2 | 0 | 0 | 109.7 | K98 S102 | K98-E100 PolarHBondContact O-N 2.94Å; E100-S102 VanDerWaalsContact C-N 3.31Å; E100-S102 PolarHBondContact O-N 3.21Å | ||
| 101 | L | 47 | Very low | 52.5 | Low | 163 Ų | 163 | 137.6 Ų | 137.6 | 85% | 0.853 | 74% | 0.736 | S | S | * | * | trans | -70.7 | 86.5 | 171.9 | -70.9 | 170.2 | 0 | 0 | 0 | 109.6 | V99 | V99-L101 PolarHBondContact O-N 2.92Š| ||
| 102 | S | 37.3 | Very low | 50.4 | Low | 98 Ų | 98 | 143.9 Ų | 143.9 | 69% | 0.685 | 75% | 0.752 | S | S | * | * | trans | -80.7 | 115.8 | 168.3 | 50.9 | 0 | 0 | 0 | 0 | 110 | E100 V104 | E100-S102 VanDerWaalsContact C-N 3.31Å; E100-S102 PolarHBondContact O-N 3.21Å; S102-V104 PolarHBondContact O-N 3.25Å; S102-V104 VanDerWaalsContact O-N 3.07Å | ||
| 103 | T | 46.4 | Very low | 48.3 | Very low | 145 Ų | 145 | 142.4 Ų | 142.4 | 89% | 0.89 | 76% | 0.76 | S | S | * | * | trans | -76.1 | 84.4 | 174.5 | 43.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 104 | V | 33.7 | Very low | 46.2 | Very low | 117 Ų | 117 | 147.2 Ų | 147.2 | 71% | 0.709 | 78% | 0.777 | S | S | * | * | trans | -97.2 | 110.5 | 172.4 | -178.9 | 0 | 0 | 0 | 0 | 110.3 | S102 V106 | S102-V104 PolarHBondContact O-N 3.25Å; S102-V104 VanDerWaalsContact O-N 3.07Å; V104-V106 PolarHBondContact O-N 3.4Å | ||
| 105 | N | 46.5 | Very low | 44.1 | Very low | 154 Ų | 154 | 153.7 Ų | 153.7 | 82% | 0.824 | 79% | 0.794 | S | S | * | * | trans | -69 | 106.8 | 179.7 | -150.6 | 14 | 0 | 0 | 0 | 110.3 | ||||
| 106 | V | 33.8 | Very low | 42.2 | Very low | 118 Ų | 118 | 152.4 Ų | 152.4 | 72% | 0.715 | 80% | 0.802 | S | S | * | * | trans | -95 | 106.4 | 175 | 177.9 | 0 | 0 | 0 | 0 | 109.6 | V104 T108 | V104-V106 PolarHBondContact O-N 3.4Å; V106-T108 PolarHBondContact O-N 2.91Å | ||
| 107 | Q | 38.7 | Very low | 40.5 | Very low | 177 Ų | 177 | 151.5 Ų | 151.5 | 83% | 0.827 | 81% | 0.806 | S | S | * | * | trans | -66.5 | 115.4 | 169.3 | -65.2 | 178.3 | 10.6 | 0 | 0 | 109.3 | ||||
| 108 | T | 35.5 | Very low | 38.6 | Very low | 131 Ų | 131 | 149.7 Ų | 149.7 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -90 | 135 | 166.6 | 49.7 | 0 | 0 | 0 | 0 | 110.2 | V106 | V106-T108 PolarHBondContact O-N 2.91Š|
| 109 | T | 35.1 | Very low | 37.1 | Very low | 138 Ų | 138 | 144.9 Ų | 144.9 | 85% | 0.847 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 140.7 | -172.8 | 44.5 | 0 | 0 | 0 | 0 | 111.7 | ||
| 110 | K | 40.7 | Very low | 35.9 | Very low | 199 Ų | 199 | 147.7 Ų | 147.7 | 87% | 0.865 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 155 | 176.1 | -63.7 | 175.8 | 177.5 | 175.4 | 0 | 111.9 | ||
| 111 | P | 33.8 | Very low | 35.2 | Very low | 131 Ų | 131 | 148.7 Ų | 148.7 | 85% | 0.851 | 83% | 0.826 | S | S | * | * | trans | -109.5 | 136.4 | 140.6 | 32.8 | -24 | 0 | 0 | 0 | 111.4 | ||||
| 112 | R | 30.4 | Very low | 34.1 | Very low | 250 Ų | 250 | 145.9 Ų | 145.9 | 94% | 0.943 | 83% | 0.827 | S | S | * | * | trans | -104.1 | 115 | -179 | 179.2 | -176 | 178.9 | -157.9 | 0.9 | 109.4 | ||||
| 113 | G | 30.3 | Very low | 33.6 | Very low | 67 Ų | 67 | 145.8 Ų | 145.8 | 69% | 0.691 | 83% | 0.832 | S | S | * | * | 96.8 | 122.5 | 129.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 114 | K | 33.1 | Very low | 32.8 | Very low | 206 Ų | 206 | 145.4 Ų | 145.4 | 90% | 0.896 | 83% | 0.829 | S | S | * | * | -163.8 | 112.6 | 119.3 | -109 | 175.5 | -176 | 178.9 | 0 | 112.8 | |||||
| 115 | R | 33.7 | Very low | 32.5 | Very low | 240 Ų | 240 | 144.8 Ų | 144.8 | 91% | 0.906 | 83% | 0.83 | S | S | * | * | trans | 43 | 138.6 | 150.9 | -68.3 | -174.3 | -178.7 | 175.2 | 0.5 | 123.7 | ||||
| 116 | P | 33.4 | Very low | 31.7 | Very low | 129 Ų | 129 | 147.9 Ų | 147.9 | 84% | 0.838 | 83% | 0.83 | S | S | * | * | trans | -91.3 | 151.6 | 176.7 | 37.4 | -33.3 | 0 | 0 | 0 | 112.8 | ||||
| 117 | S | 31.5 | Very low | 31.6 | Very low | 122 Ų | 122 | 151 Ų | 151 | 85% | 0.853 | 84% | 0.836 | S | S | * | * | trans | -111.1 | 135.5 | 159.6 | 55 | 0 | 0 | 0 | 0 | 110 | ||||
| 118 | A | 27.3 | Very low | 31.3 | Very low | 102 Ų | 102 | 154.1 Ų | 154.1 | 84% | 0.843 | 84% | 0.841 | S | S | * | * | trans | -72.5 | 148.5 | -167.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 119 | G | 29.4 | Very low | 31.3 | Very low | 68 Ų | 68 | 159.7 Ų | 159.7 | 70% | 0.701 | 85% | 0.847 | S | S | * | * | trans | 23.8 | 117.5 | 137 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 120 | L | 33.5 | Very low | 31 | Very low | 181 Ų | 181 | 157.3 Ų | 157.3 | 95% | 0.948 | 84% | 0.842 | S | S | * | * | trans | -141.5 | 120.1 | 131.7 | -108.4 | 131.1 | 0 | 0 | 0 | 108.8 | ||||
| 121 | Q | 27.7 | Very low | 30.7 | Very low | 186 Ų | 186 | 153.7 Ų | 153.7 | 87% | 0.869 | 84% | 0.838 | S | S | * | * | trans | -73.6 | 168.3 | 174.6 | -65.5 | 176.9 | 2.6 | 0 | 0 | 111 | ||||
| 122 | A | 25.5 | Very low | 30.8 | Very low | 105 Ų | 105 | 156.6 Ų | 156.6 | 87% | 0.868 | 84% | 0.841 | S | S | * | * | trans | 100.5 | 125.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 123 | A | 25.9 | Very low | 31 | Very low | 95 Ų | 95 | 151.9 Ų | 151.9 | 79% | 0.785 | 83% | 0.834 | S | S | * | * | cis | -147.2 | 129.9 | 9.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | S125 | A123-S125 PolarHBondContact O-N 3.22Å; A123-S125 VanDerWaalsContact O-N 3.17Å | ||
| 124 | V | 28.6 | Very low | 31.6 | Very low | 138 Ų | 138 | 153.9 Ų | 153.9 | 84% | 0.836 | 84% | 0.835 | S | S | * | * | trans | -72.1 | 100.1 | 167.4 | 173.4 | 0 | 0 | 0 | 0 | 107.6 | R126 | V124-R126 PolarHBondContact O-N 3.05Š| ||
| 125 | S | 28 | Very low | 31.8 | Very low | 103 Ų | 103 | 149.3 Ų | 149.3 | 72% | 0.72 | 83% | 0.826 | S | S | * | * | trans | -77.8 | 100.2 | 161.4 | 58.3 | 0 | 0 | 0 | 0 | 108.3 | A123 H127 | A123-S125 PolarHBondContact O-N 3.22Å; A123-S125 VanDerWaalsContact O-N 3.17Å; S125-H127 PolarHBondContact O-N 3.36Å | ||
| 126 | R | 30.6 | Very low | 32.1 | Very low | 220 Ų | 220 | 147 Ų | 147 | 83% | 0.83 | 82% | 0.823 | S | S | * | * | trans | -52.4 | 119.1 | 165.4 | -70.4 | 174.5 | -176.6 | 173.5 | 0.4 | 109.9 | V124 | V124-R126 PolarHBondContact O-N 3.05Š| ||
| 127 | H | 31.2 | Very low | 32.6 | Very low | 182 Ų | 182 | 147.5 Ų | 147.5 | 84% | 0.843 | 82% | 0.818 | S | S | * | * | trans | -117 | 111.4 | 147 | -74.9 | -18.2 | 0 | 0 | 0 | 108.6 | S125 | S125-H127 PolarHBondContact O-N 3.36Š| ||
| 128 | R | 31.8 | Very low | 33.6 | Very low | 243 Ų | 243 | 150.4 Ų | 150.4 | 92% | 0.917 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 130.3 | 172.7 | -83.3 | 178.9 | 158.9 | -176.6 | -5.6 | 109 | A130 | R128-A130 PolarHBondContact O-N 2.97Š|
| 129 | R | 36.3 | Very low | 34.7 | Very low | 248 Ų | 248 | 151.9 Ų | 151.9 | 94% | 0.936 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 126.5 | 153.6 | -75.1 | -176.6 | -177.5 | 177.6 | 0.3 | 107.9 | ||
| 130 | A | 28.7 | Very low | 36 | Very low | 89 Ų | 89 | 156.8 Ų | 156.8 | 74% | 0.736 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 159.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | R128 | R128-A130 PolarHBondContact O-N 2.97Š|
| 131 | P | 34.8 | Very low | 37.3 | Very low | 122 Ų | 122 | 154.2 Ų | 154.2 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 154.2 | -164.9 | 31.4 | -32.6 | 0 | 0 | 0 | 112.2 | D133 | P131-D133 PolarHBondContact O-N 3.16Š|
| 132 | E | 36.3 | Very low | 39.3 | Very low | 193 Ų | 193 | 146.7 Ų | 146.7 | 90% | 0.902 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 129 | 175.8 | -63.8 | -161.7 | 150.6 | 0 | 0 | 112 | ||
| 133 | D | 34 | Very low | 41.9 | Very low | 151 Ų | 151 | 144.6 Ų | 144.6 | 81% | 0.807 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 146.5 | 158.6 | -80.4 | -40.7 | 0 | 0 | 0 | 109.9 | P131 | P131-D133 PolarHBondContact O-N 3.16Š|
| 134 | P | 41.7 | Very low | 44.6 | Very low | 109 Ų | 109 | 145 Ų | 145 | 71% | 0.708 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 161 | -178.5 | 26.8 | -34 | 0 | 0 | 0 | 112.6 | K136 | P134-K136 PolarHBondContact O-N 3.12Š|
| 135 | P | 39.1 | Very low | 47.5 | Very low | 110 Ų | 110 | 146 Ų | 146 | 71% | 0.714 | 73% | 0.728 | S | S | * | * | trans | -70.2 | 98.4 | -162.8 | 29.5 | -34.6 | 0 | 0 | 0 | 111.2 | N137 | P135-N137 PolarHBondContact O-N 3.21Š| ||
| 136 | K | 38.6 | Very low | 50.3 | Low | 192 Ų | 192 | 144.7 Ų | 144.7 | 84% | 0.835 | 71% | 0.712 | S | S | * | * | trans | -74.6 | 121.4 | 165 | -123.4 | 171.8 | -178.1 | 176 | 0 | 108.2 | P134 R138 | P134-K136 PolarHBondContact O-N 3.12Å; K136-R138 WeakPolarHBondContact O-CG 3.34Å; K136-R138 PolarHBondContact O-N 3.03Å | ||
| 137 | N | 44.8 | Very low | 53 | Low | 139 Ų | 139 | 136.2 Ų | 136.2 | 74% | 0.743 | 69% | 0.685 | S | S | * | * | trans | -26.9 | 100.3 | -177.2 | -60.5 | -30.7 | 0 | 0 | 0 | 114.2 | P135 N139 | P135-N137 PolarHBondContact O-N 3.21Å; N137-N139 PolarHBondContact O-N 3.25Å; N137-N139 VanDerWaalsContact O-N 3.08Å | ||
| 138 | R | 51.6 | Low | 55.8 | Low | 183 Ų | 183 | 130.5 Ų | 130.5 | 69% | 0.691 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | 10.9 | -172.7 | -65.2 | -177.2 | 175.3 | 173.9 | -0.7 | 114.9 | K136 | K136-R138 WeakPolarHBondContact O-CG 3.34Å; K136-R138 PolarHBondContact O-N 3.03Å |
| 139 | N | 51.3 | Low | 58.6 | Low | 132 Ų | 132 | 121.3 Ų | 121.3 | 71% | 0.706 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | 4.2 | -173.1 | -68.8 | -3.4 | 0 | 0 | 0 | 114.2 | N137 | N137-N139 PolarHBondContact O-N 3.25Å; N137-N139 VanDerWaalsContact O-N 3.08Å |
| 140 | E | 56.9 | Low | 61.1 | Low | 171 Ų | 171 | 109.8 Ų | 109.8 | 80% | 0.799 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -15.1 | -178.8 | -81.1 | -179.5 | 163.2 | 0 | 0 | 114.5 | ||
| 141 | F | 61 | Low | 64 | Low | 128 Ų | 128 | 107 Ų | 107 | 56% | 0.561 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | -11.8 | -174.6 | -66.5 | -73.1 | 0 | 0 | 0 | 114.9 | ||
| 142 | L | 69.4 | Low | 66.7 | Low | 27 Ų | 27 | 104.2 Ų | 104.2 | 14% | 0.141 | 57% | 0.565 | C | S | . | * | S | Bend | trans | -111.7 | 136.1 | -179.1 | -62.2 | 175.7 | 0 | 0 | 0 | 109.1 | V147 L169 | L142-V147 HydrophobicContact CB-CG2 4.18Å; L142-L169 HydrophobicContact CD1-CD2 4.04Å |
| 143 | S | 80.1 | Confident | 69.2 | Low | 61 Ų | 61 | 98.3 Ų | 98.3 | 43% | 0.427 | 54% | 0.542 | S | S | . | . | trans | -63 | 143 | 176.2 | 64.4 | 0 | 0 | 0 | 0 | 110.2 | E145 L146 V147 | S143-E145 PolarHBondContact O-N 3.33Å; S143-L146 PolarHBondContact O-N 3.48Å; S143-L146 WeakPolarHBondContact OG-CD1 3.42Å; S143-L146 VanDerWaalsContact OG-CG 3.3Å; S143-L146 WeakPolarHBondContact OG-CG 3.32Å; S143-V147 PolarHBondContact O-N 3.08Å | ||
| 144 | S | 82.8 | Confident | 71.9 | Confident | 105 Ų | 105 | 91.2 Ų | 91.2 | 73% | 0.734 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -55.8 | -25.8 | 179.4 | -173.8 | 0 | 0 | 0 | 0 | 112.5 | A148 | S144-A148 PolarHBondContact O-N 2.83Å; S144-A148 VanDerWaalsContact O-N 3.16Å |
| 145 | E | 87.8 | Confident | 74.1 | Confident | 158 Ų | 158 | 90.3 Ų | 90.3 | 74% | 0.738 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -69.8 | -43.8 | 176.7 | -171.8 | 174.3 | -173.7 | 0 | 0 | 112.5 | S143 V147 A148 A149 | S143-E145 PolarHBondContact O-N 3.33Å; E145-V147 VanDerWaalsContact C-N 3.3Å; E145-V147 PolarHBondContact O-N 3.42Å; E145-A148 PolarHBondContact O-N 3.36Å; E145-A149 WeakPolarHBondContact O-CB 3.32Å; E145-A149 PolarHBondContact O-N 2.93Å |
| 146 | L | 87.4 | Confident | 76.4 | Confident | 75 Ų | 75 | 89.3 Ų | 89.3 | 39% | 0.393 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.2 | -34.5 | 177.7 | -70.5 | 173.4 | 0 | 0 | 0 | 111.9 | S143 A149 A150 | S143-L146 PolarHBondContact O-N 3.48Å; S143-L146 WeakPolarHBondContact OG-CD1 3.42Å; S143-L146 VanDerWaalsContact OG-CG 3.3Å; S143-L146 WeakPolarHBondContact OG-CG 3.32Å; L146-A149 PolarHBondContact O-N 3.21Å; L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.16Å |
| 147 | V | 88.1 | Confident | 78.6 | Confident | 43 Ų | 43 | 83.8 Ų | 83.8 | 26% | 0.261 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.3 | -38.6 | 175.2 | -179.7 | 0 | 0 | 0 | 0 | 111.5 | L142 S143 E145 S151 L169 | L142-V147 HydrophobicContact CB-CG2 4.18Å; S143-V147 PolarHBondContact O-N 3.08Å; E145-V147 VanDerWaalsContact C-N 3.3Å; E145-V147 PolarHBondContact O-N 3.42Å; V147-S151 PolarHBondContact O-N 3.19Å; V147-S151 VanDerWaalsContact O-N 3.14Å; V147-L169 HydrophobicContact CB-CD2 4.48Å; V147-L169 HydrophobicContact CG1-CD1 4.49Å; V147-L169 HydrophobicContact CG2-CD2 4.07Å |
| 148 | A | 90.3 | Very high | 80.2 | Confident | 61 Ų | 61 | 83.1 Ų | 83.1 | 50% | 0.504 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.3 | -43.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | S144 E145 S151 A152 | S144-A148 PolarHBondContact O-N 2.83Å; S144-A148 VanDerWaalsContact O-N 3.16Å; E145-A148 PolarHBondContact O-N 3.36Å; A148-S151 WeakPolarHBondContact O-CB 3.43Å; A148-S151 PolarHBondContact O-N 3.34Å; A148-A152 PolarHBondContact O-N 3.35Å |
| 149 | A | 90.3 | Very high | 81.5 | Confident | 51 Ų | 51 | 84 Ų | 84 | 42% | 0.421 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62 | -46.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | E145 L146 S151 A152 V153 | E145-A149 WeakPolarHBondContact O-CB 3.32Å; E145-A149 PolarHBondContact O-N 2.93Å; L146-A149 PolarHBondContact O-N 3.21Å; A149-S151 PolarHBondContact O-N 2.83Å; A149-A152 PolarHBondContact O-N 3.32Å; A149-A152 VanDerWaalsContact O-N 3.16Å; A149-V153 WeakPolarHBondContact O-CG2 3.44Å; A149-V153 PolarHBondContact O-N 3.48Å |
| 150 | A | 88.8 | Confident | 83 | Confident | 6 Ų | 6 | 81.9 Ų | 81.9 | 5% | 0.05 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -60.8 | -34.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | L146 A154 L168 L169 | L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.16Å; A150-A154 WeakPolarHBondContact O-CB 3.15Å; A150-A154 PolarHBondContact O-N 2.81Å; A150-L168 HydrophobicContact CB-CB 4.43Å; A150-L169 HydrophobicContact CB-CD2 3.92Å; A150-L169 HydrophobicContact CB-CG 4.25Å |
| 151 | S | 88.7 | Confident | 84.4 | Confident | 30 Ų | 30 | 78.8 Ų | 78.8 | 21% | 0.21 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -67.3 | -46.1 | 173.8 | -153.7 | 0 | 0 | 0 | 0 | 112 | V147 A148 A149 V153 A154 D155 K165 | V147-S151 PolarHBondContact O-N 3.19Å; V147-S151 VanDerWaalsContact O-N 3.14Å; A148-S151 WeakPolarHBondContact O-CB 3.43Å; A148-S151 PolarHBondContact O-N 3.34Å; A149-S151 PolarHBondContact O-N 2.83Å; S151-V153 VanDerWaalsContact C-N 3.31Å; S151-V153 PolarHBondContact O-N 3.1Å; S151-A154 PolarHBondContact O-N 2.8Å; S151-D155 PolarHBondContact O-N 3.44Å; S151-K165 PolarHBondContact OG-NZ 3.29Å |
| 152 | A | 90.9 | Very high | 85.5 | Confident | 64 Ų | 64 | 80.2 Ų | 80.2 | 53% | 0.529 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.2 | -38.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A148 A149 D155 S156 | A148-A152 PolarHBondContact O-N 3.35Å; A149-A152 PolarHBondContact O-N 3.32Å; A149-A152 VanDerWaalsContact O-N 3.16Å; A152-D155 PolarHBondContact O-N 2.84Å; A152-S156 PolarHBondContact O-N 3.44Å |
| 153 | V | 89.6 | Confident | 86.2 | Confident | 69 Ų | 69 | 82.1 Ų | 82.1 | 42% | 0.418 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.4 | -46.4 | 174.9 | 173.3 | 0 | 0 | 0 | 0 | 110.5 | A149 S151 D155 S156 L157 L168 | A149-V153 WeakPolarHBondContact O-CG2 3.44Å; A149-V153 PolarHBondContact O-N 3.48Å; S151-V153 VanDerWaalsContact C-N 3.31Å; S151-V153 PolarHBondContact O-N 3.1Å; V153-D155 PolarHBondContact O-N 3.31Å; V153-S156 PolarHBondContact O-N 2.85Å; V153-S156 PolarHBondContact O-OG 3.13Å; V153-L157 HydrophobicContact CG1-CD1 4.13Å; V153-L157 VanDerWaalsContact O-CD1 3.27Å; V153-L157 WeakPolarHBondContact O-CD1 3.39Å; V153-L157 PolarHBondContact O-N 3.16Å; V153-L168 HydrophobicContact CB-CD1 4.4Å; V153-L168 HydrophobicContact CG1-CD1 3.98Å |
| 154 | A | 90.3 | Very high | 86.5 | Confident | 2 Ų | 2 | 80.3 Ų | 80.3 | 2% | 0.017 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -61 | -32.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A150 S151 S156 T164 K165 | A150-A154 WeakPolarHBondContact O-CB 3.15Å; A150-A154 PolarHBondContact O-N 2.81Å; S151-A154 PolarHBondContact O-N 2.8Å; A154-S156 VanDerWaalsContact C-N 3.32Å; A154-T164 HydrophobicContact CB-CG2 4.29Å; A154-K165 HydrophobicContact CB-CB 3.82Å |
| 155 | D | 88.3 | Confident | 86.8 | Confident | 90 Ų | 90 | 78.7 Ų | 78.7 | 48% | 0.481 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -73.5 | -21.3 | 175.8 | -77.5 | -46.5 | 0 | 0 | 0 | 113.9 | S151 A152 V153 K161 | S151-D155 PolarHBondContact O-N 3.44Å; A152-D155 PolarHBondContact O-N 2.84Å; V153-D155 PolarHBondContact O-N 3.31Å; D155-K161 IonicContact OD1-NZ 2.74Å; D155-K161 PolarHBondContact OD1-NZ 2.99Å |
| 156 | S | 88.3 | Confident | 86.8 | Confident | 89 Ų | 89 | 74.5 Ų | 74.5 | 62% | 0.622 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -84.6 | -16.1 | 177.8 | 72.2 | 0 | 0 | 0 | 0 | 114.1 | A152 V153 A154 | A152-S156 PolarHBondContact O-N 3.44Å; V153-S156 PolarHBondContact O-N 2.85Å; V153-S156 PolarHBondContact O-OG 3.13Å; A154-S156 VanDerWaalsContact C-N 3.32Å |
| 157 | L | 84.9 | Confident | 87 | Confident | 75 Ų | 75 | 75.3 Ų | 75.3 | 39% | 0.393 | 43% | 0.426 | S | S | . | . | S | Bend | trans | -92.5 | 143.8 | 179.4 | -87.6 | 75.4 | 0 | 0 | 0 | 111.4 | V153 W159 T164 | V153-L157 HydrophobicContact CG1-CD1 4.13Å; V153-L157 VanDerWaalsContact O-CD1 3.27Å; V153-L157 WeakPolarHBondContact O-CD1 3.39Å; V153-L157 PolarHBondContact O-N 3.16Å; L157-W159 PolarHBondContact O-N 2.92Å; L157-T164 HydrophobicContact CD2-CG2 4.38Å |
| 158 | P | 78.2 | Confident | 87 | Confident | 126 Ų | 126 | 75.8 Ų | 75.8 | 82% | 0.818 | 43% | 0.426 | S | S | * | . | S | Bend | trans | -76.8 | 2.9 | 179.2 | 31 | -34.5 | 0 | 0 | 0 | 114 | ||
| 159 | W | 77.5 | Confident | 87 | Confident | 201 Ų | 201 | 74.4 Ų | 74.4 | 76% | 0.761 | 41% | 0.41 | S | S | * | . | S | Bend | trans | -90.2 | 175.2 | 179.8 | -119 | -103.3 | 0 | 0 | 0 | 112.2 | L157 K161 | L157-W159 PolarHBondContact O-N 2.92Å; W159-K161 PolarHBondContact O-N 3.5Å; W159-K161 VanDerWaalsContact O-N 3.09Å |
| 160 | D | 83.3 | Confident | 86.9 | Confident | 87 Ų | 87 | 78 Ų | 78 | 47% | 0.465 | 41% | 0.413 | S | S | . | . | trans | -58.4 | 116.5 | 179 | 175 | 22 | 0 | 0 | 0 | 111.5 | Q162 T163 T164 | D160-Q162 VanDerWaalsContact C-N 3.35Å; D160-Q162 PolarHBondContact O-N 3.31Å; D160-Q162 PolarHBondContact OD1-N 3.43Å; D160-T163 VanDerWaalsContact CB-OG1 3.23Å; D160-T163 WeakPolarHBondContact CB-OG1 3.46Å; D160-T163 PolarHBondContact O-OG1 3.46Å; D160-T163 WeakPolarHBondContact OD2-CG2 3.42Å; D160-T163 PolarHBondContact OD2-OG1 2.95Å; D160-T164 WeakPolarHBondContact O-CB 3.35Å; D160-T164 PolarHBondContact O-N 3.04Å; D160-T164 PolarHBondContact O-OG1 3.16Å | ||
| 161 | K | 87.4 | Confident | 86.9 | Confident | 107 Ų | 107 | 82.7 Ų | 82.7 | 47% | 0.465 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67.4 | -36 | -167.5 | -59.1 | -179.9 | 172 | -157.9 | 0 | 112.1 | D155 W159 K165 | D155-K161 IonicContact OD1-NZ 2.74Å; D155-K161 PolarHBondContact OD1-NZ 2.99Å; W159-K161 PolarHBondContact O-N 3.5Å; W159-K161 VanDerWaalsContact O-N 3.09Å; K161-K165 VanDerWaalsContact O-CB 3.24Å; K161-K165 WeakPolarHBondContact O-CB 3.49Å; K161-K165 PolarHBondContact O-N 3.22Å |
| 162 | Q | 83.8 | Confident | 86.8 | Confident | 158 Ų | 158 | 84.7 Ų | 84.7 | 74% | 0.738 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -76.9 | -40.6 | -175.9 | -69.2 | -173.1 | -10.7 | 0 | 0 | 111.7 | D160 S166 | D160-Q162 VanDerWaalsContact C-N 3.35Å; D160-Q162 PolarHBondContact O-N 3.31Å; D160-Q162 PolarHBondContact OD1-N 3.43Å; Q162-S166 WeakPolarHBondContact O-CB 3.36Å; Q162-S166 PolarHBondContact O-N 3.46Å; Q162-S166 PolarHBondContact O-OG 3.09Å |
| 163 | T | 84.3 | Confident | 86.6 | Confident | 66 Ų | 66 | 85 Ų | 85 | 41% | 0.405 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -67.5 | -43.3 | 175.1 | 46.4 | 0 | 0 | 0 | 0 | 110.8 | D160 K165 S166 E167 | D160-T163 VanDerWaalsContact CB-OG1 3.23Å; D160-T163 WeakPolarHBondContact CB-OG1 3.46Å; D160-T163 PolarHBondContact O-OG1 3.46Å; D160-T163 WeakPolarHBondContact OD2-CG2 3.42Å; D160-T163 PolarHBondContact OD2-OG1 2.95Å; T163-K165 PolarHBondContact O-N 3.45Å; T163-S166 WeakPolarHBondContact CA-OG 3.33Å; T163-S166 PolarHBondContact O-N 2.9Å; T163-S166 PolarHBondContact O-OG 3.48Å; T163-S166 VanDerWaalsContact O-OG 3.04Å; T163-E167 VanDerWaalsContact O-CB 3.25Å; T163-E167 WeakPolarHBondContact O-CB 3.42Å; T163-E167 PolarHBondContact O-N 3.23Å |
| 164 | T | 85.9 | Confident | 86.4 | Confident | 24 Ų | 24 | 86.5 Ų | 86.5 | 15% | 0.147 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 177.4 | -52 | 0 | 0 | 0 | 0 | 112.1 | A154 L157 D160 E167 L168 | A154-T164 HydrophobicContact CB-CG2 4.29Å; L157-T164 HydrophobicContact CD2-CG2 4.38Å; D160-T164 WeakPolarHBondContact O-CB 3.35Å; D160-T164 PolarHBondContact O-N 3.04Å; D160-T164 PolarHBondContact O-OG1 3.16Å; T164-E167 PolarHBondContact O-N 3.43Å; T164-L168 HydrophobicContact CG2-CD1 4.2Å; T164-L168 WeakPolarHBondContact O-CB 3.38Å; T164-L168 VanDerWaalsContact O-CG 3.32Å; T164-L168 WeakPolarHBondContact O-CG 3.43Å; T164-L168 PolarHBondContact O-N 3.47Å |
| 165 | K | 89.1 | Confident | 86.1 | Confident | 70 Ų | 70 | 92 Ų | 92 | 30% | 0.304 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.6 | -46.3 | 176.4 | -179.9 | 176.8 | 179.1 | 168 | 0 | 112.3 | S151 A154 K161 T163 L169 | S151-K165 PolarHBondContact OG-NZ 3.29Å; A154-K165 HydrophobicContact CB-CB 3.82Å; K161-K165 VanDerWaalsContact O-CB 3.24Å; K161-K165 WeakPolarHBondContact O-CB 3.49Å; K161-K165 PolarHBondContact O-N 3.22Å; T163-K165 PolarHBondContact O-N 3.45Å; K165-L169 HydrophobicContact CG-CD1 4.16Å; K165-L169 VanDerWaalsContact O-CG 3.29Å; K165-L169 WeakPolarHBondContact O-CG 3.44Å; K165-L169 PolarHBondContact O-N 3.46Å |
| 166 | S | 87.6 | Confident | 85.8 | Confident | 71 Ų | 71 | 91.3 Ų | 91.3 | 50% | 0.497 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -69.4 | -33.6 | -178.4 | 56.6 | 0 | 0 | 0 | 0 | 112.5 | Q162 T163 R170 | Q162-S166 WeakPolarHBondContact O-CB 3.36Å; Q162-S166 PolarHBondContact O-N 3.46Å; Q162-S166 PolarHBondContact O-OG 3.09Å; T163-S166 WeakPolarHBondContact CA-OG 3.33Å; T163-S166 PolarHBondContact O-N 2.9Å; T163-S166 PolarHBondContact O-OG 3.48Å; T163-S166 VanDerWaalsContact O-OG 3.04Å; S166-R170 WeakPolarHBondContact O-CB 3.48Å; S166-R170 PolarHBondContact O-N 2.93Å |
| 167 | E | 90.6 | Very high | 85.6 | Confident | 92 Ų | 92 | 93.2 Ų | 93.2 | 43% | 0.43 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -69.6 | -42.7 | 175.6 | -173.2 | 137.3 | -135 | 0 | 0 | 112.1 | T163 T164 R170 Q171 | T163-E167 VanDerWaalsContact O-CB 3.25Å; T163-E167 WeakPolarHBondContact O-CB 3.42Å; T163-E167 PolarHBondContact O-N 3.23Å; T164-E167 PolarHBondContact O-N 3.43Å; E167-R170 PolarHBondContact O-N 3.47Å; E167-R170 IonicContact OE1-CZ 2.85Å; E167-R170 IonicContact OE1-NH2 2.67Å; E167-R170 PolarHBondContact OE1-NH2 3.48Å; E167-Q171 WeakPolarHBondContact O-CG 3.43Å; E167-Q171 PolarHBondContact O-N 3.19Å |
| 168 | L | 88.8 | Confident | 85.4 | Confident | 52 Ų | 52 | 95.5 Ų | 95.5 | 27% | 0.272 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.1 | -43.5 | 174.4 | -75.2 | 171.3 | 0 | 0 | 0 | 112.2 | A150 V153 T164 R170 Q171 L172 | A150-L168 HydrophobicContact CB-CB 4.43Å; V153-L168 HydrophobicContact CB-CD1 4.4Å; V153-L168 HydrophobicContact CG1-CD1 3.98Å; T164-L168 HydrophobicContact CG2-CD1 4.2Å; T164-L168 WeakPolarHBondContact O-CB 3.38Å; T164-L168 VanDerWaalsContact O-CG 3.32Å; T164-L168 WeakPolarHBondContact O-CG 3.43Å; T164-L168 PolarHBondContact O-N 3.47Å; L168-R170 VanDerWaalsContact C-N 3.33Å; L168-R170 PolarHBondContact O-N 3.28Å; L168-Q171 PolarHBondContact O-N 3.26Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 WeakPolarHBondContact O-CG 3.26Å; L168-L172 PolarHBondContact O-N 3.47Å |
| 169 | L | 89.8 | Confident | 85.4 | Confident | 32 Ų | 32 | 92 Ų | 92 | 17% | 0.168 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -65.1 | -37.9 | 176.8 | -70.8 | 174.9 | 0 | 0 | 0 | 112 | L142 V147 A150 K165 L172 Q173 | L142-L169 HydrophobicContact CD1-CD2 4.04Å; V147-L169 HydrophobicContact CB-CD2 4.48Å; V147-L169 HydrophobicContact CG1-CD1 4.49Å; V147-L169 HydrophobicContact CG2-CD2 4.07Å; A150-L169 HydrophobicContact CB-CD2 3.92Å; A150-L169 HydrophobicContact CB-CG 4.25Å; K165-L169 HydrophobicContact CG-CD1 4.16Å; K165-L169 VanDerWaalsContact O-CG 3.29Å; K165-L169 WeakPolarHBondContact O-CG 3.44Å; K165-L169 PolarHBondContact O-N 3.46Å; L169-L172 PolarHBondContact O-N 3.3Å; L169-Q173 WeakPolarHBondContact O-CB 3.36Å; L169-Q173 PolarHBondContact O-N 3.46Å |
| 170 | R | 88.8 | Confident | 85.3 | Confident | 128 Ų | 128 | 88 Ų | 88 | 48% | 0.483 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 175.8 | -170.6 | -174.5 | 72.4 | -157.3 | -6.6 | 111.6 | S166 E167 L168 Q173 Q174 | S166-R170 WeakPolarHBondContact O-CB 3.48Å; S166-R170 PolarHBondContact O-N 2.93Å; E167-R170 PolarHBondContact O-N 3.47Å; E167-R170 IonicContact OE1-CZ 2.85Å; E167-R170 IonicContact OE1-NH2 2.67Å; E167-R170 PolarHBondContact OE1-NH2 3.48Å; L168-R170 VanDerWaalsContact C-N 3.33Å; L168-R170 PolarHBondContact O-N 3.28Å; R170-Q173 PolarHBondContact O-N 3.1Å; R170-Q174 WeakPolarHBondContact O-CG 3.47Å; R170-Q174 PolarHBondContact O-N 3.18Å; R170-Q174 VanDerWaalsContact O-N 3.13Å |
| 171 | Q | 88.8 | Confident | 84.8 | Confident | 104 Ų | 104 | 87.8 Ų | 87.8 | 49% | 0.486 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -68 | -41.9 | 178 | -73.4 | -178.3 | -10.2 | 0 | 0 | 112.2 | E167 L168 Q173 Q174 H175 | E167-Q171 WeakPolarHBondContact O-CG 3.43Å; E167-Q171 PolarHBondContact O-N 3.19Å; L168-Q171 PolarHBondContact O-N 3.26Å; Q171-Q173 VanDerWaalsContact C-N 3.29Å; Q171-Q173 PolarHBondContact O-N 3.11Å; Q171-Q174 PolarHBondContact O-N 2.95Å; Q171-H175 PolarHBondContact O-N 3.5Å |
| 172 | L | 87.1 | Confident | 84 | Confident | 71 Ų | 71 | 88.9 Ų | 88.9 | 37% | 0.372 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -60.9 | -40.2 | 175 | -79.3 | 171.3 | 0 | 0 | 0 | 111.9 | L168 L169 H175 E176 | L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 WeakPolarHBondContact O-CG 3.26Å; L168-L172 PolarHBondContact O-N 3.47Å; L169-L172 PolarHBondContact O-N 3.3Å; L172-H175 PolarHBondContact O-N 2.91Å; L172-E176 WeakPolarHBondContact O-CB 3.29Å; L172-E176 PolarHBondContact O-N 3.32Å |
| 173 | Q | 86.4 | Confident | 83.3 | Confident | 72 Ų | 72 | 87.5 Ų | 87.5 | 34% | 0.336 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.1 | -40.7 | 177.3 | -170.4 | 172 | 8.4 | 0 | 0 | 112.3 | L169 R170 Q171 E176 E177 | L169-Q173 WeakPolarHBondContact O-CB 3.36Å; L169-Q173 PolarHBondContact O-N 3.46Å; R170-Q173 PolarHBondContact O-N 3.1Å; Q171-Q173 VanDerWaalsContact C-N 3.29Å; Q171-Q173 PolarHBondContact O-N 3.11Å; Q173-E176 PolarHBondContact O-N 3.4Å; Q173-E177 PolarHBondContact O-N 3.08Å; Q173-E177 VanDerWaalsContact O-N 3.11Å |
| 174 | Q | 86.1 | Confident | 82.4 | Confident | 99 Ų | 99 | 88.5 Ų | 88.5 | 46% | 0.463 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 176 | -73.9 | 174.3 | -17.4 | 0 | 0 | 111.6 | R170 Q171 E177 E178 | R170-Q174 WeakPolarHBondContact O-CG 3.47Å; R170-Q174 PolarHBondContact O-N 3.18Å; R170-Q174 VanDerWaalsContact O-N 3.13Å; Q171-Q174 PolarHBondContact O-N 2.95Å; Q174-E177 PolarHBondContact O-N 3.43Å; Q174-E178 WeakPolarHBondContact O-CG 3.47Å; Q174-E178 PolarHBondContact O-N 3.23Å |
| 175 | H | 82.6 | Confident | 81.3 | Confident | 119 Ų | 119 | 96.6 Ų | 96.6 | 55% | 0.551 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -68 | -37.7 | -179.7 | -169.8 | -89.6 | 0 | 0 | 0 | 112.7 | Q171 L172 E177 E178 T179 | Q171-H175 PolarHBondContact O-N 3.5Å; L172-H175 PolarHBondContact O-N 2.91Å; H175-E177 VanDerWaalsContact C-N 3.33Å; H175-E177 PolarHBondContact O-N 2.87Å; H175-E178 PolarHBondContact O-N 2.75Å; H175-T179 WeakPolarHBondContact O-CB 3.36Å; H175-T179 VanDerWaalsContact O-CG2 3.24Å; H175-T179 WeakPolarHBondContact O-CG2 3.25Å; H175-T179 PolarHBondContact O-N 3.31Å; H175-T179 PolarHBondContact O-OG1 3.19Å |
| 176 | E | 83.3 | Confident | 79.8 | Confident | 74 Ų | 74 | 99 Ų | 99 | 35% | 0.346 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.3 | -37.6 | 174.5 | -177 | 66.2 | -161.6 | 0 | 0 | 111.7 | L172 Q173 T179 R180 | L172-E176 WeakPolarHBondContact O-CB 3.29Å; L172-E176 PolarHBondContact O-N 3.32Å; Q173-E176 PolarHBondContact O-N 3.4Å; E176-T179 WeakPolarHBondContact CA-OG1 3.36Å; E176-T179 PolarHBondContact O-OG1 3.38Å; E176-R180 WeakPolarHBondContact O-CB 3.45Å; E176-R180 VanDerWaalsContact O-CG 3.23Å; E176-R180 WeakPolarHBondContact O-CG 3.4Å; E176-R180 PolarHBondContact O-N 2.89Å; E176-R180 VanDerWaalsContact O-N 3.11Å; E176-R180 IonicContact OE1-CZ 3.73Å; E176-R180 IonicContact OE1-NE 2.99Å; E176-R180 PolarHBondContact OE1-NE 3.24Å; E176-R180 IonicContact OE1-NH2 3.41Å; E176-R180 PolarHBondContact OE1-NH2 3.14Å |
| 177 | E | 82.8 | Confident | 78.5 | Confident | 130 Ų | 130 | 101.6 Ų | 101.6 | 61% | 0.607 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -70.3 | -41.6 | 176.3 | -166.8 | 169.3 | -172 | 0 | 0 | 112.1 | Q173 Q174 H175 R180 T181 | Q173-E177 PolarHBondContact O-N 3.08Å; Q173-E177 VanDerWaalsContact O-N 3.11Å; Q174-E177 PolarHBondContact O-N 3.43Å; H175-E177 VanDerWaalsContact C-N 3.33Å; H175-E177 PolarHBondContact O-N 2.87Å; E177-R180 PolarHBondContact O-N 3.09Å; E177-T181 WeakPolarHBondContact O-CG2 3.43Å; E177-T181 PolarHBondContact O-N 2.9Å; E177-T181 PolarHBondContact O-OG1 3.31Å |
| 178 | E | 80.9 | Confident | 77 | Confident | 123 Ų | 123 | 101.4 Ų | 101.4 | 58% | 0.575 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -64.4 | -42.8 | 176.2 | -73.3 | 174.8 | -174.4 | 0 | 0 | 112.2 | Q174 H175 T181 Q182 | Q174-E178 WeakPolarHBondContact O-CG 3.47Å; Q174-E178 PolarHBondContact O-N 3.23Å; H175-E178 PolarHBondContact O-N 2.75Å; E178-T181 WeakPolarHBondContact CA-OG1 3.13Å; E178-T181 PolarHBondContact O-N 2.88Å; E178-T181 PolarHBondContact O-OG1 2.96Å; E178-Q182 WeakPolarHBondContact O-CB 3.36Å; E178-Q182 PolarHBondContact O-N 2.98Å |
| 179 | T | 78.1 | Confident | 75.6 | Confident | 52 Ų | 52 | 107.4 Ų | 107.4 | 32% | 0.319 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.8 | -37.2 | 176.7 | 52.4 | 0 | 0 | 0 | 0 | 112.6 | H175 E176 Q182 K183 | H175-T179 WeakPolarHBondContact O-CB 3.36Å; H175-T179 VanDerWaalsContact O-CG2 3.24Å; H175-T179 WeakPolarHBondContact O-CG2 3.25Å; H175-T179 PolarHBondContact O-N 3.31Å; H175-T179 PolarHBondContact O-OG1 3.19Å; E176-T179 WeakPolarHBondContact CA-OG1 3.36Å; E176-T179 PolarHBondContact O-OG1 3.38Å; T179-Q182 PolarHBondContact O-N 3.37Å; T179-K183 WeakPolarHBondContact O-CB 3.37Å; T179-K183 PolarHBondContact O-N 3.03Å |
| 180 | R | 75.1 | Confident | 74.2 | Confident | 116 Ų | 116 | 110.9 Ų | 110.9 | 44% | 0.438 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.5 | -46.8 | 173.5 | -75.4 | 175.6 | -175 | -157.4 | 3.9 | 112 | E176 E177 Q182 K183 D184 | E176-R180 WeakPolarHBondContact O-CB 3.45Å; E176-R180 VanDerWaalsContact O-CG 3.23Å; E176-R180 WeakPolarHBondContact O-CG 3.4Å; E176-R180 PolarHBondContact O-N 2.89Å; E176-R180 VanDerWaalsContact O-N 3.11Å; E176-R180 IonicContact OE1-CZ 3.73Å; E176-R180 IonicContact OE1-NE 2.99Å; E176-R180 PolarHBondContact OE1-NE 3.24Å; E176-R180 IonicContact OE1-NH2 3.41Å; E176-R180 PolarHBondContact OE1-NH2 3.14Å; E177-R180 PolarHBondContact O-N 3.09Å; R180-Q182 VanDerWaalsContact C-N 3.3Å; R180-Q182 PolarHBondContact O-N 2.9Å; R180-K183 PolarHBondContact O-N 3.4Å; R180-D184 PolarHBondContact O-N 3.2Å |
| 181 | T | 73.6 | Confident | 72.8 | Confident | 84 Ų | 84 | 107.9 Ų | 107.9 | 52% | 0.515 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.6 | -34.2 | 178.5 | 56.7 | 0 | 0 | 0 | 0 | 112.4 | E177 E178 R185 | E177-T181 WeakPolarHBondContact O-CG2 3.43Å; E177-T181 PolarHBondContact O-N 2.9Å; E177-T181 PolarHBondContact O-OG1 3.31Å; E178-T181 WeakPolarHBondContact CA-OG1 3.13Å; E178-T181 PolarHBondContact O-N 2.88Å; E178-T181 PolarHBondContact O-OG1 2.96Å; T181-R185 WeakPolarHBondContact O-CB 3.41Å; T181-R185 PolarHBondContact O-N 3.06Å |
| 182 | Q | 71.7 | Confident | 71.5 | Confident | 130 Ų | 130 | 110.2 Ų | 110.2 | 61% | 0.607 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.1 | -47.7 | 171.8 | -178.4 | 172.9 | -17.5 | 0 | 0 | 112.1 | E178 T179 R180 D184 R185 E186 | E178-Q182 WeakPolarHBondContact O-CB 3.36Å; E178-Q182 PolarHBondContact O-N 2.98Å; T179-Q182 PolarHBondContact O-N 3.37Å; R180-Q182 VanDerWaalsContact C-N 3.3Å; R180-Q182 PolarHBondContact O-N 2.9Å; Q182-D184 VanDerWaalsContact C-N 3.28Å; Q182-D184 PolarHBondContact O-N 3.25Å; Q182-R185 WeakPolarHBondContact O-CB 3.46Å; Q182-R185 PolarHBondContact O-N 3.07Å; Q182-E186 PolarHBondContact O-N 3.07Å |
| 183 | K | 68.8 | Low | 70.3 | Confident | 128 Ų | 128 | 116.9 Ų | 116.9 | 56% | 0.557 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -61.7 | -35.9 | 178.8 | -166.7 | 177.3 | -176 | 172.5 | 0 | 112.1 | T179 R180 E186 K187 | T179-K183 WeakPolarHBondContact O-CB 3.37Å; T179-K183 PolarHBondContact O-N 3.03Å; R180-K183 PolarHBondContact O-N 3.4Å; K183-E186 PolarHBondContact O-N 3.12Å; K183-K187 VanDerWaalsContact O-CG 3.28Å; K183-K187 WeakPolarHBondContact O-CG 3.48Å; K183-K187 PolarHBondContact O-N 3.45Å |
| 184 | D | 65.4 | Low | 69.2 | Low | 88 Ų | 88 | 119.9 Ų | 119.9 | 47% | 0.471 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -77.2 | -30.8 | 177.3 | -70.2 | -18.5 | 0 | 0 | 0 | 112.9 | R180 Q182 E186 K187 S188 | R180-D184 PolarHBondContact O-N 3.2Å; Q182-D184 VanDerWaalsContact C-N 3.28Å; Q182-D184 PolarHBondContact O-N 3.25Å; D184-E186 VanDerWaalsContact C-N 3.3Å; D184-K187 IonicContact OD1-NZ 2.92Å; D184-K187 PolarHBondContact OD1-NZ 3.42Å; D184-S188 WeakPolarHBondContact O-CB 3.49Å; D184-S188 PolarHBondContact O-N 2.67Å; D184-S188 VanDerWaalsContact O-N 3.08Å; D184-S188 PolarHBondContact O-OG 3.14Å |
| 185 | R | 62 | Low | 68.2 | Low | 193 Ų | 193 | 119.8 Ų | 119.8 | 73% | 0.728 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -64.2 | -33.3 | 166.4 | -100.7 | -177.8 | 172 | 175.1 | -0 | 113 | T181 Q182 S188 K189 | T181-R185 WeakPolarHBondContact O-CB 3.41Å; T181-R185 PolarHBondContact O-N 3.06Å; Q182-R185 WeakPolarHBondContact O-CB 3.46Å; Q182-R185 PolarHBondContact O-N 3.07Å; R185-S188 WeakPolarHBondContact CA-OG 3.01Å; R185-S188 PolarHBondContact O-OG 3.05Å; R185-S188 VanDerWaalsContact O-OG 3.11Å; R185-K189 WeakPolarHBondContact O-CG 3.39Å; R185-K189 PolarHBondContact O-N 3.44Å |
| 186 | E | 58.1 | Low | 67.3 | Low | 120 Ų | 120 | 119.8 Ų | 119.8 | 56% | 0.561 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -76.7 | -43.5 | 179.3 | -161.2 | 168.2 | -154.1 | 0 | 0 | 111.6 | Q182 K183 D184 S188 K189 | Q182-E186 PolarHBondContact O-N 3.07Å; K183-E186 PolarHBondContact O-N 3.12Å; D184-E186 VanDerWaalsContact C-N 3.3Å; E186-S188 VanDerWaalsContact C-N 3.29Å; E186-S188 PolarHBondContact O-N 3.26Å; E186-K189 PolarHBondContact O-N 3.32Å; E186-K189 VanDerWaalsContact O-N 3.17Å |
| 187 | K | 59.8 | Low | 66.3 | Low | 126 Ų | 126 | 120.6 Ų | 120.6 | 55% | 0.548 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -60 | -35.9 | 171.8 | -70 | 169.9 | -168.5 | 156.6 | 0 | 113.1 | K183 D184 K189 | K183-K187 VanDerWaalsContact O-CG 3.28Å; K183-K187 WeakPolarHBondContact O-CG 3.48Å; K183-K187 PolarHBondContact O-N 3.45Å; D184-K187 IonicContact OD1-NZ 2.92Å; D184-K187 PolarHBondContact OD1-NZ 3.42Å; K187-K189 VanDerWaalsContact C-N 3.34Å |
| 188 | S | 60 | Low | 65.2 | Low | 88 Ų | 88 | 121.6 Ų | 121.6 | 62% | 0.615 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -77.6 | -16.5 | 178.4 | 51.1 | 0 | 0 | 0 | 0 | 114 | D184 R185 E186 | D184-S188 WeakPolarHBondContact O-CB 3.49Å; D184-S188 PolarHBondContact O-N 2.67Å; D184-S188 VanDerWaalsContact O-N 3.08Å; D184-S188 PolarHBondContact O-OG 3.14Å; R185-S188 WeakPolarHBondContact CA-OG 3.01Å; R185-S188 PolarHBondContact O-OG 3.05Å; R185-S188 VanDerWaalsContact O-OG 3.11Å; E186-S188 VanDerWaalsContact C-N 3.29Å; E186-S188 PolarHBondContact O-N 3.26Å |
| 189 | K | 57.8 | Low | 64.1 | Low | 179 Ų | 179 | 122.1 Ų | 122.1 | 78% | 0.778 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -80.8 | -20.5 | 175.1 | -86.8 | 178.9 | 175.9 | -177 | 0 | 114.2 | R185 E186 K187 | R185-K189 WeakPolarHBondContact O-CG 3.39Å; R185-K189 PolarHBondContact O-N 3.44Å; E186-K189 PolarHBondContact O-N 3.32Å; E186-K189 VanDerWaalsContact O-N 3.17Å; K187-K189 VanDerWaalsContact C-N 3.34Å |
| 190 | I | 61.8 | Low | 63.3 | Low | 105 Ų | 105 | 129.4 Ų | 129.4 | 54% | 0.538 | 61% | 0.614 | S | S | . | * | trans | -113.9 | 67.7 | -177.2 | -46 | 171.9 | 0 | 0 | 0 | 109.6 | ||||
| 191 | S | 58.8 | Low | 62.3 | Low | 64 Ų | 64 | 131 Ų | 131 | 45% | 0.448 | 63% | 0.63 | S | S | . | * | trans | -94.3 | 113.1 | 165.9 | -167.8 | 0 | 0 | 0 | 0 | 109 | R193 H194 | S191-R193 PolarHBondContact O-N 3.2Å; S191-H194 PolarHBondContact O-N 3.3Å | ||
| 192 | F | 61 | Low | 60.7 | Low | 153 Ų | 153 | 131.7 Ų | 131.7 | 67% | 0.671 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -51.9 | -23.7 | 176.7 | -72.3 | -85 | 0 | 0 | 0 | 113.5 | H194 I195 I196 | F192-H194 VanDerWaalsContact C-N 3.34Å; F192-H194 PolarHBondContact O-N 3.44Å; F192-I195 PolarHBondContact O-N 3.16Å; F192-I196 WeakPolarHBondContact O-CG1 3.22Å; F192-I196 PolarHBondContact O-N 3.35Å; F192-I196 VanDerWaalsContact O-N 3.15Å |
| 193 | R | 63.3 | Low | 59.7 | Low | 211 Ų | 211 | 136.8 Ų | 136.8 | 80% | 0.796 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -64.7 | -33.6 | 174.3 | -126.9 | 178.6 | -176.4 | 170.3 | 1.1 | 113 | S191 S197 | S191-R193 PolarHBondContact O-N 3.2Å; R193-S197 WeakPolarHBondContact O-CB 3.42Å; R193-S197 PolarHBondContact O-N 3.37Å; R193-S197 PolarHBondContact O-OG 3.28Å |
| 194 | H | 62 | Low | 58.6 | Low | 135 Ų | 135 | 136 Ų | 136 | 63% | 0.625 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -77.3 | -34.4 | 178.1 | -137.2 | 72.8 | 0 | 0 | 0 | 111.5 | S191 F192 S197 E198 | S191-H194 PolarHBondContact O-N 3.3Å; F192-H194 VanDerWaalsContact C-N 3.34Å; F192-H194 PolarHBondContact O-N 3.44Å; H194-S197 PolarHBondContact O-N 3.05Å; H194-E198 PolarHBondContact O-N 2.75Å |
| 195 | I | 65.6 | Low | 57.6 | Low | 98 Ų | 98 | 137.7 Ų | 137.7 | 50% | 0.503 | 68% | 0.684 | S | S | . | * | H | α-helix | trans | -67.5 | -40.9 | 177.4 | -60 | 173.3 | 0 | 0 | 0 | 111.2 | F192 | F192-I195 PolarHBondContact O-N 3.16Å |
| 196 | I | 62.6 | Low | 56.6 | Low | 118 Ų | 118 | 134.1 Ų | 134.1 | 61% | 0.605 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -78 | -26.4 | -179.7 | -60.1 | 169.8 | 0 | 0 | 0 | 111.9 | F192 M199 | F192-I196 WeakPolarHBondContact O-CG1 3.22Å; F192-I196 PolarHBondContact O-N 3.35Å; F192-I196 VanDerWaalsContact O-N 3.15Å; I196-M199 PolarHBondContact O-N 3.22Å |
| 197 | S | 63.7 | Low | 55.7 | Low | 91 Ų | 91 | 132.1 Ų | 132.1 | 64% | 0.636 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -73.2 | -26.5 | 179.1 | -60 | 0 | 0 | 0 | 0 | 113.4 | R193 H194 | R193-S197 WeakPolarHBondContact O-CB 3.42Å; R193-S197 PolarHBondContact O-N 3.37Å; R193-S197 PolarHBondContact O-OG 3.28Å; H194-S197 PolarHBondContact O-N 3.05Å |
| 198 | E | 59.6 | Low | 54.8 | Low | 151 Ų | 151 | 137.2 Ų | 137.2 | 71% | 0.706 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | -10 | 176.6 | -67.8 | -69.9 | 153.6 | 0 | 0 | 112.9 | H194 K200 | H194-E198 PolarHBondContact O-N 2.75Å; E198-K200 PolarHBondContact O-N 3.29Å |
| 199 | M | 56.6 | Low | 54.3 | Low | 135 Ų | 135 | 140.2 Ų | 140.2 | 67% | 0.665 | 72% | 0.722 | S | S | * | * | trans | -78.7 | 79.8 | 174.2 | -99.6 | 173.4 | 63.1 | 0 | 0 | 111.3 | I196 I201 | I196-M199 PolarHBondContact O-N 3.22Å; M199-I201 PolarHBondContact O-N 3.44Å | ||
| 200 | K | 61.3 | Low | 53.4 | Low | 204 Ų | 204 | 137.2 Ų | 137.2 | 89% | 0.887 | 72% | 0.724 | S | S | * | * | trans | -74.9 | 104.3 | 167.8 | -104.4 | 178.2 | 166.1 | 176.9 | 0 | 110.7 | E198 A202 | E198-K200 PolarHBondContact O-N 3.29Å; K200-A202 PolarHBondContact O-N 3.37Å | ||
| 201 | I | 54.7 | Low | 52.8 | Low | 151 Ų | 151 | 138.5 Ų | 138.5 | 77% | 0.774 | 74% | 0.737 | S | S | * | * | trans | -79 | 99.9 | 169.7 | -58.9 | 169.2 | 0 | 0 | 0 | 108.1 | M199 R203 | M199-I201 PolarHBondContact O-N 3.44Å; I201-R203 PolarHBondContact O-N 2.85Å; I201-R203 VanDerWaalsContact O-N 3.17Å | ||
| 202 | A | 41 | Very low | 52.1 | Low | 98 Ų | 98 | 146.6 Ų | 146.6 | 81% | 0.81 | 76% | 0.758 | S | S | * | * | trans | -71.7 | 105.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | K200 S204 | K200-A202 PolarHBondContact O-N 3.37Å; A202-S204 PolarHBondContact O-N 3.06Å | ||
| 203 | R | 50.3 | Low | 51.4 | Low | 237 Ų | 237 | 144.8 Ų | 144.8 | 89% | 0.894 | 76% | 0.762 | S | S | * | * | trans | -81.4 | 105.3 | 167.2 | -165 | 175.3 | -170.8 | -178.3 | 2.5 | 107.4 | I201 P205 | I201-R203 PolarHBondContact O-N 2.85Å; I201-R203 VanDerWaalsContact O-N 3.17Å; R203-P205 WeakPolarHBondContact O-CD 3.13Å | ||
| 204 | S | 44.8 | Very low | 50.8 | Low | 111 Ų | 111 | 142.7 Ų | 142.7 | 78% | 0.776 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 127.9 | -180 | 48 | 0 | 0 | 0 | 0 | 111.2 | A202 | A202-S204 PolarHBondContact O-N 3.06Š|
| 205 | P | 44.4 | Very low | 50.4 | Low | 124 Ų | 124 | 144.8 Ų | 144.8 | 81% | 0.805 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 145.9 | 164.7 | 32.6 | -29.3 | 0 | 0 | 0 | 110.4 | R203 | R203-P205 WeakPolarHBondContact O-CD 3.13Š|
| 206 | S | 41.7 | Very low | 49.8 | Very low | 118 Ų | 118 | 148.9 Ų | 148.9 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 151.2 | 174.7 | 177.6 | 0 | 0 | 0 | 0 | 113.4 | ||
| 207 | A | 39.6 | Very low | 49.5 | Very low | 77 Ų | 77 | 149.9 Ų | 149.9 | 64% | 0.636 | 79% | 0.793 | S | S | * | * | trans | 81.9 | 96.1 | 156.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 208 | R | 40.2 | Very low | 48.7 | Very low | 234 Ų | 234 | 153.7 Ų | 153.7 | 88% | 0.883 | 80% | 0.801 | S | S | * | * | 159.4 | 131.9 | 100.7 | -82.2 | -179.6 | -166.1 | 178.1 | 4.7 | 111.3 | |||||
| 209 | V | 50.4 | Low | 47.7 | Very low | 150 Ų | 150 | 155.6 Ų | 155.6 | 91% | 0.909 | 81% | 0.807 | S | S | * | * | trans | 27.8 | 104 | 146.9 | -169.3 | 0 | 0 | 0 | 0 | 117 | ||||
| 210 | S | 39 | Very low | 47.2 | Very low | 116 Ų | 116 | 156.5 Ų | 156.5 | 81% | 0.811 | 81% | 0.814 | S | S | * | * | trans | -147.8 | 142.5 | 157.1 | -174.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 211 | T | 48.9 | Very low | 46.6 | Very low | 133 Ų | 133 | 155.6 Ų | 155.6 | 82% | 0.816 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 132.4 | -165.7 | -40.7 | 0 | 0 | 0 | 0 | 113.2 | P213 | T211-P213 WeakPolarHBondContact O-CD 3.43Š|
| 212 | R | 44.1 | Very low | 46 | Very low | 233 Ų | 233 | 157 Ų | 157 | 88% | 0.879 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 119.4 | -176.4 | -166.9 | -179.1 | -168.3 | -176.8 | 3.7 | 112.3 | Q214 | R212-Q214 PolarHBondContact O-N 3.13Š|
| 213 | P | 45.6 | Very low | 46 | Very low | 116 Ų | 116 | 161.1 Ų | 161.1 | 75% | 0.753 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 118.4 | 160.5 | -9.6 | 26.9 | 0 | 0 | 0 | 108.1 | T211 | T211-P213 WeakPolarHBondContact O-CD 3.43Š|
| 214 | Q | 50.7 | Low | 45.4 | Very low | 167 Ų | 167 | 156.6 Ų | 156.6 | 78% | 0.78 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -59.7 | 139.2 | 169.6 | -150.2 | 157.8 | -22.3 | 0 | 0 | 107 | R212 | R212-Q214 PolarHBondContact O-N 3.13Š|
| 215 | H | 54.7 | Low | 45.2 | Very low | 179 Ų | 179 | 158.9 Ų | 158.9 | 83% | 0.829 | 82% | 0.818 | S | S | * | * | trans | 94.7 | 62.5 | 176.2 | -45.5 | 52.7 | 0 | 0 | 0 | 115.2 | ||||
| 216 | Q | 51.8 | Low | 44.9 | Very low | 184 Ų | 184 | 158.4 Ų | 158.4 | 86% | 0.86 | 82% | 0.818 | S | S | * | * | trans | -104 | 126.9 | 156.1 | -167.4 | 172.5 | 13.6 | 0 | 0 | 108 | Q218 | Q216-Q218 PolarHBondContact O-N 3.44Š| ||
| 217 | I | 55.8 | Low | 45 | Very low | 139 Ų | 139 | 158 Ų | 158 | 71% | 0.713 | 82% | 0.815 | S | S | * | * | trans | -68.1 | 112.8 | 175.3 | -62.7 | 166.2 | 0 | 0 | 0 | 107.1 | F219 | I217-F219 HydrophobicContact CG2-CD2 4.24Å; I217-F219 HydrophobicContact CG2-CE2 4.03Å | ||
| 218 | Q | 47.6 | Very low | 44.9 | Very low | 171 Ų | 171 | 162.2 Ų | 162.2 | 80% | 0.799 | 83% | 0.826 | S | S | * | * | trans | -81.2 | 122.9 | 164.1 | -81.3 | 176.3 | -43.2 | 0 | 0 | 107.5 | Q216 | Q216-Q218 PolarHBondContact O-N 3.44Š| ||
| 219 | F | 39.1 | Very low | 45.2 | Very low | 190 Ų | 190 | 158.6 Ų | 158.6 | 83% | 0.833 | 82% | 0.819 | S | S | * | * | trans | -83.2 | 111.4 | 162.7 | -77.1 | -91.2 | 0 | 0 | 0 | 106.5 | I217 E221 | I217-F219 HydrophobicContact CG2-CD2 4.24Å; I217-F219 HydrophobicContact CG2-CE2 4.03Å; F219-E221 PolarHBondContact O-N 3.34Å | ||
| 220 | D | 45.6 | Very low | 44.9 | Very low | 154 Ų | 154 | 158.4 Ų | 158.4 | 82% | 0.824 | 81% | 0.812 | S | S | * | * | trans | -77.4 | 92.9 | 167.4 | -81.9 | -15.8 | 0 | 0 | 0 | 107.8 | ||||
| 221 | E | 49.5 | Very low | 45.2 | Very low | 186 Ų | 186 | 161.1 Ų | 161.1 | 87% | 0.869 | 81% | 0.812 | S | S | * | * | trans | -92.8 | 92.9 | 146.3 | -84.2 | -162.4 | 162.1 | 0 | 0 | 106.9 | F219 | F219-E221 PolarHBondContact O-N 3.34Š| ||
| 222 | E | 40.2 | Very low | 44.9 | Very low | 179 Ų | 179 | 163 Ų | 163 | 84% | 0.836 | 81% | 0.809 | S | S | * | * | trans | -179.7 | 132.9 | 131.4 | -103.9 | 173.8 | 159.6 | 0 | 0 | 109.3 | ||||
| 223 | M | 41.6 | Very low | 44.7 | Very low | 186 Ų | 186 | 157.8 Ų | 157.8 | 92% | 0.916 | 81% | 0.805 | S | S | * | * | trans | -99.5 | 106.7 | 178.5 | 176.8 | 154.4 | 61.6 | 0 | 0 | 107.5 | ||||
| 224 | D | 37.2 | Very low | 45 | Very low | 142 Ų | 142 | 157.5 Ų | 157.5 | 76% | 0.759 | 81% | 0.806 | S | S | * | * | trans | -135.9 | 127.4 | 164.5 | 54.1 | -15.1 | 0 | 0 | 0 | 112.2 | S226 | D224-S226 PolarHBondContact O-N 2.91Š| ||
| 225 | N | 41.4 | Very low | 44.9 | Very low | 158 Ų | 158 | 156.7 Ų | 156.7 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | -66.4 | 123.3 | 179 | -66.3 | -44 | 0 | 0 | 0 | 110.4 | ||||
| 226 | S | 38 | Very low | 44.8 | Very low | 115 Ų | 115 | 157.9 Ų | 157.9 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -174.1 | 136.7 | 131.8 | 38.4 | 0 | 0 | 0 | 0 | 112 | D224 | D224-S226 PolarHBondContact O-N 2.91Š| ||
| 227 | S | 43.3 | Very low | 45.3 | Very low | 108 Ų | 108 | 158.5 Ų | 158.5 | 76% | 0.755 | 81% | 0.81 | S | S | * | * | trans | -37.9 | 139.7 | 171.1 | 52.8 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 228 | L | 38.4 | Very low | 45.6 | Very low | 166 Ų | 166 | 160.1 Ų | 160.1 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | -166.5 | 129.5 | 122.3 | -97.6 | 167 | 0 | 0 | 0 | 110.5 | L230 | L228-L230 PolarHBondContact O-N 3.38Š| |||
| 229 | H | 46.8 | Very low | 46.4 | Very low | 159 Ų | 159 | 163.6 Ų | 163.6 | 74% | 0.736 | 82% | 0.82 | S | S | * | * | trans | -40.8 | 113.5 | 172.6 | -178 | -33.5 | 0 | 0 | 0 | 113 | ||||
| 230 | L | 42.5 | Very low | 48 | Very low | 145 Ų | 145 | 163.5 Ų | 163.5 | 76% | 0.759 | 82% | 0.819 | S | S | * | * | trans | -147.4 | 106 | 156.8 | -159 | 66.8 | 0 | 0 | 0 | 109.8 | L228 K232 | L228-L230 PolarHBondContact O-N 3.38Å; L230-K232 PolarHBondContact O-N 2.86Å | ||
| 231 | E | 45.5 | Very low | 49.6 | Very low | 173 Ų | 173 | 157.9 Ų | 157.9 | 81% | 0.808 | 80% | 0.798 | S | S | * | * | trans | -59.3 | 120.4 | 169.1 | -64.4 | -155.9 | 152 | 0 | 0 | 109.4 | ||||
| 232 | K | 43 | Very low | 51.3 | Low | 173 Ų | 173 | 157.4 Ų | 157.4 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | trans | -110.6 | 137.8 | 163.2 | -82.1 | 176.9 | 178.5 | 170.7 | 0 | 107.9 | L230 S234 | L230-K232 PolarHBondContact O-N 2.86Å; K232-S234 PolarHBondContact O-N 3.19Å | ||
| 233 | P | 40.9 | Very low | 53.4 | Low | 124 Ų | 124 | 158.6 Ų | 158.6 | 81% | 0.805 | 80% | 0.803 | S | S | * | * | trans | -62.1 | 125.3 | -178 | 26.2 | -32.2 | 0 | 0 | 0 | 109.5 | D235 | P233-D235 PolarHBondContact O-N 3.5Š| ||
| 234 | S | 50.4 | Low | 55.5 | Low | 110 Ų | 110 | 157.8 Ų | 157.8 | 77% | 0.769 | 80% | 0.795 | S | S | * | * | trans | -67.7 | 91.9 | 179.6 | 51.5 | 0 | 0 | 0 | 0 | 111.1 | K232 | K232-S234 PolarHBondContact O-N 3.19Š| ||
| 235 | D | 50.4 | Low | 57.7 | Low | 150 Ų | 150 | 154.2 Ų | 154.2 | 80% | 0.802 | 79% | 0.791 | S | S | * | * | trans | -140 | 26.7 | 166.7 | -88.6 | -36.8 | 0 | 0 | 0 | 113.4 | P233 K237 | P233-D235 PolarHBondContact O-N 3.5Å; D235-K237 PolarHBondContact O-N 3.03Å; D235-K237 VanDerWaalsContact O-N 3.12Å | ||
| 236 | F | 52.2 | Low | 60 | Low | 203 Ų | 203 | 157.3 Ų | 157.3 | 89% | 0.89 | 80% | 0.797 | S | S | * | * | trans | -73.9 | 100.8 | 152.3 | -70 | -75.6 | 0 | 0 | 0 | 106.9 | Q238 | F236-Q238 PolarHBondContact O-N 3.39Š| ||
| 237 | K | 60.9 | Low | 62.3 | Low | 197 Ų | 197 | 159.8 Ų | 159.8 | 86% | 0.857 | 79% | 0.789 | S | S | * | * | trans | -50.3 | 90.5 | 164.6 | -73.2 | 177.6 | 179.9 | 176.1 | 0 | 107.9 | D235 R239 | D235-K237 PolarHBondContact O-N 3.03Å; D235-K237 VanDerWaalsContact O-N 3.12Å; K237-R239 PolarHBondContact O-N 3.16Å | ||
| 238 | Q | 62.2 | Low | 64.4 | Low | 173 Ų | 173 | 161.4 Ų | 161.4 | 81% | 0.808 | 79% | 0.789 | S | S | * | * | trans | -54.7 | 113.1 | 168.9 | -74.2 | -174.2 | -1.8 | 0 | 0 | 104.8 | F236 K240 | F236-Q238 PolarHBondContact O-N 3.39Å; Q238-K240 VanDerWaalsContact C-N 3.33Å; Q238-K240 PolarHBondContact O-N 3.44Å | ||
| 239 | R | 64.4 | Low | 66.7 | Low | 245 Ų | 245 | 156.6 Ų | 156.6 | 93% | 0.925 | 78% | 0.779 | S | S | * | * | trans | -56.3 | 103.6 | 176.3 | -69.6 | 178 | -178.1 | 165.8 | -0.4 | 105.8 | K237 G241 | K237-R239 PolarHBondContact O-N 3.16Å; R239-G241 PolarHBondContact O-N 3.17Å; R239-G241 VanDerWaalsContact O-N 3.07Å | ||
| 240 | K | 73.4 | Confident | 68.9 | Low | 187 Ų | 187 | 155 Ų | 155 | 81% | 0.813 | 78% | 0.775 | S | S | * | * | trans | -61.5 | 115.7 | -179.9 | -64.8 | 179.4 | -178.9 | 179.3 | 0 | 106.1 | Q238 | Q238-K240 VanDerWaalsContact C-N 3.33Å; Q238-K240 PolarHBondContact O-N 3.44Å | ||
| 241 | G | 80 | Confident | 70.9 | Confident | 37 Ų | 37 | 156 Ų | 156 | 38% | 0.381 | 77% | 0.773 | S | S | . | * | trans | -61.9 | 150 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | R239 F243 K244 | R239-G241 PolarHBondContact O-N 3.17Å; R239-G241 VanDerWaalsContact O-N 3.07Å; G241-F243 PolarHBondContact O-N 2.99Å; G241-K244 PolarHBondContact O-N 3.46Å | ||
| 242 | L | 85.3 | Confident | 72.9 | Confident | 175 Ų | 175 | 153.5 Ų | 153.5 | 92% | 0.916 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.2 | -30 | -173.8 | -63.1 | 173.5 | 0 | 0 | 0 | 113.8 | ||
| 243 | F | 84.3 | Confident | 74.7 | Confident | 205 Ų | 205 | 152.1 Ų | 152.1 | 90% | 0.899 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | -0.5 | -179.5 | -58.9 | -79.2 | 0 | 0 | 0 | 114.3 | G241 | G241-F243 PolarHBondContact O-N 2.99Š|
| 244 | K | 84.7 | Confident | 76.3 | Confident | 168 Ų | 168 | 153.6 Ų | 153.6 | 73% | 0.73 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -98.6 | 98.7 | 178.5 | -66.7 | -174.4 | 178.5 | -176.7 | 0 | 109.7 | G241 | G241-K244 PolarHBondContact O-N 3.46Š|
| 245 | G | 84.5 | Confident | 77 | Confident | 67 Ų | 67 | 152.9 Ų | 152.9 | 69% | 0.691 | 76% | 0.759 | S | S | * | * | S | Bend | trans | 179.6 | -179.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113.6 | R247 | G245-R247 PolarHBondContact O-N 2.9Š|
| 246 | K | 88.6 | Confident | 77.4 | Confident | 224 Ų | 224 | 154.5 Ų | 154.5 | 97% | 0.974 | 76% | 0.759 | S | S | * | * | trans | -65.3 | 123.2 | 170.5 | -63.6 | -178.5 | -179.1 | -177.4 | 0 | 108 | ||||
| 247 | R | 87.1 | Confident | 77.8 | Confident | 166 Ų | 166 | 149.3 Ų | 149.3 | 63% | 0.626 | 75% | 0.754 | S | S | * | * | trans | -104.6 | 164.2 | 175.9 | 68 | -177.9 | -177.8 | 108 | 9.4 | 110.6 | G245 G249 I253 | G245-R247 PolarHBondContact O-N 2.9Å; R247-G249 PolarHBondContact O-N 3.39Å; R247-I253 VanDerWaalsContact NH2-CD1 3.25Å; R247-I253 VanDerWaalsContact NH2-CG1 3.35Å | ||
| 248 | L | 87.8 | Confident | 77.8 | Confident | 143 Ų | 143 | 147.5 Ų | 147.5 | 75% | 0.749 | 75% | 0.754 | S | S | * | * | trans | -66 | 117.3 | 170 | -61 | 176.6 | 0 | 0 | 0 | 108.8 | I250 | L248-I250 VanDerWaalsContact C-N 3.26Å; L248-I250 HydrophobicContact CB-CD1 4.2Å; L248-I250 HydrophobicContact CB-CG1 4.39Å; L248-I250 HydrophobicContact CD1-CD1 4.47Å; L248-I250 PolarHBondContact O-N 3.48Å | ||
| 249 | G | 86.1 | Confident | 77.9 | Confident | 65 Ų | 65 | 147.9 Ų | 147.9 | 67% | 0.67 | 76% | 0.756 | S | S | * | * | trans | -89.9 | 35 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | R247 | R247-G249 PolarHBondContact O-N 3.39Š| ||
| 250 | I | 92.1 | Very high | 77.9 | Confident | 125 Ų | 125 | 140.3 Ų | 140.3 | 64% | 0.641 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -79.4 | -35.6 | -176.6 | -57.9 | 166.1 | 0 | 0 | 0 | 110.7 | L248 | L248-I250 VanDerWaalsContact C-N 3.26Å; L248-I250 HydrophobicContact CB-CD1 4.2Å; L248-I250 HydrophobicContact CB-CG1 4.39Å; L248-I250 HydrophobicContact CD1-CD1 4.47Å; L248-I250 PolarHBondContact O-N 3.48Å |
| 251 | F | 85.9 | Confident | 77.7 | Confident | 165 Ų | 165 | 136.5 Ų | 136.5 | 72% | 0.724 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -107.5 | 120.3 | 179.6 | -61 | -81.5 | 0 | 0 | 0 | 110.3 | ||
| 252 | D | 86 | Confident | 76.9 | Confident | 121 Ų | 121 | 143.2 Ų | 143.2 | 65% | 0.647 | 76% | 0.761 | S | S | * | * | trans | -66.3 | 143.1 | 170.3 | -72.6 | -25.6 | 0 | 0 | 0 | 109.9 | K254 | D252-K254 HydrophobicContact CB-CG 4.23Å; D252-K254 PolarHBondContact O-N 3.26Å | ||
| 253 | I | 81.6 | Confident | 75.8 | Confident | 144 Ų | 144 | 141 Ų | 141 | 74% | 0.738 | 76% | 0.755 | S | S | * | * | trans | -77.5 | 40.9 | 175.2 | -43.8 | 158.3 | 0 | 0 | 0 | 109.4 | R247 A255 | R247-I253 VanDerWaalsContact NH2-CD1 3.25Å; R247-I253 VanDerWaalsContact NH2-CG1 3.35Å; I253-A255 PolarHBondContact O-N 2.85Å | ||
| 254 | K | 74.6 | Confident | 74.6 | Confident | 155 Ų | 155 | 139.8 Ų | 139.8 | 67% | 0.674 | 75% | 0.752 | S | S | * | * | trans | -62.4 | 118.6 | 169.9 | -79.4 | -179.2 | -179.8 | 175.8 | 0 | 105.8 | D252 F256 | D252-K254 HydrophobicContact CB-CG 4.23Å; D252-K254 PolarHBondContact O-N 3.26Å; K254-F256 VanDerWaalsContact C-N 3.33Å; K254-F256 PolarHBondContact O-N 3.46Å | ||
| 255 | A | 64.5 | Low | 74.2 | Confident | 95 Ų | 95 | 135.2 Ų | 135.2 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | trans | -55.6 | 107.1 | 166.6 | 0 | 0 | 0 | 0 | 0 | 105.4 | I253 A257 | I253-A255 PolarHBondContact O-N 2.85Å; A255-A257 VanDerWaalsContact C-N 3.26Å; A255-A257 PolarHBondContact O-N 3.29Å | ||
| 256 | F | 58.9 | Low | 74.1 | Confident | 184 Ų | 184 | 137.1 Ų | 137.1 | 81% | 0.807 | 75% | 0.748 | S | S | * | * | trans | -55.4 | 104.1 | 164.5 | -69.1 | -88 | 0 | 0 | 0 | 104.5 | K254 D258 | K254-F256 VanDerWaalsContact C-N 3.33Å; K254-F256 PolarHBondContact O-N 3.46Å; F256-D258 PolarHBondContact O-N 2.86Å | ||
| 257 | A | 61.5 | Low | 74 | Confident | 95 Ų | 95 | 130.2 Ų | 130.2 | 79% | 0.785 | 73% | 0.727 | S | S | * | * | trans | -66 | 113.9 | 161.2 | 0 | 0 | 0 | 0 | 0 | 103.4 | A255 E259 | A255-A257 VanDerWaalsContact C-N 3.26Å; A255-A257 PolarHBondContact O-N 3.29Å; A257-E259 PolarHBondContact O-N 2.96Å | ||
| 258 | D | 61.1 | Low | 74.2 | Confident | 158 Ų | 158 | 124.5 Ų | 124.5 | 85% | 0.845 | 71% | 0.712 | S | S | * | * | trans | -58.2 | 88.1 | 175.3 | -70.2 | -42.1 | 0 | 0 | 0 | 108.1 | F256 A260 | F256-D258 PolarHBondContact O-N 2.86Å; D258-A260 PolarHBondContact O-N 3.29Å | ||
| 259 | E | 64.4 | Low | 74.5 | Confident | 182 Ų | 182 | 123.7 Ų | 123.7 | 85% | 0.85 | 71% | 0.708 | S | S | * | * | trans | -65.6 | 115.5 | 155.6 | -171.1 | 163.5 | -163.6 | 0 | 0 | 104.7 | A257 P261 | A257-E259 PolarHBondContact O-N 2.96Å; E259-P261 VanDerWaalsContact O-N 3.09Å | ||
| 260 | A | 63.8 | Low | 74.9 | Confident | 85 Ų | 85 | 131.1 Ų | 131.1 | 70% | 0.702 | 72% | 0.716 | S | S | * | * | trans | -52.1 | 120.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | D258 E262 | D258-A260 PolarHBondContact O-N 3.29Å; A260-E262 PolarHBondContact O-N 2.87Å | ||
| 261 | P | 69.9 | Low | 75 | Confident | 108 Ų | 108 | 130.4 Ų | 130.4 | 70% | 0.701 | 71% | 0.71 | S | S | * | * | trans | -59.5 | 141.1 | -179.4 | 24.5 | -32.8 | 0 | 0 | 0 | 108.9 | E259 T263 | E259-P261 VanDerWaalsContact O-N 3.09Å; P261-T263 PolarHBondContact O-N 3.38Å | ||
| 262 | E | 63.2 | Low | 75.4 | Confident | 177 Ų | 177 | 127 Ų | 127 | 83% | 0.827 | 70% | 0.698 | S | S | * | * | trans | -54.1 | 99 | -179.3 | -63.6 | -178.3 | 174 | 0 | 0 | 110.5 | A260 E264 | A260-E262 PolarHBondContact O-N 2.87Å; E262-E264 PolarHBondContact O-N 3.29Å; E262-E264 VanDerWaalsContact O-N 3.15Å | ||
| 263 | T | 61.1 | Low | 75.8 | Confident | 129 Ų | 129 | 125.2 Ų | 125.2 | 79% | 0.791 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | 3.1 | -178.7 | 27.7 | 0 | 0 | 0 | 0 | 114.3 | P261 | P261-T263 PolarHBondContact O-N 3.38Š|
| 264 | E | 60 | Low | 76.4 | Confident | 179 Ų | 179 | 124.1 Ų | 124.1 | 84% | 0.836 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | -17.6 | -171.5 | -59.1 | -66.5 | 151.8 | 0 | 0 | 113.2 | E262 | E262-E264 PolarHBondContact O-N 3.29Å; E262-E264 VanDerWaalsContact O-N 3.15Å |
| 265 | A | 76.3 | Confident | 77.4 | Confident | 72 Ų | 72 | 119.3 Ų | 119.3 | 60% | 0.595 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -89.6 | 129.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 266 | S | 80.8 | Confident | 78.8 | Confident | 107 Ų | 107 | 120.7 Ų | 120.7 | 75% | 0.748 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 138.5 | 167.2 | 48.1 | 0 | 0 | 0 | 0 | 109.4 | S268 | S266-S268 PolarHBondContact O-N 3.17Š|
| 267 | P | 86.4 | Confident | 80.4 | Confident | 79 Ų | 79 | 117.7 Ų | 117.7 | 51% | 0.513 | 64% | 0.642 | S | S | . | * | P | Polyproline II helix | trans | -52.9 | 139 | -178.1 | -27.7 | 34.3 | 0 | 0 | 0 | 111.6 | E271 I272 | P267-E271 WeakPolarHBondContact CA-OE2 3.39Å; P267-E271 HydrophobicContact CB-CB 4.34Å; P267-I272 HydrophobicContact CB-CG1 4.07Å |
| 268 | S | 91.8 | Very high | 81.9 | Confident | 47 Ų | 47 | 117.5 Ų | 117.5 | 33% | 0.329 | 63% | 0.627 | S | S | . | * | P | Polyproline II helix | trans | -64.8 | 154.2 | 177.5 | 71.6 | 0 | 0 | 0 | 0 | 110.8 | S266 W270 E271 I272 | S266-S268 PolarHBondContact O-N 3.17Å; S268-W270 PolarHBondContact O-N 3.42Å; S268-W270 VanDerWaalsContact O-N 3.14Å; S268-E271 WeakPolarHBondContact CB-OE1 3.45Å; S268-E271 PolarHBondContact N-OE2 3.28Å; S268-E271 VanDerWaalsContact N-OE2 3.16Å; S268-E271 WeakPolarHBondContact O-CB 3.22Å; S268-E271 PolarHBondContact O-N 3.25Å; S268-E271 WeakPolarHBondContact OG-CG 3.39Å; S268-E271 PolarHBondContact OG-N 3.06Å; S268-E271 PolarHBondContact OG-OE1 3.15Å; S268-I272 WeakPolarHBondContact O-CG1 3.41Å; S268-I272 PolarHBondContact O-N 2.82Å |
| 269 | L | 94.8 | Very high | 83.4 | Confident | 125 Ų | 125 | 112.3 Ų | 112.3 | 65% | 0.654 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -54.5 | -35.8 | 176.5 | 178.6 | 62.9 | 0 | 0 | 0 | 112 | I272 E273 | L269-I272 PolarHBondContact O-N 2.84Å; L269-E273 HydrophobicContact CD1-CG 4.45Å; L269-E273 PolarHBondContact O-N 3.26Å |
| 270 | W | 94.4 | Very high | 84.6 | Confident | 221 Ų | 221 | 107 Ų | 107 | 84% | 0.837 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65 | -40.1 | 176.4 | -69.4 | 109.8 | 0 | 0 | 0 | 112.4 | S268 F274 | S268-W270 PolarHBondContact O-N 3.42Å; S268-W270 VanDerWaalsContact O-N 3.14Å; W270-F274 WeakPolarHBondContact O-CB 3.5Å; W270-F274 PolarHBondContact O-N 3.27Å |
| 271 | E | 93.6 | Very high | 86 | Confident | 111 Ų | 111 | 108.7 Ų | 108.7 | 52% | 0.519 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -65.9 | -40 | 174.7 | -74 | 151.2 | -134.6 | 0 | 0 | 111.8 | P267 S268 F274 A275 | P267-E271 WeakPolarHBondContact CA-OE2 3.39Å; P267-E271 HydrophobicContact CB-CB 4.34Å; S268-E271 WeakPolarHBondContact CB-OE1 3.45Å; S268-E271 PolarHBondContact N-OE2 3.28Å; S268-E271 VanDerWaalsContact N-OE2 3.16Å; S268-E271 WeakPolarHBondContact O-CB 3.22Å; S268-E271 PolarHBondContact O-N 3.25Å; S268-E271 WeakPolarHBondContact OG-CG 3.39Å; S268-E271 PolarHBondContact OG-N 3.06Å; S268-E271 PolarHBondContact OG-OE1 3.15Å; E271-F274 PolarHBondContact O-N 2.85Å; E271-A275 VanDerWaalsContact O-CB 3.25Å; E271-A275 WeakPolarHBondContact O-CB 3.05Å; E271-A275 PolarHBondContact O-N 2.91Å |
| 272 | I | 93.9 | Very high | 86.8 | Confident | 93 Ų | 93 | 109.7 Ų | 109.7 | 48% | 0.477 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64.2 | -49.9 | 178.1 | -63 | 169 | 0 | 0 | 0 | 110.7 | P267 S268 L269 F274 A275 K276 | P267-I272 HydrophobicContact CB-CG1 4.07Å; S268-I272 WeakPolarHBondContact O-CG1 3.41Å; S268-I272 PolarHBondContact O-N 2.82Å; L269-I272 PolarHBondContact O-N 2.84Å; I272-F274 VanDerWaalsContact C-N 3.32Å; I272-F274 PolarHBondContact O-N 2.87Å; I272-A275 PolarHBondContact O-N 3Å; I272-K276 PolarHBondContact O-N 2.65Å |
| 273 | E | 94.9 | Very high | 87.8 | Confident | 84 Ų | 84 | 107.5 Ų | 107.5 | 39% | 0.393 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.6 | -37.6 | 177.5 | -77.5 | -63.8 | 148 | 0 | 0 | 111.8 | L269 K276 Q277 | L269-E273 HydrophobicContact CD1-CG 4.45Å; L269-E273 PolarHBondContact O-N 3.26Å; E273-K276 WeakPolarHBondContact O-CB 3.46Å; E273-K276 PolarHBondContact O-N 3.48Å; E273-Q277 WeakPolarHBondContact O-CG 3.38Å; E273-Q277 PolarHBondContact O-N 3.41Å |
| 274 | F | 95.4 | Very high | 88.9 | Confident | 121 Ų | 121 | 108.6 Ų | 108.6 | 53% | 0.531 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.6 | -42.8 | 174.9 | -174.6 | -107.7 | 0 | 0 | 0 | 111.9 | W270 E271 I272 K276 Q277 L278 | W270-F274 WeakPolarHBondContact O-CB 3.5Å; W270-F274 PolarHBondContact O-N 3.27Å; E271-F274 PolarHBondContact O-N 2.85Å; I272-F274 VanDerWaalsContact C-N 3.32Å; I272-F274 PolarHBondContact O-N 2.87Å; F274-K276 VanDerWaalsContact C-N 3.29Å; F274-K276 PolarHBondContact O-N 3.28Å; F274-Q277 PolarHBondContact O-N 3.04Å; F274-L278 HydrophobicContact CD1-CD1 3.96Å; F274-L278 HydrophobicContact CD1-CG 4.36Å; F274-L278 HydrophobicContact CE1-CD1 3.61Å; F274-L278 HydrophobicContact CE1-CD2 4.44Å; F274-L278 HydrophobicContact CE1-CG 4.06Å; F274-L278 HydrophobicContact CZ-CD1 4.26Å; F274-L278 HydrophobicContact CZ-CD2 4.27Å; F274-L278 HydrophobicContact CZ-CG 4.29Å; F274-L278 WeakPolarHBondContact O-CG 3.44Å; F274-L278 PolarHBondContact O-N 2.66Å |
| 275 | A | 93.9 | Very high | 90.1 | Very high | 53 Ų | 53 | 105.9 Ų | 105.9 | 44% | 0.438 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.7 | -37.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | E271 I272 L278 A279 | E271-A275 VanDerWaalsContact O-CB 3.25Å; E271-A275 WeakPolarHBondContact O-CB 3.05Å; E271-A275 PolarHBondContact O-N 2.91Å; I272-A275 PolarHBondContact O-N 3Å; A275-L278 PolarHBondContact O-N 3.41Å; A275-A279 PolarHBondContact O-N 2.84Å |
| 276 | K | 93.8 | Very high | 90.5 | Very high | 125 Ų | 125 | 106 Ų | 106 | 54% | 0.543 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.4 | -44.8 | 173.1 | -176.5 | -179.2 | 174.6 | -175.4 | 0 | 111.9 | I272 E273 F274 L278 A279 T280 | I272-K276 PolarHBondContact O-N 2.65Å; E273-K276 WeakPolarHBondContact O-CB 3.46Å; E273-K276 PolarHBondContact O-N 3.48Å; F274-K276 VanDerWaalsContact C-N 3.29Å; F274-K276 PolarHBondContact O-N 3.28Å; K276-L278 VanDerWaalsContact C-N 3.31Å; K276-L278 PolarHBondContact O-N 2.88Å; K276-A279 WeakPolarHBondContact O-CB 3.18Å; K276-A279 PolarHBondContact O-N 2.67Å; K276-A279 VanDerWaalsContact O-N 3.16Å; K276-T280 PolarHBondContact O-N 3.26Å; K276-T280 PolarHBondContact O-OG1 3.15Å |
| 277 | Q | 94.3 | Very high | 90.8 | Very high | 121 Ų | 121 | 104.4 Ų | 104.4 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -60.6 | -40.8 | 174.9 | -70.1 | 177 | 11.5 | 0 | 0 | 111.9 | E273 F274 T280 V281 | E273-Q277 WeakPolarHBondContact O-CG 3.38Å; E273-Q277 PolarHBondContact O-N 3.41Å; F274-Q277 PolarHBondContact O-N 3.04Å; Q277-T280 PolarHBondContact O-N 3.48Å; Q277-V281 WeakPolarHBondContact O-CG2 3.29Å; Q277-V281 PolarHBondContact O-N 2.97Å; Q277-V281 VanDerWaalsContact O-N 3.15Å |
| 278 | L | 92.4 | Very high | 91.1 | Very high | 90 Ų | 90 | 105.1 Ų | 105.1 | 47% | 0.471 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.4 | -39.2 | 174.1 | -70.3 | 178 | 0 | 0 | 0 | 112.4 | F274 A275 K276 T280 V281 N282 | F274-L278 HydrophobicContact CD1-CD1 3.96Å; F274-L278 HydrophobicContact CD1-CG 4.36Å; F274-L278 HydrophobicContact CE1-CD1 3.61Å; F274-L278 HydrophobicContact CE1-CD2 4.44Å; F274-L278 HydrophobicContact CE1-CG 4.06Å; F274-L278 HydrophobicContact CZ-CD1 4.26Å; F274-L278 HydrophobicContact CZ-CD2 4.27Å; F274-L278 HydrophobicContact CZ-CG 4.29Å; F274-L278 WeakPolarHBondContact O-CG 3.44Å; F274-L278 PolarHBondContact O-N 2.66Å; A275-L278 PolarHBondContact O-N 3.41Å; K276-L278 VanDerWaalsContact C-N 3.31Å; K276-L278 PolarHBondContact O-N 2.88Å; L278-T280 VanDerWaalsContact C-N 3.34Å; L278-V281 PolarHBondContact O-N 3.22Å; L278-N282 PolarHBondContact O-N 3.06Å |
| 279 | A | 91.8 | Very high | 91.2 | Very high | 50 Ų | 50 | 104.6 Ų | 104.6 | 41% | 0.413 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62 | -43 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | A275 K276 V281 N282 E283 | A275-A279 PolarHBondContact O-N 2.84Å; K276-A279 WeakPolarHBondContact O-CB 3.18Å; K276-A279 PolarHBondContact O-N 2.67Å; K276-A279 VanDerWaalsContact O-N 3.16Å; A279-V281 VanDerWaalsContact C-N 3.32Å; A279-V281 PolarHBondContact O-N 3.07Å; A279-N282 CarbonylContact O-C 3.47Å; A279-N282 WeakPolarHBondContact O-CA 3.3Å; A279-N282 WeakPolarHBondContact O-CB 3.4Å; A279-N282 PolarHBondContact O-N 3.16Å; A279-E283 PolarHBondContact O-N 3.4Å |
| 280 | T | 90.6 | Very high | 91.2 | Very high | 71 Ų | 71 | 105.3 Ų | 105.3 | 44% | 0.436 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.9 | -31 | 178.1 | -55.9 | 0 | 0 | 0 | 0 | 113.7 | K276 Q277 L278 N282 E283 | K276-T280 PolarHBondContact O-N 3.26Å; K276-T280 PolarHBondContact O-OG1 3.15Å; Q277-T280 PolarHBondContact O-N 3.48Å; L278-T280 VanDerWaalsContact C-N 3.34Å; T280-N282 PolarHBondContact O-N 2.71Å; T280-E283 WeakPolarHBondContact CA-OE1 3.17Å; T280-E283 WeakPolarHBondContact O-CB 3.31Å; T280-E283 PolarHBondContact O-N 2.8Å; T280-E283 PolarHBondContact OG1-OE1 3.43Å |
| 281 | V | 91.9 | Very high | 91.2 | Very high | 119 Ų | 119 | 98.4 Ų | 98.4 | 72% | 0.721 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.8 | -29.3 | 171.8 | 174.2 | 0 | 0 | 0 | 0 | 111.7 | Q277 L278 A279 | Q277-V281 WeakPolarHBondContact O-CG2 3.29Å; Q277-V281 PolarHBondContact O-N 2.97Å; Q277-V281 VanDerWaalsContact O-N 3.15Å; L278-V281 PolarHBondContact O-N 3.22Å; A279-V281 VanDerWaalsContact C-N 3.32Å; A279-V281 PolarHBondContact O-N 3.07Å |
| 282 | N | 87.4 | Confident | 91.1 | Very high | 129 Ų | 129 | 97 Ų | 97 | 69% | 0.69 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -92.1 | -6.3 | 177.2 | -65.5 | -30.9 | 0 | 0 | 0 | 113.4 | L278 A279 T280 Q284 | L278-N282 PolarHBondContact O-N 3.06Å; A279-N282 CarbonylContact O-C 3.47Å; A279-N282 WeakPolarHBondContact O-CA 3.3Å; A279-N282 WeakPolarHBondContact O-CB 3.4Å; A279-N282 PolarHBondContact O-N 3.16Å; T280-N282 PolarHBondContact O-N 2.71Å; N282-Q284 PolarHBondContact O-N 3.41Å; N282-Q284 VanDerWaalsContact O-N 3.14Å |
| 283 | E | 84.6 | Confident | 91.1 | Very high | 132 Ų | 132 | 96.8 Ų | 96.8 | 62% | 0.617 | 53% | 0.53 | S | S | * | . | trans | -67.6 | 111.6 | 176.7 | -76.9 | 169.8 | -144.9 | 0 | 0 | 109.4 | A279 T280 | A279-E283 PolarHBondContact O-N 3.4Å; T280-E283 WeakPolarHBondContact CA-OE1 3.17Å; T280-E283 WeakPolarHBondContact O-CB 3.31Å; T280-E283 PolarHBondContact O-N 2.8Å; T280-E283 PolarHBondContact OG1-OE1 3.43Å | ||
| 284 | Q | 83.8 | Confident | 91 | Very high | 152 Ų | 152 | 97.2 Ų | 97.2 | 71% | 0.71 | 53% | 0.533 | S | S | * | . | trans | -110.8 | 146.2 | 170.6 | -66.2 | -174 | -3.3 | 0 | 0 | 108.7 | N282 L286 | N282-Q284 PolarHBondContact O-N 3.41Å; N282-Q284 VanDerWaalsContact O-N 3.14Å; Q284-L286 PolarHBondContact O-N 2.91Å | ||
| 285 | P | 85.4 | Confident | 90.9 | Very high | 121 Ų | 121 | 95.1 Ų | 95.1 | 79% | 0.786 | 53% | 0.525 | S | S | * | . | trans | -60 | 138.7 | 170.5 | 27.5 | -33.7 | 0 | 0 | 0 | 109 | G287 | P285-G287 PolarHBondContact O-N 3.16Š| ||
| 286 | L | 84.8 | Confident | 91 | Very high | 76 Ų | 76 | 97.6 Ų | 97.6 | 40% | 0.398 | 52% | 0.523 | S | S | . | . | trans | -57.5 | 114.7 | -179.4 | -59.3 | 172.7 | 0 | 0 | 0 | 109.7 | Q284 E291 E292 | Q284-L286 PolarHBondContact O-N 2.91Å; L286-E291 WeakPolarHBondContact CA-OE2 3.4Å; L286-E291 HydrophobicContact CD2-CB 4.03Å; L286-E291 HydrophobicContact CD2-CG 3.58Å; L286-E292 HydrophobicContact CD1-CB 3.92Å; L286-E292 HydrophobicContact CD1-CG 4.15Å | ||
| 287 | G | 86.1 | Confident | 91.1 | Very high | 72 Ų | 72 | 93.8 Ų | 93.8 | 74% | 0.742 | 51% | 0.51 | S | S | * | . | trans | -83.1 | -21 | -175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | P285 E291 | P285-G287 PolarHBondContact O-N 3.16Å; G287-E291 PolarHBondContact N-OE2 3.14Å | ||
| 288 | N | 94.5 | Very high | 91 | Very high | 95 Ų | 95 | 96.4 Ų | 96.4 | 51% | 0.508 | 52% | 0.52 | S | S | . | . | S | Bend | trans | -145.6 | 151.9 | -171.1 | -166.9 | -1.8 | 0 | 0 | 0 | 111.7 | F290 E291 E292 | N288-F290 PolarHBondContact O-N 3.37Å; N288-E291 VanDerWaalsContact O-CB 3.3Å; N288-E291 WeakPolarHBondContact O-CB 3.48Å; N288-E291 PolarHBondContact O-N 3.19Å; N288-E292 PolarHBondContact O-N 3.33Å |
| 289 | G | 93.9 | Very high | 91 | Very high | 36 Ų | 36 | 96.4 Ų | 96.4 | 37% | 0.371 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.6 | -27.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | E291 E292 M293 | G289-E291 VanDerWaalsContact C-N 3.3Å; G289-E291 PolarHBondContact O-N 3.04Å; G289-E292 PolarHBondContact O-N 2.97Å; G289-M293 WeakPolarHBondContact O-CG 3.35Å; G289-M293 PolarHBondContact O-N 3.45Å |
| 290 | F | 94.3 | Very high | 91.1 | Very high | 139 Ų | 139 | 97 Ų | 97 | 61% | 0.61 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.6 | -34.8 | 171.5 | -72.2 | -69.9 | 0 | 0 | 0 | 112.6 | N288 M293 I294 | N288-F290 PolarHBondContact O-N 3.37Å; F290-M293 HydrophobicContact CD1-SD 4.45Å; F290-M293 PolarHBondContact O-N 3.49Å; F290-I294 WeakPolarHBondContact O-CB 3.33Å; F290-I294 WeakPolarHBondContact O-CD1 3.45Å; F290-I294 WeakPolarHBondContact O-CG1 3.5Å; F290-I294 PolarHBondContact O-N 3.34Å |
| 291 | E | 93.5 | Very high | 91.3 | Very high | 77 Ų | 77 | 100.4 Ų | 100.4 | 36% | 0.36 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -69.4 | -39.3 | 178.1 | -159.6 | -179.6 | 178 | 0 | 0 | 110.8 | L286 G287 N288 G289 I294 Q295 | L286-E291 WeakPolarHBondContact CA-OE2 3.4Å; L286-E291 HydrophobicContact CD2-CB 4.03Å; L286-E291 HydrophobicContact CD2-CG 3.58Å; G287-E291 PolarHBondContact N-OE2 3.14Å; N288-E291 VanDerWaalsContact O-CB 3.3Å; N288-E291 WeakPolarHBondContact O-CB 3.48Å; N288-E291 PolarHBondContact O-N 3.19Å; G289-E291 VanDerWaalsContact C-N 3.3Å; G289-E291 PolarHBondContact O-N 3.04Å; E291-I294 PolarHBondContact O-N 3.35Å; E291-Q295 WeakPolarHBondContact O-CB 3.3Å; E291-Q295 PolarHBondContact O-N 3.03Å |
| 292 | E | 91.9 | Very high | 91.3 | Very high | 81 Ų | 81 | 97.2 Ų | 97.2 | 38% | 0.379 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.4 | -45.9 | 171.3 | -173 | 175.8 | -157.9 | 0 | 0 | 111.6 | L286 N288 G289 I294 Q295 W296 | L286-E292 HydrophobicContact CD1-CB 3.92Å; L286-E292 HydrophobicContact CD1-CG 4.15Å; N288-E292 PolarHBondContact O-N 3.33Å; G289-E292 PolarHBondContact O-N 2.97Å; E292-I294 PolarHBondContact O-N 3Å; E292-Q295 PolarHBondContact O-N 3.34Å; E292-W296 HydrophobicContact CG-CD2 4.24Å; E292-W296 HydrophobicContact CG-CH2 4.26Å; E292-W296 HydrophobicContact CG-CZ2 3.74Å; E292-W296 PolarHBondContact O-N 3.37Å; E292-W296 WeakPolarHBondContact OE1-CZ2 3.47Å |
| 293 | M | 93.7 | Very high | 91.6 | Very high | 89 Ų | 89 | 100 Ų | 100 | 44% | 0.438 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 174.8 | -70.3 | 175.5 | 65.1 | 0 | 0 | 111.9 | G289 F290 Q295 W296 T297 L302 | G289-M293 WeakPolarHBondContact O-CG 3.35Å; G289-M293 PolarHBondContact O-N 3.45Å; F290-M293 HydrophobicContact CD1-SD 4.45Å; F290-M293 PolarHBondContact O-N 3.49Å; M293-Q295 VanDerWaalsContact C-N 3.33Å; M293-Q295 PolarHBondContact O-N 3.34Å; M293-W296 PolarHBondContact O-N 3.43Å; M293-T297 PolarHBondContact O-N 3.17Å; M293-T297 PolarHBondContact O-OG1 3.04Å; M293-T297 VanDerWaalsContact O-OG1 3.05Å; M293-L302 HydrophobicContact CB-CD2 4.35Å; M293-L302 HydrophobicContact CE-CD2 4.17Å |
| 294 | I | 93.8 | Very high | 92 | Very high | 92 Ų | 92 | 100.3 Ų | 100.3 | 47% | 0.472 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.3 | -42.7 | 177 | -70.3 | 161.8 | 0 | 0 | 0 | 110.5 | F290 E291 E292 T297 K298 | F290-I294 WeakPolarHBondContact O-CB 3.33Å; F290-I294 WeakPolarHBondContact O-CD1 3.45Å; F290-I294 WeakPolarHBondContact O-CG1 3.5Å; F290-I294 PolarHBondContact O-N 3.34Å; E291-I294 PolarHBondContact O-N 3.35Å; E292-I294 PolarHBondContact O-N 3Å; I294-T297 PolarHBondContact O-N 3.08Å; I294-K298 HydrophobicContact CG2-CD 4.21Å; I294-K298 WeakPolarHBondContact O-CG 3.37Å; I294-K298 PolarHBondContact O-N 2.85Å |
| 295 | Q | 93.4 | Very high | 92.4 | Very high | 77 Ų | 77 | 100.1 Ų | 100.1 | 36% | 0.36 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -46.2 | 175.9 | -179.2 | 172.4 | 4.1 | 0 | 0 | 111 | E291 E292 M293 T297 K298 E299 | E291-Q295 WeakPolarHBondContact O-CB 3.3Å; E291-Q295 PolarHBondContact O-N 3.03Å; E292-Q295 PolarHBondContact O-N 3.34Å; M293-Q295 VanDerWaalsContact C-N 3.33Å; M293-Q295 PolarHBondContact O-N 3.34Å; Q295-T297 VanDerWaalsContact C-N 3.3Å; Q295-T297 PolarHBondContact O-N 3.12Å; Q295-K298 PolarHBondContact O-N 3.34Å; Q295-E299 HydrophobicContact CG-CG 4.34Å; Q295-E299 VanDerWaalsContact CG-OE1 3.27Å; Q295-E299 WeakPolarHBondContact CG-OE1 3.11Å; Q295-E299 PolarHBondContact NE2-OE1 2.8Å; Q295-E299 WeakPolarHBondContact O-CB 3.3Å; Q295-E299 VanDerWaalsContact O-CG 3.3Å; Q295-E299 WeakPolarHBondContact O-CG 3.27Å; Q295-E299 PolarHBondContact O-N 3.14Å |
| 296 | W | 95 | Very high | 92.9 | Very high | 105 Ų | 105 | 100.1 Ų | 100.1 | 40% | 0.398 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -34 | 176.4 | -70 | -3.6 | 0 | 0 | 0 | 113.2 | E292 M293 G300 K301 L302 | E292-W296 HydrophobicContact CG-CD2 4.24Å; E292-W296 HydrophobicContact CG-CH2 4.26Å; E292-W296 HydrophobicContact CG-CZ2 3.74Å; E292-W296 PolarHBondContact O-N 3.37Å; E292-W296 WeakPolarHBondContact OE1-CZ2 3.47Å; M293-W296 PolarHBondContact O-N 3.43Å; W296-G300 PolarHBondContact O-N 3.4Å; W296-G300 VanDerWaalsContact O-N 3.16Å; W296-K301 HydrophobicContact CB-CB 4.12Å; W296-K301 HydrophobicContact CG-CB 4.49Å; W296-K301 HydrophobicContact CG-CD 4.38Å; W296-K301 PolarHBondContact O-N 2.9Å; W296-L302 HydrophobicContact CB-CB 4.09Å; W296-L302 PolarHBondContact O-N 3.3Å |
| 297 | T | 95.4 | Very high | 93.3 | Very high | 45 Ų | 45 | 99.9 Ų | 99.9 | 28% | 0.276 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.4 | -44.8 | 172 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | M293 I294 Q295 E299 G300 E304 | M293-T297 PolarHBondContact O-N 3.17Å; M293-T297 PolarHBondContact O-OG1 3.04Å; M293-T297 VanDerWaalsContact O-OG1 3.05Å; I294-T297 PolarHBondContact O-N 3.08Å; Q295-T297 VanDerWaalsContact C-N 3.3Å; Q295-T297 PolarHBondContact O-N 3.12Å; T297-E299 VanDerWaalsContact C-N 3.28Å; T297-E299 PolarHBondContact O-N 3.03Å; T297-G300 PolarHBondContact O-N 2.92Å; T297-E304 HydrophobicContact CG2-CG 4.3Å |
| 298 | K | 91.8 | Very high | 93.6 | Very high | 176 Ų | 176 | 100.9 Ų | 100.9 | 77% | 0.765 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.3 | -35.2 | 175.7 | -73 | 174.4 | 180 | 177.5 | 0 | 112.7 | I294 Q295 G300 | I294-K298 HydrophobicContact CG2-CD 4.21Å; I294-K298 WeakPolarHBondContact O-CG 3.37Å; I294-K298 PolarHBondContact O-N 2.85Å; Q295-K298 PolarHBondContact O-N 3.34Å; K298-G300 VanDerWaalsContact C-N 3.25Å; K298-G300 PolarHBondContact O-N 2.98Å |
| 299 | E | 93.9 | Very high | 93.6 | Very high | 91 Ų | 91 | 104 Ų | 104 | 43% | 0.425 | 52% | 0.521 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | -7 | 175.5 | -70.1 | 174.8 | -173.7 | 0 | 0 | 113.1 | Q295 T297 K301 | Q295-E299 HydrophobicContact CG-CG 4.34Å; Q295-E299 VanDerWaalsContact CG-OE1 3.27Å; Q295-E299 WeakPolarHBondContact CG-OE1 3.11Å; Q295-E299 PolarHBondContact NE2-OE1 2.8Å; Q295-E299 WeakPolarHBondContact O-CB 3.3Å; Q295-E299 VanDerWaalsContact O-CG 3.3Å; Q295-E299 WeakPolarHBondContact O-CG 3.27Å; Q295-E299 PolarHBondContact O-N 3.14Å; T297-E299 VanDerWaalsContact C-N 3.28Å; T297-E299 PolarHBondContact O-N 3.03Å; E299-K301 VanDerWaalsContact C-N 3.29Å; E299-K301 HydrophobicContact CB-CD 4.38Å; E299-K301 HydrophobicContact CB-CG 4.27Å; E299-K301 PolarHBondContact O-N 2.95Å; E299-K301 WeakPolarHBondContact OE2-CD 3.38Å; E299-K301 WeakPolarHBondContact OE2-CE 3.1Å; E299-K301 IonicContact OE2-NZ 3.37Å; E299-K301 PolarHBondContact OE2-NZ 3.19Å |
| 300 | G | 92.8 | Very high | 93.4 | Very high | 61 Ų | 61 | 108.8 Ų | 108.8 | 63% | 0.629 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.8 | 15.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | W296 T297 K298 | W296-G300 PolarHBondContact O-N 3.4Å; W296-G300 VanDerWaalsContact O-N 3.16Å; T297-G300 PolarHBondContact O-N 2.92Å; K298-G300 VanDerWaalsContact C-N 3.25Å; K298-G300 PolarHBondContact O-N 2.98Å |
| 301 | K | 94.3 | Very high | 93.3 | Very high | 143 Ų | 143 | 105.3 Ų | 105.3 | 62% | 0.622 | 53% | 0.532 | S | S | * | . | trans | -79.2 | -38.9 | 176.3 | -68.8 | 175.2 | 177.7 | 163.4 | 0 | 112.2 | W296 E299 | W296-K301 HydrophobicContact CB-CB 4.12Å; W296-K301 HydrophobicContact CG-CB 4.49Å; W296-K301 HydrophobicContact CG-CD 4.38Å; W296-K301 PolarHBondContact O-N 2.9Å; E299-K301 VanDerWaalsContact C-N 3.29Å; E299-K301 HydrophobicContact CB-CD 4.38Å; E299-K301 HydrophobicContact CB-CG 4.27Å; E299-K301 PolarHBondContact O-N 2.95Å; E299-K301 WeakPolarHBondContact OE2-CD 3.38Å; E299-K301 WeakPolarHBondContact OE2-CE 3.1Å; E299-K301 IonicContact OE2-NZ 3.37Å; E299-K301 PolarHBondContact OE2-NZ 3.19Å | ||
| 302 | L | 93 | Very high | 93 | Very high | 53 Ų | 53 | 106.1 Ų | 106.1 | 28% | 0.277 | 56% | 0.56 | S | S | . | * | S | Bend | trans | -94.6 | 146.3 | 176 | -167 | 67.3 | 0 | 0 | 0 | 109.6 | M293 W296 | M293-L302 HydrophobicContact CB-CD2 4.35Å; M293-L302 HydrophobicContact CE-CD2 4.17Å; W296-L302 HydrophobicContact CB-CB 4.09Å; W296-L302 PolarHBondContact O-N 3.3Å |
| 303 | W | 94.1 | Very high | 92.9 | Very high | 188 Ų | 188 | 109.5 Ų | 109.5 | 71% | 0.712 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 142.5 | 172.3 | -69.6 | -5.5 | 0 | 0 | 0 | 111.5 | F305 V307 | W303-F305 VanDerWaalsContact O-CD2 3.29Å; W303-F305 WeakPolarHBondContact O-CD2 3.42Å; W303-F305 VanDerWaalsContact O-CE2 3.3Å; W303-F305 WeakPolarHBondContact O-CE2 3.37Å; W303-V307 HydrophobicContact CE3-CG1 3.94Å; W303-V307 HydrophobicContact CE3-CG2 4.17Å; W303-V307 HydrophobicContact CZ3-CG1 4.12Å |
| 304 | E | 93.1 | Very high | 92.5 | Very high | 137 Ų | 137 | 111.1 Ų | 111.1 | 64% | 0.64 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 141.9 | 170.7 | -63 | -176.8 | 179.3 | 0 | 0 | 110 | T297 | T297-E304 HydrophobicContact CG2-CG 4.3Š|
| 305 | F | 92.4 | Very high | 92.1 | Very high | 149 Ų | 149 | 108.1 Ų | 108.1 | 65% | 0.654 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -112.7 | 139.9 | -179.2 | -70 | -86.8 | 0 | 0 | 0 | 110.5 | W303 V307 | W303-F305 VanDerWaalsContact O-CD2 3.29Å; W303-F305 WeakPolarHBondContact O-CD2 3.42Å; W303-F305 VanDerWaalsContact O-CE2 3.3Å; W303-F305 WeakPolarHBondContact O-CE2 3.37Å; F305-V307 HydrophobicContact CD1-CG2 3.81Å; F305-V307 HydrophobicContact CE1-CG2 3.69Å |
| 306 | P | 94.3 | Very high | 91.6 | Very high | 121 Ų | 121 | 109.1 Ų | 109.1 | 79% | 0.786 | 58% | 0.577 | S | S | * | * | S | Bend | cis | -69.4 | 145.8 | 0.1 | 29.5 | -35.1 | 0 | 0 | 0 | 113 | N308 | P306-N308 PolarHBondContact O-N 2.92Å; P306-N308 VanDerWaalsContact O-N 3.12Å |
| 307 | V | 93.4 | Very high | 91.2 | Very high | 71 Ų | 71 | 106.7 Ų | 106.7 | 43% | 0.43 | 58% | 0.584 | S | S | . | * | trans | -60.8 | 117.1 | -174.8 | -178.4 | 0 | 0 | 0 | 0 | 110 | W303 F305 | W303-V307 HydrophobicContact CE3-CG1 3.94Å; W303-V307 HydrophobicContact CE3-CG2 4.17Å; W303-V307 HydrophobicContact CZ3-CG1 4.12Å; F305-V307 HydrophobicContact CD1-CG2 3.81Å; F305-V307 HydrophobicContact CE1-CG2 3.69Å | ||
| 308 | N | 93.9 | Very high | 90.9 | Very high | 93 Ų | 93 | 106.3 Ų | 106.3 | 50% | 0.497 | 58% | 0.584 | S | S | . | * | trans | -106.3 | 121.5 | 170.7 | -178.1 | 7.1 | 0 | 0 | 0 | 109 | P306 E310 A311 | P306-N308 PolarHBondContact O-N 2.92Å; P306-N308 VanDerWaalsContact O-N 3.12Å; N308-E310 PolarHBondContact O-N 3.46Å; N308-E310 PolarHBondContact OD1-N 2.99Å; N308-A311 HydrophobicContact CB-CB 4.29Å; N308-A311 VanDerWaalsContact O-CB 3.31Å; N308-A311 WeakPolarHBondContact O-CB 3.35Å; N308-A311 PolarHBondContact O-N 3.3Å | ||
| 309 | N | 93.7 | Very high | 90.9 | Very high | 159 Ų | 159 | 103.2 Ų | 103.2 | 85% | 0.85 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -19.3 | 178.7 | -65.1 | -28.5 | 0 | 0 | 0 | 112.9 | ||
| 310 | E | 90.4 | Very high | 90.8 | Very high | 137 Ų | 137 | 105.5 Ų | 105.5 | 64% | 0.64 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.9 | 7.5 | 179.8 | -61.5 | 173.9 | -179 | 0 | 0 | 112 | N308 G312 F313 | N308-E310 PolarHBondContact O-N 3.46Å; N308-E310 PolarHBondContact OD1-N 2.99Å; E310-G312 PolarHBondContact O-N 3.37Å; E310-F313 PolarHBondContact O-N 3.42Å |
| 311 | A | 90.8 | Very high | 90.8 | Very high | 67 Ų | 67 | 105.3 Ų | 105.3 | 55% | 0.554 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.7 | 124.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | N308 F313 | N308-A311 HydrophobicContact CB-CB 4.29Å; N308-A311 VanDerWaalsContact O-CB 3.31Å; N308-A311 WeakPolarHBondContact O-CB 3.35Å; N308-A311 PolarHBondContact O-N 3.3Å; A311-F313 PolarHBondContact O-N 3.15Å |
| 312 | G | 87.8 | Confident | 90.7 | Very high | 93 Ų | 93 | 100.7 Ų | 100.7 | 96% | 0.959 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.5 | 2.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | E310 | E310-G312 PolarHBondContact O-N 3.37Š|
| 313 | F | 89.2 | Confident | 90.7 | Very high | 152 Ų | 152 | 100 Ų | 100 | 67% | 0.667 | 54% | 0.541 | S | S | * | . | trans | -110.4 | 106.8 | 171.2 | -177.2 | -101.9 | 0 | 0 | 0 | 109.3 | E310 A311 | E310-F313 PolarHBondContact O-N 3.42Å; A311-F313 PolarHBondContact O-N 3.15Å | ||
| 314 | D | 86.1 | Confident | 90.6 | Very high | 124 Ų | 124 | 95.1 Ų | 95.1 | 66% | 0.663 | 53% | 0.528 | S | S | * | . | trans | -121.8 | 124.6 | 172.3 | -171.5 | 3.8 | 0 | 0 | 0 | 107.7 | D316 G317 | D314-D316 PolarHBondContact O-N 3Å; D314-G317 PolarHBondContact OD1-N 3.35Å; D314-G317 VanDerWaalsContact OD1-N 3.14Å | ||
| 315 | D | 84.5 | Confident | 90.5 | Very high | 29 Ų | 29 | 94.6 Ų | 94.6 | 16% | 0.155 | 52% | 0.524 | C | S | . | . | trans | -79.5 | 57.4 | -179.9 | -171.6 | 57.5 | 0 | 0 | 0 | 110.8 | G317 S318 H323 S357 | D315-G317 PolarHBondContact O-N 2.96Å; D315-G317 VanDerWaalsContact O-N 3.08Å; D315-S318 WeakPolarHBondContact O-CB 3.25Å; D315-S318 PolarHBondContact O-N 3.03Å; D315-S318 PolarHBondContact O-OG 3.11Å; D315-S318 WeakPolarHBondContact OD2-CB 3.43Å; D315-H323 IonicContact OD2-CE1 2.94Å; D315-H323 PolarHBondContact OD2-CE1 2.96Å; D315-H323 IonicContact OD2-NE2 2.91Å; D315-H323 PolarHBondContact OD2-NE2 3.49Å; D315-S357 WeakPolarHBondContact OD1-CA 3.45Å; D315-S357 WeakPolarHBondContact OD1-CB 3.35Å | ||
| 316 | D | 83.7 | Confident | 90.5 | Very high | 98 Ų | 98 | 87.6 Ų | 87.6 | 52% | 0.524 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 55.5 | 24.4 | -177.1 | -64.2 | -60.6 | 0 | 0 | 0 | 114.2 | D314 S318 K359 | D314-D316 PolarHBondContact O-N 3Å; D316-S318 PolarHBondContact O-N 3.34Å; D316-K359 IonicContact OD1-NZ 2.94Å; D316-K359 PolarHBondContact OD1-NZ 3.18Å; D316-K359 VanDerWaalsContact OD1-NZ 3.14Å; D316-K359 WeakPolarHBondContact OD2-CE 3.45Å; D316-K359 IonicContact OD2-NZ 2.9Å; D316-K359 PolarHBondContact OD2-NZ 2.99Å |
| 317 | G | 86.4 | Confident | 90.2 | Very high | 53 Ų | 53 | 86.3 Ų | 86.3 | 55% | 0.546 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 70.1 | 18 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | D314 D315 | D314-G317 PolarHBondContact OD1-N 3.35Å; D314-G317 VanDerWaalsContact OD1-N 3.14Å; D315-G317 PolarHBondContact O-N 2.96Å; D315-G317 VanDerWaalsContact O-N 3.08Å |
| 318 | S | 90.1 | Very high | 90 | Very high | 38 Ų | 38 | 88.3 Ų | 88.3 | 27% | 0.266 | 48% | 0.483 | S | S | . | . | trans | -70.6 | 134 | 179.2 | -55.5 | 0 | 0 | 0 | 0 | 111.2 | D315 D316 | D315-S318 WeakPolarHBondContact O-CB 3.25Å; D315-S318 PolarHBondContact O-N 3.03Å; D315-S318 PolarHBondContact O-OG 3.11Å; D315-S318 WeakPolarHBondContact OD2-CB 3.43Å; D316-S318 PolarHBondContact O-N 3.34Å | ||
| 319 | E | 91.7 | Very high | 89.6 | Confident | 110 Ų | 110 | 87.5 Ų | 87.5 | 51% | 0.514 | 48% | 0.476 | S | S | . | . | trans | -86.8 | 168.8 | 176.4 | -67.8 | -171.2 | -165.4 | 0 | 0 | 112 | H321 D322 H323 | E319-H321 VanDerWaalsContact CB-ND1 3.35Å; E319-H321 WeakPolarHBondContact CB-ND1 3.47Å; E319-H321 PolarHBondContact O-N 3.05Å; E319-H321 IonicContact OE2-CE1 2.66Å; E319-H321 PolarHBondContact OE2-CE1 2.97Å; E319-H321 IonicContact OE2-ND1 2.85Å; E319-H321 PolarHBondContact OE2-ND1 3.39Å; E319-D322 PolarHBondContact O-N 2.94Å; E319-H323 PolarHBondContact O-ND1 3.24Å; E319-H323 VanDerWaalsContact O-ND1 3.13Å | ||
| 320 | F | 92.1 | Very high | 89.2 | Confident | 140 Ų | 140 | 80 Ų | 80 | 61% | 0.614 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -59.4 | -32.3 | 178.1 | 76 | -86.6 | 0 | 0 | 0 | 112.3 | D322 H323 I324 | F320-D322 VanDerWaalsContact C-N 3.28Å; F320-D322 PolarHBondContact O-N 3.4Å; F320-H323 PolarHBondContact O-N 2.77Å; F320-I324 HydrophobicContact CD2-CD1 4.07Å; F320-I324 WeakPolarHBondContact O-CG1 3.49Å; F320-I324 PolarHBondContact O-N 3.2Å |
| 321 | H | 92.3 | Very high | 88.8 | Confident | 57 Ų | 57 | 81.9 Ų | 81.9 | 26% | 0.264 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -71.4 | -25.8 | -174.8 | 69.3 | -104 | 0 | 0 | 0 | 111.8 | E319 F325 | E319-H321 VanDerWaalsContact CB-ND1 3.35Å; E319-H321 WeakPolarHBondContact CB-ND1 3.47Å; E319-H321 PolarHBondContact O-N 3.05Å; E319-H321 IonicContact OE2-CE1 2.66Å; E319-H321 PolarHBondContact OE2-CE1 2.97Å; E319-H321 IonicContact OE2-ND1 2.85Å; E319-H321 PolarHBondContact OE2-ND1 3.39Å; H321-F325 HydrophobicContact CB-CD2 3.79Å; H321-F325 HydrophobicContact CB-CE2 4.07Å; H321-F325 WeakPolarHBondContact O-CA 3.3Å; H321-F325 VanDerWaalsContact O-CB 3.28Å; H321-F325 WeakPolarHBondContact O-CB 3.49Å; H321-F325 VanDerWaalsContact O-CD2 3.31Å; H321-F325 WeakPolarHBondContact O-CD2 3.12Å; H321-F325 PolarHBondContact O-N 3.35Å |
| 322 | D | 91.8 | Very high | 88.2 | Confident | 46 Ų | 46 | 80 Ų | 80 | 25% | 0.246 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -78.4 | -27.2 | 173.8 | -64.3 | -37.8 | 0 | 0 | 0 | 112.3 | E319 F320 L326 K328 V358 | E319-D322 PolarHBondContact O-N 2.94Å; F320-D322 VanDerWaalsContact C-N 3.28Å; F320-D322 PolarHBondContact O-N 3.4Å; D322-L326 WeakPolarHBondContact O-CD2 3.42Å; D322-K328 IonicContact OD1-NZ 2.91Å; D322-K328 PolarHBondContact OD1-NZ 3.11Å; D322-V358 HydrophobicContact CB-CG1 4.31Å; D322-V358 HydrophobicContact CB-CG2 4.04Å |
| 323 | H | 92.5 | Very high | 88 | Confident | 38 Ų | 38 | 75.9 Ų | 75.9 | 18% | 0.176 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -76.2 | -34.7 | 172.8 | -73.4 | 82.5 | 0 | 0 | 0 | 113.4 | D315 E319 F320 S351 V358 K361 | D315-H323 IonicContact OD2-CE1 2.94Å; D315-H323 PolarHBondContact OD2-CE1 2.96Å; D315-H323 IonicContact OD2-NE2 2.91Å; D315-H323 PolarHBondContact OD2-NE2 3.49Å; E319-H323 PolarHBondContact O-ND1 3.24Å; E319-H323 VanDerWaalsContact O-ND1 3.13Å; F320-H323 PolarHBondContact O-N 2.77Å; H323-S351 WeakPolarHBondContact O-CA 3.38Å; H323-V358 VanDerWaalsContact CE1-CG2 3.4Å; H323-V358 WeakPolarHBondContact CE1-CG2 3.28Å; H323-K361 PolarHBondContact CD2-NZ 3.03Å |
| 324 | I | 92.1 | Very high | 87.8 | Confident | 86 Ų | 86 | 69.6 Ų | 69.6 | 44% | 0.441 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -91.6 | -45.4 | -173.5 | -62.5 | 179.7 | 0 | 0 | 0 | 111.2 | F320 L326 | F320-I324 HydrophobicContact CD2-CD1 4.07Å; F320-I324 WeakPolarHBondContact O-CG1 3.49Å; F320-I324 PolarHBondContact O-N 3.2Å; I324-L326 PolarHBondContact O-N 2.89Å |
| 325 | F | 92 | Very high | 87.6 | Confident | 125 Ų | 125 | 72.3 Ų | 72.3 | 55% | 0.548 | 37% | 0.367 | S | S | . | . | trans | -96.1 | 74.4 | -174.5 | -54.6 | -65.9 | 0 | 0 | 0 | 111.7 | H321 D327 | H321-F325 HydrophobicContact CB-CD2 3.79Å; H321-F325 HydrophobicContact CB-CE2 4.07Å; H321-F325 WeakPolarHBondContact O-CA 3.3Å; H321-F325 VanDerWaalsContact O-CB 3.28Å; H321-F325 WeakPolarHBondContact O-CB 3.49Å; H321-F325 VanDerWaalsContact O-CD2 3.31Å; H321-F325 WeakPolarHBondContact O-CD2 3.12Å; H321-F325 PolarHBondContact O-N 3.35Å; F325-D327 PolarHBondContact O-N 2.9Å | ||
| 326 | L | 91.6 | Very high | 87.3 | Confident | 2 Ų | 2 | 79.5 Ų | 79.5 | 1% | 0.01 | 40% | 0.399 | C | S | . | . | G | 310 helix | trans | -79.9 | 1.7 | 176.1 | -60.7 | 172.9 | 0 | 0 | 0 | 113.7 | D322 I324 K328 H329 T347 L350 K361 I365 | D322-L326 WeakPolarHBondContact O-CD2 3.42Å; I324-L326 PolarHBondContact O-N 2.89Å; L326-K328 PolarHBondContact O-N 3.41Å; L326-H329 PolarHBondContact O-N 2.97Å; L326-T347 HydrophobicContact CB-CG2 3.99Å; L326-L350 HydrophobicContact CD1-CB 3.54Å; L326-L350 HydrophobicContact CD1-CD1 4.3Å; L326-K361 HydrophobicContact CD1-CB 4.29Å; L326-K361 HydrophobicContact CD1-CD 4.21Å; L326-K361 HydrophobicContact CD2-CB 4.25Å; L326-K361 HydrophobicContact CD2-CD 4.49Å; L326-I365 HydrophobicContact CB-CD1 4.14Å; L326-I365 HydrophobicContact CD1-CD1 4.45Å |
| 327 | D | 88.9 | Confident | 87.4 | Confident | 94 Ų | 94 | 76.4 Ų | 76.4 | 50% | 0.503 | 39% | 0.391 | S | S | . | . | G | 310 helix | trans | -62.8 | -24.7 | -180 | -162.8 | 21.4 | 0 | 0 | 0 | 112.1 | F325 H329 L330 R340 | F325-D327 PolarHBondContact O-N 2.9Å; D327-H329 PolarHBondContact O-N 2.94Å; D327-H329 VanDerWaalsContact O-N 3.16Å; D327-L330 WeakPolarHBondContact O-CB 3.48Å; D327-L330 PolarHBondContact O-N 3.41Å; D327-R340 IonicContact OD1-CZ 3.94Å; D327-R340 IonicContact OD1-NH2 3.84Å; D327-R340 PolarHBondContact OD1-NH2 2.95Å; D327-R340 IonicContact OD2-NH2 3.14Å |
| 328 | K | 88.1 | Confident | 87.5 | Confident | 114 Ų | 114 | 78 Ų | 78 | 50% | 0.496 | 39% | 0.392 | S | S | . | . | G | 310 helix | trans | -53.5 | -34.4 | 171.6 | -59.7 | 177.1 | -173.6 | 171.4 | 0 | 112.2 | D322 L326 | D322-K328 IonicContact OD1-NZ 2.91Å; D322-K328 PolarHBondContact OD1-NZ 3.11Å; L326-K328 PolarHBondContact O-N 3.41Å |
| 329 | H | 86 | Confident | 87.4 | Confident | 76 Ų | 76 | 76.7 Ų | 76.7 | 35% | 0.352 | 38% | 0.381 | S | S | . | . | G | 310 helix | trans | -89.4 | -2.3 | -178.4 | -58 | -75.5 | 0 | 0 | 0 | 113.2 | L326 D327 V362 I365 | L326-H329 PolarHBondContact O-N 2.97Å; D327-H329 PolarHBondContact O-N 2.94Å; D327-H329 VanDerWaalsContact O-N 3.16Å; H329-V362 WeakPolarHBondContact NE2-CG2 3.47Å; H329-I365 HydrophobicContact CB-CD1 3.98Å; H329-I365 HydrophobicContact CB-CG2 4.15Å |
| 330 | L | 85.6 | Confident | 87.4 | Confident | 2 Ų | 2 | 73.4 Ų | 73.4 | 1% | 0.01 | 36% | 0.364 | C | S | . | . | G | 310 helix | trans | -89.4 | 0 | 178.8 | -65 | -176.1 | 0 | 0 | 0 | 113.9 | D327 G332 F333 M343 T347 | D327-L330 WeakPolarHBondContact O-CB 3.48Å; D327-L330 PolarHBondContact O-N 3.41Å; L330-G332 PolarHBondContact O-N 2.93Å; L330-F333 HydrophobicContact CD2-CD2 4.05Å; L330-F333 HydrophobicContact CD2-CE2 4.27Å; L330-F333 PolarHBondContact O-N 3.45Å; L330-F333 VanDerWaalsContact O-N 3.12Å; L330-M343 HydrophobicContact CD2-CB 3.87Å; L330-M343 HydrophobicContact CD2-CE 3.93Å; L330-T347 HydrophobicContact CD1-CG2 3.95Å; L330-T347 HydrophobicContact CD2-CG2 3.81Å; L330-T347 HydrophobicContact CG-CG2 4.03Å |
| 331 | E | 81.6 | Confident | 87.3 | Confident | 176 Ų | 176 | 71.8 Ų | 71.8 | 82% | 0.822 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | -25.3 | 179.3 | -67 | -173 | 173.2 | 0 | 0 | 113.5 | F333 | E331-F333 VanDerWaalsContact C-N 3.26Å; E331-F333 PolarHBondContact O-N 3.32Å |
| 332 | G | 77.9 | Confident | 87.3 | Confident | 26 Ų | 26 | 73.3 Ų | 73.3 | 27% | 0.268 | 37% | 0.367 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.7 | 6.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | L330 | L330-G332 PolarHBondContact O-N 2.93Š|
| 333 | F | 83.4 | Confident | 87.4 | Confident | 8 Ų | 8 | 71.1 Ų | 71.1 | 4% | 0.035 | 36% | 0.355 | C | S | . | . | S | Bend | trans | -115.7 | 152.2 | -179.6 | -66.9 | -95.9 | 0 | 0 | 0 | 110.9 | L330 E331 K335 I339 M343 I365 F368 R369 F372 F386 | L330-F333 HydrophobicContact CD2-CD2 4.05Å; L330-F333 HydrophobicContact CD2-CE2 4.27Å; L330-F333 PolarHBondContact O-N 3.45Å; L330-F333 VanDerWaalsContact O-N 3.12Å; E331-F333 VanDerWaalsContact C-N 3.26Å; E331-F333 PolarHBondContact O-N 3.32Å; F333-K335 PolarHBondContact O-N 3.03Å; F333-I339 HydrophobicContact CD1-CG2 3.94Å; F333-M343 HydrophobicContact CD1-CG 3.65Å; F333-M343 HydrophobicContact CD1-SD 4.36Å; F333-M343 HydrophobicContact CE1-CE 3.94Å; F333-M343 HydrophobicContact CE1-CG 3.62Å; F333-M343 HydrophobicContact CE1-SD 3.71Å; F333-M343 HydrophobicContact CE2-CE 3.94Å; F333-M343 HydrophobicContact CG-CG 4.21Å; F333-M343 HydrophobicContact CZ-CE 3.53Å; F333-M343 HydrophobicContact CZ-CG 4.18Å; F333-M343 HydrophobicContact CZ-SD 3.94Å; F333-I365 HydrophobicContact CE2-CG2 3.82Å; F333-I365 HydrophobicContact CZ-CG2 4.28Å; F333-F368 HydrophobicContact CE1-CB 4.49Å; F333-F368 HydrophobicContact CZ-CB 4.29Å; F333-R369 HydrophobicContact CE2-CB 4.39Å; F333-R369 HydrophobicContact CZ-CB 3.93Å; F333-F372 HydrophobicContact CD1-CD2 4.45Å; F333-F372 AromaticContact CE1-CD2 3.8Å; F333-F372 HydrophobicContact CE1-CD2 3.8Å; F333-F372 HydrophobicContact CE1-CE2 4.04Å; F333-F386 AromaticContact CD1-CE2 3.77Å; F333-F386 HydrophobicContact CD1-CE2 3.77Å; F333-F386 HydrophobicContact CD1-CZ 4.18Å; F333-F386 HydrophobicContact CE1-CE2 4.27Å; F333-F386 HydrophobicContact CE1-CZ 4.44Å |
| 334 | P | 85.6 | Confident | 87.3 | Confident | 19 Ų | 19 | 73.6 Ų | 73.6 | 12% | 0.123 | 37% | 0.367 | C | S | . | . | trans | -58.4 | 133.7 | 175.5 | 23.6 | -33.5 | 0 | 0 | 0 | 110.8 | Q336 I339 R340 F386 | P334-Q336 PolarHBondContact O-N 3.22Å; P334-I339 HydrophobicContact CG-CB 4.22Å; P334-I339 HydrophobicContact CG-CG2 4.37Å; P334-R340 WeakPolarHBondContact O-CB 3.41Å; P334-F386 HydrophobicContact CG-CD2 4.1Å | ||
| 335 | K | 81 | Confident | 87.4 | Confident | 182 Ų | 182 | 75.2 Ų | 75.2 | 79% | 0.791 | 38% | 0.376 | S | S | * | . | S | Bend | trans | -68 | -21.5 | -177.3 | -65 | -175.9 | -179.4 | -177.9 | 0 | 113.5 | F333 | F333-K335 PolarHBondContact O-N 3.03Š|
| 336 | Q | 79.4 | Confident | 87.5 | Confident | 179 Ų | 179 | 70.5 Ų | 70.5 | 84% | 0.836 | 36% | 0.357 | S | S | * | . | S | Bend | trans | -133.4 | 140.6 | -179.8 | -64.7 | -178.4 | -0.9 | 0 | 0 | 109 | P334 | P334-Q336 PolarHBondContact O-N 3.22Š|
| 337 | G | 85.3 | Confident | 87.6 | Confident | 33 Ų | 33 | 71.2 Ų | 71.2 | 34% | 0.34 | 36% | 0.362 | S | S | . | . | S | Bend | trans | 129.9 | 176.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114 | I339 R340 I341 | G337-I339 PolarHBondContact O-N 2.9Å; G337-R340 WeakPolarHBondContact O-CB 3.47Å; G337-R340 PolarHBondContact O-N 2.94Å; G337-R340 VanDerWaalsContact O-N 3.13Å; G337-I341 PolarHBondContact O-N 3.21Å |
| 338 | P | 89.3 | Confident | 87.8 | Confident | 87 Ų | 87 | 69 Ų | 69 | 57% | 0.565 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -60.1 | -32.2 | -178.4 | -24 | 34.4 | 0 | 0 | 0 | 113.3 | I341 F342 | P338-I341 PolarHBondContact O-N 3.4Å; P338-F342 WeakPolarHBondContact O-CB 3.35Å; P338-F342 PolarHBondContact O-N 2.99Å |
| 339 | I | 88.1 | Confident | 88.1 | Confident | 10 Ų | 10 | 65.6 Ų | 65.6 | 5% | 0.051 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.6 | -39.9 | 178.5 | -60.4 | 176.3 | 0 | 0 | 0 | 110.6 | F333 P334 G337 F342 M343 F372 L379 V384 F386 | F333-I339 HydrophobicContact CD1-CG2 3.94Å; P334-I339 HydrophobicContact CG-CB 4.22Å; P334-I339 HydrophobicContact CG-CG2 4.37Å; G337-I339 PolarHBondContact O-N 2.9Å; I339-F342 PolarHBondContact O-N 3.16Å; I339-M343 HydrophobicContact CG2-CG 4.34Å; I339-M343 WeakPolarHBondContact O-CB 3.32Å; I339-M343 WeakPolarHBondContact O-CG 3.47Å; I339-M343 PolarHBondContact O-N 3.24Å; I339-F372 HydrophobicContact CD1-CD1 4.44Å; I339-F372 HydrophobicContact CG1-CE1 4.48Å; I339-F372 HydrophobicContact CG2-CD2 4.29Å; I339-F372 HydrophobicContact CG2-CE2 3.98Å; I339-F372 HydrophobicContact CG2-CZ 4.14Å; I339-L379 HydrophobicContact CD1-CD1 4.1Å; I339-L379 HydrophobicContact CD1-CD2 4.18Å; I339-V384 HydrophobicContact CD1-CG1 3.59Å; I339-V384 HydrophobicContact CG1-CG1 3.99Å; I339-F386 HydrophobicContact CD1-CB 4.43Å; I339-F386 HydrophobicContact CD1-CD2 3.68Å; I339-F386 HydrophobicContact CD1-CE2 4.48Å; I339-F386 HydrophobicContact CG2-CD2 4.33Å; I339-F386 HydrophobicContact CG2-CE2 4.19Å |
| 340 | R | 89.9 | Confident | 88.5 | Confident | 42 Ų | 42 | 62.9 Ų | 62.9 | 16% | 0.158 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.9 | -48.1 | 175.9 | -176.6 | 66.2 | -178.1 | -156.1 | 8.6 | 111 | D327 P334 G337 F342 M343 E344 | D327-R340 IonicContact OD1-CZ 3.94Å; D327-R340 IonicContact OD1-NH2 3.84Å; D327-R340 PolarHBondContact OD1-NH2 2.95Å; D327-R340 IonicContact OD2-NH2 3.14Å; P334-R340 WeakPolarHBondContact O-CB 3.41Å; G337-R340 WeakPolarHBondContact O-CB 3.47Å; G337-R340 PolarHBondContact O-N 2.94Å; G337-R340 VanDerWaalsContact O-N 3.13Å; R340-F342 VanDerWaalsContact C-N 3.3Å; R340-F342 PolarHBondContact O-N 2.96Å; R340-M343 PolarHBondContact O-N 3.15Å; R340-E344 HydrophobicContact CG-CG 4.46Å; R340-E344 WeakPolarHBondContact CG-OE1 3.36Å; R340-E344 IonicContact CZ-OE1 3.78Å; R340-E344 IonicContact NE-OE1 3.88Å; R340-E344 PolarHBondContact NE-OE1 2.88Å; R340-E344 IonicContact NH2-OE1 2.88Å; R340-E344 WeakPolarHBondContact O-CB 3.45Å; R340-E344 VanDerWaalsContact O-CG 3.32Å; R340-E344 WeakPolarHBondContact O-CG 3.48Å; R340-E344 PolarHBondContact O-N 3.29Å |
| 341 | I | 91 | Very high | 88.9 | Confident | 106 Ų | 106 | 64.4 Ų | 64.4 | 54% | 0.544 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.3 | -42.5 | 178.7 | -60.3 | 169.5 | 0 | 0 | 0 | 110.6 | G337 P338 E344 L345 | G337-I341 PolarHBondContact O-N 3.21Å; P338-I341 PolarHBondContact O-N 3.4Å; I341-E344 PolarHBondContact O-N 3.11Å; I341-L345 WeakPolarHBondContact O-CG 3.44Å; I341-L345 PolarHBondContact O-N 3.01Å; I341-L345 VanDerWaalsContact O-N 3.13Å |
| 342 | F | 92.6 | Very high | 89.5 | Confident | 88 Ų | 88 | 63.6 Ų | 63.6 | 39% | 0.386 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63 | -47.3 | 175.6 | 175.6 | -99.2 | 0 | 0 | 0 | 111.9 | P338 I339 R340 E344 L345 V346 F368 F372 | P338-F342 WeakPolarHBondContact O-CB 3.35Å; P338-F342 PolarHBondContact O-N 2.99Å; I339-F342 PolarHBondContact O-N 3.16Å; R340-F342 VanDerWaalsContact C-N 3.3Å; R340-F342 PolarHBondContact O-N 2.96Å; F342-E344 VanDerWaalsContact C-N 3.33Å; F342-E344 PolarHBondContact O-N 3.49Å; F342-L345 WeakPolarHBondContact O-CB 3.4Å; F342-L345 PolarHBondContact O-N 3.06Å; F342-L345 VanDerWaalsContact O-N 3.15Å; F342-V346 HydrophobicContact CD1-CG2 4.16Å; F342-V346 HydrophobicContact CE1-CG2 3.68Å; F342-V346 HydrophobicContact CE2-CG2 4.28Å; F342-V346 HydrophobicContact CZ-CG2 3.74Å; F342-V346 WeakPolarHBondContact O-CG2 3.42Å; F342-V346 PolarHBondContact O-N 2.97Å; F342-F368 AromaticContact CE1-CD1 3.82Å; F342-F368 HydrophobicContact CE1-CD1 3.82Å; F342-F368 AromaticContact CE1-CE1 3.52Å; F342-F368 HydrophobicContact CE1-CE1 3.52Å; F342-F368 HydrophobicContact CE1-CZ 4.03Å; F342-F368 HydrophobicContact CZ-CD1 4.43Å; F342-F368 AromaticContact CZ-CE1 3.68Å; F342-F368 HydrophobicContact CZ-CE1 3.68Å; F342-F368 AromaticContact CZ-CZ 4Å; F342-F368 HydrophobicContact CZ-CZ 4Å; F342-F372 HydrophobicContact CD1-CZ 4.13Å; F342-F372 HydrophobicContact CE1-CZ 4.29Å |
| 343 | M | 92.8 | Very high | 90.3 | Very high | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -67.9 | -31.7 | 179.3 | -71.1 | -55.2 | -58.9 | 0 | 0 | 113 | L330 F333 I339 R340 L345 V346 T347 I365 F368 F372 | L330-M343 HydrophobicContact CD2-CB 3.87Å; L330-M343 HydrophobicContact CD2-CE 3.93Å; F333-M343 HydrophobicContact CD1-CG 3.65Å; F333-M343 HydrophobicContact CD1-SD 4.36Å; F333-M343 HydrophobicContact CE1-CE 3.94Å; F333-M343 HydrophobicContact CE1-CG 3.62Å; F333-M343 HydrophobicContact CE1-SD 3.71Å; F333-M343 HydrophobicContact CE2-CE 3.94Å; F333-M343 HydrophobicContact CG-CG 4.21Å; F333-M343 HydrophobicContact CZ-CE 3.53Å; F333-M343 HydrophobicContact CZ-CG 4.18Å; F333-M343 HydrophobicContact CZ-SD 3.94Å; I339-M343 HydrophobicContact CG2-CG 4.34Å; I339-M343 WeakPolarHBondContact O-CB 3.32Å; I339-M343 WeakPolarHBondContact O-CG 3.47Å; I339-M343 PolarHBondContact O-N 3.24Å; R340-M343 PolarHBondContact O-N 3.15Å; M343-L345 VanDerWaalsContact C-N 3.32Å; M343-V346 PolarHBondContact O-N 3.45Å; M343-T347 WeakPolarHBondContact O-CB 3.4Å; M343-T347 WeakPolarHBondContact O-CG2 3.47Å; M343-T347 PolarHBondContact O-N 3.49Å; M343-T347 PolarHBondContact O-OG1 3.45Å; M343-I365 HydrophobicContact CE-CG1 4.47Å; M343-I365 HydrophobicContact CE-CG2 3.99Å; M343-F368 HydrophobicContact CE-CB 4.14Å; M343-F368 HydrophobicContact CE-CD2 4.31Å; M343-F368 HydrophobicContact CE-CG 4.45Å; M343-F368 HydrophobicContact SD-CB 3.85Å; M343-F368 HydrophobicContact SD-CD2 4.25Å; M343-F368 HydrophobicContact SD-CG 3.98Å; M343-F372 HydrophobicContact SD-CE2 4.21Å |
| 344 | E | 91.4 | Very high | 90.7 | Very high | 90 Ų | 90 | 69.5 Ų | 69.5 | 42% | 0.421 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -63.7 | -37.7 | 170.8 | -77.2 | 172.7 | -173.3 | 0 | 0 | 111.6 | R340 I341 F342 T347 S348 | R340-E344 HydrophobicContact CG-CG 4.46Å; R340-E344 WeakPolarHBondContact CG-OE1 3.36Å; R340-E344 IonicContact CZ-OE1 3.78Å; R340-E344 IonicContact NE-OE1 3.88Å; R340-E344 PolarHBondContact NE-OE1 2.88Å; R340-E344 IonicContact NH2-OE1 2.88Å; R340-E344 WeakPolarHBondContact O-CB 3.45Å; R340-E344 VanDerWaalsContact O-CG 3.32Å; R340-E344 WeakPolarHBondContact O-CG 3.48Å; R340-E344 PolarHBondContact O-N 3.29Å; I341-E344 PolarHBondContact O-N 3.11Å; F342-E344 VanDerWaalsContact C-N 3.33Å; F342-E344 PolarHBondContact O-N 3.49Å; E344-T347 WeakPolarHBondContact CA-OG1 3.39Å; E344-T347 PolarHBondContact O-OG1 3Å; E344-T347 VanDerWaalsContact O-OG1 3.1Å; E344-S348 WeakPolarHBondContact O-CB 3.47Å; E344-S348 PolarHBondContact O-N 3.16Å |
| 345 | L | 94.3 | Very high | 91 | Very high | 120 Ų | 120 | 78.5 Ų | 78.5 | 63% | 0.628 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -67.5 | -43.3 | 172.6 | -72 | 167.6 | 0 | 0 | 0 | 112 | I341 F342 M343 S348 G349 | I341-L345 WeakPolarHBondContact O-CG 3.44Å; I341-L345 PolarHBondContact O-N 3.01Å; I341-L345 VanDerWaalsContact O-N 3.13Å; F342-L345 WeakPolarHBondContact O-CB 3.4Å; F342-L345 PolarHBondContact O-N 3.06Å; F342-L345 VanDerWaalsContact O-N 3.15Å; M343-L345 VanDerWaalsContact C-N 3.32Å; L345-S348 PolarHBondContact O-N 3.3Å; L345-G349 PolarHBondContact O-N 3.42Å |
| 346 | V | 93.9 | Very high | 91.6 | Very high | 26 Ų | 26 | 71.6 Ų | 71.6 | 16% | 0.158 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -61 | -50.5 | 176.9 | 171.8 | 0 | 0 | 0 | 0 | 110.5 | F342 M343 S348 G349 L350 F368 | F342-V346 HydrophobicContact CD1-CG2 4.16Å; F342-V346 HydrophobicContact CE1-CG2 3.68Å; F342-V346 HydrophobicContact CE2-CG2 4.28Å; F342-V346 HydrophobicContact CZ-CG2 3.74Å; F342-V346 WeakPolarHBondContact O-CG2 3.42Å; F342-V346 PolarHBondContact O-N 2.97Å; M343-V346 PolarHBondContact O-N 3.45Å; V346-S348 PolarHBondContact O-N 3.14Å; V346-G349 WeakPolarHBondContact O-CA 3.23Å; V346-G349 PolarHBondContact O-N 2.95Å; V346-G349 VanDerWaalsContact O-N 3.1Å; V346-L350 HydrophobicContact CG1-CD1 3.95Å; V346-L350 HydrophobicContact CG1-CG 4.35Å; V346-L350 WeakPolarHBondContact O-CG 3.45Å; V346-L350 PolarHBondContact O-N 3.24Å; V346-F368 HydrophobicContact CG1-CD2 4.14Å; V346-F368 HydrophobicContact CG1-CE2 3.73Å; V346-F368 HydrophobicContact CG2-CE2 4.06Å; V346-F368 HydrophobicContact CG2-CZ 4.17Å |
| 347 | T | 93 | Very high | 92.2 | Very high | 17 Ų | 17 | 64.1 Ų | 64.1 | 10% | 0.104 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.6 | -39.5 | 178.9 | 49.8 | 0 | 0 | 0 | 0 | 112.2 | L326 L330 M343 E344 G349 L350 S351 I365 | L326-T347 HydrophobicContact CB-CG2 3.99Å; L330-T347 HydrophobicContact CD1-CG2 3.95Å; L330-T347 HydrophobicContact CD2-CG2 3.81Å; L330-T347 HydrophobicContact CG-CG2 4.03Å; M343-T347 WeakPolarHBondContact O-CB 3.4Å; M343-T347 WeakPolarHBondContact O-CG2 3.47Å; M343-T347 PolarHBondContact O-N 3.49Å; M343-T347 PolarHBondContact O-OG1 3.45Å; E344-T347 WeakPolarHBondContact CA-OG1 3.39Å; E344-T347 PolarHBondContact O-OG1 3Å; E344-T347 VanDerWaalsContact O-OG1 3.1Å; T347-G349 VanDerWaalsContact C-N 3.32Å; T347-G349 PolarHBondContact O-N 3.41Å; T347-L350 PolarHBondContact O-N 3.38Å; T347-S351 WeakPolarHBondContact O-CB 3.32Å; T347-S351 PolarHBondContact O-N 3.08Å; T347-I365 HydrophobicContact CG2-CD1 4.03Å; T347-I365 HydrophobicContact CG2-CG1 4.5Å |
| 348 | S | 93.3 | Very high | 92.6 | Very high | 48 Ų | 48 | 63.5 Ų | 63.5 | 34% | 0.336 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60 | -40.9 | 170.1 | 164.4 | 0 | 0 | 0 | 0 | 111.9 | E344 L345 V346 S351 K352 | E344-S348 WeakPolarHBondContact O-CB 3.47Å; E344-S348 PolarHBondContact O-N 3.16Å; L345-S348 PolarHBondContact O-N 3.3Å; V346-S348 PolarHBondContact O-N 3.14Å; S348-S351 PolarHBondContact O-OG 3.47Å; S348-K352 WeakPolarHBondContact O-CG 3.42Å; S348-K352 PolarHBondContact O-N 3.04Å |
| 349 | G | 94.5 | Very high | 92.8 | Very high | 43 Ų | 43 | 65.1 Ų | 65.1 | 44% | 0.443 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.8 | -45.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | L345 V346 T347 K352 | L345-G349 PolarHBondContact O-N 3.42Å; V346-G349 WeakPolarHBondContact O-CA 3.23Å; V346-G349 PolarHBondContact O-N 2.95Å; V346-G349 VanDerWaalsContact O-N 3.1Å; T347-G349 VanDerWaalsContact C-N 3.32Å; T347-G349 PolarHBondContact O-N 3.41Å; G349-K352 PolarHBondContact O-N 3.13Å |
| 350 | L | 95.2 | Very high | 93 | Very high | 19 Ų | 19 | 68.7 Ų | 68.7 | 10% | 0.099 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.8 | -36.3 | 177.6 | -68.8 | 174.7 | 0 | 0 | 0 | 112.1 | L326 V346 T347 K352 N353 L356 K361 H364 I365 | L326-L350 HydrophobicContact CD1-CB 3.54Å; L326-L350 HydrophobicContact CD1-CD1 4.3Å; V346-L350 HydrophobicContact CG1-CD1 3.95Å; V346-L350 HydrophobicContact CG1-CG 4.35Å; V346-L350 WeakPolarHBondContact O-CG 3.45Å; V346-L350 PolarHBondContact O-N 3.24Å; T347-L350 PolarHBondContact O-N 3.38Å; L350-K352 VanDerWaalsContact C-N 3.26Å; L350-K352 PolarHBondContact O-N 3.27Å; L350-N353 PolarHBondContact O-N 2.99Å; L350-L356 HydrophobicContact CD2-CD1 4.07Å; L350-K361 HydrophobicContact CB-CD 4.38Å; L350-K361 HydrophobicContact CB-CG 4.29Å; L350-K361 HydrophobicContact CD1-CB 4.46Å; L350-K361 HydrophobicContact CD2-CG 4.4Å; L350-K361 VanDerWaalsContact O-CE 3.26Å; L350-K361 WeakPolarHBondContact O-CE 3.24Å; L350-K361 PolarHBondContact O-NZ 3.03Å; L350-H364 HydrophobicContact CD1-CB 4.13Å; L350-H364 HydrophobicContact CD2-CB 4.42Å; L350-I365 HydrophobicContact CD1-CD1 4.36Å; L350-I365 HydrophobicContact CD1-CG1 4Å |
| 351 | S | 93.6 | Very high | 93.2 | Very high | 33 Ų | 33 | 66.8 Ų | 66.8 | 23% | 0.231 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -63.2 | -32.6 | 178 | 74.1 | 0 | 0 | 0 | 0 | 112.9 | H323 T347 S348 N353 | H323-S351 WeakPolarHBondContact O-CA 3.38Å; T347-S351 WeakPolarHBondContact O-CB 3.32Å; T347-S351 PolarHBondContact O-N 3.08Å; S348-S351 PolarHBondContact O-OG 3.47Å; S351-N353 VanDerWaalsContact C-N 3.29Å; S351-N353 PolarHBondContact O-N 2.87Å |
| 352 | K | 94.7 | Very high | 93.3 | Very high | 160 Ų | 160 | 62.7 Ų | 62.7 | 70% | 0.696 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84 | -3.2 | 179.9 | -67 | 175.1 | -173.1 | 178 | 0 | 113.5 | S348 G349 L350 P354 | S348-K352 WeakPolarHBondContact O-CG 3.42Å; S348-K352 PolarHBondContact O-N 3.04Å; G349-K352 PolarHBondContact O-N 3.13Å; L350-K352 VanDerWaalsContact C-N 3.26Å; L350-K352 PolarHBondContact O-N 3.27Å; K352-P354 VanDerWaalsContact O-CD 3.29Å; K352-P354 WeakPolarHBondContact O-CD 3.45Å |
| 353 | N | 94.4 | Very high | 93.4 | Very high | 47 Ų | 47 | 63 Ų | 63 | 25% | 0.251 | 33% | 0.33 | S | S | . | . | trans | -91.8 | 114.6 | -177.3 | -166.2 | -19.3 | 0 | 0 | 0 | 111 | L350 S351 Y355 L356 K361 | L350-N353 PolarHBondContact O-N 2.99Å; S351-N353 VanDerWaalsContact C-N 3.29Å; S351-N353 PolarHBondContact O-N 2.87Å; N353-Y355 WeakPolarHBondContact OD1-CB 3.49Å; N353-Y355 WeakPolarHBondContact OD1-CD2 3.45Å; N353-Y355 PolarHBondContact OD1-N 3.48Å; N353-L356 HydrophobicContact CB-CD1 4.44Å; N353-L356 WeakPolarHBondContact ND2-CD1 3.4Å; N353-L356 WeakPolarHBondContact ND2-CG 3.38Å; N353-K361 PolarHBondContact O-NZ 3.47Å | ||
| 354 | P | 92.3 | Very high | 93.5 | Very high | 111 Ų | 111 | 67.2 Ų | 67.2 | 72% | 0.721 | 35% | 0.35 | S | S | * | . | S | Bend | trans | -85.1 | -10 | 176.3 | -8.7 | 28.9 | 0 | 0 | 0 | 113.8 | K352 | K352-P354 VanDerWaalsContact O-CD 3.29Å; K352-P354 WeakPolarHBondContact O-CD 3.45Å |
| 355 | Y | 91.8 | Very high | 93.5 | Very high | 207 Ų | 207 | 63.1 Ų | 63.1 | 81% | 0.812 | 33% | 0.331 | S | S | * | . | S | Bend | trans | -92.8 | -7.6 | -173.1 | -54.3 | -69.6 | 0 | 0 | 0 | 113.7 | N353 | N353-Y355 WeakPolarHBondContact OD1-CB 3.49Å; N353-Y355 WeakPolarHBondContact OD1-CD2 3.45Å; N353-Y355 PolarHBondContact OD1-N 3.48Å |
| 356 | L | 92.8 | Very high | 93.4 | Very high | 38 Ų | 38 | 62.2 Ų | 62.2 | 20% | 0.199 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -111 | 136.3 | -178.2 | -63.2 | 177.7 | 0 | 0 | 0 | 110.3 | L350 N353 Q360 K361 | L350-L356 HydrophobicContact CD2-CD1 4.07Å; N353-L356 HydrophobicContact CB-CD1 4.44Å; N353-L356 WeakPolarHBondContact ND2-CD1 3.4Å; N353-L356 WeakPolarHBondContact ND2-CG 3.38Å; L356-Q360 HydrophobicContact CB-CB 4.38Å; L356-Q360 HydrophobicContact CD2-CB 4.39Å; L356-Q360 VanDerWaalsContact CD2-OE1 3.24Å; L356-K361 HydrophobicContact CB-CG 4.11Å; L356-K361 WeakPolarHBondContact O-CE 3.46Å |
| 357 | S | 93.2 | Very high | 93.5 | Very high | 22 Ų | 22 | 68.1 Ų | 68.1 | 15% | 0.154 | 34% | 0.343 | C | S | . | . | trans | -72.9 | 162.2 | 171.2 | 66.2 | 0 | 0 | 0 | 0 | 111.5 | D315 K359 Q360 K361 | D315-S357 WeakPolarHBondContact OD1-CA 3.45Å; D315-S357 WeakPolarHBondContact OD1-CB 3.35Å; S357-K359 VanDerWaalsContact C-N 3.26Å; S357-K359 PolarHBondContact O-N 2.69Å; S357-Q360 PolarHBondContact O-N 3.48Å; S357-Q360 WeakPolarHBondContact OG-CG 3.37Å; S357-K361 WeakPolarHBondContact O-CG 3.38Å; S357-K361 PolarHBondContact O-N 2.96Å; S357-K361 VanDerWaalsContact O-N 3.07Å | ||
| 358 | V | 92.7 | Very high | 93.5 | Very high | 20 Ų | 20 | 69.1 Ų | 69.1 | 12% | 0.121 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -55.4 | -43.5 | 176.5 | -179.5 | 0 | 0 | 0 | 0 | 111.4 | D322 H323 Q360 K361 V362 | D322-V358 HydrophobicContact CB-CG1 4.31Å; D322-V358 HydrophobicContact CB-CG2 4.04Å; H323-V358 VanDerWaalsContact CE1-CG2 3.4Å; H323-V358 WeakPolarHBondContact CE1-CG2 3.28Å; V358-Q360 VanDerWaalsContact C-N 3.34Å; V358-Q360 PolarHBondContact O-N 3.29Å; V358-K361 WeakPolarHBondContact O-CB 3.47Å; V358-K361 PolarHBondContact O-N 3.42Å; V358-K361 VanDerWaalsContact O-N 3.09Å; V358-V362 HydrophobicContact CG1-CG2 4.3Å; V358-V362 WeakPolarHBondContact O-CG2 3.27Å; V358-V362 PolarHBondContact O-N 3.23Å |
| 359 | K | 92.7 | Very high | 93.3 | Very high | 120 Ų | 120 | 72.6 Ų | 72.6 | 52% | 0.522 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -55.4 | -48.7 | 178.1 | -67.7 | 173.6 | -178.4 | 159.4 | 0 | 111.6 | D316 S357 K361 V362 D363 | D316-K359 IonicContact OD1-NZ 2.94Å; D316-K359 PolarHBondContact OD1-NZ 3.18Å; D316-K359 VanDerWaalsContact OD1-NZ 3.14Å; D316-K359 WeakPolarHBondContact OD2-CE 3.45Å; D316-K359 IonicContact OD2-NZ 2.9Å; D316-K359 PolarHBondContact OD2-NZ 2.99Å; S357-K359 VanDerWaalsContact C-N 3.26Å; S357-K359 PolarHBondContact O-N 2.69Å; K359-K361 VanDerWaalsContact C-N 3.32Å; K359-K361 PolarHBondContact O-N 3.35Å; K359-V362 PolarHBondContact O-N 3.42Å; K359-V362 VanDerWaalsContact O-N 3.16Å; K359-D363 PolarHBondContact O-N 3Å |
| 360 | Q | 93.7 | Very high | 93.2 | Very high | 85 Ų | 85 | 75 Ų | 75 | 40% | 0.397 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.7 | -39.3 | 178.1 | -68.3 | 171 | -14.9 | 0 | 0 | 111.9 | L356 S357 V358 V362 D363 H364 | L356-Q360 HydrophobicContact CB-CB 4.38Å; L356-Q360 HydrophobicContact CD2-CB 4.39Å; L356-Q360 VanDerWaalsContact CD2-OE1 3.24Å; S357-Q360 PolarHBondContact O-N 3.48Å; S357-Q360 WeakPolarHBondContact OG-CG 3.37Å; V358-Q360 VanDerWaalsContact C-N 3.34Å; V358-Q360 PolarHBondContact O-N 3.29Å; Q360-V362 VanDerWaalsContact C-N 3.33Å; Q360-V362 PolarHBondContact O-N 3.04Å; Q360-D363 PolarHBondContact O-N 2.97Å; Q360-H364 PolarHBondContact O-CD2 3.07Å; Q360-H364 PolarHBondContact O-N 3.01Å |
| 361 | K | 93.8 | Very high | 93.1 | Very high | 2 Ų | 2 | 78.9 Ų | 78.9 | 1% | 0.009 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.6 | -40 | 176.1 | -64.2 | 179.3 | -169.3 | -160.6 | 0 | 111.6 | H323 L326 L350 N353 L356 S357 V358 K359 H364 I365 | H323-K361 PolarHBondContact CD2-NZ 3.03Å; L326-K361 HydrophobicContact CD1-CB 4.29Å; L326-K361 HydrophobicContact CD1-CD 4.21Å; L326-K361 HydrophobicContact CD2-CB 4.25Å; L326-K361 HydrophobicContact CD2-CD 4.49Å; L350-K361 HydrophobicContact CB-CD 4.38Å; L350-K361 HydrophobicContact CB-CG 4.29Å; L350-K361 HydrophobicContact CD1-CB 4.46Å; L350-K361 HydrophobicContact CD2-CG 4.4Å; L350-K361 VanDerWaalsContact O-CE 3.26Å; L350-K361 WeakPolarHBondContact O-CE 3.24Å; L350-K361 PolarHBondContact O-NZ 3.03Å; N353-K361 PolarHBondContact O-NZ 3.47Å; L356-K361 HydrophobicContact CB-CG 4.11Å; L356-K361 WeakPolarHBondContact O-CE 3.46Å; S357-K361 WeakPolarHBondContact O-CG 3.38Å; S357-K361 PolarHBondContact O-N 2.96Å; S357-K361 VanDerWaalsContact O-N 3.07Å; V358-K361 WeakPolarHBondContact O-CB 3.47Å; V358-K361 PolarHBondContact O-N 3.42Å; V358-K361 VanDerWaalsContact O-N 3.09Å; K359-K361 VanDerWaalsContact C-N 3.32Å; K359-K361 PolarHBondContact O-N 3.35Å; K361-H364 PolarHBondContact O-N 3.04Å; K361-I365 WeakPolarHBondContact O-CG1 3.34Å; K361-I365 PolarHBondContact O-N 3.5Å |
| 362 | V | 93.1 | Very high | 93 | Very high | 21 Ų | 21 | 78.4 Ų | 78.4 | 13% | 0.127 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -65.8 | -46.2 | 175.8 | 175.6 | 0 | 0 | 0 | 0 | 110.7 | H329 V358 K359 Q360 H364 I365 E366 | H329-V362 WeakPolarHBondContact NE2-CG2 3.47Å; V358-V362 HydrophobicContact CG1-CG2 4.3Å; V358-V362 WeakPolarHBondContact O-CG2 3.27Å; V358-V362 PolarHBondContact O-N 3.23Å; K359-V362 PolarHBondContact O-N 3.42Å; K359-V362 VanDerWaalsContact O-N 3.16Å; Q360-V362 VanDerWaalsContact C-N 3.33Å; Q360-V362 PolarHBondContact O-N 3.04Å; V362-H364 PolarHBondContact O-N 3.28Å; V362-I365 WeakPolarHBondContact O-CA 3.46Å; V362-I365 WeakPolarHBondContact O-CB 3.29Å; V362-I365 PolarHBondContact O-N 3.41Å; V362-E366 HydrophobicContact CG1-CG 4.23Å; V362-E366 PolarHBondContact O-N 2.74Å |
| 363 | D | 94.7 | Very high | 92.6 | Very high | 95 Ų | 95 | 74 Ų | 74 | 51% | 0.508 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -56.3 | -39.8 | 177.3 | -65.1 | -17.4 | 0 | 0 | 0 | 111.7 | K359 Q360 I365 E366 W367 | K359-D363 PolarHBondContact O-N 3Å; Q360-D363 PolarHBondContact O-N 2.97Å; D363-I365 PolarHBondContact O-N 3.23Å; D363-E366 PolarHBondContact O-N 2.89Å; D363-W367 WeakPolarHBondContact O-CB 3.38Å; D363-W367 PolarHBondContact O-N 3.02Å |
| 364 | H | 94.3 | Very high | 92.5 | Very high | 88 Ų | 88 | 78.6 Ų | 78.6 | 41% | 0.407 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -61.5 | -41.6 | 174.6 | -82.2 | -66.7 | 0 | 0 | 0 | 112.7 | L350 Q360 K361 V362 F368 | L350-H364 HydrophobicContact CD1-CB 4.13Å; L350-H364 HydrophobicContact CD2-CB 4.42Å; Q360-H364 PolarHBondContact O-CD2 3.07Å; Q360-H364 PolarHBondContact O-N 3.01Å; K361-H364 PolarHBondContact O-N 3.04Å; V362-H364 PolarHBondContact O-N 3.28Å; H364-F368 WeakPolarHBondContact O-CD2 3.32Å; H364-F368 PolarHBondContact O-N 3.03Å |
| 365 | I | 92.4 | Very high | 92.4 | Very high | 4 Ų | 4 | 77 Ų | 77 | 2% | 0.021 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -69.6 | -42.2 | 179.2 | -64 | 167.4 | 0 | 0 | 0 | 110.4 | L326 H329 F333 M343 T347 L350 K361 V362 D363 W367 F368 R369 | L326-I365 HydrophobicContact CB-CD1 4.14Å; L326-I365 HydrophobicContact CD1-CD1 4.45Å; H329-I365 HydrophobicContact CB-CD1 3.98Å; H329-I365 HydrophobicContact CB-CG2 4.15Å; F333-I365 HydrophobicContact CE2-CG2 3.82Å; F333-I365 HydrophobicContact CZ-CG2 4.28Å; M343-I365 HydrophobicContact CE-CG1 4.47Å; M343-I365 HydrophobicContact CE-CG2 3.99Å; T347-I365 HydrophobicContact CG2-CD1 4.03Å; T347-I365 HydrophobicContact CG2-CG1 4.5Å; L350-I365 HydrophobicContact CD1-CD1 4.36Å; L350-I365 HydrophobicContact CD1-CG1 4Å; K361-I365 WeakPolarHBondContact O-CG1 3.34Å; K361-I365 PolarHBondContact O-N 3.5Å; V362-I365 WeakPolarHBondContact O-CA 3.46Å; V362-I365 WeakPolarHBondContact O-CB 3.29Å; V362-I365 PolarHBondContact O-N 3.41Å; D363-I365 PolarHBondContact O-N 3.23Å; I365-W367 VanDerWaalsContact C-N 3.31Å; I365-W367 PolarHBondContact O-N 3.47Å; I365-F368 PolarHBondContact O-N 3.09Å; I365-R369 PolarHBondContact O-N 3.45Å |
| 366 | E | 92.4 | Very high | 92 | Very high | 100 Ų | 100 | 70.3 Ų | 70.3 | 47% | 0.467 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.5 | -37.6 | 176.4 | -70.3 | -172.7 | 176.5 | 0 | 0 | 112.1 | V362 D363 F368 R369 N370 | V362-E366 HydrophobicContact CG1-CG 4.23Å; V362-E366 PolarHBondContact O-N 2.74Å; D363-E366 PolarHBondContact O-N 2.89Å; E366-F368 VanDerWaalsContact C-N 3.34Å; E366-F368 PolarHBondContact O-N 3.21Å; E366-R369 WeakPolarHBondContact O-CB 3.25Å; E366-R369 PolarHBondContact O-N 3.42Å; E366-R369 VanDerWaalsContact O-N 3.16Å; E366-N370 PolarHBondContact O-N 3.04Å |
| 367 | W | 95.3 | Very high | 91.7 | Very high | 151 Ų | 151 | 73.9 Ų | 73.9 | 57% | 0.572 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -58.9 | -45.2 | 173.3 | -177.8 | 86.4 | 0 | 0 | 0 | 111.9 | D363 I365 R369 N370 Y371 | D363-W367 WeakPolarHBondContact O-CB 3.38Å; D363-W367 PolarHBondContact O-N 3.02Å; I365-W367 VanDerWaalsContact C-N 3.31Å; I365-W367 PolarHBondContact O-N 3.47Å; W367-R369 VanDerWaalsContact C-N 3.31Å; W367-R369 PolarHBondContact O-N 3.02Å; W367-N370 PolarHBondContact O-N 3.35Å; W367-Y371 HydrophobicContact CH2-CD2 4.21Å; W367-Y371 HydrophobicContact CH2-CG 4.4Å; W367-Y371 HydrophobicContact CZ2-CD2 4.39Å; W367-Y371 WeakPolarHBondContact O-CB 3.24Å; W367-Y371 PolarHBondContact O-N 2.7Å |
| 368 | F | 92.1 | Very high | 91.5 | Very high | 37 Ų | 37 | 76.9 Ų | 76.9 | 16% | 0.162 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.3 | -39.7 | 175 | -79.6 | -67.7 | 0 | 0 | 0 | 112.1 | F333 F342 M343 V346 H364 I365 E366 N370 Y371 F372 | F333-F368 HydrophobicContact CE1-CB 4.49Å; F333-F368 HydrophobicContact CZ-CB 4.29Å; F342-F368 AromaticContact CE1-CD1 3.82Å; F342-F368 HydrophobicContact CE1-CD1 3.82Å; F342-F368 AromaticContact CE1-CE1 3.52Å; F342-F368 HydrophobicContact CE1-CE1 3.52Å; F342-F368 HydrophobicContact CE1-CZ 4.03Å; F342-F368 HydrophobicContact CZ-CD1 4.43Å; F342-F368 AromaticContact CZ-CE1 3.68Å; F342-F368 HydrophobicContact CZ-CE1 3.68Å; F342-F368 AromaticContact CZ-CZ 4Å; F342-F368 HydrophobicContact CZ-CZ 4Å; M343-F368 HydrophobicContact CE-CB 4.14Å; M343-F368 HydrophobicContact CE-CD2 4.31Å; M343-F368 HydrophobicContact CE-CG 4.45Å; M343-F368 HydrophobicContact SD-CB 3.85Å; M343-F368 HydrophobicContact SD-CD2 4.25Å; M343-F368 HydrophobicContact SD-CG 3.98Å; V346-F368 HydrophobicContact CG1-CD2 4.14Å; V346-F368 HydrophobicContact CG1-CE2 3.73Å; V346-F368 HydrophobicContact CG2-CE2 4.06Å; V346-F368 HydrophobicContact CG2-CZ 4.17Å; H364-F368 WeakPolarHBondContact O-CD2 3.32Å; H364-F368 PolarHBondContact O-N 3.03Å; I365-F368 PolarHBondContact O-N 3.09Å; E366-F368 VanDerWaalsContact C-N 3.34Å; E366-F368 PolarHBondContact O-N 3.21Å; F368-N370 PolarHBondContact O-N 3.49Å; F368-Y371 PolarHBondContact O-N 2.84Å; F368-F372 HydrophobicContact CB-CD2 4.42Å; F368-F372 HydrophobicContact CB-CE2 4.16Å; F368-F372 HydrophobicContact CD1-CE2 4.3Å; F368-F372 WeakPolarHBondContact O-CD2 3.38Å; F368-F372 PolarHBondContact O-N 3.35Å |
| 369 | R | 89.8 | Confident | 91.1 | Very high | 122 Ų | 122 | 77.2 Ų | 77.2 | 46% | 0.46 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.2 | -47.5 | 176.7 | -172.2 | -177.3 | 179.6 | -169.6 | -0.8 | 111.2 | F333 I365 E366 W367 F372 N373 | F333-R369 HydrophobicContact CE2-CB 4.39Å; F333-R369 HydrophobicContact CZ-CB 3.93Å; I365-R369 PolarHBondContact O-N 3.45Å; E366-R369 WeakPolarHBondContact O-CB 3.25Å; E366-R369 PolarHBondContact O-N 3.42Å; E366-R369 VanDerWaalsContact O-N 3.16Å; W367-R369 VanDerWaalsContact C-N 3.31Å; W367-R369 PolarHBondContact O-N 3.02Å; R369-F372 PolarHBondContact O-N 3.33Å; R369-N373 VanDerWaalsContact O-CG 3.31Å; R369-N373 PolarHBondContact O-N 3.29Å; R369-N373 VanDerWaalsContact O-N 3.09Å; R369-N373 PolarHBondContact O-ND2 3.12Å |
| 370 | N | 92.7 | Very high | 90.6 | Very high | 92 Ų | 92 | 78.1 Ų | 78.1 | 49% | 0.492 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 177.4 | -67.4 | -15 | 0 | 0 | 0 | 111.4 | E366 W367 F368 F372 N373 E374 | E366-N370 PolarHBondContact O-N 3.04Å; W367-N370 PolarHBondContact O-N 3.35Å; F368-N370 PolarHBondContact O-N 3.49Å; N370-F372 PolarHBondContact O-N 3.07Å; N370-N373 WeakPolarHBondContact O-CB 3.45Å; N370-N373 PolarHBondContact O-N 3.42Å; N370-E374 WeakPolarHBondContact O-CG 3.34Å; N370-E374 PolarHBondContact O-N 3.48Å |
| 371 | Y | 93 | Very high | 90.2 | Very high | 102 Ų | 102 | 81.4 Ų | 81.4 | 40% | 0.4 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -59.9 | -46.1 | 177.2 | 179.8 | -96.6 | 0 | 0 | 0 | 112.8 | W367 F368 N373 E374 K375 | W367-Y371 HydrophobicContact CH2-CD2 4.21Å; W367-Y371 HydrophobicContact CH2-CG 4.4Å; W367-Y371 HydrophobicContact CZ2-CD2 4.39Å; W367-Y371 WeakPolarHBondContact O-CB 3.24Å; W367-Y371 PolarHBondContact O-N 2.7Å; F368-Y371 PolarHBondContact O-N 2.84Å; Y371-N373 VanDerWaalsContact C-N 3.32Å; Y371-N373 PolarHBondContact O-N 3.45Å; Y371-E374 PolarHBondContact O-N 3.19Å; Y371-K375 HydrophobicContact CE1-CG 4.22Å; Y371-K375 HydrophobicContact CE2-CG 4.22Å; Y371-K375 WeakPolarHBondContact O-CG 3.49Å; Y371-K375 PolarHBondContact O-N 3.5Å; Y371-K375 VanDerWaalsContact O-N 3.11Å |
| 372 | F | 90.4 | Very high | 89.6 | Confident | 23 Ų | 23 | 86.5 Ų | 86.5 | 10% | 0.101 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -67.8 | -33.5 | 177.4 | -69.9 | -59.5 | 0 | 0 | 0 | 112.5 | F333 I339 F342 M343 F368 R369 N370 K375 Q376 L379 F386 | F333-F372 HydrophobicContact CD1-CD2 4.45Å; F333-F372 AromaticContact CE1-CD2 3.8Å; F333-F372 HydrophobicContact CE1-CD2 3.8Å; F333-F372 HydrophobicContact CE1-CE2 4.04Å; I339-F372 HydrophobicContact CD1-CD1 4.44Å; I339-F372 HydrophobicContact CG1-CE1 4.48Å; I339-F372 HydrophobicContact CG2-CD2 4.29Å; I339-F372 HydrophobicContact CG2-CE2 3.98Å; I339-F372 HydrophobicContact CG2-CZ 4.14Å; F342-F372 HydrophobicContact CD1-CZ 4.13Å; F342-F372 HydrophobicContact CE1-CZ 4.29Å; M343-F372 HydrophobicContact SD-CE2 4.21Å; F368-F372 HydrophobicContact CB-CD2 4.42Å; F368-F372 HydrophobicContact CB-CE2 4.16Å; F368-F372 HydrophobicContact CD1-CE2 4.3Å; F368-F372 WeakPolarHBondContact O-CD2 3.38Å; F368-F372 PolarHBondContact O-N 3.35Å; R369-F372 PolarHBondContact O-N 3.33Å; N370-F372 PolarHBondContact O-N 3.07Å; F372-K375 CarbonylContact O-C 3.53Å; F372-K375 PolarHBondContact O-N 3.07Å; F372-Q376 WeakPolarHBondContact O-CG 3.3Å; F372-Q376 PolarHBondContact O-N 3.17Å; F372-L379 HydrophobicContact CB-CD1 4.3Å; F372-L379 HydrophobicContact CD1-CD1 4.11Å; F372-F386 HydrophobicContact CB-CD1 4.48Å; F372-F386 HydrophobicContact CB-CD2 4.06Å; F372-F386 HydrophobicContact CB-CE1 4.18Å; F372-F386 HydrophobicContact CB-CE2 3.71Å; F372-F386 HydrophobicContact CB-CG 4.42Å; F372-F386 HydrophobicContact CB-CZ 3.77Å; F372-F386 HydrophobicContact CD2-CE2 4.15Å; F372-F386 HydrophobicContact CG-CD2 4.5Å; F372-F386 HydrophobicContact CG-CE2 4.11Å |
| 373 | N | 87.4 | Confident | 88.9 | Confident | 68 Ų | 68 | 94.9 Ų | 94.9 | 36% | 0.364 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63 | -40.7 | 172.9 | -75.9 | -28.7 | 0 | 0 | 0 | 112.4 | R369 N370 Y371 K375 Q376 F386 | R369-N373 VanDerWaalsContact O-CG 3.31Å; R369-N373 PolarHBondContact O-N 3.29Å; R369-N373 VanDerWaalsContact O-N 3.09Å; R369-N373 PolarHBondContact O-ND2 3.12Å; N370-N373 WeakPolarHBondContact O-CB 3.45Å; N370-N373 PolarHBondContact O-N 3.42Å; Y371-N373 VanDerWaalsContact C-N 3.32Å; Y371-N373 PolarHBondContact O-N 3.45Å; N373-K375 VanDerWaalsContact C-N 3.31Å; N373-K375 PolarHBondContact O-N 2.85Å; N373-Q376 WeakPolarHBondContact O-CG 3.11Å; N373-Q376 PolarHBondContact OD1-NE2 3.45Å; N373-F386 VanDerWaalsContact OD1-CE1 3.25Å; N373-F386 WeakPolarHBondContact OD1-CE1 3.44Å |
| 374 | E | 91.5 | Very high | 87.9 | Confident | 142 Ų | 142 | 91.8 Ų | 91.8 | 66% | 0.664 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -69.5 | -27.2 | 175.5 | -71.3 | -178.1 | -174.1 | 0 | 0 | 113.3 | N370 Y371 | N370-E374 WeakPolarHBondContact O-CG 3.34Å; N370-E374 PolarHBondContact O-N 3.48Å; Y371-E374 PolarHBondContact O-N 3.19Å |
| 375 | K | 90.7 | Very high | 86.7 | Confident | 79 Ų | 79 | 95.5 Ų | 95.5 | 34% | 0.343 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.3 | 19.2 | -176.3 | -56.9 | -53.9 | 176.4 | -164.3 | 0 | 114 | Y371 F372 N373 D377 I378 L379 | Y371-K375 HydrophobicContact CE1-CG 4.22Å; Y371-K375 HydrophobicContact CE2-CG 4.22Å; Y371-K375 WeakPolarHBondContact O-CG 3.49Å; Y371-K375 PolarHBondContact O-N 3.5Å; Y371-K375 VanDerWaalsContact O-N 3.11Å; F372-K375 CarbonylContact O-C 3.53Å; F372-K375 PolarHBondContact O-N 3.07Å; N373-K375 VanDerWaalsContact C-N 3.31Å; N373-K375 PolarHBondContact O-N 2.85Å; K375-D377 PolarHBondContact O-N 3.24Å; K375-I378 HydrophobicContact CB-CD1 4.37Å; K375-I378 HydrophobicContact CD-CD1 3.94Å; K375-I378 PolarHBondContact O-N 2.83Å; K375-I378 VanDerWaalsContact O-N 3.1Å; K375-L379 WeakPolarHBondContact O-CG 3.33Å; K375-L379 PolarHBondContact O-N 3.4Å; K375-L379 VanDerWaalsContact O-N 3.16Å |
| 376 | Q | 83 | Confident | 85.5 | Confident | 66 Ų | 66 | 96.2 Ų | 96.2 | 31% | 0.308 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -55.4 | -34.9 | -179.9 | -76.1 | -175.9 | 5 | 0 | 0 | 113.8 | F372 N373 I378 L379 K380 | F372-Q376 WeakPolarHBondContact O-CG 3.3Å; F372-Q376 PolarHBondContact O-N 3.17Å; N373-Q376 WeakPolarHBondContact O-CG 3.11Å; N373-Q376 PolarHBondContact OD1-NE2 3.45Å; Q376-I378 VanDerWaalsContact C-N 3.34Å; Q376-I378 PolarHBondContact O-N 3.27Å; Q376-L379 PolarHBondContact O-N 3.39Å; Q376-K380 WeakPolarHBondContact O-CG 3.21Å; Q376-K380 PolarHBondContact O-N 3.17Å |
| 377 | D | 87 | Confident | 83.9 | Confident | 113 Ų | 113 | 99.4 Ų | 99.4 | 60% | 0.604 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62.7 | -42 | 179 | -62.9 | -29 | 0 | 0 | 0 | 111.7 | K375 L379 K380 E381 | K375-D377 PolarHBondContact O-N 3.24Å; D377-L379 VanDerWaalsContact C-N 3.33Å; D377-L379 PolarHBondContact O-N 3.17Å; D377-K380 PolarHBondContact O-N 3.07Å; D377-E381 WeakPolarHBondContact O-CG 3.23Å; D377-E381 PolarHBondContact O-N 3.28Å; D377-E381 VanDerWaalsContact O-N 3.08Å |
| 378 | I | 89.7 | Confident | 83.3 | Confident | 85 Ų | 85 | 96.8 Ų | 96.8 | 44% | 0.436 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.6 | -36.7 | 176.6 | -52.8 | 178.8 | 0 | 0 | 0 | 110.5 | K375 Q376 E381 N382 | K375-I378 HydrophobicContact CB-CD1 4.37Å; K375-I378 HydrophobicContact CD-CD1 3.94Å; K375-I378 PolarHBondContact O-N 2.83Å; K375-I378 VanDerWaalsContact O-N 3.1Å; Q376-I378 VanDerWaalsContact C-N 3.34Å; Q376-I378 PolarHBondContact O-N 3.27Å; I378-E381 PolarHBondContact O-N 3.16Å; I378-N382 PolarHBondContact O-N 3.19Å; I378-N382 PolarHBondContact O-ND2 3.48Å |
| 379 | L | 83.8 | Confident | 82.9 | Confident | 26 Ų | 26 | 99.9 Ų | 99.9 | 14% | 0.136 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -67.1 | -40.2 | 178.1 | -63.1 | 175.3 | 0 | 0 | 0 | 111.4 | I339 F372 K375 Q376 D377 N382 K383 V384 F386 | I339-L379 HydrophobicContact CD1-CD1 4.1Å; I339-L379 HydrophobicContact CD1-CD2 4.18Å; F372-L379 HydrophobicContact CB-CD1 4.3Å; F372-L379 HydrophobicContact CD1-CD1 4.11Å; K375-L379 WeakPolarHBondContact O-CG 3.33Å; K375-L379 PolarHBondContact O-N 3.4Å; K375-L379 VanDerWaalsContact O-N 3.16Å; Q376-L379 PolarHBondContact O-N 3.39Å; D377-L379 VanDerWaalsContact C-N 3.33Å; D377-L379 PolarHBondContact O-N 3.17Å; L379-N382 CarbonylContact O-C 3.39Å; L379-N382 PolarHBondContact O-N 3.11Å; L379-K383 PolarHBondContact O-N 3.36Å; L379-V384 CarbonylContact C-O 3.49Å; L379-V384 PolarHBondContact O-N 3.07Å; L379-F386 HydrophobicContact CD1-CB 3.9Å; L379-F386 HydrophobicContact CD1-CG 4.34Å |
| 380 | K | 82.6 | Confident | 82.5 | Confident | 140 Ų | 140 | 98.7 Ų | 98.7 | 61% | 0.609 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.2 | -42.8 | 174 | -72.4 | 171.8 | -174.6 | 167.6 | 0 | 112 | Q376 D377 N382 K383 | Q376-K380 WeakPolarHBondContact O-CG 3.21Å; Q376-K380 PolarHBondContact O-N 3.17Å; D377-K380 PolarHBondContact O-N 3.07Å; K380-N382 PolarHBondContact O-N 3.2Å; K380-K383 PolarHBondContact O-N 3.34Å; K380-K383 VanDerWaalsContact O-N 3.13Å |
| 381 | E | 85.6 | Confident | 81.9 | Confident | 153 Ų | 153 | 99.1 Ų | 99.1 | 72% | 0.715 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -58.5 | -35.9 | 174.6 | -73.1 | 175.9 | -175.6 | 0 | 0 | 112.3 | D377 I378 K383 | D377-E381 WeakPolarHBondContact O-CG 3.23Å; D377-E381 PolarHBondContact O-N 3.28Å; D377-E381 VanDerWaalsContact O-N 3.08Å; I378-E381 PolarHBondContact O-N 3.16Å; E381-K383 VanDerWaalsContact C-N 3.33Å; E381-K383 PolarHBondContact O-N 3.34Å |
| 382 | N | 80.4 | Confident | 81.2 | Confident | 109 Ų | 109 | 98.9 Ų | 98.9 | 58% | 0.583 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.4 | 9.8 | -179.8 | -72.9 | -80.5 | 0 | 0 | 0 | 114 | I378 L379 K380 V384 | I378-N382 PolarHBondContact O-N 3.19Å; I378-N382 PolarHBondContact O-ND2 3.48Å; L379-N382 CarbonylContact O-C 3.39Å; L379-N382 PolarHBondContact O-N 3.11Å; K380-N382 PolarHBondContact O-N 3.2Å; N382-V384 PolarHBondContact O-N 2.92Å |
| 383 | K | 77.3 | Confident | 80.6 | Confident | 198 Ų | 198 | 104 Ų | 104 | 86% | 0.861 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.9 | 31.9 | -178.3 | -52.2 | 177.8 | -179.4 | 178.7 | 0 | 113.8 | L379 K380 E381 | L379-K383 PolarHBondContact O-N 3.36Å; K380-K383 PolarHBondContact O-N 3.34Å; K380-K383 VanDerWaalsContact O-N 3.13Å; E381-K383 VanDerWaalsContact C-N 3.33Å; E381-K383 PolarHBondContact O-N 3.34Å |
| 384 | V | 73.9 | Confident | 80.1 | Confident | 30 Ų | 30 | 106.6 Ų | 106.6 | 18% | 0.182 | 52% | 0.523 | C | S | . | . | trans | -107.6 | 112 | 173.2 | -176.8 | 0 | 0 | 0 | 0 | 108.1 | I339 L379 N382 | I339-V384 HydrophobicContact CD1-CG1 3.59Å; I339-V384 HydrophobicContact CG1-CG1 3.99Å; L379-V384 CarbonylContact C-O 3.49Å; L379-V384 PolarHBondContact O-N 3.07Å; N382-V384 PolarHBondContact O-N 2.92Å | ||
| 385 | E | 69.1 | Low | 79.2 | Confident | 165 Ų | 165 | 103.8 Ų | 103.8 | 77% | 0.771 | 51% | 0.512 | S | S | * | . | trans | -83.3 | 121.7 | 176.7 | -67.5 | -179.3 | -177.3 | 0 | 0 | 110 | ||||
| 386 | F | 67.6 | Low | 78.3 | Confident | 20 Ų | 20 | 105.9 Ų | 105.9 | 9% | 0.088 | 53% | 0.526 | C | S | . | . | trans | -111.6 | 102.1 | 171.3 | -169.9 | -89.9 | 0 | 0 | 0 | 106.9 | F333 P334 I339 F372 N373 L379 | F333-F386 AromaticContact CD1-CE2 3.77Å; F333-F386 HydrophobicContact CD1-CE2 3.77Å; F333-F386 HydrophobicContact CD1-CZ 4.18Å; F333-F386 HydrophobicContact CE1-CE2 4.27Å; F333-F386 HydrophobicContact CE1-CZ 4.44Å; P334-F386 HydrophobicContact CG-CD2 4.1Å; I339-F386 HydrophobicContact CD1-CB 4.43Å; I339-F386 HydrophobicContact CD1-CD2 3.68Å; I339-F386 HydrophobicContact CD1-CE2 4.48Å; I339-F386 HydrophobicContact CG2-CD2 4.33Å; I339-F386 HydrophobicContact CG2-CE2 4.19Å; F372-F386 HydrophobicContact CB-CD1 4.48Å; F372-F386 HydrophobicContact CB-CD2 4.06Å; F372-F386 HydrophobicContact CB-CE1 4.18Å; F372-F386 HydrophobicContact CB-CE2 3.71Å; F372-F386 HydrophobicContact CB-CG 4.42Å; F372-F386 HydrophobicContact CB-CZ 3.77Å; F372-F386 HydrophobicContact CD2-CE2 4.15Å; F372-F386 HydrophobicContact CG-CD2 4.5Å; F372-F386 HydrophobicContact CG-CE2 4.11Å; N373-F386 VanDerWaalsContact OD1-CE1 3.25Å; N373-F386 WeakPolarHBondContact OD1-CE1 3.44Å; L379-F386 HydrophobicContact CD1-CB 3.9Å; L379-F386 HydrophobicContact CD1-CG 4.34Å | ||
| 387 | T | 59.2 | Low | 77.8 | Confident | 166 Ų | 166 | 109.5 Ų | 109.5 | 100% | 1.018 | 55% | 0.546 | S | S | * | . | trans | -126.2 | 0 | 174.8 | 47.8 | 0 | 0 | 0 | 0 | 110.5 |
Retrieved 387 of 387 residues in 140.8 ms
(Link to these results)