| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.1 | Very low | 39.2 | Very low | 256 Ų | 256 | 150.9 Ų | 150.9 | 100% | 1.261 | 81% | 0.807 | S | S | * | * | 0 | 134.1 | 0 | -81.2 | 168.3 | 164.4 | 0 | 0 | 106.7 | |||||
| 2 | E | 38.3 | Very low | 39.1 | Very low | 184 Ų | 184 | 149.8 Ų | 149.8 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | -106.6 | 163.9 | -161.8 | -175.4 | 59.1 | 92.9 | 0 | 0 | 111.9 | ||||
| 3 | S | 35.8 | Very low | 39 | Very low | 80 Ų | 80 | 147.6 Ų | 147.6 | 56% | 0.559 | 81% | 0.813 | S | S | * | * | trans | 77.9 | 146.6 | 165.9 | -119.2 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 4 | R | 40.6 | Very low | 39.2 | Very low | 216 Ų | 216 | 145.1 Ų | 145.1 | 82% | 0.815 | 81% | 0.81 | S | S | * | * | cis | -156.5 | 141.2 | 12.6 | -166.1 | 170.1 | -73.8 | 170.8 | -8.8 | 112.2 | ||||
| 5 | V | 43.4 | Very low | 39.2 | Very low | 121 Ų | 121 | 142.6 Ų | 142.6 | 73% | 0.733 | 81% | 0.807 | S | S | * | * | trans | -101.1 | 147.4 | 163.6 | 175.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 6 | P | 47.1 | Very low | 39.4 | Very low | 118 Ų | 118 | 144.3 Ų | 144.3 | 77% | 0.766 | 81% | 0.812 | S | S | * | * | -136.2 | 166.9 | 127.2 | 22.7 | -2.9 | 0 | 0 | 0 | 114.6 | |||||
| 7 | H | 39.1 | Very low | 39.5 | Very low | 169 Ų | 169 | 144.8 Ų | 144.8 | 78% | 0.782 | 81% | 0.81 | S | S | * | * | trans | -88.9 | 169.4 | -165.4 | -72.6 | -108.7 | 0 | 0 | 0 | 117 | ||||
| 8 | H | 33.1 | Very low | 39.6 | Very low | 173 Ų | 173 | 143.1 Ų | 143.1 | 80% | 0.801 | 81% | 0.809 | S | S | * | * | trans | 106.4 | 149.1 | 131.1 | -112.6 | -79.5 | 0 | 0 | 0 | 122 | ||||
| 9 | I | 39.1 | Very low | 39.4 | Very low | 146 Ų | 146 | 144.9 Ų | 144.9 | 75% | 0.749 | 81% | 0.811 | S | S | * | * | trans | -137.1 | 141.5 | -163.6 | -57.4 | 164.3 | 0 | 0 | 0 | 105.3 | ||||
| 10 | P | 43.6 | Very low | 39.5 | Very low | 125 Ų | 125 | 143.8 Ų | 143.8 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | -157.8 | 176.3 | 65.3 | 43.9 | -22.4 | 0 | 0 | 0 | 120.6 | |||||
| 11 | G | 32.1 | Very low | 39.7 | Very low | 72 Ų | 72 | 144.3 Ų | 144.3 | 74% | 0.742 | 81% | 0.81 | S | S | * | * | trans | 94.1 | 143.3 | 153.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 12 | V | 37.5 | Very low | 39.7 | Very low | 138 Ų | 138 | 139.9 Ų | 139.9 | 84% | 0.836 | 79% | 0.791 | S | S | * | * | cis | -148.4 | 143.9 | 1.7 | -82.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 13 | S | 38.5 | Very low | 39.7 | Very low | 121 Ų | 121 | 136.8 Ų | 136.8 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | trans | -96.8 | 115.7 | 176.4 | -63.8 | 0 | 0 | 0 | 0 | 111.5 | S15 | S13-S15 PolarHBondContact O-N 3.02Š| ||
| 14 | S | 41.9 | Very low | 39.6 | Very low | 112 Ų | 112 | 137.7 Ų | 137.7 | 78% | 0.783 | 79% | 0.786 | S | S | * | * | trans | -89 | 95.2 | 173.3 | -64.7 | 0 | 0 | 0 | 0 | 111.3 | L16 | S14-L16 PolarHBondContact O-N 2.81Š| ||
| 15 | S | 39.2 | Very low | 39.6 | Very low | 108 Ų | 108 | 138.1 Ų | 138.1 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | -80.3 | 98.2 | 173.1 | 38.8 | 0 | 0 | 0 | 0 | 111.7 | S13 I17 | S13-S15 PolarHBondContact O-N 3.02Å; S15-I17 PolarHBondContact O-N 3.48Å | ||
| 16 | L | 41.6 | Very low | 39.5 | Very low | 170 Ų | 170 | 137.6 Ų | 137.6 | 89% | 0.89 | 78% | 0.784 | S | S | * | * | trans | -80.5 | 101 | 167 | -69.3 | 174.7 | 0 | 0 | 0 | 109.9 | S14 | S14-L16 PolarHBondContact O-N 2.81Š| ||
| 17 | I | 42.1 | Very low | 39.5 | Very low | 152 Ų | 152 | 137.4 Ų | 137.4 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 116.6 | 166.3 | -86 | 169.4 | 0 | 0 | 0 | 108.9 | S15 | S15-I17 PolarHBondContact O-N 3.48Š|
| 18 | S | 40.9 | Very low | 39.5 | Very low | 114 Ų | 114 | 139.5 Ų | 139.5 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 120 | 170.9 | 39.4 | 0 | 0 | 0 | 0 | 109.9 | ||
| 19 | Q | 36.3 | Very low | 39.8 | Very low | 178 Ų | 178 | 134.6 Ų | 134.6 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -82 | 136.6 | 170.3 | -72.2 | -168.4 | -31.1 | 0 | 0 | 110.8 | ||
| 20 | P | 41.4 | Very low | 40 | Very low | 123 Ų | 123 | 138.4 Ų | 138.4 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 137.1 | 172.9 | 30.3 | -32.9 | 0 | 0 | 0 | 111.3 | L22 | P20-L22 PolarHBondContact O-N 3.1Š|
| 21 | L | 42.7 | Very low | 39.8 | Very low | 154 Ų | 154 | 140 Ų | 140 | 81% | 0.806 | 79% | 0.788 | S | S | * | * | trans | -72.5 | 113.1 | -178.2 | -160.2 | 179.8 | 0 | 0 | 0 | 110.2 | D23 | L21-D23 HydrophobicContact CD2-CB 4.05Š| ||
| 22 | L | 39.8 | Very low | 40.4 | Very low | 164 Ų | 164 | 143.6 Ų | 143.6 | 86% | 0.859 | 79% | 0.786 | S | S | * | * | trans | -102 | 98 | 164.4 | -85.1 | 170.6 | 0 | 0 | 0 | 109.9 | P20 S24 | P20-L22 PolarHBondContact O-N 3.1Å; L22-S24 PolarHBondContact O-N 3.26Å | ||
| 23 | D | 38.4 | Very low | 40.7 | Very low | 118 Ų | 118 | 144.6 Ų | 144.6 | 63% | 0.631 | 78% | 0.781 | S | S | * | * | trans | -69.8 | 123.6 | 167.6 | -176.9 | 41.5 | 0 | 0 | 0 | 109.2 | L21 | L21-D23 HydrophobicContact CD2-CB 4.05Š| ||
| 24 | S | 32.9 | Very low | 41.1 | Very low | 99 Ų | 99 | 144.7 Ų | 144.7 | 69% | 0.692 | 78% | 0.779 | S | S | * | * | trans | -151.8 | 84.3 | 171.4 | -82.9 | 0 | 0 | 0 | 0 | 109.5 | L22 V26 | L22-S24 PolarHBondContact O-N 3.26Å; S24-V26 PolarHBondContact O-N 3.38Å; S24-V26 VanDerWaalsContact O-N 3.11Å | ||
| 25 | R | 40.8 | Very low | 41.5 | Very low | 226 Ų | 226 | 146.5 Ų | 146.5 | 85% | 0.853 | 78% | 0.779 | S | S | * | * | trans | -59.7 | 110.7 | 167.1 | -72.4 | -177.8 | -179.4 | 158.1 | 1.3 | 110.2 | ||||
| 26 | V | 41 | Very low | 42.4 | Very low | 109 Ų | 109 | 146.6 Ų | 146.6 | 66% | 0.661 | 78% | 0.775 | S | S | * | * | trans | -115.9 | 115.3 | 162.4 | -173.2 | 0 | 0 | 0 | 0 | 108.1 | S24 Y28 | S24-V26 PolarHBondContact O-N 3.38Å; S24-V26 VanDerWaalsContact O-N 3.11Å; V26-Y28 HydrophobicContact CG1-CD2 3.77Å; V26-Y28 HydrophobicContact CG1-CE2 3.96Å; V26-Y28 PolarHBondContact O-N 2.96Å | ||
| 27 | P | 48.7 | Very low | 43.2 | Very low | 115 Ų | 115 | 145.9 Ų | 145.9 | 75% | 0.747 | 77% | 0.77 | S | S | * | * | trans | -92.1 | 93.1 | -172 | 34.4 | -32.8 | 0 | 0 | 0 | 111.8 | ||||
| 28 | Y | 39 | Very low | 44.3 | Very low | 212 Ų | 212 | 145.8 Ų | 145.8 | 83% | 0.831 | 76% | 0.761 | S | S | * | * | trans | -135.2 | 128.3 | 168.7 | -73.4 | -68.6 | 0 | 0 | 0 | 114.1 | V26 | V26-Y28 HydrophobicContact CG1-CD2 3.77Å; V26-Y28 HydrophobicContact CG1-CE2 3.96Å; V26-Y28 PolarHBondContact O-N 2.96Å | ||
| 29 | G | 38.5 | Very low | 45.2 | Very low | 71 Ų | 71 | 144.3 Ų | 144.3 | 73% | 0.732 | 75% | 0.749 | S | S | * | * | trans | 67.6 | 78.5 | 131 | 0 | 0 | 0 | 0 | 0 | 118 | L31 | G29-L31 PolarHBondContact O-N 2.04Å; G29-L31 VanDerWaalsContact O-N 3.12Å | ||
| 30 | R | 43.9 | Very low | 46.3 | Very low | 225 Ų | 225 | 142.4 Ų | 142.4 | 85% | 0.849 | 74% | 0.743 | S | S | * | * | trans | -30.7 | 108.6 | 157.9 | -171.1 | -167.6 | -159.1 | 176.5 | 7.9 | 113.9 | ||||
| 31 | L | 39.4 | Very low | 47 | Very low | 158 Ų | 158 | 143.5 Ų | 143.5 | 83% | 0.827 | 74% | 0.742 | S | S | * | * | trans | -133.1 | 94.6 | 162.9 | -121.2 | 159.4 | 0 | 0 | 0 | 108.9 | G29 H33 | G29-L31 PolarHBondContact O-N 2.04Å; G29-L31 VanDerWaalsContact O-N 3.12Å; L31-H33 PolarHBondContact O-N 3.4Å | ||
| 32 | Q | 44.3 | Very low | 47.3 | Very low | 149 Ų | 149 | 142.4 Ų | 142.4 | 70% | 0.696 | 73% | 0.733 | S | S | * | * | trans | -86.4 | 100.8 | 179.8 | -72.7 | 179.6 | -49.6 | 0 | 0 | 110.2 | ||||
| 33 | H | 44.3 | Very low | 48.1 | Very low | 158 Ų | 158 | 140 Ų | 140 | 73% | 0.731 | 72% | 0.72 | S | S | * | * | trans | -144.9 | 117.5 | 153.7 | -81.1 | 96.5 | 0 | 0 | 0 | 108.1 | L31 L35 | L31-H33 PolarHBondContact O-N 3.4Å; H33-L35 PolarHBondContact O-N 2.92Å | ||
| 34 | P | 45.8 | Very low | 48.9 | Very low | 124 Ų | 124 | 143.8 Ų | 143.8 | 81% | 0.805 | 73% | 0.731 | S | S | * | * | trans | -74.4 | 97.5 | 173.8 | 30 | -31.4 | 0 | 0 | 0 | 109 | T36 | P34-T36 PolarHBondContact O-N 3.37Š| ||
| 35 | L | 50 | Low | 49.7 | Very low | 150 Ų | 150 | 144.4 Ų | 144.4 | 79% | 0.785 | 74% | 0.735 | S | S | * | * | trans | -70.8 | 110.2 | 161.4 | -70.3 | 172.9 | 0 | 0 | 0 | 107.5 | H33 I37 | H33-L35 PolarHBondContact O-N 2.92Å; L35-I37 VanDerWaalsContact C-N 3.28Å; L35-I37 PolarHBondContact O-N 2.93Å | ||
| 36 | T | 58.5 | Low | 50.1 | Low | 110 Ų | 110 | 137.8 Ų | 137.8 | 68% | 0.675 | 72% | 0.723 | S | S | * | * | trans | -69.9 | 87.1 | 174.8 | -53.1 | 0 | 0 | 0 | 0 | 109.4 | P34 Y38 | P34-T36 PolarHBondContact O-N 3.37Å; T36-Y38 HydrophobicContact CG2-CD2 3.88Å; T36-Y38 HydrophobicContact CG2-CE2 3.51Å; T36-Y38 PolarHBondContact O-N 2.88Å | ||
| 37 | I | 59.2 | Low | 50.9 | Low | 154 Ų | 154 | 140 Ų | 140 | 79% | 0.79 | 73% | 0.726 | S | S | * | * | trans | -75.1 | 104.9 | 172.8 | -61.3 | 167.2 | 0 | 0 | 0 | 107.3 | L35 | L35-I37 VanDerWaalsContact C-N 3.28Å; L35-I37 PolarHBondContact O-N 2.93Å | ||
| 38 | Y | 64.6 | Low | 51.2 | Low | 151 Ų | 151 | 139.9 Ų | 139.9 | 59% | 0.592 | 72% | 0.723 | S | S | * | * | trans | -71.9 | 145.5 | 172.6 | -82.7 | -96.3 | 0 | 0 | 0 | 110.7 | T36 | T36-Y38 HydrophobicContact CG2-CD2 3.88Å; T36-Y38 HydrophobicContact CG2-CE2 3.51Å; T36-Y38 PolarHBondContact O-N 2.88Å | ||
| 39 | P | 58.8 | Low | 51.9 | Low | 82 Ų | 82 | 136.6 Ų | 136.6 | 53% | 0.532 | 72% | 0.715 | S | S | . | * | trans | -63.8 | 147 | 176 | 26.3 | -33.7 | 0 | 0 | 0 | 111.8 | D41 Q42 | P39-D41 PolarHBondContact O-N 3.22Å; P39-Q42 PolarHBondContact O-N 3.49Å | ||
| 40 | I | 61 | Low | 52.4 | Low | 138 Ų | 138 | 139.7 Ų | 139.7 | 71% | 0.708 | 72% | 0.715 | S | S | * | * | G | 310 helix | trans | -56.8 | -27.6 | -169.7 | -70.4 | 175.5 | 0 | 0 | 0 | 113.2 | Q42 I43 | I40-Q42 PolarHBondContact O-N 3.16Å; I40-Q42 VanDerWaalsContact O-N 3.1Å; I40-I43 HydrophobicContact CB-CD1 4.29Å; I40-I43 HydrophobicContact CG1-CD1 4.23Å; I40-I43 HydrophobicContact CG2-CD1 4.24Å; I40-I43 WeakPolarHBondContact O-CB 3.17Å; I40-I43 WeakPolarHBondContact O-CG1 3.41Å; I40-I43 PolarHBondContact O-N 2.86Å |
| 41 | D | 55.8 | Low | 53.5 | Low | 146 Ų | 146 | 135.8 Ų | 135.8 | 78% | 0.781 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -63.1 | -17.1 | -178.3 | -56.4 | -58.3 | 0 | 0 | 0 | 114.5 | P39 | P39-D41 PolarHBondContact O-N 3.22Š|
| 42 | Q | 49.5 | Very low | 54.1 | Low | 132 Ų | 132 | 138.7 Ų | 138.7 | 62% | 0.617 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -88.5 | -6.4 | 174.7 | -70.7 | -166.7 | 5.8 | 0 | 0 | 114.8 | P39 I40 K44 | P39-Q42 PolarHBondContact O-N 3.49Å; I40-Q42 PolarHBondContact O-N 3.16Å; I40-Q42 VanDerWaalsContact O-N 3.1Å; Q42-K44 PolarHBondContact O-N 2.78Å |
| 43 | I | 54.9 | Low | 55 | Low | 113 Ų | 113 | 138.2 Ų | 138.2 | 58% | 0.579 | 71% | 0.713 | S | S | * | * | trans | -73.1 | -15 | -178 | -54.4 | 172.4 | 0 | 0 | 0 | 111.3 | I40 S45 | I40-I43 HydrophobicContact CB-CD1 4.29Å; I40-I43 HydrophobicContact CG1-CD1 4.23Å; I40-I43 HydrophobicContact CG2-CD1 4.24Å; I40-I43 WeakPolarHBondContact O-CB 3.17Å; I40-I43 WeakPolarHBondContact O-CG1 3.41Å; I40-I43 PolarHBondContact O-N 2.86Å; I43-S45 VanDerWaalsContact C-N 3.33Å; I43-S45 PolarHBondContact O-N 3.18Å | ||
| 44 | K | 55.2 | Low | 55.2 | Low | 198 Ų | 198 | 137.6 Ų | 137.6 | 86% | 0.861 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | 54.1 | -171.7 | -158 | -172.6 | 177.8 | -175.9 | 0 | 114.6 | Q42 | Q42-K44 PolarHBondContact O-N 2.78Š|
| 45 | S | 51 | Low | 55.3 | Low | 111 Ų | 111 | 135.5 Ų | 135.5 | 78% | 0.776 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -163.7 | -5.4 | 160.4 | 59.4 | 0 | 0 | 0 | 0 | 116.3 | I43 H47 | I43-S45 VanDerWaalsContact C-N 3.33Å; I43-S45 PolarHBondContact O-N 3.18Å; S45-H47 VanDerWaalsContact C-N 3.27Å; S45-H47 PolarHBondContact O-N 2.81Å |
| 46 | S | 48.3 | Very low | 55.1 | Low | 88 Ų | 88 | 134.9 Ų | 134.9 | 62% | 0.615 | 71% | 0.709 | S | S | * | * | trans | -77.4 | 79.5 | 170.3 | 61.1 | 0 | 0 | 0 | 0 | 110.6 | V48 | S46-V48 PolarHBondContact O-N 3.23Š| ||
| 47 | H | 57.6 | Low | 54.5 | Low | 155 Ų | 155 | 133.8 Ų | 133.8 | 72% | 0.718 | 71% | 0.711 | S | S | * | * | trans | -70.7 | 76.3 | 165.8 | -169.4 | -87.8 | 0 | 0 | 0 | 109.2 | S45 E49 | S45-H47 VanDerWaalsContact C-N 3.27Å; S45-H47 PolarHBondContact O-N 2.81Å; H47-E49 VanDerWaalsContact C-N 3.35Å; H47-E49 IonicContact CE1-OE2 3.38Å; H47-E49 PolarHBondContact CE1-OE2 3.26Å; H47-E49 PolarHBondContact O-N 3.16Å; H47-E49 VanDerWaalsContact O-N 3.09Å | ||
| 48 | V | 56.1 | Low | 53.9 | Low | 113 Ų | 113 | 132.8 Ų | 132.8 | 69% | 0.685 | 71% | 0.712 | S | S | * | * | trans | -69.2 | 99.7 | 162 | 164.1 | 0 | 0 | 0 | 0 | 106.2 | S46 N50 | S46-V48 PolarHBondContact O-N 3.23Å; V48-N50 PolarHBondContact O-N 2.98Å | ||
| 49 | E | 52.6 | Low | 52.8 | Low | 143 Ų | 143 | 132.8 Ų | 132.8 | 67% | 0.668 | 73% | 0.727 | S | S | * | * | trans | -66.9 | 123.7 | 167.7 | -168.5 | 144.2 | 79.5 | 0 | 0 | 107.6 | H47 D51 | H47-E49 VanDerWaalsContact C-N 3.35Å; H47-E49 IonicContact CE1-OE2 3.38Å; H47-E49 PolarHBondContact CE1-OE2 3.26Å; H47-E49 PolarHBondContact O-N 3.16Å; H47-E49 VanDerWaalsContact O-N 3.09Å; E49-D51 PolarHBondContact O-N 3.48Å; E49-D51 VanDerWaalsContact O-N 3.12Å | ||
| 50 | N | 50.6 | Low | 52.2 | Low | 135 Ų | 135 | 133.1 Ų | 133.1 | 72% | 0.722 | 74% | 0.737 | S | S | * | * | trans | -78.1 | 95.2 | 174.5 | -85.2 | -44.5 | 0 | 0 | 0 | 108.4 | V48 Y52 | V48-N50 PolarHBondContact O-N 2.98Å; N50-Y52 PolarHBondContact O-N 2.81Å | ||
| 51 | D | 65.3 | Low | 51 | Low | 143 Ų | 143 | 135.9 Ų | 135.9 | 77% | 0.765 | 75% | 0.747 | S | S | * | * | trans | -59.1 | 98.4 | 164.1 | -95.1 | -52.1 | 0 | 0 | 0 | 109.3 | E49 I53 | E49-D51 PolarHBondContact O-N 3.48Å; E49-D51 VanDerWaalsContact O-N 3.12Å; D51-I53 PolarHBondContact O-N 3.31Å; D51-I53 VanDerWaalsContact O-N 3.1Å | ||
| 52 | Y | 53.6 | Low | 49.9 | Very low | 219 Ų | 219 | 138 Ų | 138 | 86% | 0.859 | 75% | 0.752 | S | S | * | * | trans | -73.1 | 101.6 | 176.4 | -121.1 | -93.6 | 0 | 0 | 0 | 108.7 | N50 D54 | N50-Y52 PolarHBondContact O-N 2.81Å; Y52-D54 PolarHBondContact O-N 2.77Å | ||
| 53 | I | 61.6 | Low | 49.5 | Very low | 139 Ų | 139 | 137.2 Ų | 137.2 | 71% | 0.713 | 76% | 0.758 | S | S | * | * | trans | -70.4 | 99.6 | 174.5 | -56.8 | -60.2 | 0 | 0 | 0 | 109 | D51 S55 | D51-I53 PolarHBondContact O-N 3.31Å; D51-I53 VanDerWaalsContact O-N 3.1Å; I53-S55 PolarHBondContact O-N 3Å | ||
| 54 | D | 50 | Low | 48.4 | Very low | 145 Ų | 145 | 139 Ų | 139 | 78% | 0.775 | 77% | 0.774 | S | S | * | * | trans | -70.8 | 125.8 | 170.1 | -156 | -52.7 | 0 | 0 | 0 | 109.6 | Y52 | Y52-D54 PolarHBondContact O-N 2.77Š| ||
| 55 | S | 46.4 | Very low | 47.3 | Very low | 81 Ų | 81 | 133.7 Ų | 133.7 | 57% | 0.566 | 76% | 0.762 | S | S | * | * | trans | 73.7 | 95.8 | 179.6 | -57.9 | 0 | 0 | 0 | 0 | 118 | I53 A57 | I53-S55 PolarHBondContact O-N 3Å; S55-A57 PolarHBondContact O-N 3.04Å | ||
| 56 | P | 45.7 | Very low | 46.5 | Very low | 137 Ų | 137 | 137 Ų | 137 | 89% | 0.89 | 77% | 0.765 | S | S | * | * | trans | -80.2 | 43.2 | 176.2 | 36.4 | -37.9 | 0 | 0 | 0 | 113.2 | ||||
| 57 | A | 46.3 | Very low | 45.7 | Very low | 87 Ų | 87 | 142.5 Ų | 142.5 | 72% | 0.719 | 78% | 0.778 | S | S | * | * | trans | -101 | -8.3 | -168.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | S55 | S55-A57 PolarHBondContact O-N 3.04Š| ||
| 58 | V | 47.1 | Very low | 44.4 | Very low | 133 Ų | 133 | 140.2 Ų | 140.2 | 81% | 0.806 | 78% | 0.78 | S | S | * | * | trans | -136.2 | 64.5 | -174.8 | -164 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 59 | V | 41.3 | Very low | 43.2 | Very low | 150 Ų | 150 | 139.4 Ų | 139.4 | 91% | 0.909 | 79% | 0.785 | S | S | * | * | trans | -128 | 68.1 | 157.4 | -171.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 60 | A | 45.8 | Very low | 42.2 | Very low | 90 Ų | 90 | 139.9 Ų | 139.9 | 74% | 0.744 | 79% | 0.792 | S | S | * | * | trans | -135.1 | 63 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 61 | Q | 37.5 | Very low | 41.3 | Very low | 196 Ų | 196 | 142.2 Ų | 142.2 | 92% | 0.916 | 80% | 0.798 | S | S | * | * | trans | -156.2 | 117.9 | 164 | -113 | 156.3 | 45.3 | 0 | 0 | 112.2 | ||||
| 62 | Q | 32.1 | Very low | 39.5 | Very low | 189 Ų | 189 | 139.3 Ų | 139.3 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -80.8 | 163.1 | 159.7 | -99.9 | -178.3 | -29.5 | 0 | 0 | 110 | ||||
| 63 | P | 40.3 | Very low | 38.3 | Very low | 116 Ų | 116 | 140.3 Ų | 140.3 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | trans | -93.3 | 150.5 | -156.4 | 35.6 | -36.5 | 0 | 0 | 0 | 114.6 | ||||
| 64 | V | 31.2 | Very low | 36.7 | Very low | 151 Ų | 151 | 139.3 Ų | 139.3 | 92% | 0.915 | 81% | 0.808 | S | S | * | * | trans | -145.3 | 150.1 | 145.8 | 174.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 65 | S | 32.9 | Very low | 35.7 | Very low | 87 Ų | 87 | 140.5 Ų | 140.5 | 61% | 0.608 | 81% | 0.809 | S | S | * | * | trans | -76.6 | 157.1 | -175.5 | -163.3 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 66 | Q | 34.9 | Very low | 34.8 | Very low | 179 Ų | 179 | 141 Ų | 141 | 84% | 0.836 | 81% | 0.813 | S | S | * | * | trans | 73.9 | 116.8 | 146.8 | -84.6 | 169.6 | 29.4 | 0 | 0 | 123 | ||||
| 67 | K | 31 | Very low | 34.3 | Very low | 204 Ų | 204 | 143.1 Ų | 143.1 | 89% | 0.887 | 81% | 0.81 | S | S | * | * | 113.6 | 136.3 | 120.8 | -158.6 | 170.2 | -177.6 | 179 | 0 | 118.8 | |||||
| 68 | S | 29.5 | Very low | 34 | Very low | 108 Ų | 108 | 143.7 Ų | 143.7 | 76% | 0.755 | 81% | 0.807 | S | S | * | * | trans | -53.3 | 148.3 | -168 | -46.5 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 69 | A | 31.3 | Very low | 33.4 | Very low | 96 Ų | 96 | 146.3 Ų | 146.3 | 79% | 0.793 | 81% | 0.81 | S | S | * | * | trans | 53.8 | 123.2 | 134.7 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 70 | N | 31.4 | Very low | 33.6 | Very low | 152 Ų | 152 | 144 Ų | 144 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | -166.5 | 171.1 | 93.7 | -153.7 | -0.6 | 0 | 0 | 0 | 112.6 | |||||
| 71 | H | 31.6 | Very low | 33 | Very low | 185 Ų | 185 | 147.5 Ų | 147.5 | 86% | 0.856 | 80% | 0.804 | S | S | * | * | trans | -52.5 | 151.9 | 175.4 | -84.5 | -90.9 | 0 | 0 | 0 | 116.3 | ||||
| 72 | G | 28.9 | Very low | 32.8 | Very low | 82 Ų | 82 | 143.8 Ų | 143.8 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | trans | -177.7 | 94.4 | 160.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 73 | R | 28.3 | Very low | 32.9 | Very low | 240 Ų | 240 | 140.2 Ų | 140.2 | 91% | 0.906 | 79% | 0.786 | S | S | * | * | trans | -107.8 | 122.9 | 173 | 169.9 | -170.6 | 173 | -144.3 | -3 | 109.2 | ||||
| 74 | C | 28.1 | Very low | 32.7 | Very low | 118 Ų | 118 | 139.8 Ų | 139.8 | 80% | 0.797 | 78% | 0.781 | S | S | * | * | trans | -177.7 | 160.5 | 158 | -93 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 75 | E | 28.8 | Very low | 33 | Very low | 170 Ų | 170 | 140.4 Ų | 140.4 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | cis | -157.7 | 156.4 | -37 | -170.9 | 156.7 | 94.3 | 0 | 0 | 106.2 | ||||
| 76 | S | 27.8 | Very low | 33.4 | Very low | 91 Ų | 91 | 142.2 Ų | 142.2 | 64% | 0.636 | 78% | 0.784 | S | S | * | * | trans | -77.6 | 143.4 | -178.3 | 47.4 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 77 | H | 33.8 | Very low | 33.4 | Very low | 182 Ų | 182 | 144.4 Ų | 144.4 | 84% | 0.843 | 78% | 0.784 | S | S | * | * | -173.1 | 155.3 | 124.3 | -101.3 | -71.4 | 0 | 0 | 0 | 111.9 | |||||
| 78 | P | 41 | Very low | 34.2 | Very low | 99 Ų | 99 | 141.4 Ų | 141.4 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | trans | -105.3 | 164.4 | -170.4 | 40.1 | -33.5 | 0 | 0 | 0 | 113.6 | ||||
| 79 | H | 33.2 | Very low | 34.2 | Very low | 187 Ų | 187 | 141.6 Ų | 141.6 | 87% | 0.866 | 78% | 0.778 | S | S | * | * | trans | -165.6 | 159.6 | 135 | -106.1 | -75.2 | 0 | 0 | 0 | 109.7 | ||||
| 80 | P | 46.8 | Very low | 34.4 | Very low | 103 Ų | 103 | 147.7 Ų | 147.7 | 67% | 0.669 | 79% | 0.787 | S | S | * | * | trans | -94.2 | 161.4 | -160.1 | 37.6 | -36.6 | 0 | 0 | 0 | 113.4 | ||||
| 81 | D | 32.3 | Very low | 34.6 | Very low | 163 Ų | 163 | 146.2 Ų | 146.2 | 87% | 0.872 | 79% | 0.789 | S | S | * | * | trans | -152.7 | 160.5 | 145.4 | -110.2 | -36.9 | 0 | 0 | 0 | 113.2 | ||||
| 82 | T | 34.6 | Very low | 34.6 | Very low | 118 Ų | 118 | 141.3 Ų | 141.3 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | trans | -76.9 | 157.2 | -165 | 49.9 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 83 | T | 33.6 | Very low | 35.2 | Very low | 113 Ų | 113 | 149 Ų | 149 | 69% | 0.693 | 79% | 0.792 | S | S | * | * | trans | 122.5 | 126.4 | 136.6 | -47.4 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 84 | T | 36.2 | Very low | 36.3 | Very low | 107 Ų | 107 | 142.6 Ų | 142.6 | 66% | 0.656 | 78% | 0.781 | S | S | * | * | trans | 78.5 | 134.1 | 154.2 | 26.2 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 85 | H | 36.9 | Very low | 36.4 | Very low | 165 Ų | 165 | 143.1 Ų | 143.1 | 76% | 0.764 | 79% | 0.786 | S | S | * | * | trans | 82.9 | 113.3 | 162.3 | -55.1 | -55.2 | 0 | 0 | 0 | 119.3 | W87 | H85-W87 PolarHBondContact O-N 2.78Š| ||
| 86 | P | 42.5 | Very low | 36.6 | Very low | 124 Ų | 124 | 140.3 Ų | 140.3 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | trans | -89.8 | 103.6 | 176 | 34.3 | -30.4 | 0 | 0 | 0 | 111.4 | ||||
| 87 | W | 34.9 | Very low | 37 | Very low | 226 Ų | 226 | 144.3 Ų | 144.3 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | trans | -129.1 | 100.2 | 158.5 | -102.1 | 79.6 | 0 | 0 | 0 | 110.4 | H85 | H85-W87 PolarHBondContact O-N 2.78Š| ||
| 88 | I | 46.7 | Very low | 37 | Very low | 141 Ų | 141 | 141.1 Ų | 141.1 | 72% | 0.723 | 80% | 0.796 | S | S | * | * | trans | 23 | 107 | 154.5 | -17.1 | 175.5 | 0 | 0 | 0 | 117.4 | ||||
| 89 | S | 29.8 | Very low | 36.8 | Very low | 112 Ų | 112 | 142.3 Ų | 142.3 | 78% | 0.783 | 81% | 0.807 | S | S | * | * | trans | -160.8 | 112.8 | 151.4 | -84.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 90 | F | 35.6 | Very low | 37 | Very low | 223 Ų | 223 | 138.6 Ų | 138.6 | 98% | 0.978 | 80% | 0.801 | S | S | * | * | trans | -129.2 | 112.7 | 159.8 | -99.2 | -80.3 | 0 | 0 | 0 | 108 | ||||
| 91 | S | 35.8 | Very low | 36.5 | Very low | 122 Ų | 122 | 138.6 Ų | 138.6 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | trans | -134.3 | 118.2 | 168.6 | 49.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 92 | G | 31.1 | Very low | 36.7 | Very low | 82 Ų | 82 | 136.6 Ų | 136.6 | 85% | 0.845 | 80% | 0.803 | S | S | * | * | trans | -167.6 | 88.9 | -174.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 93 | R | 41.3 | Very low | 37.2 | Very low | 243 Ų | 243 | 137.6 Ų | 137.6 | 92% | 0.917 | 81% | 0.809 | S | S | * | * | trans | -87.8 | 179 | 171.1 | -99.6 | -173.7 | -179.3 | -158.3 | 2.8 | 109.9 | ||||
| 94 | P | 51.1 | Low | 37.4 | Very low | 106 Ų | 106 | 138.3 Ų | 138.3 | 69% | 0.688 | 82% | 0.819 | S | S | * | * | cis | -132 | 170.7 | -8.1 | 33.8 | -15.9 | 0 | 0 | 0 | 114.9 | ||||
| 95 | S | 31.1 | Very low | 37.7 | Very low | 128 Ų | 128 | 138.3 Ų | 138.3 | 90% | 0.895 | 82% | 0.823 | S | S | * | * | trans | -160.8 | 149.4 | 130 | -83 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 96 | S | 33 | Very low | 38.6 | Very low | 111 Ų | 111 | 136.6 Ų | 136.6 | 78% | 0.776 | 82% | 0.82 | S | S | * | * | trans | -99 | 145.3 | -164.2 | -43 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 97 | I | 36.4 | Very low | 38.5 | Very low | 175 Ų | 175 | 139.2 Ų | 139.2 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | -161.6 | 144.7 | 115.6 | 37 | 171.5 | 0 | 0 | 0 | 109.8 | |||||
| 98 | S | 33.2 | Very low | 38.9 | Very low | 115 Ų | 115 | 139.3 Ų | 139.3 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | trans | -92.1 | 149.9 | -175.5 | -48.2 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 99 | S | 36.4 | Very low | 38.6 | Very low | 125 Ų | 125 | 138.7 Ų | 138.7 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | -152.7 | 120.1 | 138.4 | -87.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 100 | S | 37.1 | Very low | 39.2 | Very low | 108 Ų | 108 | 141.7 Ų | 141.7 | 76% | 0.755 | 83% | 0.825 | S | S | * | * | trans | -63.4 | 164.1 | 168.3 | -45.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 101 | S | 36.9 | Very low | 39.1 | Very low | 104 Ų | 104 | 136.5 Ų | 136.5 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | cis | -162.1 | 156.4 | 33.6 | -49.1 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 102 | S | 37.4 | Very low | 39.3 | Very low | 121 Ų | 121 | 138.6 Ų | 138.6 | 85% | 0.846 | 80% | 0.804 | S | S | * | * | trans | 67.7 | 106.4 | 144.4 | -54.6 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 103 | T | 45.3 | Very low | 39.6 | Very low | 139 Ų | 139 | 139.9 Ų | 139.9 | 85% | 0.853 | 81% | 0.806 | S | S | * | * | trans | -81.9 | 149.7 | 154 | 49.8 | 0 | 0 | 0 | 0 | 112 | ||||
| 104 | S | 36.6 | Very low | 39.3 | Very low | 128 Ų | 128 | 132.5 Ų | 132.5 | 90% | 0.895 | 80% | 0.797 | S | S | * | * | trans | -151.6 | 143.2 | 147.8 | -167.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 105 | S | 41.8 | Very low | 38.8 | Very low | 107 Ų | 107 | 133.6 Ų | 133.6 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | -96.2 | 160.6 | -152.7 | -52 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 106 | D | 57.1 | Low | 38.9 | Very low | 129 Ų | 129 | 133.2 Ų | 133.2 | 69% | 0.69 | 80% | 0.797 | S | S | * | * | trans | -52.1 | 136.1 | 165.5 | -52.8 | -105.9 | 0 | 0 | 0 | 113.6 | ||||
| 107 | Q | 39.8 | Very low | 39.1 | Very low | 179 Ų | 179 | 133.4 Ų | 133.4 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | -178.2 | 115.3 | 119.1 | -123.7 | 95.2 | 94.8 | 0 | 0 | 111.2 | |||||
| 108 | R | 43.3 | Very low | 39 | Very low | 227 Ų | 227 | 130.8 Ų | 130.8 | 86% | 0.857 | 79% | 0.787 | S | S | * | * | 178.9 | 153 | 129.3 | -100.8 | 179.6 | 96 | 142.1 | 5.4 | 113 | |||||
| 109 | L | 41 | Very low | 39.2 | Very low | 128 Ų | 128 | 130.9 Ų | 130.9 | 67% | 0.67 | 78% | 0.783 | S | S | * | * | trans | 58.9 | 78.7 | 170.1 | -96.4 | 79.6 | 0 | 0 | 0 | 117.1 | ||||
| 110 | L | 41.6 | Very low | 38.9 | Very low | 175 Ų | 175 | 131.9 Ų | 131.9 | 92% | 0.916 | 78% | 0.778 | S | S | * | * | -53 | 125.8 | 126.7 | -76.4 | 156.1 | 0 | 0 | 0 | 108.6 | |||||
| 111 | D | 33.8 | Very low | 38.8 | Very low | 114 Ų | 114 | 135 Ų | 135 | 61% | 0.61 | 78% | 0.781 | S | S | * | * | trans | -151.1 | 130.5 | 150.6 | -124.8 | -174.1 | 0 | 0 | 0 | 114.2 | ||||
| 112 | H | 39.2 | Very low | 38.7 | Very low | 167 Ų | 167 | 138.6 Ų | 138.6 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | trans | 58.3 | 84.3 | 154.5 | -55.7 | -14.3 | 0 | 0 | 0 | 120.6 | ||||
| 113 | A | 38.1 | Very low | 38.9 | Very low | 109 Ų | 109 | 138.7 Ų | 138.7 | 90% | 0.901 | 78% | 0.783 | S | S | * | * | trans | -137.6 | 65.6 | 153.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 114 | A | 35.1 | Very low | 38.2 | Very low | 87 Ų | 87 | 138.5 Ų | 138.5 | 72% | 0.719 | 78% | 0.777 | S | S | * | * | trans | -140.1 | 118.4 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 115 | P | 40.1 | Very low | 37.9 | Very low | 129 Ų | 129 | 137.9 Ų | 137.9 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | -66.3 | 135.9 | 174.6 | -19.4 | 32.2 | 0 | 0 | 0 | 111.4 | ||||
| 116 | T | 34.3 | Very low | 37.3 | Very low | 121 Ų | 121 | 138.5 Ų | 138.5 | 74% | 0.742 | 77% | 0.768 | S | S | * | * | trans | -71.5 | 134.1 | 172.6 | 43.1 | 0 | 0 | 0 | 0 | 110.9 | T118 | T116-T118 PolarHBondContact O-N 3.32Š| ||
| 117 | P | 36.3 | Very low | 36.1 | Very low | 114 Ų | 114 | 138.5 Ų | 138.5 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | trans | -78.4 | 107.4 | 164.1 | 30.4 | -29.7 | 0 | 0 | 0 | 108.6 | V119 | P117-V119 PolarHBondContact O-N 3.41Š| ||
| 118 | T | 34.5 | Very low | 35.7 | Very low | 120 Ų | 120 | 137 Ų | 137 | 74% | 0.736 | 76% | 0.76 | S | S | * | * | trans | -66.8 | 104.1 | 169.7 | 46.5 | 0 | 0 | 0 | 0 | 109.3 | T116 D120 | T116-T118 PolarHBondContact O-N 3.32Å; T118-D120 PolarHBondContact O-N 2.98Å | ||
| 119 | V | 38.4 | Very low | 35.1 | Very low | 118 Ų | 118 | 135 Ų | 135 | 72% | 0.715 | 76% | 0.761 | S | S | * | * | trans | -87.3 | 97.2 | 167.6 | 178.1 | 0 | 0 | 0 | 0 | 107.3 | P117 H121 | P117-V119 PolarHBondContact O-N 3.41Å; V119-H121 PolarHBondContact O-N 3.26Å | ||
| 120 | D | 29.3 | Very low | 34.6 | Very low | 145 Ų | 145 | 132.4 Ų | 132.4 | 78% | 0.775 | 77% | 0.765 | S | S | * | * | trans | -67.5 | 117.3 | 169.3 | -75.3 | -66.7 | 0 | 0 | 0 | 109.9 | T118 | T118-D120 PolarHBondContact O-N 2.98Š| ||
| 121 | H | 34.2 | Very low | 34.6 | Very low | 175 Ų | 175 | 129.8 Ų | 129.8 | 81% | 0.81 | 76% | 0.759 | S | S | * | * | trans | -111.9 | 127.3 | 165.8 | -105 | 24 | 0 | 0 | 0 | 109.7 | V119 | V119-H121 PolarHBondContact O-N 3.26Š| ||
| 122 | H | 36.3 | Very low | 34.6 | Very low | 179 Ų | 179 | 130.9 Ų | 130.9 | 83% | 0.829 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 144.6 | 179.8 | -86.6 | 48.1 | 0 | 0 | 0 | 112.7 | ||
| 123 | P | 41.6 | Very low | 34.3 | Very low | 122 Ų | 122 | 130.2 Ų | 130.2 | 79% | 0.792 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 126.3 | 146.1 | 31.3 | -27.4 | 0 | 0 | 0 | 109.9 | ||
| 124 | N | 29.2 | Very low | 33.9 | Very low | 136 Ų | 136 | 130.6 Ų | 130.6 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 139.8 | 172.9 | 175.5 | 44.4 | 0 | 0 | 0 | 111.3 | N126 | N124-N126 PolarHBondContact ND2-OD1 2.73Š|
| 125 | S | 30.7 | Very low | 33.8 | Very low | 115 Ų | 115 | 132.6 Ų | 132.6 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | -140.3 | 124.6 | 163.2 | -166.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 126 | N | 30.2 | Very low | 33.4 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 64% | 0.636 | 75% | 0.75 | S | S | * | * | trans | -74.7 | 138.5 | -174 | -56 | -25.2 | 0 | 0 | 0 | 111.5 | N124 | N124-N126 PolarHBondContact ND2-OD1 2.73Š| ||
| 127 | N | 30.5 | Very low | 33 | Very low | 130 Ų | 130 | 131.6 Ų | 131.6 | 70% | 0.695 | 75% | 0.751 | S | S | * | * | 168.7 | 141 | 97.8 | -104.8 | -15.9 | 0 | 0 | 0 | 115.6 | |||||
| 128 | H | 31.1 | Very low | 32.7 | Very low | 147 Ų | 147 | 137.5 Ų | 137.5 | 68% | 0.681 | 76% | 0.759 | S | S | * | * | trans | 67.7 | 122.1 | 144.8 | -73.3 | -53.5 | 0 | 0 | 0 | 124.7 | ||||
| 129 | Q | 32.7 | Very low | 32.5 | Very low | 185 Ų | 185 | 137.7 Ų | 137.7 | 86% | 0.864 | 76% | 0.76 | S | S | * | * | trans | 85.5 | 127 | 137.7 | -66.6 | 172.5 | 46.9 | 0 | 0 | 121.2 | ||||
| 130 | G | 28.6 | Very low | 32.4 | Very low | 74 Ų | 74 | 138.1 Ų | 138.1 | 76% | 0.763 | 77% | 0.765 | S | S | * | * | trans | 145.3 | 123.3 | 166.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 131 | P | 41.9 | Very low | 32.4 | Very low | 120 Ų | 120 | 140.5 Ų | 140.5 | 78% | 0.779 | 77% | 0.768 | S | S | * | * | trans | -127.3 | 173.9 | -162.8 | 39.9 | -23.9 | 0 | 0 | 0 | 118.5 | ||||
| 132 | I | 34.2 | Very low | 32.2 | Very low | 137 Ų | 137 | 136.4 Ų | 136.4 | 70% | 0.703 | 76% | 0.759 | S | S | * | * | trans | 72.2 | 119.8 | 160.1 | -18.2 | -179 | 0 | 0 | 0 | 119.7 | ||||
| 133 | N | 33.8 | Very low | 32.4 | Very low | 152 Ų | 152 | 135.6 Ų | 135.6 | 81% | 0.813 | 76% | 0.76 | S | S | * | * | 175.7 | 111.5 | 115.9 | -84 | -19.8 | 0 | 0 | 0 | 115.3 | |||||
| 134 | T | 28.5 | Very low | 31.9 | Very low | 117 Ų | 117 | 136.6 Ų | 136.6 | 72% | 0.718 | 76% | 0.759 | S | S | * | * | trans | -14.4 | 142.3 | 156.6 | -26.1 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 135 | V | 33.8 | Very low | 32.8 | Very low | 130 Ų | 130 | 138 Ų | 138 | 79% | 0.788 | 77% | 0.766 | S | S | * | * | 172.5 | 100.8 | 114.5 | 163 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 136 | T | 30.4 | Very low | 32.8 | Very low | 104 Ų | 104 | 141.6 Ų | 141.6 | 64% | 0.638 | 77% | 0.767 | S | S | * | * | 53.3 | 115.5 | 124.7 | -35.5 | 0 | 0 | 0 | 0 | 124.6 | |||||
| 137 | T | 26.4 | Very low | 33.4 | Very low | 125 Ų | 125 | 141.7 Ų | 141.7 | 77% | 0.767 | 78% | 0.777 | S | S | * | * | trans | 64.1 | 135.7 | 148.2 | 58 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 138 | R | 30 | Very low | 33.8 | Very low | 238 Ų | 238 | 139.4 Ų | 139.4 | 90% | 0.898 | 78% | 0.776 | S | S | * | * | cis | -150.3 | 148.4 | 42.1 | -74.2 | 179.3 | 169.3 | 175.4 | -4.2 | 113 | ||||
| 139 | T | 31.3 | Very low | 34.1 | Very low | 124 Ų | 124 | 142.4 Ų | 142.4 | 76% | 0.761 | 79% | 0.787 | S | S | * | * | trans | -95.2 | 163.8 | 160.1 | 51.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 140 | P | 36.5 | Very low | 34.5 | Very low | 127 Ų | 127 | 140.8 Ų | 140.8 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | -130.6 | 169 | 102.7 | 37.1 | -29.3 | 0 | 0 | 0 | 114.6 | |||||
| 141 | K | 29.4 | Very low | 35 | Very low | 194 Ų | 194 | 142.3 Ų | 142.3 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | trans | -85.9 | 173.3 | -178 | -33.9 | 163.1 | 179.3 | 169.1 | 0 | 108.9 | ||||
| 142 | S | 29.1 | Very low | 34.8 | Very low | 89 Ų | 89 | 142.4 Ų | 142.4 | 62% | 0.622 | 79% | 0.79 | S | S | * | * | cis | -170.1 | 160.1 | 6 | 63.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 143 | L | 40 | Very low | 35.3 | Very low | 162 Ų | 162 | 139.1 Ų | 139.1 | 85% | 0.848 | 79% | 0.79 | S | S | * | * | trans | 65.4 | 155.8 | 159.7 | -52.4 | 166.8 | 0 | 0 | 0 | 115.1 | ||||
| 144 | D | 31.9 | Very low | 35.8 | Very low | 143 Ų | 143 | 138.7 Ų | 138.7 | 77% | 0.765 | 78% | 0.783 | S | S | * | * | cis | -143.7 | 161.7 | 12.9 | -175.3 | -121.9 | 0 | 0 | 0 | 111.4 | ||||
| 145 | L | 46.8 | Very low | 36.9 | Very low | 167 Ų | 167 | 142.2 Ų | 142.2 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | trans | -97.4 | 102.8 | -176.8 | -170.6 | 78.8 | 0 | 0 | 0 | 112 | ||||
| 146 | K | 32 | Very low | 37.8 | Very low | 190 Ų | 190 | 142.3 Ų | 142.3 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | trans | -134.2 | 113.6 | 167.1 | -162.6 | 169.9 | -175.8 | 177.9 | 0 | 113.6 | A148 | K146-A148 PolarHBondContact O-N 3.48Š| ||
| 147 | S | 42.8 | Very low | 39.4 | Very low | 121 Ų | 121 | 142.8 Ų | 142.8 | 85% | 0.846 | 77% | 0.773 | S | S | * | * | trans | -69.3 | 121.3 | 174.1 | -179.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 148 | A | 37.6 | Very low | 41 | Very low | 82 Ų | 82 | 143 Ų | 143 | 68% | 0.678 | 77% | 0.769 | S | S | * | * | trans | -159.6 | 93.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 112 | K146 I150 | K146-A148 PolarHBondContact O-N 3.48Å; A148-I150 PolarHBondContact O-N 3.05Å | ||
| 149 | K | 38 | Very low | 42.9 | Very low | 209 Ų | 209 | 139.3 Ų | 139.3 | 91% | 0.909 | 76% | 0.759 | S | S | * | * | trans | 35.6 | 82 | 149.7 | -163.8 | 175.5 | 180 | 178.9 | 0 | 117.5 | ||||
| 150 | I | 40.8 | Very low | 45.1 | Very low | 151 Ų | 151 | 137 Ų | 137 | 77% | 0.774 | 75% | 0.745 | S | S | * | * | trans | -83.8 | 128.9 | 165.4 | -59.4 | 176.8 | 0 | 0 | 0 | 109.2 | A148 | A148-I150 PolarHBondContact O-N 3.05Š| ||
| 151 | P | 39.2 | Very low | 47 | Very low | 107 Ų | 107 | 131 Ų | 131 | 70% | 0.695 | 71% | 0.706 | S | S | * | * | trans | -69.1 | 138.6 | 170.3 | 29.3 | -33.2 | 0 | 0 | 0 | 110.5 | G153 | P151-G153 VanDerWaalsContact C-N 3.28Å; P151-G153 PolarHBondContact O-N 3.31Å | ||
| 152 | A | 38.1 | Very low | 49.2 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 100% | 1.008 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -71.2 | 80 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 153 | G | 44.3 | Very low | 51.2 | Low | 67 Ų | 67 | 134 Ų | 134 | 69% | 0.691 | 71% | 0.713 | S | S | * | * | trans | -157.2 | 36.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | P151 | P151-G153 VanDerWaalsContact C-N 3.28Å; P151-G153 PolarHBondContact O-N 3.31Å | ||
| 154 | E | 45 | Very low | 52.9 | Low | 144 Ų | 144 | 128.5 Ų | 128.5 | 67% | 0.673 | 69% | 0.687 | S | S | * | * | trans | -141.9 | 37 | -178.7 | -120.3 | -171.6 | -106.1 | 0 | 0 | 114.7 | K156 | E154-K156 PolarHBondContact O-N 2.05Å; E154-K156 WeakPolarHBondContact OE2-CE 3.33Å | ||
| 155 | K | 51.3 | Low | 54.7 | Low | 191 Ų | 191 | 124.5 Ų | 124.5 | 83% | 0.83 | 68% | 0.68 | S | S | * | * | trans | -74.4 | 76 | 158.4 | -74 | -176.9 | -177.9 | 173.7 | 0 | 108.7 | H157 | K155-H157 PolarHBondContact O-N 3.45Š| ||
| 156 | K | 53.7 | Low | 56.2 | Low | 132 Ų | 132 | 121.1 Ų | 121.1 | 57% | 0.574 | 66% | 0.659 | S | S | * | * | trans | -42.2 | 134 | -173.8 | -60.6 | 176.4 | 179.8 | 177.9 | 0 | 111.5 | E154 L158 | E154-K156 PolarHBondContact O-N 2.05Å; E154-K156 WeakPolarHBondContact OE2-CE 3.33Å; K156-L158 HydrophobicContact CB-CD1 3.75Å; K156-L158 HydrophobicContact CB-CD2 4.19Å; K156-L158 HydrophobicContact CB-CG 3.58Å; K156-L158 HydrophobicContact CD-CD1 4.19Å; K156-L158 PolarHBondContact O-N 3.41Å | ||
| 157 | H | 63.3 | Low | 58.5 | Low | 114 Ų | 114 | 113 Ų | 113 | 53% | 0.528 | 63% | 0.625 | S | S | . | * | trans | -68 | 35.9 | -177.5 | -67.7 | -72.5 | 0 | 0 | 0 | 114.8 | K155 F159 C167 C172 | K155-H157 PolarHBondContact O-N 3.45Å; H157-F159 PolarHBondContact O-N 2.74Å; H157-C167 HydrophobicContact CB-CB 4.35Å; H157-C167 VanDerWaalsContact CB-SG 3.58Å; H157-C167 PolarHBondContact O-SG 2.76Å; H157-C172 PolarHBondContact ND1-SG 2.72Å | ||
| 158 | L | 60.1 | Low | 60.1 | Low | 130 Ų | 130 | 113.1 Ų | 113.1 | 68% | 0.681 | 61% | 0.607 | S | S | * | * | trans | -71.6 | -23.3 | -164.1 | -64.3 | 171.1 | 0 | 0 | 0 | 115 | K156 V160 | K156-L158 HydrophobicContact CB-CD1 3.75Å; K156-L158 HydrophobicContact CB-CD2 4.19Å; K156-L158 HydrophobicContact CB-CG 3.58Å; K156-L158 HydrophobicContact CD-CD1 4.19Å; K156-L158 PolarHBondContact O-N 3.41Å; L158-V160 PolarHBondContact O-N 3.21Å | ||
| 159 | F | 69.5 | Low | 61.9 | Low | 159 Ų | 159 | 110.3 Ų | 110.3 | 70% | 0.697 | 58% | 0.582 | S | S | * | * | trans | -79.9 | 66.7 | 178.2 | -61.6 | -73.3 | 0 | 0 | 0 | 110.6 | H157 R168 | H157-F159 PolarHBondContact O-N 2.74Å; F159-R168 HydrophobicContact CB-CB 4.3Å; F159-R168 WeakPolarHBondContact O-CA 3.02Å; F159-R168 WeakPolarHBondContact O-CB 3.29Å; F159-R168 WeakPolarHBondContact O-CG 3.43Å; F159-R168 PolarHBondContact O-N 2.85Å | ||
| 160 | V | 77.6 | Confident | 63.3 | Low | 76 Ų | 76 | 105.8 Ų | 105.8 | 46% | 0.461 | 57% | 0.572 | S | S | . | * | B | Isolated β-bridge | trans | -77.5 | 143.1 | 174.5 | -176.4 | 0 | 0 | 0 | 0 | 109.6 | L158 G165 | L158-V160 PolarHBondContact O-N 3.21Å; V160-G165 VanDerWaalsContact CG1-C 3.41Å; V160-G165 VanDerWaalsContact CG1-O 3.26Å; V160-G165 WeakPolarHBondContact CG1-O 3.26Å |
| 161 | C | 77.1 | Confident | 64.6 | Low | 0 Ų | 0 | 104.1 Ų | 104.1 | 0% | 0 | 56% | 0.561 | C | S | . | * | trans | -84.5 | 122.2 | 175.7 | -175.2 | 0 | 0 | 0 | 0 | 111.5 | H163 C164 G165 K166 R168 C276 | C161-H163 VanDerWaalsContact C-N 3.27Å; C161-H163 PolarHBondContact O-N 3.36Å; C161-C164 HydrophobicContact CB-CB 4.45Å; C161-C164 VanDerWaalsContact CB-SG 3.53Å; C161-C164 PolarHBondContact O-N 2.74Å; C161-C164 VanDerWaalsContact O-N 3.1Å; C161-G165 PolarHBondContact O-N 3.33Å; C161-K166 PolarHBondContact N-O 3.43Å; C161-R168 HydrophobicContact CB-CG 4.09Å; C161-R168 PolarHBondContact SG-NH2 2.88Å; C161-C276 HydrophobicContact CB-CB 3.72Å; C161-C276 WeakPolarHBondContact CB-SG 3.44Å; C161-C276 PolarHBondContact SG-SG 3.2Å | ||
| 162 | E | 75.9 | Confident | 66 | Low | 198 Ų | 198 | 99.4 Ų | 99.4 | 93% | 0.925 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -33.1 | 178.5 | -64.6 | -179.1 | 121.6 | 0 | 0 | 113.6 | C164 | E162-C164 PolarHBondContact O-N 3.12Š|
| 163 | H | 69.8 | Low | 67.5 | Low | 149 Ų | 149 | 96 Ų | 96 | 69% | 0.69 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | -20.3 | 177 | -74.3 | -61.7 | 0 | 0 | 0 | 115.1 | C161 | C161-H163 VanDerWaalsContact C-N 3.27Å; C161-H163 PolarHBondContact O-N 3.36Å |
| 164 | C | 75.8 | Confident | 68.3 | Low | 46 Ų | 46 | 97.6 Ų | 97.6 | 31% | 0.311 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -136.7 | -7.6 | -166.7 | 93.4 | 0 | 0 | 0 | 0 | 115 | C161 E162 K166 C276 | C161-C164 HydrophobicContact CB-CB 4.45Å; C161-C164 VanDerWaalsContact CB-SG 3.53Å; C161-C164 PolarHBondContact O-N 2.74Å; C161-C164 VanDerWaalsContact O-N 3.1Å; E162-C164 PolarHBondContact O-N 3.12Å; C164-K166 PolarHBondContact O-N 2.82Å; C164-K166 VanDerWaalsContact SG-CB 3.5Å; C164-K166 PolarHBondContact SG-N 3.31Å; C164-K166 VanDerWaalsContact SG-N 3.37Å; C164-C276 WeakPolarHBondContact CB-SG 3.26Å; C164-C276 WeakPolarHBondContact SG-CB 3.35Å; C164-C276 CovalentContact SG-SG 2.04Å; C164-C276 PolarHBondContact SG-SG 3.04Å |
| 165 | G | 69.7 | Low | 68.9 | Low | 60 Ų | 60 | 94.5 Ų | 94.5 | 62% | 0.619 | 48% | 0.482 | S | S | * | . | S | Bend | trans | 66.5 | -1.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | V160 C161 | V160-G165 VanDerWaalsContact CG1-C 3.41Å; V160-G165 VanDerWaalsContact CG1-O 3.26Å; V160-G165 WeakPolarHBondContact CG1-O 3.26Å; C161-G165 PolarHBondContact O-N 3.33Å |
| 166 | K | 77.9 | Confident | 69.4 | Low | 96 Ų | 96 | 91.4 Ų | 91.4 | 42% | 0.417 | 47% | 0.465 | S | S | . | . | trans | -95.1 | 150.3 | -177.9 | -56.8 | -177.3 | 178.5 | -165.2 | 0 | 112.2 | C161 C164 P274 G275 C276 | C161-K166 PolarHBondContact N-O 3.43Å; C164-K166 PolarHBondContact O-N 2.82Å; C164-K166 VanDerWaalsContact SG-CB 3.5Å; C164-K166 PolarHBondContact SG-N 3.31Å; C164-K166 VanDerWaalsContact SG-N 3.37Å; K166-P274 WeakPolarHBondContact CB-O 3.4Å; K166-G275 WeakPolarHBondContact CD-O 3.49Å; K166-C276 HydrophobicContact CB-CB 3.96Å | ||
| 167 | C | 81.3 | Confident | 69.8 | Low | 18 Ų | 18 | 88.8 Ų | 88.8 | 12% | 0.122 | 47% | 0.468 | C | S | . | . | B | Isolated β-bridge | trans | -68.3 | 140.4 | 178.6 | -166.7 | 0 | 0 | 0 | 0 | 112.3 | H157 C169 C172 G275 C276 | H157-C167 HydrophobicContact CB-CB 4.35Å; H157-C167 VanDerWaalsContact CB-SG 3.58Å; H157-C167 PolarHBondContact O-SG 2.76Å; C167-C169 PolarHBondContact SG-N 3.3Å; C167-C169 VanDerWaalsContact SG-N 3.41Å; C167-C172 HydrophobicContact CB-CB 4.25Å; C167-G275 CarbonylContact O-C 3.48Å; C167-G275 WeakPolarHBondContact O-CA 3.32Å; C167-C276 PolarHBondContact O-N 3.1Å |
| 168 | R | 75.6 | Confident | 69.4 | Low | 125 Ų | 125 | 85.8 Ų | 85.8 | 47% | 0.472 | 46% | 0.456 | S | S | . | . | trans | -96 | 10.8 | 174.9 | -58.9 | 177.9 | 171.7 | -173 | 0.7 | 112.6 | F159 C161 C276 | F159-R168 HydrophobicContact CB-CB 4.3Å; F159-R168 WeakPolarHBondContact O-CA 3.02Å; F159-R168 WeakPolarHBondContact O-CB 3.29Å; F159-R168 WeakPolarHBondContact O-CG 3.43Å; F159-R168 PolarHBondContact O-N 2.85Å; C161-R168 HydrophobicContact CB-CG 4.09Å; C161-R168 PolarHBondContact SG-NH2 2.88Å; R168-C276 HydrophobicContact CG-CB 4.2Å | ||
| 169 | C | 75.9 | Confident | 69.3 | Low | 23 Ų | 23 | 82.4 Ų | 82.4 | 16% | 0.155 | 44% | 0.442 | C | S | . | . | trans | -61 | 150.7 | 179.9 | 93.7 | 0 | 0 | 0 | 0 | 111.9 | C167 E171 C172 T173 | C167-C169 PolarHBondContact SG-N 3.3Å; C167-C169 VanDerWaalsContact SG-N 3.41Å; C169-E171 VanDerWaalsContact C-N 3.34Å; C169-E171 PolarHBondContact O-N 3.49Å; C169-C172 HydrophobicContact CB-CB 4.11Å; C169-C172 WeakPolarHBondContact CB-SG 3.33Å; C169-C172 VanDerWaalsContact O-CB 3.28Å; C169-C172 WeakPolarHBondContact O-CB 3.16Å; C169-C172 PolarHBondContact O-N 3.48Å; C169-C172 VanDerWaalsContact O-N 3.09Å; C169-C172 WeakPolarHBondContact SG-CB 3.47Å; C169-C172 PolarHBondContact SG-N 3.24Å; C169-C172 CovalentContact SG-SG 2.05Å; C169-C172 PolarHBondContact SG-SG 3.1Å; C169-T173 WeakPolarHBondContact O-CB 3.46Å; C169-T173 WeakPolarHBondContact O-CG2 3.39Å; C169-T173 PolarHBondContact O-N 2.85Å; C169-T173 PolarHBondContact O-OG1 3.01Å | ||
| 170 | T | 67.4 | Low | 68.6 | Low | 114 Ų | 114 | 77.2 Ų | 77.2 | 70% | 0.699 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -60.1 | -43.4 | -179.5 | 45.7 | 0 | 0 | 0 | 0 | 111.6 | C172 T173 L174 | T170-C172 PolarHBondContact O-N 2.96Å; T170-T173 WeakPolarHBondContact CA-OG1 3.33Å; T170-T173 PolarHBondContact O-N 3.39Å; T170-T173 PolarHBondContact O-OG1 2.96Å; T170-L174 WeakPolarHBondContact O-CB 3.37Å; T170-L174 PolarHBondContact O-N 2.68Å |
| 171 | E | 68.7 | Low | 67.3 | Low | 115 Ų | 115 | 76.3 Ų | 76.3 | 54% | 0.537 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.5 | -26.6 | 175.9 | -60.3 | 169.1 | -163.4 | 0 | 0 | 113.9 | C169 R176 | C169-E171 VanDerWaalsContact C-N 3.34Å; C169-E171 PolarHBondContact O-N 3.49Å; E171-R176 PolarHBondContact O-NH2 3.03Å; E171-R176 VanDerWaalsContact O-NH2 3.1Å |
| 172 | C | 68.7 | Low | 66.1 | Low | 9 Ų | 9 | 85 Ų | 85 | 6% | 0.061 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -82.6 | -33.1 | 180 | -51.5 | 0 | 0 | 0 | 0 | 111.7 | H157 C167 C169 T170 G275 | H157-C172 PolarHBondContact ND1-SG 2.72Å; C167-C172 HydrophobicContact CB-CB 4.25Å; C169-C172 HydrophobicContact CB-CB 4.11Å; C169-C172 WeakPolarHBondContact CB-SG 3.33Å; C169-C172 VanDerWaalsContact O-CB 3.28Å; C169-C172 WeakPolarHBondContact O-CB 3.16Å; C169-C172 PolarHBondContact O-N 3.48Å; C169-C172 VanDerWaalsContact O-N 3.09Å; C169-C172 WeakPolarHBondContact SG-CB 3.47Å; C169-C172 PolarHBondContact SG-N 3.24Å; C169-C172 CovalentContact SG-SG 2.05Å; C169-C172 PolarHBondContact SG-SG 3.1Å; T170-C172 PolarHBondContact O-N 2.96Å; C172-G275 VanDerWaalsContact O-CA 3.26Å; C172-G275 WeakPolarHBondContact O-CA 3.24Å; C172-G275 PolarHBondContact O-N 3.05Å |
| 173 | T | 68 | Low | 64.9 | Low | 49 Ų | 49 | 81.5 Ų | 81.5 | 30% | 0.301 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -100.2 | -13.3 | -174.1 | 53 | 0 | 0 | 0 | 0 | 113.2 | C169 T170 R273 | C169-T173 WeakPolarHBondContact O-CB 3.46Å; C169-T173 WeakPolarHBondContact O-CG2 3.39Å; C169-T173 PolarHBondContact O-N 2.85Å; C169-T173 PolarHBondContact O-OG1 3.01Å; T170-T173 WeakPolarHBondContact CA-OG1 3.33Å; T170-T173 PolarHBondContact O-N 3.39Å; T170-T173 PolarHBondContact O-OG1 2.96Å; T173-R273 PolarHBondContact O-NH1 3.27Å |
| 174 | L | 61 | Low | 63.8 | Low | 102 Ų | 102 | 75.5 Ų | 75.5 | 53% | 0.534 | 42% | 0.421 | S | S | . | . | S | Bend | trans | -59 | 144 | 178.3 | -162.8 | 70.8 | 0 | 0 | 0 | 112.4 | T170 R176 R273 | T170-L174 WeakPolarHBondContact O-CB 3.37Å; T170-L174 PolarHBondContact O-N 2.68Å; L174-R176 PolarHBondContact O-N 2.95Å; L174-R273 PolarHBondContact O-NE 3.01Å |
| 175 | P | 58.6 | Low | 62.7 | Low | 79 Ų | 79 | 80.2 Ų | 80.2 | 51% | 0.513 | 44% | 0.443 | S | S | . | . | trans | -53.1 | 134.2 | 164.7 | -23.8 | 33.5 | 0 | 0 | 0 | 113.4 | D269 R273 | P175-D269 VanDerWaalsContact CA-OD2 3.27Å; P175-D269 WeakPolarHBondContact CA-OD2 3.31Å; P175-R273 VanDerWaalsContact CA-NH2 3.31Å | ||
| 176 | R | 62.8 | Low | 62 | Low | 125 Ų | 125 | 85.2 Ų | 85.2 | 47% | 0.472 | 45% | 0.451 | S | S | . | . | trans | -109.2 | 88.1 | 177.9 | -70.8 | -68.8 | 178.2 | 167 | -3 | 107.9 | E171 L174 Q265 D269 R273 | E171-R176 PolarHBondContact O-NH2 3.03Å; E171-R176 VanDerWaalsContact O-NH2 3.1Å; L174-R176 PolarHBondContact O-N 2.95Å; R176-Q265 PolarHBondContact O-NE2 3.2Å; R176-D269 PolarHBondContact N-OD2 3.44Å; R176-R273 HydrophobicContact CG-CG 4.48Å | ||
| 177 | A | 60.3 | Low | 60.8 | Low | 78 Ų | 78 | 89 Ų | 89 | 65% | 0.645 | 47% | 0.47 | S | S | * | . | trans | -45.9 | 141.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 178 | L | 56.1 | Low | 59.6 | Low | 51 Ų | 51 | 90.9 Ų | 90.9 | 27% | 0.267 | 48% | 0.482 | S | S | . | . | trans | -55.4 | 127.3 | 176.8 | -84 | 163.3 | 0 | 0 | 0 | 107.8 | S180 A192 Q265 Y268 | L178-S180 PolarHBondContact O-N 3.41Å; L178-A192 HydrophobicContact CD1-CB 4.42Å; L178-Q265 VanDerWaalsContact CB-OE1 3.31Å; L178-Q265 HydrophobicContact CD1-CB 3.85Å; L178-Q265 HydrophobicContact CG-CB 4.31Å; L178-Q265 VanDerWaalsContact CG-OE1 3.27Å; L178-Q265 VanDerWaalsContact N-CD 3.34Å; L178-Y268 HydrophobicContact CD2-CD1 4.08Å; L178-Y268 HydrophobicContact CD2-CD2 4.49Å; L178-Y268 HydrophobicContact CD2-CG 3.98Å | ||
| 179 | P | 57.4 | Low | 58.5 | Low | 59 Ų | 59 | 91.8 Ų | 91.8 | 38% | 0.383 | 50% | 0.496 | S | S | . | . | trans | -54.6 | 133.1 | 173 | -23.2 | 31.5 | 0 | 0 | 0 | 109.9 | C181 | P179-C181 PolarHBondContact O-N 3.48Š| ||
| 180 | S | 54.8 | Low | 57.6 | Low | 49 Ų | 49 | 93.4 Ų | 93.4 | 34% | 0.343 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | 12.4 | 178.9 | 49.2 | 0 | 0 | 0 | 0 | 114.4 | L178 C190 | L178-S180 PolarHBondContact O-N 3.41Å; S180-C190 CarbonylContact O-C 3.59Å |
| 181 | C | 50.9 | Low | 57.8 | Low | 58 Ų | 58 | 90 Ų | 90 | 39% | 0.392 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -131.5 | 25.7 | -159.6 | -45.1 | 0 | 0 | 0 | 0 | 113.4 | P179 | P179-C181 PolarHBondContact O-N 3.48Š|
| 182 | W | 50.5 | Low | 58.1 | Low | 181 Ų | 181 | 86.6 Ų | 86.6 | 69% | 0.686 | 48% | 0.479 | S | S | * | . | S | Bend | trans | -80.1 | -22.5 | -176 | -87.3 | 68.7 | 0 | 0 | 0 | 115.1 | Y268 | W182-Y268 AromaticContact CZ2-CE2 3.92Å; W182-Y268 HydrophobicContact CZ2-CE2 3.92Å |
| 183 | V | 51.9 | Low | 58.5 | Low | 125 Ų | 125 | 89.4 Ų | 89.4 | 76% | 0.758 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -113.7 | -25.3 | -169.6 | 178.8 | 0 | 0 | 0 | 0 | 112.9 | ||
| 184 | C | 47.3 | Very low | 58.9 | Low | 24 Ų | 24 | 89.6 Ų | 89.6 | 16% | 0.162 | 50% | 0.495 | C | S | . | . | S | Bend | trans | -130.9 | 135.1 | -179.7 | -177 | 0 | 0 | 0 | 0 | 107.9 | Q186 E187 C188 | C184-Q186 PolarHBondContact O-N 3.09Å; C184-E187 VanDerWaalsContact SG-C 3.56Å; C184-C188 HydrophobicContact CB-CB 3.39Å; C184-C188 WeakPolarHBondContact CB-SG 3.13Å; C184-C188 WeakPolarHBondContact SG-CB 3.49Å; C184-C188 PolarHBondContact SG-N 3.26Å; C184-C188 CovalentContact SG-SG 2.04Å; C184-C188 PolarHBondContact SG-SG 2.89Å |
| 185 | N | 52.3 | Low | 59.8 | Low | 145 Ų | 145 | 90 Ų | 90 | 78% | 0.775 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -77.1 | 63.7 | -163.3 | -165.1 | 8.8 | 0 | 0 | 0 | 112.1 | E187 | N185-E187 PolarHBondContact O-N 3.09Š|
| 186 | Q | 53.5 | Low | 61.1 | Low | 165 Ų | 165 | 87 Ų | 87 | 77% | 0.771 | 48% | 0.477 | S | S | * | . | S | Bend | trans | 65 | -2.8 | -167.1 | -60.5 | -176.8 | 89.2 | 0 | 0 | 116.5 | C184 | C184-Q186 PolarHBondContact O-N 3.09Š|
| 187 | E | 53.6 | Low | 62.1 | Low | 176 Ų | 176 | 81.9 Ų | 81.9 | 82% | 0.822 | 46% | 0.459 | S | S | * | . | S | Bend | trans | -85 | -7.8 | -177.8 | -60.5 | -174.7 | 145.7 | 0 | 0 | 114.8 | C184 N185 | C184-E187 VanDerWaalsContact SG-C 3.56Å; N185-E187 PolarHBondContact O-N 3.09Å |
| 188 | C | 55.8 | Low | 63.1 | Low | 56 Ų | 56 | 82.9 Ų | 82.9 | 38% | 0.378 | 46% | 0.457 | S | S | . | . | S | Bend | trans | -136.5 | 130.2 | -179.7 | -36.1 | 0 | 0 | 0 | 0 | 110.7 | C184 C190 | C184-C188 HydrophobicContact CB-CB 3.39Å; C184-C188 WeakPolarHBondContact CB-SG 3.13Å; C184-C188 WeakPolarHBondContact SG-CB 3.49Å; C184-C188 PolarHBondContact SG-N 3.26Å; C184-C188 CovalentContact SG-SG 2.04Å; C184-C188 PolarHBondContact SG-SG 2.89Å; C188-C190 VanDerWaalsContact CB-SG 3.54Å; C188-C190 PolarHBondContact O-N 2.72Å |
| 189 | L | 52.8 | Low | 64.3 | Low | 145 Ų | 145 | 83.9 Ų | 83.9 | 76% | 0.759 | 47% | 0.473 | S | S | * | . | trans | -74.2 | 54.5 | 172.1 | -77.4 | 164.5 | 0 | 0 | 0 | 112 | S191 | L189-S191 VanDerWaalsContact C-N 3.26Å; L189-S191 PolarHBondContact O-N 2.87Å | ||
| 190 | C | 57.9 | Low | 65.7 | Low | 57 Ų | 57 | 81.3 Ų | 81.3 | 39% | 0.385 | 46% | 0.456 | S | S | . | . | trans | -77.9 | 72.9 | 179.3 | -69 | 0 | 0 | 0 | 0 | 111.2 | S180 C188 | S180-C190 CarbonylContact O-C 3.59Å; C188-C190 VanDerWaalsContact CB-SG 3.54Å; C188-C190 PolarHBondContact O-N 2.72Å | ||
| 191 | S | 71.4 | Confident | 67.2 | Low | 41 Ų | 41 | 80.1 Ų | 80.1 | 29% | 0.287 | 45% | 0.448 | S | S | . | . | trans | -60 | 145.2 | 166.6 | 94.1 | 0 | 0 | 0 | 0 | 110 | L189 Q193 S194 L195 | L189-S191 VanDerWaalsContact C-N 3.26Å; L189-S191 PolarHBondContact O-N 2.87Å; S191-Q193 PolarHBondContact O-N 3.3Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; S191-Q193 PolarHBondContact OG-N 2.77Å; S191-S194 WeakPolarHBondContact O-CB 3.28Å; S191-S194 PolarHBondContact O-N 2.95Å; S191-S194 WeakPolarHBondContact OG-CB 3.26Å; S191-S194 PolarHBondContact OG-N 3.41Å; S191-S194 PolarHBondContact OG-OG 3.24Å; S191-L195 PolarHBondContact O-N 2.94Å; S191-L195 VanDerWaalsContact O-N 3.09Å | ||
| 192 | A | 75.4 | Confident | 68.7 | Low | 45 Ų | 45 | 77.8 Ų | 77.8 | 37% | 0.372 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -58.3 | -30.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L178 V196 | L178-A192 HydrophobicContact CD1-CB 4.42Å; A192-V196 VanDerWaalsContact O-CG2 3.31Å; A192-V196 WeakPolarHBondContact O-CG2 3.12Å; A192-V196 PolarHBondContact O-N 3.35Å |
| 193 | Q | 76.3 | Confident | 70.2 | Confident | 67 Ų | 67 | 71.9 Ų | 71.9 | 31% | 0.313 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -71.2 | -42.7 | 175.3 | -169.2 | 63.5 | 50.4 | 0 | 0 | 111.7 | S191 L195 V196 D197 | S191-Q193 PolarHBondContact O-N 3.3Å; S191-Q193 VanDerWaalsContact O-N 3.16Å; S191-Q193 PolarHBondContact OG-N 2.77Å; Q193-L195 VanDerWaalsContact C-N 3.3Å; Q193-L195 PolarHBondContact O-N 3.33Å; Q193-V196 PolarHBondContact O-N 3.15Å; Q193-D197 PolarHBondContact NE2-OD1 3.49Å; Q193-D197 WeakPolarHBondContact O-CB 3.28Å; Q193-D197 VanDerWaalsContact O-CG 3.23Å; Q193-D197 PolarHBondContact O-N 3.15Å |
| 194 | S | 75.9 | Confident | 71.7 | Confident | 54 Ų | 54 | 70.2 Ų | 70.2 | 38% | 0.378 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.3 | -38.8 | 177.1 | -51.7 | 0 | 0 | 0 | 0 | 111.9 | S191 T198 | S191-S194 WeakPolarHBondContact O-CB 3.28Å; S191-S194 PolarHBondContact O-N 2.95Å; S191-S194 WeakPolarHBondContact OG-CB 3.26Å; S191-S194 PolarHBondContact OG-N 3.41Å; S191-S194 PolarHBondContact OG-OG 3.24Å; S194-T198 WeakPolarHBondContact O-CB 3.14Å; S194-T198 PolarHBondContact O-N 3.47Å; S194-T198 VanDerWaalsContact O-N 3.08Å; S194-T198 PolarHBondContact O-OG1 3.48Å |
| 195 | L | 81.2 | Confident | 73.5 | Confident | 110 Ų | 110 | 69.1 Ų | 69.1 | 58% | 0.576 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -65.7 | -44.8 | 174.6 | 180 | 61.9 | 0 | 0 | 0 | 111.8 | S191 Q193 T198 A199 | S191-L195 PolarHBondContact O-N 2.94Å; S191-L195 VanDerWaalsContact O-N 3.09Å; Q193-L195 VanDerWaalsContact C-N 3.3Å; Q193-L195 PolarHBondContact O-N 3.33Å; L195-T198 PolarHBondContact O-N 2.95Å; L195-A199 VanDerWaalsContact O-CB 3.24Å; L195-A199 WeakPolarHBondContact O-CB 3.45Å; L195-A199 PolarHBondContact O-N 3.48Å |
| 196 | V | 84.3 | Confident | 74.9 | Confident | 16 Ų | 16 | 65.5 Ų | 65.5 | 10% | 0.097 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.3 | -46.8 | 175.8 | 168.4 | 0 | 0 | 0 | 0 | 110.5 | A192 Q193 T198 A199 T200 Y254 A257 A261 | A192-V196 VanDerWaalsContact O-CG2 3.31Å; A192-V196 WeakPolarHBondContact O-CG2 3.12Å; A192-V196 PolarHBondContact O-N 3.35Å; Q193-V196 PolarHBondContact O-N 3.15Å; V196-T198 VanDerWaalsContact C-N 3.33Å; V196-T198 PolarHBondContact O-N 2.86Å; V196-A199 PolarHBondContact O-N 2.78Å; V196-T200 HydrophobicContact CG1-CG2 4.22Å; V196-T200 VanDerWaalsContact O-CB 3.27Å; V196-T200 WeakPolarHBondContact O-CB 3.2Å; V196-T200 WeakPolarHBondContact O-CG2 3.37Å; V196-T200 PolarHBondContact O-N 2.79Å; V196-T200 PolarHBondContact O-OG1 3.35Å; V196-Y254 HydrophobicContact CG1-CD2 3.75Å; V196-Y254 HydrophobicContact CG1-CE2 3.87Å; V196-A257 HydrophobicContact CG1-CB 4.03Å; V196-A257 HydrophobicContact CG2-CB 4.28Å; V196-A261 HydrophobicContact CG2-CB 4.19Å |
| 197 | D | 83.8 | Confident | 76.2 | Confident | 18 Ų | 18 | 59.1 Ų | 59.1 | 10% | 0.096 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -60.8 | -40.6 | -179 | -71.4 | 0.4 | 0 | 0 | 0 | 112.1 | Q193 C201 M202 C203 K206 Y254 | Q193-D197 PolarHBondContact NE2-OD1 3.49Å; Q193-D197 WeakPolarHBondContact O-CB 3.28Å; Q193-D197 VanDerWaalsContact O-CG 3.23Å; Q193-D197 PolarHBondContact O-N 3.15Å; D197-C201 PolarHBondContact O-N 3.23Å; D197-M202 PolarHBondContact O-N 3.18Å; D197-C203 PolarHBondContact O-N 3.06Å; D197-K206 IonicContact OD1-NZ 3.86Å; D197-K206 IonicContact OD2-NZ 2.68Å; D197-K206 PolarHBondContact OD2-NZ 2.82Å; D197-Y254 WeakPolarHBondContact OD1-CE2 3.27Å |
| 198 | T | 81.6 | Confident | 77.5 | Confident | 98 Ų | 98 | 53.4 Ų | 53.4 | 60% | 0.601 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -72.1 | -48.1 | 177.1 | -58.8 | 0 | 0 | 0 | 0 | 112.2 | S194 L195 V196 T200 C201 | S194-T198 WeakPolarHBondContact O-CB 3.14Å; S194-T198 PolarHBondContact O-N 3.47Å; S194-T198 VanDerWaalsContact O-N 3.08Å; S194-T198 PolarHBondContact O-OG1 3.48Å; L195-T198 PolarHBondContact O-N 2.95Å; V196-T198 VanDerWaalsContact C-N 3.33Å; V196-T198 PolarHBondContact O-N 2.86Å; T198-T200 PolarHBondContact O-N 2.97Å; T198-C201 PolarHBondContact O-N 2.77Å |
| 199 | A | 82.4 | Confident | 78.5 | Confident | 73 Ų | 73 | 51.5 Ų | 51.5 | 60% | 0.603 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -67.3 | -22.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L195 V196 | L195-A199 VanDerWaalsContact O-CB 3.24Å; L195-A199 WeakPolarHBondContact O-CB 3.45Å; L195-A199 PolarHBondContact O-N 3.48Å; V196-A199 PolarHBondContact O-N 2.78Å |
| 200 | T | 85.8 | Confident | 79.6 | Confident | 4 Ų | 4 | 51 Ų | 51 | 3% | 0.025 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.7 | 3.7 | -176.8 | 64 | 0 | 0 | 0 | 0 | 112.9 | V196 T198 M202 C250 L251 Y254 A257 | V196-T200 HydrophobicContact CG1-CG2 4.22Å; V196-T200 VanDerWaalsContact O-CB 3.27Å; V196-T200 WeakPolarHBondContact O-CB 3.2Å; V196-T200 WeakPolarHBondContact O-CG2 3.37Å; V196-T200 PolarHBondContact O-N 2.79Å; V196-T200 PolarHBondContact O-OG1 3.35Å; T198-T200 PolarHBondContact O-N 2.97Å; T200-M202 PolarHBondContact O-N 2.04Å; T200-C250 WeakPolarHBondContact CA-O 3.2Å; T200-C250 WeakPolarHBondContact CB-O 3.49Å; T200-C250 CarbonylContact O-C 3.49Å; T200-L251 WeakPolarHBondContact O-CA 3.48Å; T200-L251 VanDerWaalsContact O-CD2 3.32Å; T200-L251 WeakPolarHBondContact O-CD2 3.38Å; T200-L251 PolarHBondContact O-N 3.17Å; T200-Y254 HydrophobicContact CG2-CD2 4.35Å; T200-Y254 WeakPolarHBondContact OG1-CD2 3.13Å; T200-A257 HydrophobicContact CG2-CB 4.07Å |
| 201 | C | 85.6 | Confident | 80.4 | Confident | 24 Ų | 24 | 53.9 Ų | 53.9 | 16% | 0.162 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 63.8 | 11.3 | -176.6 | -42.4 | 0 | 0 | 0 | 0 | 114.4 | D197 T198 C203 L204 L248 C250 L251 | D197-C201 PolarHBondContact O-N 3.23Å; T198-C201 PolarHBondContact O-N 2.77Å; C201-C203 PolarHBondContact O-N 2.84Å; C201-L204 HydrophobicContact CB-CD1 4.29Å; C201-L204 WeakPolarHBondContact O-CB 3.26Å; C201-L204 PolarHBondContact O-N 2.05Å; C201-L204 VanDerWaalsContact O-N 3.07Å; C201-L248 HydrophobicContact CB-CD1 4.2Å; C201-C250 HydrophobicContact CB-CB 4.18Å; C201-C250 WeakPolarHBondContact CB-SG 3.07Å; C201-C250 WeakPolarHBondContact SG-CB 3.07Å; C201-C250 CovalentContact SG-SG 2.05Å; C201-C250 PolarHBondContact SG-SG 2.92Å; C201-L251 HydrophobicContact CB-CD2 4.48Å; C201-L251 HydrophobicContact CB-CG 4.49Å |
| 202 | M | 84.1 | Confident | 80.1 | Confident | 9 Ų | 9 | 55.6 Ų | 55.6 | 4% | 0.044 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -66.9 | -22.4 | 178.7 | -172.5 | 57.2 | 66.6 | 0 | 0 | 112.4 | D197 T200 L204 V205 K206 P226 L251 Y254 | D197-M202 PolarHBondContact O-N 3.18Å; T200-M202 PolarHBondContact O-N 2.04Å; M202-L204 VanDerWaalsContact C-N 3.31Å; M202-L204 PolarHBondContact O-N 3.38Å; M202-V205 PolarHBondContact O-N 3.04Å; M202-V205 HydrophobicContact SD-CB 3.78Å; M202-V205 HydrophobicContact SD-CG1 3.76Å; M202-V205 HydrophobicContact SD-CG2 4.28Å; M202-K206 WeakPolarHBondContact O-CG 3.37Å; M202-K206 PolarHBondContact O-N 3.33Å; M202-P226 HydrophobicContact SD-CG 4.36Å; M202-L251 HydrophobicContact CB-CD2 4.4Å; M202-L251 HydrophobicContact CE-CD2 3.81Å; M202-L251 HydrophobicContact SD-CD2 4.41Å; M202-Y254 HydrophobicContact CB-CD2 3.87Å; M202-Y254 HydrophobicContact CB-CE2 4.02Å; M202-Y254 HydrophobicContact CB-CG 4.43Å; M202-Y254 HydrophobicContact CE-CD1 3.48Å; M202-Y254 VanDerWaalsContact CE-CD1 3.48Å; M202-Y254 HydrophobicContact CE-CD2 4.14Å; M202-Y254 HydrophobicContact CE-CE1 3.87Å; M202-Y254 HydrophobicContact CE-CE2 4.48Å; M202-Y254 HydrophobicContact CE-CG 3.61Å; M202-Y254 HydrophobicContact CG-CD2 4.01Å; M202-Y254 HydrophobicContact CG-CE1 4.46Å; M202-Y254 HydrophobicContact CG-CE2 3.78Å; M202-Y254 HydrophobicContact CG-CG 4.44Å |
| 203 | C | 82 | Confident | 79.4 | Confident | 57 Ų | 57 | 55 Ų | 55 | 39% | 0.385 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -58.8 | -39.2 | 168.4 | 56.2 | 0 | 0 | 0 | 0 | 112.9 | D197 C201 K206 G207 | D197-C203 PolarHBondContact O-N 3.06Å; C201-C203 PolarHBondContact O-N 2.84Å; C203-K206 PolarHBondContact O-N 2.92Å; C203-G207 PolarHBondContact O-N 2.61Å |
| 204 | L | 82.8 | Confident | 78.2 | Confident | 91 Ų | 91 | 57.7 Ų | 57.7 | 48% | 0.476 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -67 | -42.5 | 176.9 | -59.6 | 178.2 | 0 | 0 | 0 | 110.9 | C201 M202 K206 G207 I208 L248 | C201-L204 HydrophobicContact CB-CD1 4.29Å; C201-L204 WeakPolarHBondContact O-CB 3.26Å; C201-L204 PolarHBondContact O-N 2.05Å; C201-L204 VanDerWaalsContact O-N 3.07Å; M202-L204 VanDerWaalsContact C-N 3.31Å; M202-L204 PolarHBondContact O-N 3.38Å; L204-K206 PolarHBondContact O-N 3.38Å; L204-G207 PolarHBondContact O-N 3.18Å; L204-I208 WeakPolarHBondContact O-CD1 3.31Å; L204-I208 VanDerWaalsContact O-CG1 3.24Å; L204-I208 WeakPolarHBondContact O-CG1 3.34Å; L204-I208 PolarHBondContact O-N 3.25Å; L204-L248 HydrophobicContact CD1-CD1 3.96Å |
| 205 | V | 84.3 | Confident | 77.1 | Confident | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -57.9 | -49.1 | 174.6 | 170.7 | 0 | 0 | 0 | 0 | 110.8 | M202 G207 I208 F209 P226 M241 L244 L251 | M202-V205 PolarHBondContact O-N 3.04Å; M202-V205 HydrophobicContact SD-CB 3.78Å; M202-V205 HydrophobicContact SD-CG1 3.76Å; M202-V205 HydrophobicContact SD-CG2 4.28Å; V205-G207 PolarHBondContact O-N 3.25Å; V205-I208 PolarHBondContact O-N 3.04Å; V205-F209 HydrophobicContact CG1-CD2 3.74Å; V205-F209 HydrophobicContact CG1-CE2 3.88Å; V205-F209 VanDerWaalsContact O-CD2 3.31Å; V205-F209 WeakPolarHBondContact O-CD2 3.34Å; V205-F209 PolarHBondContact O-N 3.42Å; V205-P226 HydrophobicContact CG1-CB 4.42Å; V205-M241 HydrophobicContact CG1-CE 3.52Å; V205-M241 HydrophobicContact CG1-SD 3.56Å; V205-M241 VanDerWaalsContact CG1-SD 3.56Å; V205-M241 HydrophobicContact CG2-SD 4.45Å; V205-L244 HydrophobicContact CG2-CD1 3.91Å; V205-L251 HydrophobicContact CG2-CD1 3.77Å; V205-L251 HydrophobicContact CG2-CD2 3.52Å; V205-L251 HydrophobicContact CG2-CG 4.32Å |
| 206 | K | 82.1 | Confident | 75.8 | Confident | 69 Ų | 69 | 63 Ų | 63 | 30% | 0.3 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59.3 | -43.5 | 176.7 | -71.6 | 175.9 | 177.7 | -177.1 | 0 | 112.2 | D197 M202 C203 L204 F209 Y210 | D197-K206 IonicContact OD1-NZ 3.86Å; D197-K206 IonicContact OD2-NZ 2.68Å; D197-K206 PolarHBondContact OD2-NZ 2.82Å; M202-K206 WeakPolarHBondContact O-CG 3.37Å; M202-K206 PolarHBondContact O-N 3.33Å; C203-K206 PolarHBondContact O-N 2.92Å; L204-K206 PolarHBondContact O-N 3.38Å; K206-F209 PolarHBondContact O-N 3.47Å; K206-Y210 WeakPolarHBondContact O-CB 3.34Å; K206-Y210 PolarHBondContact O-N 3.08Å |
| 207 | G | 81.8 | Confident | 74.3 | Confident | 32 Ų | 32 | 70.6 Ų | 70.6 | 33% | 0.33 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.4 | -37.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | C203 L204 V205 Y210 H211 | C203-G207 PolarHBondContact O-N 2.61Å; L204-G207 PolarHBondContact O-N 3.18Å; V205-G207 PolarHBondContact O-N 3.25Å; G207-Y210 PolarHBondContact O-N 3.21Å; G207-H211 PolarHBondContact O-CD2 3.18Å; G207-H211 PolarHBondContact O-N 3.05Å |
| 208 | I | 79.5 | Confident | 73 | Confident | 56 Ų | 56 | 75.4 Ų | 75.4 | 29% | 0.287 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -68.9 | -45.4 | 174.6 | -62.9 | 158.8 | 0 | 0 | 0 | 110.5 | L204 V205 Y210 H211 C212 F240 L244 | L204-I208 WeakPolarHBondContact O-CD1 3.31Å; L204-I208 VanDerWaalsContact O-CG1 3.24Å; L204-I208 WeakPolarHBondContact O-CG1 3.34Å; L204-I208 PolarHBondContact O-N 3.25Å; V205-I208 PolarHBondContact O-N 3.04Å; I208-Y210 VanDerWaalsContact C-N 3.26Å; I208-Y210 PolarHBondContact O-N 2.99Å; I208-H211 PolarHBondContact O-N 3.01Å; I208-C212 VanDerWaalsContact O-CB 3.24Å; I208-C212 WeakPolarHBondContact O-CB 3.42Å; I208-C212 PolarHBondContact O-N 3.09Å; I208-C212 PolarHBondContact O-SG 2.74Å; I208-C212 VanDerWaalsContact O-SG 3.34Å; I208-F240 HydrophobicContact CG2-CE1 3.73Å; I208-F240 HydrophobicContact CG2-CZ 3.71Å; I208-L244 HydrophobicContact CD1-CD1 4.02Å; I208-L244 HydrophobicContact CD1-CD2 4.37Å |
| 209 | F | 77.6 | Confident | 71.6 | Confident | 15 Ų | 15 | 79.8 Ų | 79.8 | 7% | 0.066 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -63.6 | -31.5 | 176 | -86 | -72.5 | 0 | 0 | 0 | 112.9 | V205 K206 T213 C222 A223 R237 F240 M241 | V205-F209 HydrophobicContact CG1-CD2 3.74Å; V205-F209 HydrophobicContact CG1-CE2 3.88Å; V205-F209 VanDerWaalsContact O-CD2 3.31Å; V205-F209 WeakPolarHBondContact O-CD2 3.34Å; V205-F209 PolarHBondContact O-N 3.42Å; K206-F209 PolarHBondContact O-N 3.47Å; F209-T213 PolarHBondContact O-OG1 3.39Å; F209-T213 VanDerWaalsContact O-OG1 3.08Å; F209-C222 HydrophobicContact CD1-CB 4.37Å; F209-A223 HydrophobicContact CB-CB 4.47Å; F209-R237 HydrophobicContact CE1-CG 4.12Å; F209-R237 HydrophobicContact CZ-CB 4.42Å; F209-F240 HydrophobicContact CE2-CD1 4.08Å; F209-F240 HydrophobicContact CE2-CE1 4.42Å; F209-F240 AromaticContact CZ-CD1 3.9Å; F209-F240 HydrophobicContact CZ-CD1 3.9Å; F209-M241 HydrophobicContact CD2-CE 4.04Å; F209-M241 HydrophobicContact CE2-CE 3.27Å; F209-M241 HydrophobicContact CE2-SD 3.92Å; F209-M241 HydrophobicContact CZ-CE 3.9Å |
| 210 | Y | 75.1 | Confident | 70.2 | Confident | 136 Ų | 136 | 78.1 Ų | 78.1 | 53% | 0.533 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.1 | -54.5 | 173.8 | -178.5 | -105.8 | 0 | 0 | 0 | 111.4 | K206 G207 I208 | K206-Y210 WeakPolarHBondContact O-CB 3.34Å; K206-Y210 PolarHBondContact O-N 3.08Å; G207-Y210 PolarHBondContact O-N 3.21Å; I208-Y210 VanDerWaalsContact C-N 3.26Å; I208-Y210 PolarHBondContact O-N 2.99Å |
| 211 | H | 74.6 | Confident | 68.9 | Low | 116 Ų | 116 | 81 Ų | 81 | 54% | 0.537 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -73.6 | -33.4 | -179 | -71.9 | -52.5 | 0 | 0 | 0 | 114.2 | G207 I208 T213 E214 | G207-H211 PolarHBondContact O-CD2 3.18Å; G207-H211 PolarHBondContact O-N 3.05Å; I208-H211 PolarHBondContact O-N 3.01Å; H211-T213 PolarHBondContact O-N 3.45Å; H211-E214 IonicContact CE1-OE2 3.69Å; H211-E214 IonicContact CG-OE2 2.95Å; H211-E214 IonicContact ND1-OE2 3.21Å; H211-E214 PolarHBondContact ND1-OE2 3.16Å; H211-E214 PolarHBondContact O-N 2.9Å |
| 212 | C | 65.6 | Low | 67.4 | Low | 78 Ų | 78 | 80.1 Ų | 80.1 | 53% | 0.527 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | 0.1 | 179.5 | -68.6 | 0 | 0 | 0 | 0 | 114.4 | I208 | I208-C212 VanDerWaalsContact O-CB 3.24Å; I208-C212 WeakPolarHBondContact O-CB 3.42Å; I208-C212 PolarHBondContact O-N 3.09Å; I208-C212 PolarHBondContact O-SG 2.74Å; I208-C212 VanDerWaalsContact O-SG 3.34Å |
| 213 | T | 60.5 | Low | 66 | Low | 32 Ų | 32 | 80.5 Ų | 80.5 | 20% | 0.196 | 43% | 0.432 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -126.3 | 19.9 | 172.3 | 67.4 | 0 | 0 | 0 | 0 | 112.9 | F209 H211 D215 C222 | F209-T213 PolarHBondContact O-OG1 3.39Å; F209-T213 VanDerWaalsContact O-OG1 3.08Å; H211-T213 PolarHBondContact O-N 3.45Å; T213-D215 VanDerWaalsContact C-N 3.28Å; T213-C222 HydrophobicContact CG2-CB 3.94Å; T213-C222 WeakPolarHBondContact CG2-SG 3.27Å; T213-C222 PolarHBondContact OG1-SG 2.82Å |
| 214 | E | 50.8 | Low | 64.8 | Low | 123 Ų | 123 | 84.5 Ų | 84.5 | 58% | 0.575 | 45% | 0.45 | S | S | * | . | S | Bend | trans | -78.8 | -19.2 | 159.5 | -66.1 | -176 | 100.6 | 0 | 0 | 110.9 | H211 | H211-E214 IonicContact CE1-OE2 3.69Å; H211-E214 IonicContact CG-OE2 2.95Å; H211-E214 IonicContact ND1-OE2 3.21Å; H211-E214 PolarHBondContact ND1-OE2 3.16Å; H211-E214 PolarHBondContact O-N 2.9Å |
| 215 | D | 54.1 | Low | 63.7 | Low | 148 Ų | 148 | 86.3 Ų | 86.3 | 79% | 0.791 | 45% | 0.454 | S | S | * | . | S | Bend | trans | -93.7 | -12.3 | -177.5 | -65.8 | -40.2 | 0 | 0 | 0 | 114.9 | T213 | T213-D215 VanDerWaalsContact C-N 3.28Š|
| 216 | E | 54 | Low | 62.5 | Low | 127 Ų | 127 | 87 Ų | 87 | 59% | 0.593 | 46% | 0.459 | S | S | * | . | S | Bend | trans | -127.8 | 137.5 | 176.3 | -62.4 | -160.3 | 148.8 | 0 | 0 | 109.8 | D218 | E216-D218 PolarHBondContact O-N 3.31Š|
| 217 | D | 52.8 | Low | 61.3 | Low | 177 Ų | 177 | 86.9 Ų | 86.9 | 95% | 0.947 | 47% | 0.466 | S | S | * | . | S | Bend | trans | -68.9 | 16.4 | -159.8 | -45.2 | -86.8 | 0 | 0 | 0 | 116.9 | E219 | D217-E219 PolarHBondContact O-N 3.2Š|
| 218 | D | 56.1 | Low | 60.2 | Low | 119 Ų | 119 | 86.7 Ų | 86.7 | 64% | 0.636 | 46% | 0.459 | S | S | * | . | trans | -95.9 | 68 | 179.6 | -89.7 | -49.5 | 0 | 0 | 0 | 111.8 | E216 G220 | E216-D218 PolarHBondContact O-N 3.31Å; D218-G220 PolarHBondContact O-N 3.21Å | ||
| 219 | E | 51.3 | Low | 59.1 | Low | 190 Ų | 190 | 88.1 Ų | 88.1 | 89% | 0.888 | 47% | 0.473 | S | S | * | . | trans | -47 | 115.1 | -174.9 | -164.9 | 178.7 | 98 | 0 | 0 | 114.2 | D217 S221 | D217-E219 PolarHBondContact O-N 3.2Å; E219-S221 PolarHBondContact O-N 3.46Å | ||
| 220 | G | 53.1 | Low | 58.1 | Low | 38 Ų | 38 | 92 Ų | 92 | 39% | 0.392 | 50% | 0.502 | S | S | . | . | S | Bend | trans | 71.8 | -26 | 162.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | D218 C222 A223 | D218-G220 PolarHBondContact O-N 3.21Å; G220-C222 PolarHBondContact O-N 2.95Å; G220-A223 PolarHBondContact O-N 3.47Å |
| 221 | S | 58.1 | Low | 57.4 | Low | 65 Ų | 65 | 88 Ų | 88 | 46% | 0.455 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.6 | -22.1 | -169.8 | -164.4 | 0 | 0 | 0 | 0 | 114.4 | E219 Q231 | E219-S221 PolarHBondContact O-N 3.46Å; S221-Q231 PolarHBondContact OG-NE2 2.77Å; S221-Q231 VanDerWaalsContact OG-NE2 3.09Å |
| 222 | C | 54.6 | Low | 56.6 | Low | 5 Ų | 5 | 86.3 Ų | 86.3 | 3% | 0.034 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -72.9 | -40.4 | -180 | 59 | 0 | 0 | 0 | 0 | 114.4 | F209 T213 G220 K225 R237 | F209-C222 HydrophobicContact CD1-CB 4.37Å; T213-C222 HydrophobicContact CG2-CB 3.94Å; T213-C222 WeakPolarHBondContact CG2-SG 3.27Å; T213-C222 PolarHBondContact OG1-SG 2.82Å; G220-C222 PolarHBondContact O-N 2.95Å; C222-K225 CarbonylContact O-C 3.55Å; C222-R237 PolarHBondContact O-NH2 3.14Å |
| 223 | A | 54.4 | Low | 56.5 | Low | 16 Ų | 16 | 87.8 Ų | 87.8 | 13% | 0.132 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -81 | -32.7 | -166.8 | 0 | 0 | 0 | 0 | 0 | 112 | F209 G220 P226 | F209-A223 HydrophobicContact CB-CB 4.47Å; G220-A223 PolarHBondContact O-N 3.47Å; A223-P226 WeakPolarHBondContact O-CD 3.48Å |
| 224 | D | 58.4 | Low | 56.9 | Low | 141 Ų | 141 | 87.7 Ų | 87.7 | 75% | 0.754 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -70.8 | -30 | 176.5 | -74 | -32.5 | 0 | 0 | 0 | 113.2 | P226 | D224-P226 VanDerWaalsContact C-CD 3.44Å |
| 225 | K | 59.4 | Low | 57.8 | Low | 129 Ų | 129 | 86.6 Ų | 86.6 | 56% | 0.561 | 50% | 0.502 | S | S | * | . | trans | -131.3 | 66.1 | -174.6 | -98.4 | 163.6 | 64.4 | -175.2 | 0 | 112.6 | C222 C227 S228 | C222-K225 CarbonylContact O-C 3.55Å; K225-C227 PolarHBondContact O-N 3.46Å; K225-S228 PolarHBondContact O-N 2.68Å | ||
| 226 | P | 58.5 | Low | 58.8 | Low | 15 Ų | 15 | 82.5 Ų | 82.5 | 10% | 0.097 | 49% | 0.489 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53 | -28.2 | 179.3 | 16.1 | -30.3 | 0 | 0 | 0 | 114.7 | M202 V205 A223 D224 M241 | M202-P226 HydrophobicContact SD-CG 4.36Å; V205-P226 HydrophobicContact CG1-CB 4.42Å; A223-P226 WeakPolarHBondContact O-CD 3.48Å; D224-P226 VanDerWaalsContact C-CD 3.44Å; P226-M241 HydrophobicContact CB-CE 3.24Å; P226-M241 VanDerWaalsContact O-CE 3.22Å; P226-M241 WeakPolarHBondContact O-CE 3.1Å |
| 227 | C | 58.1 | Low | 59.9 | Low | 66 Ų | 66 | 78 Ų | 78 | 45% | 0.446 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.9 | 18 | -174.9 | -46.2 | 0 | 0 | 0 | 0 | 114.6 | K225 W238 | K225-C227 PolarHBondContact O-N 3.46Å; C227-W238 HydrophobicContact CB-CH2 4.39Å |
| 228 | S | 58.3 | Low | 61.2 | Low | 28 Ų | 28 | 75.4 Ų | 75.4 | 20% | 0.196 | 44% | 0.444 | C | S | . | . | trans | -85.2 | 128.9 | -177.4 | -163.6 | 0 | 0 | 0 | 0 | 112.6 | K225 S230 | K225-S228 PolarHBondContact O-N 2.68Å; S228-S230 VanDerWaalsContact C-N 3.32Å; S228-S230 PolarHBondContact O-N 3.47Å; S228-S230 PolarHBondContact OG-OG 3.34Å; S228-S230 VanDerWaalsContact OG-OG 3.08Å | ||
| 229 | C | 54.9 | Low | 62.4 | Low | 86 Ų | 86 | 73.4 Ų | 73.4 | 58% | 0.581 | 44% | 0.439 | S | S | * | . | trans | -86 | 6.3 | 178.8 | -59.8 | 0 | 0 | 0 | 0 | 114.8 | W238 | C229-W238 VanDerWaalsContact SG-CZ2 3.6Å; C229-W238 PolarHBondContact SG-NE1 3.45Å | ||
| 230 | S | 57.3 | Low | 63.8 | Low | 97 Ų | 97 | 68.2 Ų | 68.2 | 68% | 0.678 | 41% | 0.414 | S | S | * | . | trans | -98.6 | 11.2 | -164.8 | 67.5 | 0 | 0 | 0 | 0 | 115.8 | S228 | S228-S230 VanDerWaalsContact C-N 3.32Å; S228-S230 PolarHBondContact O-N 3.47Å; S228-S230 PolarHBondContact OG-OG 3.34Å; S228-S230 VanDerWaalsContact OG-OG 3.08Å | ||
| 231 | Q | 61.4 | Low | 65.1 | Low | 53 Ų | 53 | 67.7 Ų | 67.7 | 25% | 0.248 | 40% | 0.401 | C | S | . | . | S | Bend | trans | -114.2 | 155.6 | -178.4 | -93.5 | 165 | -21.1 | 0 | 0 | 111.4 | S221 C234 | S221-Q231 PolarHBondContact OG-NE2 2.77Å; S221-Q231 VanDerWaalsContact OG-NE2 3.09Å; Q231-C234 PolarHBondContact O-N 3.07Å |
| 232 | A | 57.4 | Low | 66.2 | Low | 80 Ų | 80 | 67 Ų | 67 | 66% | 0.661 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52 | 150 | 159.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | C234 | A232-C234 VanDerWaalsContact C-N 3.27Å; A232-C234 PolarHBondContact O-N 3.3Å |
| 233 | N | 63.1 | Low | 67.7 | Low | 109 Ų | 109 | 69.4 Ų | 69.4 | 58% | 0.583 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66 | 18.1 | -176.7 | -50.8 | -34 | 0 | 0 | 0 | 116.2 | C235 A236 R237 | N233-C235 VanDerWaalsContact C-N 3.35Å; N233-C235 PolarHBondContact O-N 3.17Å; N233-A236 HydrophobicContact CB-CB 4.44Å; N233-A236 PolarHBondContact O-N 2.96Å; N233-A236 VanDerWaalsContact O-N 3.08Å; N233-R237 PolarHBondContact O-N 3.39Å; N233-R237 VanDerWaalsContact O-N 3.15Å |
| 234 | C | 68 | Low | 69 | Low | 30 Ų | 30 | 69.9 Ų | 69.9 | 20% | 0.203 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -42.1 | -54.5 | 171.5 | -178.4 | 0 | 0 | 0 | 0 | 113.2 | Q231 A232 A236 R237 W238 | Q231-C234 PolarHBondContact O-N 3.07Å; A232-C234 VanDerWaalsContact C-N 3.27Å; A232-C234 PolarHBondContact O-N 3.3Å; C234-A236 VanDerWaalsContact C-N 3.34Å; C234-A236 PolarHBondContact O-N 3.19Å; C234-R237 PolarHBondContact O-N 3.38Å; C234-W238 PolarHBondContact O-N 2.86Å |
| 235 | C | 71.3 | Confident | 70.2 | Confident | 100 Ų | 100 | 64.7 Ų | 64.7 | 68% | 0.676 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -62 | -35.3 | -178.2 | -61.1 | 0 | 0 | 0 | 0 | 114.1 | N233 S239 | N233-C235 VanDerWaalsContact C-N 3.35Å; N233-C235 PolarHBondContact O-N 3.17Å; C235-S239 VanDerWaalsContact O-CB 3.32Å; C235-S239 WeakPolarHBondContact O-CB 3.48Å; C235-S239 PolarHBondContact O-N 2.89Å; C235-S239 PolarHBondContact O-OG 3.34Å |
| 236 | A | 75.3 | Confident | 71.2 | Confident | 62 Ų | 62 | 64.3 Ų | 64.3 | 51% | 0.512 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -67.1 | -42.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | N233 C234 S239 F240 | N233-A236 HydrophobicContact CB-CB 4.44Å; N233-A236 PolarHBondContact O-N 2.96Å; N233-A236 VanDerWaalsContact O-N 3.08Å; C234-A236 VanDerWaalsContact C-N 3.34Å; C234-A236 PolarHBondContact O-N 3.19Å; A236-S239 PolarHBondContact O-N 3.43Å; A236-F240 WeakPolarHBondContact O-CB 3.24Å; A236-F240 PolarHBondContact O-N 2.66Å |
| 237 | R | 76 | Confident | 72.4 | Confident | 33 Ų | 33 | 69 Ų | 69 | 13% | 0.125 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -65.9 | -44.2 | 177.9 | -62.9 | -176.9 | 62.8 | 168.2 | -1.9 | 112.5 | F209 C222 N233 C234 S239 F240 M241 | F209-R237 HydrophobicContact CE1-CG 4.12Å; F209-R237 HydrophobicContact CZ-CB 4.42Å; C222-R237 PolarHBondContact O-NH2 3.14Å; N233-R237 PolarHBondContact O-N 3.39Å; N233-R237 VanDerWaalsContact O-N 3.15Å; C234-R237 PolarHBondContact O-N 3.38Å; R237-S239 VanDerWaalsContact C-N 3.34Å; R237-S239 PolarHBondContact O-N 2.98Å; R237-F240 PolarHBondContact O-N 3.29Å; R237-M241 VanDerWaalsContact O-CG 3.25Å; R237-M241 WeakPolarHBondContact O-CG 3.32Å; R237-M241 PolarHBondContact O-N 2.9Å |
| 238 | W | 80.8 | Confident | 73.5 | Confident | 121 Ų | 121 | 68 Ų | 68 | 46% | 0.458 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.4 | -37.5 | 173.9 | -76.2 | 100.7 | 0 | 0 | 0 | 112.3 | C227 C229 C234 M241 A242 | C227-W238 HydrophobicContact CB-CH2 4.39Å; C229-W238 VanDerWaalsContact SG-CZ2 3.6Å; C229-W238 PolarHBondContact SG-NE1 3.45Å; C234-W238 PolarHBondContact O-N 2.86Å; W238-M241 PolarHBondContact O-N 3.44Å; W238-A242 WeakPolarHBondContact O-CB 3.33Å; W238-A242 PolarHBondContact O-N 3.32Å |
| 239 | S | 80.2 | Confident | 74.6 | Confident | 78 Ų | 78 | 70.7 Ų | 70.7 | 55% | 0.545 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.6 | -41.2 | 173.8 | -58.9 | 0 | 0 | 0 | 0 | 112.1 | C235 A236 R237 A242 A243 | C235-S239 VanDerWaalsContact O-CB 3.32Å; C235-S239 WeakPolarHBondContact O-CB 3.48Å; C235-S239 PolarHBondContact O-N 2.89Å; C235-S239 PolarHBondContact O-OG 3.34Å; A236-S239 PolarHBondContact O-N 3.43Å; R237-S239 VanDerWaalsContact C-N 3.34Å; R237-S239 PolarHBondContact O-N 2.98Å; S239-A242 PolarHBondContact O-N 2.9Å; S239-A243 WeakPolarHBondContact O-CB 3.41Å; S239-A243 PolarHBondContact O-N 3.49Å |
| 240 | F | 82 | Confident | 75.9 | Confident | 80 Ų | 80 | 68 Ų | 68 | 35% | 0.351 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.7 | -44.3 | 176.4 | -173.2 | -110.8 | 0 | 0 | 0 | 111.9 | I208 F209 A236 R237 A242 A243 L244 | I208-F240 HydrophobicContact CG2-CE1 3.73Å; I208-F240 HydrophobicContact CG2-CZ 3.71Å; F209-F240 HydrophobicContact CE2-CD1 4.08Å; F209-F240 HydrophobicContact CE2-CE1 4.42Å; F209-F240 AromaticContact CZ-CD1 3.9Å; F209-F240 HydrophobicContact CZ-CD1 3.9Å; A236-F240 WeakPolarHBondContact O-CB 3.24Å; A236-F240 PolarHBondContact O-N 2.66Å; R237-F240 PolarHBondContact O-N 3.29Å; F240-A242 VanDerWaalsContact C-N 3.32Å; F240-A242 PolarHBondContact O-N 2.9Å; F240-A243 PolarHBondContact O-N 2.72Å; F240-L244 HydrophobicContact CD1-CD1 4.01Å; F240-L244 HydrophobicContact CD1-CG 4.46Å; F240-L244 HydrophobicContact CE1-CD1 3.47Å; F240-L244 VanDerWaalsContact CE1-CD1 3.47Å; F240-L244 HydrophobicContact CE1-CG 4.09Å; F240-L244 HydrophobicContact CE2-CG 4.48Å; F240-L244 HydrophobicContact CZ-CD1 3.83Å; F240-L244 HydrophobicContact CZ-CD2 4.25Å; F240-L244 HydrophobicContact CZ-CG 4.07Å; F240-L244 WeakPolarHBondContact O-CG 3.21Å; F240-L244 PolarHBondContact O-N 3.31Å |
| 241 | M | 79.5 | Confident | 77 | Confident | 27 Ų | 27 | 64.2 Ų | 64.2 | 13% | 0.133 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -58.6 | -42.7 | 171.6 | -70.5 | -65.8 | -165.9 | 0 | 0 | 112.5 | V205 F209 P226 R237 W238 L244 S245 | V205-M241 HydrophobicContact CG1-CE 3.52Å; V205-M241 HydrophobicContact CG1-SD 3.56Å; V205-M241 VanDerWaalsContact CG1-SD 3.56Å; V205-M241 HydrophobicContact CG2-SD 4.45Å; F209-M241 HydrophobicContact CD2-CE 4.04Å; F209-M241 HydrophobicContact CE2-CE 3.27Å; F209-M241 HydrophobicContact CE2-SD 3.92Å; F209-M241 HydrophobicContact CZ-CE 3.9Å; P226-M241 HydrophobicContact CB-CE 3.24Å; P226-M241 VanDerWaalsContact O-CE 3.22Å; P226-M241 WeakPolarHBondContact O-CE 3.1Å; R237-M241 VanDerWaalsContact O-CG 3.25Å; R237-M241 WeakPolarHBondContact O-CG 3.32Å; R237-M241 PolarHBondContact O-N 2.9Å; W238-M241 PolarHBondContact O-N 3.44Å; M241-L244 PolarHBondContact O-N 2.98Å; M241-S245 WeakPolarHBondContact O-CB 3.39Å; M241-S245 PolarHBondContact O-N 3.49Å |
| 242 | A | 82.3 | Confident | 77.9 | Confident | 50 Ų | 50 | 66.9 Ų | 66.9 | 41% | 0.413 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.3 | -45.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111 | W238 S239 F240 S245 V246 | W238-A242 WeakPolarHBondContact O-CB 3.33Å; W238-A242 PolarHBondContact O-N 3.32Å; S239-A242 PolarHBondContact O-N 2.9Å; F240-A242 VanDerWaalsContact C-N 3.32Å; F240-A242 PolarHBondContact O-N 2.9Å; A242-S245 PolarHBondContact O-N 2.99Å; A242-S245 VanDerWaalsContact O-N 3.14Å; A242-S245 PolarHBondContact O-OG 3.01Å; A242-V246 PolarHBondContact O-N 3.45Å |
| 243 | A | 84.3 | Confident | 79.2 | Confident | 56 Ų | 56 | 66.4 Ų | 66.4 | 46% | 0.463 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60 | -46.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | S239 F240 S245 V246 V247 | S239-A243 WeakPolarHBondContact O-CB 3.41Å; S239-A243 PolarHBondContact O-N 3.49Å; F240-A243 PolarHBondContact O-N 2.72Å; A243-S245 VanDerWaalsContact C-N 3.29Å; A243-S245 PolarHBondContact O-N 3.18Å; A243-V246 PolarHBondContact O-N 3.08Å; A243-V247 PolarHBondContact O-N 3.27Å |
| 244 | L | 81.8 | Confident | 80.2 | Confident | 26 Ų | 26 | 62.9 Ų | 62.9 | 14% | 0.136 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -61.1 | -36.9 | 174 | -70.9 | -176.3 | 0 | 0 | 0 | 112 | V205 I208 F240 M241 V246 V247 L248 L251 | V205-L244 HydrophobicContact CG2-CD1 3.91Å; I208-L244 HydrophobicContact CD1-CD1 4.02Å; I208-L244 HydrophobicContact CD1-CD2 4.37Å; F240-L244 HydrophobicContact CD1-CD1 4.01Å; F240-L244 HydrophobicContact CD1-CG 4.46Å; F240-L244 HydrophobicContact CE1-CD1 3.47Å; F240-L244 VanDerWaalsContact CE1-CD1 3.47Å; F240-L244 HydrophobicContact CE1-CG 4.09Å; F240-L244 HydrophobicContact CE2-CG 4.48Å; F240-L244 HydrophobicContact CZ-CD1 3.83Å; F240-L244 HydrophobicContact CZ-CD2 4.25Å; F240-L244 HydrophobicContact CZ-CG 4.07Å; F240-L244 WeakPolarHBondContact O-CG 3.21Å; F240-L244 PolarHBondContact O-N 3.31Å; M241-L244 PolarHBondContact O-N 2.98Å; L244-V246 VanDerWaalsContact C-N 3.26Å; L244-V246 PolarHBondContact O-N 3.05Å; L244-V247 PolarHBondContact O-N 3.19Å; L244-L248 WeakPolarHBondContact O-CA 3.44Å; L244-L248 WeakPolarHBondContact O-CB 3.35Å; L244-L248 PolarHBondContact O-N 3.47Å; L244-L251 HydrophobicContact CB-CD1 3.83Å |
| 245 | S | 83.8 | Confident | 80.9 | Confident | 32 Ų | 32 | 67.3 Ų | 67.3 | 22% | 0.224 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -66.8 | -23.2 | 178 | 78.1 | 0 | 0 | 0 | 0 | 114.3 | M241 A242 A243 L248 | M241-S245 WeakPolarHBondContact O-CB 3.39Å; M241-S245 PolarHBondContact O-N 3.49Å; A242-S245 PolarHBondContact O-N 2.99Å; A242-S245 VanDerWaalsContact O-N 3.14Å; A242-S245 PolarHBondContact O-OG 3.01Å; A243-S245 VanDerWaalsContact C-N 3.29Å; A243-S245 PolarHBondContact O-N 3.18Å; S245-L248 CarbonylContact O-C 3.2Å |
| 246 | V | 81.4 | Confident | 81.5 | Confident | 122 Ų | 122 | 66.5 Ų | 66.5 | 74% | 0.739 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -75.1 | -38 | 172.8 | 175.3 | 0 | 0 | 0 | 0 | 111.2 | A242 A243 L244 | A242-V246 PolarHBondContact O-N 3.45Å; A243-V246 PolarHBondContact O-N 3.08Å; L244-V246 VanDerWaalsContact C-N 3.26Å; L244-V246 PolarHBondContact O-N 3.05Å |
| 247 | V | 82.4 | Confident | 81.9 | Confident | 114 Ų | 114 | 65 Ų | 65 | 69% | 0.691 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -79.1 | -34.2 | 177.9 | -177.5 | 0 | 0 | 0 | 0 | 111.6 | A243 L244 P249 | A243-V247 PolarHBondContact O-N 3.27Å; L244-V247 PolarHBondContact O-N 3.19Å; V247-P249 WeakPolarHBondContact O-CD 3.02Å |
| 248 | L | 81.7 | Confident | 82.2 | Confident | 43 Ų | 43 | 64.1 Ų | 64.1 | 23% | 0.225 | 38% | 0.377 | C | S | . | . | trans | -125 | 79.1 | -175.1 | -67 | 173.3 | 0 | 0 | 0 | 109.6 | C201 L204 L244 S245 C250 L251 | C201-L248 HydrophobicContact CB-CD1 4.2Å; L204-L248 HydrophobicContact CD1-CD1 3.96Å; L244-L248 WeakPolarHBondContact O-CA 3.44Å; L244-L248 WeakPolarHBondContact O-CB 3.35Å; L244-L248 PolarHBondContact O-N 3.47Å; S245-L248 CarbonylContact O-C 3.2Å; L248-C250 PolarHBondContact O-N 3.3Å; L248-L251 HydrophobicContact CB-CD1 3.87Å; L248-L251 HydrophobicContact CB-CG 4.15Å; L248-L251 HydrophobicContact CD1-CD1 4.33Å; L248-L251 WeakPolarHBondContact O-CB 3.12Å; L248-L251 PolarHBondContact O-N 3.45Å | ||
| 249 | P | 80.9 | Confident | 82.3 | Confident | 86 Ų | 86 | 60.2 Ų | 60.2 | 56% | 0.558 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -61.4 | -18.3 | -179.3 | 24.2 | -34.4 | 0 | 0 | 0 | 113.4 | V247 L251 I252 | V247-P249 WeakPolarHBondContact O-CD 3.02Å; P249-L251 PolarHBondContact O-N 3.49Å; P249-I252 PolarHBondContact O-N 3.41Å; P249-I252 VanDerWaalsContact O-N 3.15Å |
| 250 | C | 83.2 | Confident | 82.4 | Confident | 30 Ų | 30 | 62.4 Ų | 62.4 | 20% | 0.203 | 38% | 0.38 | C | S | . | . | G | 310 helix | trans | -52.2 | -29.4 | 167.7 | 42.9 | 0 | 0 | 0 | 0 | 113.6 | T200 C201 L248 I252 C253 Y254 | T200-C250 WeakPolarHBondContact CA-O 3.2Å; T200-C250 WeakPolarHBondContact CB-O 3.49Å; T200-C250 CarbonylContact O-C 3.49Å; C201-C250 HydrophobicContact CB-CB 4.18Å; C201-C250 WeakPolarHBondContact CB-SG 3.07Å; C201-C250 WeakPolarHBondContact SG-CB 3.07Å; C201-C250 CovalentContact SG-SG 2.05Å; C201-C250 PolarHBondContact SG-SG 2.92Å; L248-C250 PolarHBondContact O-N 3.3Å; C250-I252 VanDerWaalsContact C-N 3.34Å; C250-I252 PolarHBondContact O-N 2.89Å; C250-C253 WeakPolarHBondContact O-CB 3.39Å; C250-C253 PolarHBondContact O-N 2.98Å; C250-C253 VanDerWaalsContact O-N 3.15Å; C250-Y254 PolarHBondContact O-N 3.31Å |
| 251 | L | 80.5 | Confident | 82.4 | Confident | 17 Ų | 17 | 59.8 Ų | 59.8 | 9% | 0.089 | 37% | 0.373 | C | S | . | . | G | 310 helix | trans | -67.8 | -32 | 179.1 | -71.8 | 169.1 | 0 | 0 | 0 | 112.9 | T200 C201 M202 V205 L244 L248 P249 C253 Y254 | T200-L251 WeakPolarHBondContact O-CA 3.48Å; T200-L251 VanDerWaalsContact O-CD2 3.32Å; T200-L251 WeakPolarHBondContact O-CD2 3.38Å; T200-L251 PolarHBondContact O-N 3.17Å; C201-L251 HydrophobicContact CB-CD2 4.48Å; C201-L251 HydrophobicContact CB-CG 4.49Å; M202-L251 HydrophobicContact CB-CD2 4.4Å; M202-L251 HydrophobicContact CE-CD2 3.81Å; M202-L251 HydrophobicContact SD-CD2 4.41Å; V205-L251 HydrophobicContact CG2-CD1 3.77Å; V205-L251 HydrophobicContact CG2-CD2 3.52Å; V205-L251 HydrophobicContact CG2-CG 4.32Å; L244-L251 HydrophobicContact CB-CD1 3.83Å; L248-L251 HydrophobicContact CB-CD1 3.87Å; L248-L251 HydrophobicContact CB-CG 4.15Å; L248-L251 HydrophobicContact CD1-CD1 4.33Å; L248-L251 WeakPolarHBondContact O-CB 3.12Å; L248-L251 PolarHBondContact O-N 3.45Å; P249-L251 PolarHBondContact O-N 3.49Å; L251-C253 PolarHBondContact O-N 2.9Å; L251-Y254 WeakPolarHBondContact O-CB 3.24Å; L251-Y254 PolarHBondContact O-N 3.18Å |
| 252 | I | 80.9 | Confident | 82.5 | Confident | 108 Ų | 108 | 65 Ų | 65 | 55% | 0.554 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -33.8 | 175.2 | -56.2 | 177.5 | 0 | 0 | 0 | 109.7 | P249 C250 Y254 P256 | P249-I252 PolarHBondContact O-N 3.41Å; P249-I252 VanDerWaalsContact O-N 3.15Å; C250-I252 VanDerWaalsContact C-N 3.34Å; C250-I252 PolarHBondContact O-N 2.89Å; I252-Y254 VanDerWaalsContact C-N 3.25Å; I252-Y254 PolarHBondContact O-N 3.27Å; I252-P256 VanDerWaalsContact O-CD 3.24Å; I252-P256 WeakPolarHBondContact O-CD 3.32Å |
| 253 | C | 84.3 | Confident | 82.6 | Confident | 71 Ų | 71 | 68 Ų | 68 | 48% | 0.48 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | -11.5 | 175.6 | -61 | 0 | 0 | 0 | 0 | 113.9 | C250 L251 L255 P256 A257 | C250-C253 WeakPolarHBondContact O-CB 3.39Å; C250-C253 PolarHBondContact O-N 2.98Å; C250-C253 VanDerWaalsContact O-N 3.15Å; L251-C253 PolarHBondContact O-N 2.9Å; C253-L255 PolarHBondContact O-N 3.42Å; C253-P256 WeakPolarHBondContact O-CD 3.5Å; C253-P256 WeakPolarHBondContact O-CG 3.31Å; C253-A257 WeakPolarHBondContact O-CB 3.45Å; C253-A257 PolarHBondContact O-N 2.85Å |
| 254 | Y | 83.9 | Confident | 82.3 | Confident | 34 Ų | 34 | 66.9 Ų | 66.9 | 13% | 0.133 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 177.2 | 178 | -107.6 | 0 | 0 | 0 | 113.2 | V196 D197 T200 M202 C250 L251 I252 T258 | V196-Y254 HydrophobicContact CG1-CD2 3.75Å; V196-Y254 HydrophobicContact CG1-CE2 3.87Å; D197-Y254 WeakPolarHBondContact OD1-CE2 3.27Å; T200-Y254 HydrophobicContact CG2-CD2 4.35Å; T200-Y254 WeakPolarHBondContact OG1-CD2 3.13Å; M202-Y254 HydrophobicContact CB-CD2 3.87Å; M202-Y254 HydrophobicContact CB-CE2 4.02Å; M202-Y254 HydrophobicContact CB-CG 4.43Å; M202-Y254 HydrophobicContact CE-CD1 3.48Å; M202-Y254 VanDerWaalsContact CE-CD1 3.48Å; M202-Y254 HydrophobicContact CE-CD2 4.14Å; M202-Y254 HydrophobicContact CE-CE1 3.87Å; M202-Y254 HydrophobicContact CE-CE2 4.48Å; M202-Y254 HydrophobicContact CE-CG 3.61Å; M202-Y254 HydrophobicContact CG-CD2 4.01Å; M202-Y254 HydrophobicContact CG-CE1 4.46Å; M202-Y254 HydrophobicContact CG-CE2 3.78Å; M202-Y254 HydrophobicContact CG-CG 4.44Å; C250-Y254 PolarHBondContact O-N 3.31Å; L251-Y254 WeakPolarHBondContact O-CB 3.24Å; L251-Y254 PolarHBondContact O-N 3.18Å; I252-Y254 VanDerWaalsContact C-N 3.25Å; I252-Y254 PolarHBondContact O-N 3.27Å; Y254-T258 WeakPolarHBondContact CE2-OG1 3.46Å; Y254-T258 WeakPolarHBondContact O-CB 3.14Å; Y254-T258 PolarHBondContact O-N 3.33Å; Y254-T258 PolarHBondContact O-OG1 3.15Å |
| 255 | L | 82.6 | Confident | 82.2 | Confident | 124 Ų | 124 | 68 Ų | 68 | 65% | 0.649 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -62.8 | -53.4 | -179.6 | -62.5 | 175.9 | 0 | 0 | 0 | 112.3 | C253 G259 | C253-L255 PolarHBondContact O-N 3.42Å; L255-G259 PolarHBondContact O-N 3.08Å |
| 256 | P | 84.9 | Confident | 81.9 | Confident | 82 Ų | 82 | 73 Ų | 73 | 53% | 0.532 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.4 | -36.3 | 176 | 26 | -33.9 | 0 | 0 | 0 | 112.8 | I252 C253 G259 L260 | I252-P256 VanDerWaalsContact O-CD 3.24Å; I252-P256 WeakPolarHBondContact O-CD 3.32Å; C253-P256 WeakPolarHBondContact O-CD 3.5Å; C253-P256 WeakPolarHBondContact O-CG 3.31Å; P256-G259 PolarHBondContact O-N 2.79Å; P256-L260 WeakPolarHBondContact O-CB 3.41Å; P256-L260 PolarHBondContact O-N 3.24Å |
| 257 | A | 82.5 | Confident | 81.7 | Confident | 31 Ų | 31 | 70.4 Ų | 70.4 | 26% | 0.256 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -65.1 | -44.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | V196 T200 C253 G259 L260 A261 | V196-A257 HydrophobicContact CG1-CB 4.03Å; V196-A257 HydrophobicContact CG2-CB 4.28Å; T200-A257 HydrophobicContact CG2-CB 4.07Å; C253-A257 WeakPolarHBondContact O-CB 3.45Å; C253-A257 PolarHBondContact O-N 2.85Å; A257-G259 VanDerWaalsContact C-N 3.33Å; A257-G259 PolarHBondContact O-N 3.22Å; A257-L260 PolarHBondContact O-N 3.3Å; A257-A261 WeakPolarHBondContact O-CB 3.49Å; A257-A261 PolarHBondContact O-N 3.37Å |
| 258 | T | 82.9 | Confident | 81.3 | Confident | 14 Ų | 14 | 68.2 Ų | 68.2 | 9% | 0.086 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -63.4 | -39.8 | 173.7 | -58.3 | 0 | 0 | 0 | 0 | 111.4 | Y254 K262 | Y254-T258 WeakPolarHBondContact CE2-OG1 3.46Å; Y254-T258 WeakPolarHBondContact O-CB 3.14Å; Y254-T258 PolarHBondContact O-N 3.33Å; Y254-T258 PolarHBondContact O-OG1 3.15Å; T258-K262 HydrophobicContact CG2-CD 4.2Å; T258-K262 WeakPolarHBondContact O-CB 3.21Å; T258-K262 WeakPolarHBondContact O-CG 3.43Å; T258-K262 PolarHBondContact O-N 3.46Å |
| 259 | G | 82.8 | Confident | 81.1 | Confident | 40 Ų | 40 | 66.7 Ų | 66.7 | 41% | 0.412 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.4 | -46.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L255 P256 A257 K262 L263 | L255-G259 PolarHBondContact O-N 3.08Å; P256-G259 PolarHBondContact O-N 2.79Å; A257-G259 VanDerWaalsContact C-N 3.33Å; A257-G259 PolarHBondContact O-N 3.22Å; G259-K262 PolarHBondContact O-N 3.34Å; G259-L263 WeakPolarHBondContact O-CB 3.34Å; G259-L263 PolarHBondContact O-N 3.36Å |
| 260 | L | 82.6 | Confident | 80.7 | Confident | 123 Ų | 123 | 65.8 Ų | 65.8 | 64% | 0.644 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -65.9 | -42.1 | 177.8 | -177.2 | 61 | 0 | 0 | 0 | 111.8 | P256 A257 K262 L263 G264 | P256-L260 WeakPolarHBondContact O-CB 3.41Å; P256-L260 PolarHBondContact O-N 3.24Å; A257-L260 PolarHBondContact O-N 3.3Å; L260-K262 PolarHBondContact O-N 3.36Å; L260-L263 PolarHBondContact O-N 3.19Å; L260-G264 PolarHBondContact O-N 2.86Å |
| 261 | A | 81.7 | Confident | 80.2 | Confident | 25 Ų | 25 | 69.8 Ų | 69.8 | 21% | 0.207 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -60.9 | -44.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | V196 A257 G264 Q265 | V196-A261 HydrophobicContact CG2-CB 4.19Å; A257-A261 WeakPolarHBondContact O-CB 3.49Å; A257-A261 PolarHBondContact O-N 3.37Å; A261-G264 PolarHBondContact O-N 2.98Å; A261-Q265 WeakPolarHBondContact O-CB 3.38Å; A261-Q265 PolarHBondContact O-N 3.48Å |
| 262 | K | 82.3 | Confident | 79.6 | Confident | 138 Ų | 138 | 71.3 Ų | 71.3 | 60% | 0.6 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -69.3 | -33 | 176.2 | -72.7 | 178 | -179.2 | 174.6 | 0 | 113.2 | T258 G259 L260 K266 | T258-K262 HydrophobicContact CG2-CD 4.2Å; T258-K262 WeakPolarHBondContact O-CB 3.21Å; T258-K262 WeakPolarHBondContact O-CG 3.43Å; T258-K262 PolarHBondContact O-N 3.46Å; G259-K262 PolarHBondContact O-N 3.34Å; L260-K262 PolarHBondContact O-N 3.36Å; K262-K266 VanDerWaalsContact O-CB 3.31Å; K262-K266 WeakPolarHBondContact O-CB 3.43Å; K262-K266 PolarHBondContact O-N 2.92Å |
| 263 | L | 82.4 | Confident | 79 | Confident | 112 Ų | 112 | 69.3 Ų | 69.3 | 59% | 0.586 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -72.2 | -40.5 | 173.8 | -176.2 | 59.8 | 0 | 0 | 0 | 111.6 | G259 L260 K266 C267 | G259-L263 WeakPolarHBondContact O-CB 3.34Å; G259-L263 PolarHBondContact O-N 3.36Å; L260-L263 PolarHBondContact O-N 3.19Å; L263-K266 CarbonylContact O-C 3.58Å; L263-K266 PolarHBondContact O-N 3.08Å; L263-C267 VanDerWaalsContact O-CB 3.29Å; L263-C267 WeakPolarHBondContact O-CB 3.48Å; L263-C267 PolarHBondContact O-N 3.38Å |
| 264 | G | 80 | Confident | 78.1 | Confident | 33 Ų | 33 | 70 Ų | 70 | 34% | 0.34 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.7 | -47.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L260 A261 K266 C267 Y268 | L260-G264 PolarHBondContact O-N 2.86Å; A261-G264 PolarHBondContact O-N 2.98Å; G264-K266 PolarHBondContact O-N 3.01Å; G264-C267 PolarHBondContact O-N 2.87Å; G264-Y268 WeakPolarHBondContact O-CB 3.47Å; G264-Y268 PolarHBondContact O-N 3.4Å |
| 265 | Q | 78.6 | Confident | 77.6 | Confident | 49 Ų | 49 | 68.4 Ų | 68.4 | 23% | 0.229 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -53 | -53.8 | 169.3 | 178.7 | 67.7 | 76.8 | 0 | 0 | 111.1 | R176 L178 A261 C267 Y268 D269 | R176-Q265 PolarHBondContact O-NE2 3.2Å; L178-Q265 VanDerWaalsContact CB-OE1 3.31Å; L178-Q265 HydrophobicContact CD1-CB 3.85Å; L178-Q265 HydrophobicContact CG-CB 4.31Å; L178-Q265 VanDerWaalsContact CG-OE1 3.27Å; L178-Q265 VanDerWaalsContact N-CD 3.34Å; A261-Q265 WeakPolarHBondContact O-CB 3.38Å; A261-Q265 PolarHBondContact O-N 3.48Å; Q265-C267 VanDerWaalsContact C-N 3.28Å; Q265-C267 PolarHBondContact O-N 3.21Å; Q265-Y268 PolarHBondContact O-N 3Å; Q265-D269 PolarHBondContact NE2-OD1 3.09Å; Q265-D269 WeakPolarHBondContact O-CB 3.33Å; Q265-D269 PolarHBondContact O-N 3.38Å; Q265-D269 VanDerWaalsContact O-OD1 3.04Å |
| 266 | K | 76.7 | Confident | 77.3 | Confident | 136 Ų | 136 | 63.4 Ų | 63.4 | 59% | 0.591 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -62.7 | -34.1 | -179.2 | -170.3 | 174.6 | -176.7 | 177 | 0 | 112.6 | K262 L263 G264 N270 | K262-K266 VanDerWaalsContact O-CB 3.31Å; K262-K266 WeakPolarHBondContact O-CB 3.43Å; K262-K266 PolarHBondContact O-N 2.92Å; L263-K266 CarbonylContact O-C 3.58Å; L263-K266 PolarHBondContact O-N 3.08Å; G264-K266 PolarHBondContact O-N 3.01Å; K266-N270 WeakPolarHBondContact O-CB 3.35Å; K266-N270 PolarHBondContact O-N 3.48Å; K266-N270 PolarHBondContact O-ND2 3.11Å; K266-N270 PolarHBondContact O-OD1 2.83Å |
| 267 | C | 77.3 | Confident | 76.7 | Confident | 68 Ų | 68 | 66.8 Ų | 66.8 | 46% | 0.459 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -70.7 | -45.3 | 175.4 | -166.8 | 0 | 0 | 0 | 0 | 111.3 | L263 G264 Q265 D269 N270 V271 | L263-C267 VanDerWaalsContact O-CB 3.29Å; L263-C267 WeakPolarHBondContact O-CB 3.48Å; L263-C267 PolarHBondContact O-N 3.38Å; G264-C267 PolarHBondContact O-N 2.87Å; Q265-C267 VanDerWaalsContact C-N 3.28Å; Q265-C267 PolarHBondContact O-N 3.21Å; C267-D269 PolarHBondContact O-N 3.12Å; C267-N270 WeakPolarHBondContact O-CA 3.41Å; C267-N270 WeakPolarHBondContact O-CB 3.42Å; C267-N270 PolarHBondContact O-N 2.78Å; C267-V271 WeakPolarHBondContact O-CG2 3.24Å; C267-V271 PolarHBondContact O-N 3.09Å |
| 268 | Y | 75.9 | Confident | 76.4 | Confident | 69 Ų | 69 | 68.1 Ų | 68.1 | 27% | 0.271 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.2 | -46 | 173.1 | -175.2 | -101.5 | 0 | 0 | 0 | 111.2 | L178 W182 G264 Q265 N270 V271 S272 | L178-Y268 HydrophobicContact CD2-CD1 4.08Å; L178-Y268 HydrophobicContact CD2-CD2 4.49Å; L178-Y268 HydrophobicContact CD2-CG 3.98Å; W182-Y268 AromaticContact CZ2-CE2 3.92Å; W182-Y268 HydrophobicContact CZ2-CE2 3.92Å; G264-Y268 WeakPolarHBondContact O-CB 3.47Å; G264-Y268 PolarHBondContact O-N 3.4Å; Q265-Y268 PolarHBondContact O-N 3Å; Y268-N270 VanDerWaalsContact C-N 3.26Å; Y268-N270 PolarHBondContact O-N 3.1Å; Y268-V271 PolarHBondContact O-N 2.86Å; Y268-S272 VanDerWaalsContact CD2-OG 3.26Å; Y268-S272 WeakPolarHBondContact CD2-OG 3.25Å; Y268-S272 WeakPolarHBondContact CE2-OG 3.22Å; Y268-S272 WeakPolarHBondContact O-CA 3.49Å; Y268-S272 WeakPolarHBondContact O-CB 3.34Å; Y268-S272 PolarHBondContact O-N 2.91Å; Y268-S272 PolarHBondContact O-OG 2.93Å |
| 269 | D | 77.1 | Confident | 75.8 | Confident | 11 Ų | 11 | 76.7 Ų | 76.7 | 6% | 0.059 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -57.5 | -35.6 | 169.9 | -90 | 82.1 | 0 | 0 | 0 | 113.5 | P175 R176 Q265 C267 R273 | P175-D269 VanDerWaalsContact CA-OD2 3.27Å; P175-D269 WeakPolarHBondContact CA-OD2 3.31Å; R176-D269 PolarHBondContact N-OD2 3.44Å; Q265-D269 PolarHBondContact NE2-OD1 3.09Å; Q265-D269 WeakPolarHBondContact O-CB 3.33Å; Q265-D269 PolarHBondContact O-N 3.38Å; Q265-D269 VanDerWaalsContact O-OD1 3.04Å; C267-D269 PolarHBondContact O-N 3.12Å; D269-R273 VanDerWaalsContact O-CB 3.28Å; D269-R273 WeakPolarHBondContact O-CB 3.49Å; D269-R273 WeakPolarHBondContact O-CD 3.46Å; D269-R273 WeakPolarHBondContact O-CG 3.47Å; D269-R273 IonicContact OD2-CZ 2.66Å; D269-R273 IonicContact OD2-NE 2.83Å; D269-R273 PolarHBondContact OD2-NE 3.12Å; D269-R273 IonicContact OD2-NH2 3.91Å; D269-R273 PolarHBondContact OD2-NH2 3.35Å |
| 270 | N | 72.1 | Confident | 74.4 | Confident | 66 Ų | 66 | 80.2 Ų | 80.2 | 35% | 0.353 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -72.2 | -34 | -179.9 | -74 | -31 | 0 | 0 | 0 | 112.7 | K266 C267 Y268 R277 | K266-N270 WeakPolarHBondContact O-CB 3.35Å; K266-N270 PolarHBondContact O-N 3.48Å; K266-N270 PolarHBondContact O-ND2 3.11Å; K266-N270 PolarHBondContact O-OD1 2.83Å; C267-N270 WeakPolarHBondContact O-CA 3.41Å; C267-N270 WeakPolarHBondContact O-CB 3.42Å; C267-N270 PolarHBondContact O-N 2.78Å; Y268-N270 VanDerWaalsContact C-N 3.26Å; Y268-N270 PolarHBondContact O-N 3.1Å; N270-R277 VanDerWaalsContact CB-NH1 3.34Å; N270-R277 PolarHBondContact O-NH1 3.22Å; N270-R277 PolarHBondContact OD1-NH1 2.87Å; N270-R277 PolarHBondContact OD1-NH2 3.47Å |
| 271 | V | 72.5 | Confident | 72.7 | Confident | 114 Ų | 114 | 78.8 Ų | 78.8 | 69% | 0.691 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -94.8 | -46 | -173.8 | 175.7 | 0 | 0 | 0 | 0 | 111.4 | C267 Y268 | C267-V271 WeakPolarHBondContact O-CG2 3.24Å; C267-V271 PolarHBondContact O-N 3.09Å; Y268-V271 PolarHBondContact O-N 2.86Å |
| 272 | S | 66.8 | Low | 70.7 | Confident | 50 Ų | 50 | 85.4 Ų | 85.4 | 35% | 0.35 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -85.5 | -7.1 | -172.8 | -50.7 | 0 | 0 | 0 | 0 | 114.2 | Y268 P274 | Y268-S272 VanDerWaalsContact CD2-OG 3.26Å; Y268-S272 WeakPolarHBondContact CD2-OG 3.25Å; Y268-S272 WeakPolarHBondContact CE2-OG 3.22Å; Y268-S272 WeakPolarHBondContact O-CA 3.49Å; Y268-S272 WeakPolarHBondContact O-CB 3.34Å; Y268-S272 PolarHBondContact O-N 2.91Å; Y268-S272 PolarHBondContact O-OG 2.93Å; S272-P274 WeakPolarHBondContact O-CD 3.36Å |
| 273 | R | 68.5 | Low | 68.4 | Low | 66 Ų | 66 | 87 Ų | 87 | 25% | 0.249 | 48% | 0.482 | C | S | . | . | trans | -78.5 | 121.4 | 173.3 | -79.5 | -171.5 | -151.4 | -170.6 | 16.9 | 111.3 | T173 L174 P175 R176 D269 G275 | T173-R273 PolarHBondContact O-NH1 3.27Å; L174-R273 PolarHBondContact O-NE 3.01Å; P175-R273 VanDerWaalsContact CA-NH2 3.31Å; R176-R273 HydrophobicContact CG-CG 4.48Å; D269-R273 VanDerWaalsContact O-CB 3.28Å; D269-R273 WeakPolarHBondContact O-CB 3.49Å; D269-R273 WeakPolarHBondContact O-CD 3.46Å; D269-R273 WeakPolarHBondContact O-CG 3.47Å; D269-R273 IonicContact OD2-CZ 2.66Å; D269-R273 IonicContact OD2-NE 2.83Å; D269-R273 PolarHBondContact OD2-NE 3.12Å; D269-R273 IonicContact OD2-NH2 3.91Å; D269-R273 PolarHBondContact OD2-NH2 3.35Å; R273-G275 VanDerWaalsContact C-N 3.31Å; R273-G275 PolarHBondContact O-N 3.37Å | ||
| 274 | P | 65.9 | Low | 67.7 | Low | 84 Ų | 84 | 85.7 Ų | 85.7 | 55% | 0.545 | 48% | 0.477 | S | S | . | . | trans | -77.9 | -14.3 | 177.1 | 32.5 | -35.7 | 0 | 0 | 0 | 113.2 | K166 S272 | K166-P274 WeakPolarHBondContact CB-O 3.4Å; S272-P274 WeakPolarHBondContact O-CD 3.36Å | ||
| 275 | G | 73.7 | Confident | 67 | Low | 2 Ų | 2 | 88.5 Ų | 88.5 | 2% | 0.021 | 48% | 0.484 | C | S | . | . | S | Bend | trans | -77.3 | 167.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | K166 C167 C172 R273 | K166-G275 WeakPolarHBondContact CD-O 3.49Å; C167-G275 CarbonylContact O-C 3.48Å; C167-G275 WeakPolarHBondContact O-CA 3.32Å; C172-G275 VanDerWaalsContact O-CA 3.26Å; C172-G275 WeakPolarHBondContact O-CA 3.24Å; C172-G275 PolarHBondContact O-N 3.05Å; R273-G275 VanDerWaalsContact C-N 3.31Å; R273-G275 PolarHBondContact O-N 3.37Å |
| 276 | C | 76.6 | Confident | 66.4 | Low | 19 Ų | 19 | 90.7 Ų | 90.7 | 13% | 0.128 | 50% | 0.498 | C | S | . | . | trans | -74.7 | 153.1 | 178.1 | -158 | 0 | 0 | 0 | 0 | 113.3 | C161 C164 K166 C167 R168 | C161-C276 HydrophobicContact CB-CB 3.72Å; C161-C276 WeakPolarHBondContact CB-SG 3.44Å; C161-C276 PolarHBondContact SG-SG 3.2Å; C164-C276 WeakPolarHBondContact CB-SG 3.26Å; C164-C276 WeakPolarHBondContact SG-CB 3.35Å; C164-C276 CovalentContact SG-SG 2.04Å; C164-C276 PolarHBondContact SG-SG 3.04Å; K166-C276 HydrophobicContact CB-CB 3.96Å; C167-C276 PolarHBondContact O-N 3.1Å; R168-C276 HydrophobicContact CG-CB 4.2Å | ||
| 277 | R | 73 | Confident | 65.8 | Low | 153 Ų | 153 | 88 Ų | 88 | 58% | 0.577 | 49% | 0.493 | S | S | * | . | trans | -129.8 | 8.5 | -175.6 | -60.1 | -175.1 | 62.5 | 179 | 4.8 | 114.4 | N270 K279 | N270-R277 VanDerWaalsContact CB-NH1 3.34Å; N270-R277 PolarHBondContact O-NH1 3.22Å; N270-R277 PolarHBondContact OD1-NH1 2.87Å; N270-R277 PolarHBondContact OD1-NH2 3.47Å; R277-K279 PolarHBondContact O-N 3.05Å | ||
| 278 | C | 75.4 | Confident | 65 | Low | 59 Ų | 59 | 89.3 Ų | 89.3 | 40% | 0.399 | 50% | 0.495 | S | S | . | . | trans | -56.3 | 126.1 | 174 | -63.5 | 0 | 0 | 0 | 0 | 108.9 | N280 | C278-N280 PolarHBondContact O-N 3.26Š| ||
| 279 | K | 69.5 | Low | 64.3 | Low | 194 Ų | 194 | 90.6 Ų | 90.6 | 84% | 0.843 | 51% | 0.51 | S | S | * | . | trans | -55.1 | 142.1 | 160.7 | -73.4 | -177 | 176.7 | -179 | 0 | 107.1 | R277 S281 | R277-K279 PolarHBondContact O-N 3.05Å; K279-S281 VanDerWaalsContact C-N 3.28Å; K279-S281 PolarHBondContact O-N 3.42Å | ||
| 280 | N | 53.2 | Low | 63.4 | Low | 113 Ų | 113 | 96.3 Ų | 96.3 | 60% | 0.604 | 54% | 0.542 | S | S | * | . | trans | -70.1 | 86.2 | -172.2 | -158.7 | 13 | 0 | 0 | 0 | 109.6 | C278 Q282 | C278-N280 PolarHBondContact O-N 3.26Å; N280-Q282 PolarHBondContact ND2-NE2 3.33Å; N280-Q282 VanDerWaalsContact ND2-NE2 3.12Å; N280-Q282 PolarHBondContact O-N 3.43Å | ||
| 281 | S | 46.8 | Very low | 62.7 | Low | 93 Ų | 93 | 98.6 Ų | 98.6 | 65% | 0.65 | 56% | 0.557 | S | S | * | * | trans | -67.8 | 80 | 162.8 | -59.8 | 0 | 0 | 0 | 0 | 107.1 | K279 A283 | K279-S281 VanDerWaalsContact C-N 3.28Å; K279-S281 PolarHBondContact O-N 3.42Å; S281-A283 PolarHBondContact O-N 3.3Å | ||
| 282 | Q | 40.7 | Very low | 61.9 | Low | 164 Ų | 164 | 97.3 Ų | 97.3 | 77% | 0.766 | 55% | 0.546 | S | S | * | . | trans | -66.5 | 108.4 | 162.7 | -64.9 | -179.9 | 11.1 | 0 | 0 | 106.1 | N280 | N280-Q282 PolarHBondContact ND2-NE2 3.33Å; N280-Q282 VanDerWaalsContact ND2-NE2 3.12Å; N280-Q282 PolarHBondContact O-N 3.43Å | ||
| 283 | A | 33.1 | Very low | 61.5 | Low | 171 Ų | 171 | 101.6 Ų | 101.6 | 100% | 1.413 | 56% | 0.563 | S | S | * | * | trans | -111.8 | 0 | 162.1 | 0 | 0 | 0 | 0 | 0 | 106.7 | S281 | S281-A283 PolarHBondContact O-N 3.3Š|
Retrieved 283 of 283 residues in 88.5 ms
(Link to these results)