| 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 | 31.4 | Very low | 31.5 | Very low | 225 Ų | 225 | 166.3 Ų | 166.3 | 100% | 1.108 | 78% | 0.779 | S | S | * | * | 0 | 111 | 0 | -80.9 | -75.1 | -165.6 | 0 | 0 | 107.4 | |||||
| 2 | D | 31.4 | Very low | 31.6 | Very low | 132 Ų | 132 | 157.8 Ų | 157.8 | 71% | 0.706 | 75% | 0.749 | S | S | * | * | trans | 73.7 | 38.6 | 160.5 | -48.3 | -20.1 | 0 | 0 | 0 | 122.2 | ||||
| 3 | F | 30.8 | Very low | 31.6 | Very low | 198 Ų | 198 | 153.5 Ų | 153.5 | 87% | 0.868 | 73% | 0.728 | S | S | * | * | trans | -91.8 | -8.3 | 168.8 | -104.1 | -89.1 | 0 | 0 | 0 | 115.4 | ||||
| 4 | L | 30.3 | Very low | 31.6 | Very low | 167 Ų | 167 | 148.4 Ų | 148.4 | 87% | 0.874 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -10 | -173.9 | -93.8 | 151.3 | 0 | 0 | 0 | 114.9 | ||
| 5 | L | 31.4 | Very low | 31.4 | Very low | 139 Ų | 139 | 145.7 Ų | 145.7 | 73% | 0.728 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.2 | 1.7 | -175.2 | -96.3 | 143.9 | 0 | 0 | 0 | 115.1 | ||
| 6 | Y | 31.2 | Very low | 31.3 | Very low | 161 Ų | 161 | 139.7 Ų | 139.7 | 63% | 0.631 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -102.5 | -6.9 | -175.5 | -121.5 | -90.9 | 0 | 0 | 0 | 115.4 | ||
| 7 | L | 32.4 | Very low | 31.2 | Very low | 147 Ų | 147 | 134.4 Ų | 134.4 | 77% | 0.77 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -84 | -17.7 | -177.2 | -88.4 | 153.8 | 0 | 0 | 0 | 114.2 | K9 | L7-K9 VanDerWaalsContact C-N 3.3Å; L7-K9 PolarHBondContact O-N 3.26Å |
| 8 | E | 30.5 | Very low | 30.9 | Very low | 169 Ų | 169 | 129.1 Ų | 129.1 | 79% | 0.79 | 62% | 0.622 | S | S | * | * | G | 310 helix | trans | -75.5 | -13.1 | 177.5 | -74.2 | -170.4 | 147.6 | 0 | 0 | 114.3 | Y10 | E8-Y10 VanDerWaalsContact C-N 3.29Å; E8-Y10 PolarHBondContact O-N 2.98Å |
| 9 | K | 33.8 | Very low | 30.7 | Very low | 157 Ų | 157 | 129.2 Ų | 129.2 | 68% | 0.683 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -78.9 | -0.5 | -176.4 | -91.6 | -177.7 | 178.3 | 174.4 | 0 | 115.7 | L7 | L7-K9 VanDerWaalsContact C-N 3.3Å; L7-K9 PolarHBondContact O-N 3.26Å |
| 10 | Y | 33.4 | Very low | 30.6 | Very low | 200 Ų | 200 | 128.4 Ų | 128.4 | 78% | 0.784 | 62% | 0.622 | S | S | * | * | G | 310 helix | trans | -114.9 | 28.9 | -178.3 | -75.4 | -80.3 | 0 | 0 | 0 | 114.1 | E8 P12 | E8-Y10 VanDerWaalsContact C-N 3.29Å; E8-Y10 PolarHBondContact O-N 2.98Å; Y10-P12 WeakPolarHBondContact O-CD 3.49Å |
| 11 | Q | 29.9 | Very low | 30.6 | Very low | 134 Ų | 134 | 129.1 Ų | 129.1 | 63% | 0.626 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 119.1 | 164.7 | -73.8 | -157.3 | -6.1 | 0 | 0 | 110.5 | Q13 | Q11-Q13 PolarHBondContact O-N 3.09Š|
| 12 | P | 33.4 | Very low | 30.8 | Very low | 64 Ų | 64 | 127.3 Ų | 127.3 | 42% | 0.416 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -69.5 | 124.6 | 172.1 | 8.2 | 2.9 | 0 | 0 | 0 | 109.2 | Y10 D204 | Y10-P12 WeakPolarHBondContact O-CD 3.49Å; P12-D204 VanDerWaalsContact CB-OD2 3.26Å; P12-D204 WeakPolarHBondContact CB-OD2 3.41Å |
| 13 | Q | 31.6 | Very low | 30.6 | Very low | 102 Ų | 102 | 126.6 Ų | 126.6 | 48% | 0.477 | 61% | 0.614 | S | S | . | * | P | Polyproline II helix | trans | -77.7 | 121.7 | 176.1 | -64.9 | 180 | 7.4 | 0 | 0 | 109 | Q11 Y15 | Q11-Q13 PolarHBondContact O-N 3.09Å; Q13-Y15 HydrophobicContact CB-CE2 4.16Å; Q13-Y15 WeakPolarHBondContact O-CD2 3.11Å; Q13-Y15 PolarHBondContact O-N 3.37Å |
| 14 | L | 31 | Very low | 30.6 | Very low | 83 Ų | 83 | 122.2 Ų | 122.2 | 44% | 0.435 | 60% | 0.603 | S | S | . | * | trans | -63.9 | 115.7 | 175.1 | -84.9 | 155.8 | 0 | 0 | 0 | 110.7 | I29 | L14-I29 HydrophobicContact CB-CB 4.15Å; L14-I29 HydrophobicContact CB-CD1 4.16Å; L14-I29 PolarHBondContact O-N 2.98Å | ||
| 15 | Y | 29.2 | Very low | 30.5 | Very low | 107 Ų | 107 | 119 Ų | 119 | 42% | 0.42 | 59% | 0.586 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -105.2 | 123.9 | 165.4 | -64.4 | -83.8 | 0 | 0 | 0 | 108.8 | Q13 K26 | Q13-Y15 HydrophobicContact CB-CE2 4.16Å; Q13-Y15 WeakPolarHBondContact O-CD2 3.11Å; Q13-Y15 PolarHBondContact O-N 3.37Å; Y15-K26 HydrophobicContact CD1-CB 4.22Å; Y15-K26 HydrophobicContact CD1-CD 4.49Å |
| 16 | V | 29.5 | Very low | 30.4 | Very low | 50 Ų | 50 | 119.6 Ų | 119.6 | 30% | 0.303 | 58% | 0.583 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -85.7 | 120.3 | 161.8 | -178.7 | 0 | 0 | 0 | 0 | 106.7 | K27 I29 | V16-K27 PolarHBondContact N-O 3.3Å; V16-I29 HydrophobicContact CG2-CD1 3.33Å; V16-I29 HydrophobicContact CG2-CG1 3.85Å |
| 17 | T | 28.7 | Very low | 30.5 | Very low | 49 Ų | 49 | 119.6 Ų | 119.6 | 30% | 0.301 | 59% | 0.586 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -104 | 97.3 | 168.8 | 48.4 | 0 | 0 | 0 | 0 | 108.5 | V24 | T17-V24 HydrophobicContact CG2-CG1 4.47Å |
| 18 | S | 26.6 | Very low | 30.3 | Very low | 40 Ų | 40 | 121.2 Ų | 121.2 | 28% | 0.28 | 58% | 0.582 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -80.5 | 123 | 162.7 | 57.4 | 0 | 0 | 0 | 0 | 108.1 | ||
| 19 | I | 26.9 | Very low | 30.5 | Very low | 131 Ų | 131 | 116.9 Ų | 116.9 | 67% | 0.672 | 56% | 0.563 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -88.6 | 108.1 | 168.3 | -59.1 | 173.9 | 0 | 0 | 0 | 107 | ||
| 20 | I | 28.9 | Very low | 30.2 | Very low | 113 Ų | 113 | 114.7 Ų | 114.7 | 58% | 0.579 | 57% | 0.565 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -121.7 | 117.6 | 165.9 | -55.7 | 174.6 | 0 | 0 | 0 | 105.3 | H22 N23 | I20-H22 PolarHBondContact O-N 2.82Å; I20-N23 PolarHBondContact O-N 3.21Å |
| 21 | D | 30.2 | Very low | 30.2 | Very low | 143 Ų | 143 | 109.2 Ų | 109.2 | 77% | 0.765 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 44.3 | 65.5 | 173.1 | -62.5 | -28.2 | 0 | 0 | 0 | 115.5 | N23 | D21-N23 PolarHBondContact O-N 3.28Š|
| 22 | H | 35.6 | Very low | 30.1 | Very low | 187 Ų | 187 | 108.6 Ų | 108.6 | 87% | 0.866 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 56.8 | 5 | 172.3 | -64.6 | -45.3 | 0 | 0 | 0 | 117.6 | I20 | I20-H22 PolarHBondContact O-N 2.82Š|
| 23 | N | 27.5 | Very low | 30 | Very low | 118 Ų | 118 | 110.2 Ų | 110.2 | 63% | 0.631 | 58% | 0.575 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -103.7 | 119.1 | 174.4 | -79.9 | -28.1 | 0 | 0 | 0 | 111.2 | I20 D21 I25 | I20-N23 PolarHBondContact O-N 3.21Å; D21-N23 PolarHBondContact O-N 3.28Å; N23-I25 PolarHBondContact O-N 2.74Å |
| 24 | V | 31.3 | Very low | 29.9 | Very low | 105 Ų | 105 | 110.4 Ų | 110.4 | 64% | 0.636 | 59% | 0.586 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -80.4 | 100.2 | 175.8 | -179.8 | 0 | 0 | 0 | 0 | 109.1 | T17 K26 | T17-V24 HydrophobicContact CG2-CG1 4.47Å; V24-K26 HydrophobicContact CG1-CG 4.3Å |
| 25 | I | 28.2 | Very low | 29.7 | Very low | 100 Ų | 100 | 114.1 Ų | 114.1 | 51% | 0.513 | 61% | 0.605 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.6 | 116.7 | 170.1 | -59 | 175 | 0 | 0 | 0 | 108.2 | N23 | N23-I25 PolarHBondContact O-N 2.74Å |
| 26 | K | 29.4 | Very low | 29.6 | Very low | 152 Ų | 152 | 116.3 Ų | 116.3 | 66% | 0.661 | 62% | 0.622 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -92.1 | 111.1 | 172.8 | -66.2 | -178.6 | -176.8 | 178.7 | 0 | 108.9 | Y15 V24 | Y15-K26 HydrophobicContact CD1-CB 4.22Å; Y15-K26 HydrophobicContact CD1-CD 4.49Å; V24-K26 HydrophobicContact CG1-CG 4.3Å |
| 27 | K | 33 | Very low | 29.5 | Very low | 161 Ų | 161 | 121.8 Ų | 121.8 | 70% | 0.7 | 65% | 0.645 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -104.7 | 127.2 | 169.4 | -123.1 | 178.6 | -179.4 | 178.5 | 0 | 109.9 | V16 | V16-K27 PolarHBondContact N-O 3.3Å |
| 28 | R | 28.6 | Very low | 29.4 | Very low | 180 Ų | 180 | 124.6 Ų | 124.6 | 68% | 0.679 | 67% | 0.666 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -75 | 121.5 | 176.4 | -159.1 | 179.7 | -167.2 | -168.7 | 0.7 | 108.1 | ||
| 29 | I | 34.1 | Very low | 29.6 | Very low | 78 Ų | 78 | 128.2 Ų | 128.2 | 40% | 0.4 | 69% | 0.687 | S | S | . | * | P | Polyproline II helix | trans | -80.6 | 124.3 | 164 | -63 | 171.9 | 0 | 0 | 0 | 106.6 | L14 V16 S31 | L14-I29 HydrophobicContact CB-CB 4.15Å; L14-I29 HydrophobicContact CB-CD1 4.16Å; L14-I29 PolarHBondContact O-N 2.98Å; V16-I29 HydrophobicContact CG2-CD1 3.33Å; V16-I29 HydrophobicContact CG2-CG1 3.85Å; I29-S31 PolarHBondContact O-N 2.67Å |
| 30 | P | 28 | Very low | 29.8 | Very low | 112 Ų | 112 | 129.2 Ų | 129.2 | 73% | 0.727 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 120.8 | 171.8 | 24.5 | -28.8 | 0 | 0 | 0 | 109.3 | S32 | P30-S32 PolarHBondContact O-N 3.1Š|
| 31 | S | 32.4 | Very low | 29.8 | Very low | 85 Ų | 85 | 131.5 Ų | 131.5 | 59% | 0.594 | 71% | 0.707 | S | S | * | * | trans | -63.7 | 114.9 | 166.2 | 51.1 | 0 | 0 | 0 | 0 | 108.3 | I29 T33 | I29-S31 PolarHBondContact O-N 2.67Å; S31-T33 VanDerWaalsContact C-N 3.27Å; S31-T33 PolarHBondContact O-N 3.25Å | ||
| 32 | S | 29.3 | Very low | 30.1 | Very low | 120 Ų | 120 | 132.4 Ų | 132.4 | 84% | 0.839 | 71% | 0.711 | S | S | * | * | trans | -74 | 82.1 | 172.4 | 57.1 | 0 | 0 | 0 | 0 | 109.7 | P30 | P30-S32 PolarHBondContact O-N 3.1Š| ||
| 33 | T | 30.3 | Very low | 29.9 | Very low | 98 Ų | 98 | 130.6 Ų | 130.6 | 60% | 0.601 | 71% | 0.708 | S | S | * | * | trans | -87.5 | 119.8 | 154.6 | 15.6 | 0 | 0 | 0 | 0 | 107.3 | S31 L35 | S31-T33 VanDerWaalsContact C-N 3.27Å; S31-T33 PolarHBondContact O-N 3.25Å; T33-L35 PolarHBondContact O-N 3.04Å | ||
| 34 | P | 29.2 | Very low | 30.3 | Very low | 107 Ų | 107 | 132.7 Ų | 132.7 | 70% | 0.695 | 72% | 0.719 | S | S | * | * | trans | -65 | 124.2 | 164.9 | 28 | -29.3 | 0 | 0 | 0 | 107.4 | I36 | P34-I36 PolarHBondContact O-N 2.97Š| ||
| 35 | L | 26.4 | Very low | 30.3 | Very low | 161 Ų | 161 | 132.2 Ų | 132.2 | 84% | 0.843 | 72% | 0.721 | S | S | * | * | trans | -58.6 | 107.9 | 165.7 | -100 | 94.6 | 0 | 0 | 0 | 107.6 | T33 Q37 | T33-L35 PolarHBondContact O-N 3.04Å; L35-Q37 PolarHBondContact O-N 3.11Å | ||
| 36 | I | 28.1 | Very low | 30.6 | Very low | 152 Ų | 152 | 134.2 Ų | 134.2 | 78% | 0.779 | 73% | 0.732 | S | S | * | * | trans | -86.2 | 99.2 | 161.1 | -60.9 | 177.4 | 0 | 0 | 0 | 105.8 | P34 S38 | P34-I36 PolarHBondContact O-N 2.97Å; I36-S38 PolarHBondContact O-N 3.4Å | ||
| 37 | Q | 28 | Very low | 30.8 | Very low | 166 Ų | 166 | 133.4 Ų | 133.4 | 78% | 0.776 | 74% | 0.735 | S | S | * | * | trans | -66.6 | 106.9 | 165.6 | -82.2 | 177.6 | -24.2 | 0 | 0 | 108.5 | L35 | L35-Q37 PolarHBondContact O-N 3.11Š| ||
| 38 | S | 26.4 | Very low | 30.9 | Very low | 107 Ų | 107 | 132.2 Ų | 132.2 | 75% | 0.748 | 74% | 0.737 | S | S | * | * | trans | -86.6 | 102.7 | 162.9 | 58.2 | 0 | 0 | 0 | 0 | 108.7 | I36 | I36-S38 PolarHBondContact O-N 3.4Š| ||
| 39 | T | 30.1 | Very low | 31.2 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 71% | 0.712 | 74% | 0.738 | S | S | * | * | trans | -143.4 | 107.2 | 161.6 | 40.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 40 | N | 31.3 | Very low | 31.2 | Very low | 153 Ų | 153 | 132.5 Ų | 132.5 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | trans | 59.5 | 104.8 | 142 | -64.8 | -7.5 | 0 | 0 | 0 | 119.3 | N42 | N40-N42 PolarHBondContact O-N 3.11Š| ||
| 41 | N | 28.9 | Very low | 31.6 | Very low | 160 Ų | 160 | 133.2 Ų | 133.2 | 86% | 0.856 | 75% | 0.75 | S | S | * | * | trans | -39.1 | 120.8 | 143.8 | -81.8 | -16.9 | 0 | 0 | 0 | 110.8 | ||||
| 42 | N | 35.2 | Very low | 31.7 | Very low | 162 Ų | 162 | 135.1 Ų | 135.1 | 87% | 0.866 | 75% | 0.754 | S | S | * | * | trans | -143.3 | 123.6 | 142.7 | -102.8 | -15.7 | 0 | 0 | 0 | 108.9 | N40 | N40-N42 PolarHBondContact O-N 3.11Š| ||
| 43 | N | 32.4 | Very low | 32.1 | Very low | 149 Ų | 149 | 136.9 Ų | 136.9 | 80% | 0.797 | 75% | 0.754 | S | S | * | * | trans | -46.7 | 134.9 | 171.5 | -69.2 | -32.7 | 0 | 0 | 0 | 111.4 | ||||
| 44 | N | 34.7 | Very low | 32.2 | Very low | 162 Ų | 162 | 140.4 Ų | 140.4 | 87% | 0.866 | 77% | 0.769 | S | S | * | * | -166 | 132.5 | 122 | -101.5 | -18.3 | 0 | 0 | 0 | 112.9 | |||||
| 45 | S | 32.4 | Very low | 32.5 | Very low | 95 Ų | 95 | 139.1 Ų | 139.1 | 66% | 0.664 | 78% | 0.776 | S | S | * | * | trans | -50.8 | 138.7 | 168.7 | 175.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 46 | N | 33.4 | Very low | 32.8 | Very low | 142 Ų | 142 | 138.6 Ų | 138.6 | 76% | 0.759 | 77% | 0.773 | S | S | * | * | -179.7 | 121.8 | 115.1 | -91.3 | -12.6 | 0 | 0 | 0 | 113.1 | |||||
| 47 | N | 33.7 | Very low | 33 | Very low | 135 Ų | 135 | 137.6 Ų | 137.6 | 72% | 0.722 | 77% | 0.77 | S | S | * | * | trans | 19.7 | 122.7 | 133.3 | -79.9 | -9.7 | 0 | 0 | 0 | 118.4 | ||||
| 48 | N | 35.5 | Very low | 33.2 | Very low | 136 Ų | 136 | 138.4 Ų | 138.4 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | 169.7 | 125.8 | 94.5 | -102.8 | -21.4 | 0 | 0 | 0 | 113 | |||||
| 49 | N | 35.4 | Very low | 33.2 | Very low | 131 Ų | 131 | 144.1 Ų | 144.1 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | 59.9 | 136.2 | 128.5 | -87.6 | -7.9 | 0 | 0 | 0 | 123.9 | |||||
| 50 | N | 35.1 | Very low | 33.2 | Very low | 133 Ų | 133 | 144.4 Ų | 144.4 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | 82 | 148.8 | 146.1 | -64.1 | -13.1 | 0 | 0 | 0 | 118.1 | ||||
| 51 | N | 35 | Very low | 32.9 | Very low | 128 Ų | 128 | 143 Ų | 143 | 68% | 0.684 | 78% | 0.784 | S | S | * | * | cis | -179 | 145.1 | -30.8 | -132 | -8.9 | 0 | 0 | 0 | 103.2 | ||||
| 52 | N | 35.6 | Very low | 32.7 | Very low | 124 Ų | 124 | 145.8 Ų | 145.8 | 66% | 0.663 | 78% | 0.782 | S | S | * | * | trans | 59.1 | 117.6 | 146.6 | -68.7 | -8.3 | 0 | 0 | 0 | 120.8 | ||||
| 53 | N | 37.8 | Very low | 32.4 | Very low | 157 Ų | 157 | 143.9 Ų | 143.9 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | 166 | 146.3 | 85.3 | -98.9 | -22.6 | 0 | 0 | 0 | 114.3 | |||||
| 54 | N | 31.9 | Very low | 32.1 | Very low | 172 Ų | 172 | 143.3 Ų | 143.3 | 92% | 0.92 | 78% | 0.779 | S | S | * | * | trans | -61 | 152.3 | 173.9 | -83.4 | -29.5 | 0 | 0 | 0 | 115.2 | ||||
| 55 | G | 35.3 | Very low | 31.8 | Very low | 81 Ų | 81 | 143.4 Ų | 143.4 | 84% | 0.835 | 78% | 0.778 | S | S | * | * | trans | -158.1 | 110.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 56 | N | 33.2 | Very low | 31.6 | Very low | 149 Ų | 149 | 146.6 Ų | 146.6 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | trans | -87.3 | 165.9 | -172.4 | -116.2 | -10.5 | 0 | 0 | 0 | 113.6 | ||||
| 57 | N | 31.6 | Very low | 31.2 | Very low | 131 Ų | 131 | 146.1 Ų | 146.1 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | trans | 80.5 | 140.7 | 156 | -59.4 | -20 | 0 | 0 | 0 | 116.6 | ||||
| 58 | Q | 33 | Very low | 30.9 | Very low | 183 Ų | 183 | 147.7 Ų | 147.7 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | cis | -168.3 | 140.5 | 36.9 | -135.6 | 159.2 | 19.4 | 0 | 0 | 110.5 | ||||
| 59 | Y | 26 | Very low | 30.3 | Very low | 228 Ų | 228 | 146.2 Ų | 146.2 | 89% | 0.894 | 79% | 0.787 | S | S | * | * | trans | -77.7 | 145.1 | 171.4 | -87.3 | -93.2 | 0 | 0 | 0 | 112.1 | ||||
| 60 | S | 30.1 | Very low | 30 | Very low | 121 Ų | 121 | 150.1 Ų | 150.1 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | trans | -129 | 109.2 | 155.9 | 63.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 61 | T | 24.4 | Very low | 29.5 | Very low | 124 Ų | 124 | 151 Ų | 151 | 76% | 0.761 | 80% | 0.799 | S | S | * | * | trans | -80.5 | 148.4 | 171.5 | 43.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 62 | R | 25.4 | Very low | 29 | Very low | 218 Ų | 218 | 151.7 Ų | 151.7 | 82% | 0.823 | 80% | 0.802 | S | S | * | * | 137.3 | 112.2 | 113.7 | -158.1 | 178.4 | -158.2 | -176.4 | 4.1 | 113.9 | |||||
| 63 | S | 29.4 | Very low | 28.5 | Very low | 122 Ų | 122 | 153 Ų | 153 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -164.3 | 114.4 | 133.1 | 57.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 64 | N | 24.8 | Very low | 28 | Very low | 138 Ų | 138 | 155.3 Ų | 155.3 | 74% | 0.738 | 81% | 0.812 | S | S | * | * | trans | -69 | 143.1 | 179.7 | -60.6 | -26.8 | 0 | 0 | 0 | 112.5 | ||||
| 65 | I | 29.2 | Very low | 27.9 | Very low | 164 Ų | 164 | 155.4 Ų | 155.4 | 84% | 0.841 | 81% | 0.81 | S | S | * | * | trans | -150 | 112.4 | 135.8 | -61.8 | -169.1 | 0 | 0 | 0 | 109.4 | ||||
| 66 | H | 28.4 | Very low | 27.4 | Very low | 161 Ų | 161 | 159.9 Ų | 159.9 | 75% | 0.745 | 81% | 0.81 | S | S | * | * | trans | 49.9 | 101.2 | 152.6 | -83.8 | -74.4 | 0 | 0 | 0 | 123.3 | ||||
| 67 | D | 25.5 | Very low | 27 | Very low | 133 Ų | 133 | 159.9 Ų | 159.9 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | 35.5 | 103.2 | 119.6 | -66.8 | -33.1 | 0 | 0 | 0 | 120.3 | |||||
| 68 | L | 27 | Very low | 26.8 | Very low | 168 Ų | 168 | 160.6 Ų | 160.6 | 88% | 0.88 | 81% | 0.813 | S | S | * | * | trans | -140.9 | 86.5 | 136.1 | -107.3 | 144.1 | 0 | 0 | 0 | 107.3 | Y70 | L68-Y70 PolarHBondContact O-N 3.02Š| ||
| 69 | S | 23.3 | Very low | 26.4 | Very low | 105 Ų | 105 | 159.8 Ų | 159.8 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | trans | -70 | 105.7 | 168 | 54.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 70 | Y | 27.6 | Very low | 26.4 | Very low | 213 Ų | 213 | 155 Ų | 155 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | trans | -131.9 | 103.3 | 151.4 | -100.4 | -82.9 | 0 | 0 | 0 | 108.7 | L68 | L68-Y70 PolarHBondContact O-N 3.02Š| ||
| 71 | N | 25.4 | Very low | 26.1 | Very low | 152 Ų | 152 | 160.1 Ų | 160.1 | 81% | 0.813 | 80% | 0.803 | S | S | * | * | trans | 22.2 | 110.5 | 155.7 | -85.7 | -16.9 | 0 | 0 | 0 | 119.1 | ||||
| 72 | N | 24.4 | Very low | 26.2 | Very low | 141 Ų | 141 | 157.9 Ų | 157.9 | 75% | 0.754 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -27.9 | 144.5 | 137.2 | -65.5 | -33.4 | 0 | 0 | 0 | 114 | ||
| 73 | N | 26 | Very low | 26.3 | Very low | 152 Ų | 152 | 155.2 Ų | 155.2 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | trans | 108.9 | 15.3 | 156 | -55.8 | -19 | 0 | 0 | 0 | 120.9 | ||||
| 74 | F | 27.3 | Very low | 26.1 | Very low | 205 Ų | 205 | 157.3 Ų | 157.3 | 90% | 0.899 | 79% | 0.793 | S | S | * | * | trans | -118.9 | 106.6 | 168.8 | -84.7 | -91.9 | 0 | 0 | 0 | 111.6 | ||||
| 75 | I | 28.4 | Very low | 26.1 | Very low | 174 Ų | 174 | 154 Ų | 154 | 89% | 0.892 | 78% | 0.78 | S | S | * | * | S | Bend | trans | 134.3 | 46.8 | 168.3 | -60.5 | 152.9 | 0 | 0 | 0 | 109.8 | ||
| 76 | Q | 25.1 | Very low | 26.1 | Very low | 175 Ų | 175 | 154.5 Ų | 154.5 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -128.9 | 136.5 | 145.7 | -85.9 | -174.9 | -16.4 | 0 | 0 | 105.2 | ||
| 77 | N | 25.5 | Very low | 26.4 | Very low | 150 Ų | 150 | 153 Ų | 153 | 80% | 0.802 | 77% | 0.771 | S | S | * | * | trans | 82.5 | 87.2 | -179.8 | -51.8 | -25.1 | 0 | 0 | 0 | 116.4 | ||||
| 78 | N | 26.3 | Very low | 26.7 | Very low | 145 Ų | 145 | 152.6 Ų | 152.6 | 78% | 0.775 | 77% | 0.767 | S | S | * | * | -166.8 | 76.5 | 119.4 | -90.7 | -18 | 0 | 0 | 0 | 109 | L80 | N78-L80 PolarHBondContact O-N 3.39Å; N78-L80 VanDerWaalsContact O-N 3.09Å | |||
| 79 | I | 25.7 | Very low | 27.7 | Very low | 167 Ų | 167 | 146.4 Ų | 146.4 | 86% | 0.856 | 74% | 0.735 | S | S | * | * | trans | -70.7 | 83.3 | 146.5 | -63.1 | 170.1 | 0 | 0 | 0 | 104.4 | ||||
| 80 | L | 26.2 | Very low | 28.9 | Very low | 127 Ų | 127 | 145.4 Ų | 145.4 | 67% | 0.665 | 73% | 0.728 | S | S | * | * | trans | -97.7 | 99.1 | 162.3 | -146.5 | 84.3 | 0 | 0 | 0 | 106.4 | N78 T82 | N78-L80 PolarHBondContact O-N 3.39Å; N78-L80 VanDerWaalsContact O-N 3.09Å; L80-T82 VanDerWaalsContact C-N 3.32Å; L80-T82 HydrophobicContact CD2-CG2 3.81Å; L80-T82 HydrophobicContact CG-CG2 4.35Å; L80-T82 PolarHBondContact O-N 3.27Å | ||
| 81 | R | 23.9 | Very low | 30.5 | Very low | 228 Ų | 228 | 143.4 Ų | 143.4 | 86% | 0.86 | 72% | 0.72 | S | S | * | * | trans | -53 | 99.6 | 155.9 | -82.1 | 173.8 | 157.9 | 179.4 | -6.3 | 107.7 | ||||
| 82 | T | 26.1 | Very low | 33.1 | Very low | 77 Ų | 77 | 141.8 Ų | 141.8 | 47% | 0.472 | 71% | 0.711 | S | S | . | * | trans | -124.5 | 87.2 | 158.8 | 42.6 | 0 | 0 | 0 | 0 | 108.2 | L80 N84 S85 | L80-T82 VanDerWaalsContact C-N 3.32Å; L80-T82 HydrophobicContact CD2-CG2 3.81Å; L80-T82 HydrophobicContact CG-CG2 4.35Å; L80-T82 PolarHBondContact O-N 3.27Å; T82-N84 PolarHBondContact O-N 3.41Å; T82-S85 WeakPolarHBondContact CB-OG 3.47Å; T82-S85 PolarHBondContact OG1-OG 3.49Å | ||
| 83 | L | 26.3 | Very low | 36 | Very low | 163 Ų | 163 | 137 Ų | 137 | 85% | 0.853 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47 | 126 | 148.7 | -74.8 | 134.1 | 0 | 0 | 0 | 107.1 | ||
| 84 | N | 25.3 | Very low | 39 | Very low | 166 Ų | 166 | 130.6 Ų | 130.6 | 89% | 0.888 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.5 | 48.5 | 178.5 | -64.1 | -12.3 | 0 | 0 | 0 | 118.9 | T82 | T82-N84 PolarHBondContact O-N 3.41Š|
| 85 | S | 25.3 | Very low | 41.7 | Very low | 68 Ų | 68 | 126.5 Ų | 126.5 | 48% | 0.476 | 64% | 0.637 | S | S | . | * | trans | -132.6 | 123.9 | 162.2 | 61.2 | 0 | 0 | 0 | 0 | 110.9 | T82 F87 | T82-S85 WeakPolarHBondContact CB-OG 3.47Å; T82-S85 PolarHBondContact OG1-OG 3.49Å; S85-F87 PolarHBondContact O-N 3.26Å | ||
| 86 | Q | 29.1 | Very low | 44.6 | Very low | 175 Ų | 175 | 119.8 Ų | 119.8 | 82% | 0.818 | 60% | 0.601 | S | S | * | * | trans | -21.1 | 123.6 | 162.7 | -74.7 | 160 | -32.1 | 0 | 0 | 111.1 | I88 | Q86-I88 HydrophobicContact CB-CG1 4.48Å; Q86-I88 PolarHBondContact O-N 2.91Å | ||
| 87 | F | 34.1 | Very low | 47.7 | Very low | 130 Ų | 130 | 111.4 Ų | 111.4 | 57% | 0.57 | 56% | 0.563 | S | S | * | * | trans | -59.6 | 87.8 | 167.1 | -93.8 | -90 | 0 | 0 | 0 | 107.8 | S85 L89 L277 | S85-F87 PolarHBondContact O-N 3.26Å; F87-L89 VanDerWaalsContact C-N 3.29Å; F87-L89 PolarHBondContact O-N 3.41Å; F87-L277 WeakPolarHBondContact CZ-O 2.9Å | ||
| 88 | I | 33.3 | Very low | 50.7 | Low | 124 Ų | 124 | 109 Ų | 109 | 64% | 0.636 | 55% | 0.545 | S | S | * | . | trans | -69.8 | 98.3 | 171.5 | -58.2 | 176.2 | 0 | 0 | 0 | 104.5 | Q86 S90 | Q86-I88 HydrophobicContact CB-CG1 4.48Å; Q86-I88 PolarHBondContact O-N 2.91Å; I88-S90 PolarHBondContact O-N 2.67Å; I88-S90 PolarHBondContact O-OG 2.95Å | ||
| 89 | L | 47.5 | Very low | 53.7 | Low | 38 Ų | 38 | 108.7 Ų | 108.7 | 20% | 0.199 | 54% | 0.542 | C | S | . | . | trans | -65.8 | 57.6 | 166.7 | -74.7 | 157.6 | 0 | 0 | 0 | 109.9 | F87 Y91 H112 I147 I232 L277 | F87-L89 VanDerWaalsContact C-N 3.29Å; F87-L89 PolarHBondContact O-N 3.41Å; L89-Y91 VanDerWaalsContact C-N 3.25Å; L89-Y91 PolarHBondContact O-N 3.47Å; L89-H112 HydrophobicContact CD1-CB 3.79Å; L89-H112 WeakPolarHBondContact CD1-CD2 3.13Å; L89-I147 HydrophobicContact CB-CG2 4.18Å; L89-I147 HydrophobicContact CD1-CD1 4.42Å; L89-I147 HydrophobicContact CD2-CD1 3.95Å; L89-I232 HydrophobicContact CD1-CD1 4.38Å; L89-L277 HydrophobicContact CD2-CD2 4.35Å | ||
| 90 | S | 47.7 | Very low | 56.7 | Low | 84 Ų | 84 | 103.4 Ų | 103.4 | 59% | 0.587 | 52% | 0.515 | S | S | * | . | trans | -82.9 | 0.5 | 179.4 | 46.5 | 0 | 0 | 0 | 0 | 113 | I88 | I88-S90 PolarHBondContact O-N 2.67Å; I88-S90 PolarHBondContact O-OG 2.95Å | ||
| 91 | Y | 60.9 | Low | 59.9 | Low | 171 Ų | 171 | 97.4 Ų | 97.4 | 67% | 0.671 | 48% | 0.484 | S | S | * | . | S | Bend | trans | -100 | 124.2 | -178.1 | -67.6 | -77.3 | 0 | 0 | 0 | 110.8 | L89 W93 | L89-Y91 VanDerWaalsContact C-N 3.25Å; L89-Y91 PolarHBondContact O-N 3.47Å; Y91-W93 PolarHBondContact O-N 2.87Å; Y91-W93 PolarHBondContact O-NE1 3.13Å |
| 92 | D | 79.9 | Confident | 62.9 | Low | 117 Ų | 117 | 89.1 Ų | 89.1 | 63% | 0.626 | 46% | 0.456 | S | S | * | . | trans | -69 | 110.3 | 166.4 | -179.7 | 10.1 | 0 | 0 | 0 | 109.8 | S94 | D92-S94 VanDerWaalsContact CG-OG 3.28Å; D92-S94 PolarHBondContact O-N 3.29Å; D92-S94 WeakPolarHBondContact OD1-CB 3.47Å; D92-S94 PolarHBondContact OD1-N 3.2Å; D92-S94 PolarHBondContact OD1-OG 3.12Å; D92-S94 PolarHBondContact OD2-OG 3.45Å | ||
| 93 | W | 86.9 | Confident | 65.9 | Low | 40 Ų | 40 | 89.5 Ų | 89.5 | 15% | 0.152 | 46% | 0.455 | C | S | . | . | trans | -80 | 2.4 | 179.6 | -68 | 85.8 | 0 | 0 | 0 | 113.3 | Y91 N95 F96 L97 L110 I147 L273 K276 | Y91-W93 PolarHBondContact O-N 2.87Å; Y91-W93 PolarHBondContact O-NE1 3.13Å; W93-N95 VanDerWaalsContact C-N 3.33Å; W93-N95 PolarHBondContact O-N 3.41Å; W93-F96 HydrophobicContact CE3-CB 3.98Å; W93-F96 AromaticContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD2 4.44Å; W93-F96 HydrophobicContact CE3-CE1 4.2Å; W93-F96 AromaticContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CZ3-CD1 4.21Å; W93-F96 HydrophobicContact CZ3-CD2 4.42Å; W93-F96 HydrophobicContact CZ3-CE1 4.45Å; W93-F96 HydrophobicContact CZ3-CG 4.18Å; W93-F96 WeakPolarHBondContact O-CB 3.14Å; W93-F96 PolarHBondContact O-N 2.87Å; W93-L97 WeakPolarHBondContact O-CG 3.23Å; W93-L97 PolarHBondContact O-N 3.29Å; W93-L110 HydrophobicContact CB-CD2 3.75Å; W93-L110 HydrophobicContact CG-CD2 3.85Å; W93-I147 VanDerWaalsContact CD1-O 3.32Å; W93-I147 PolarHBondContact N-O 3.12Å; W93-L273 HydrophobicContact CD2-CD2 4.04Å; W93-L273 HydrophobicContact CE3-CD2 3.58Å; W93-L273 HydrophobicContact CH2-CD2 4.13Å; W93-L273 HydrophobicContact CZ3-CD2 3.63Å; W93-K276 HydrophobicContact CH2-CB 4.09Å; W93-K276 HydrophobicContact CH2-CD 3.85Å; W93-K276 HydrophobicContact CZ3-CD 3.62Å | ||
| 94 | S | 87.8 | Confident | 69 | Low | 18 Ų | 18 | 85.8 Ų | 85.8 | 13% | 0.126 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -51.9 | -45.6 | -176.5 | -64.3 | 0 | 0 | 0 | 0 | 113.5 | D92 L97 K98 Q149 | D92-S94 VanDerWaalsContact CG-OG 3.28Å; D92-S94 PolarHBondContact O-N 3.29Å; D92-S94 WeakPolarHBondContact OD1-CB 3.47Å; D92-S94 PolarHBondContact OD1-N 3.2Å; D92-S94 PolarHBondContact OD1-OG 3.12Å; D92-S94 PolarHBondContact OD2-OG 3.45Å; S94-L97 PolarHBondContact O-N 2.94Å; S94-K98 WeakPolarHBondContact O-CB 3.38Å; S94-K98 PolarHBondContact O-N 3.06Å; S94-Q149 WeakPolarHBondContact CA-O 3.29Å; S94-Q149 WeakPolarHBondContact CB-O 3.3Å; S94-Q149 PolarHBondContact OG-N 2.77Å; S94-Q149 PolarHBondContact OG-O 2.87Å |
| 95 | N | 84.6 | Confident | 72.1 | Confident | 119 Ų | 119 | 77.9 Ų | 77.9 | 64% | 0.636 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -66.8 | -39.5 | 178.2 | -79.8 | -23.3 | 0 | 0 | 0 | 112.6 | W93 K98 I99 | W93-N95 VanDerWaalsContact C-N 3.33Å; W93-N95 PolarHBondContact O-N 3.41Å; N95-K98 PolarHBondContact O-N 3.01Å; N95-I99 WeakPolarHBondContact O-CG1 3.05Å; N95-I99 PolarHBondContact O-N 2.89Å |
| 96 | F | 88.4 | Confident | 75.1 | Confident | 33 Ų | 33 | 76.4 Ų | 76.4 | 15% | 0.145 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 174.9 | 167.8 | -93.2 | 0 | 0 | 0 | 111 | W93 N100 V269 L272 L273 K276 | W93-F96 HydrophobicContact CE3-CB 3.98Å; W93-F96 AromaticContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD2 4.44Å; W93-F96 HydrophobicContact CE3-CE1 4.2Å; W93-F96 AromaticContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CZ3-CD1 4.21Å; W93-F96 HydrophobicContact CZ3-CD2 4.42Å; W93-F96 HydrophobicContact CZ3-CE1 4.45Å; W93-F96 HydrophobicContact CZ3-CG 4.18Å; W93-F96 WeakPolarHBondContact O-CB 3.14Å; W93-F96 PolarHBondContact O-N 2.87Å; F96-N100 PolarHBondContact O-N 3.39Å; F96-N100 PolarHBondContact O-ND2 2.5Å; F96-V269 HydrophobicContact CE1-CG1 3.75Å; F96-V269 HydrophobicContact CZ-CG1 4.34Å; F96-L272 HydrophobicContact CE2-CB 4.25Å; F96-L272 HydrophobicContact CE2-CD1 4.47Å; F96-L272 HydrophobicContact CZ-CB 3.77Å; F96-L272 HydrophobicContact CZ-CD1 4.4Å; F96-L273 HydrophobicContact CD1-CD2 4.16Å; F96-L273 HydrophobicContact CE1-CD1 4.42Å; F96-L273 HydrophobicContact CE1-CD2 3.58Å; F96-L273 HydrophobicContact CE1-CG 3.7Å; F96-L273 HydrophobicContact CZ-CD2 4.19Å; F96-L273 HydrophobicContact CZ-CG 4.18Å; F96-K276 HydrophobicContact CE2-CD 4.2Å |
| 97 | L | 90.5 | Very high | 78 | Confident | 0 Ų | 0 | 71 Ų | 71 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.2 | -46.5 | 175.7 | -64.9 | 171.8 | 0 | 0 | 0 | 111.2 | W93 S94 I99 N100 L101 V108 L110 L249 V269 | W93-L97 WeakPolarHBondContact O-CG 3.23Å; W93-L97 PolarHBondContact O-N 3.29Å; S94-L97 PolarHBondContact O-N 2.94Å; L97-I99 PolarHBondContact O-N 3.36Å; L97-N100 PolarHBondContact O-N 2.85Å; L97-L101 HydrophobicContact CD2-CD1 4.28Å; L97-L101 VanDerWaalsContact O-CB 3.28Å; L97-L101 WeakPolarHBondContact O-CB 3.46Å; L97-L101 PolarHBondContact O-N 3.33Å; L97-V108 HydrophobicContact CB-CG1 3.93Å; L97-V108 HydrophobicContact CD1-CG1 4.11Å; L97-V108 HydrophobicContact CD1-CG2 4.5Å; L97-V108 HydrophobicContact CD2-CG2 4.36Å; L97-V108 HydrophobicContact CG-CG1 4.46Å; L97-L110 HydrophobicContact CD1-CB 3.89Å; L97-L249 HydrophobicContact CD2-CD1 4.07Å; L97-V269 HydrophobicContact CD2-CG1 3.99Å |
| 98 | K | 89 | Confident | 80.8 | Confident | 100 Ų | 100 | 64.8 Ų | 64.8 | 44% | 0.435 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -54.1 | -55.3 | 178 | 177.3 | 172.2 | 179.5 | -176.7 | 0 | 111.4 | S94 N95 N100 L101 L102 Y150 | S94-K98 WeakPolarHBondContact O-CB 3.38Å; S94-K98 PolarHBondContact O-N 3.06Å; N95-K98 PolarHBondContact O-N 3.01Å; K98-N100 PolarHBondContact O-N 3.31Å; K98-L101 PolarHBondContact O-N 2.83Å; K98-L102 VanDerWaalsContact O-CB 3.24Å; K98-L102 WeakPolarHBondContact O-CB 3.31Å; K98-L102 PolarHBondContact O-N 2.8Å; K98-Y150 HydrophobicContact CB-CD2 3.47Å; K98-Y150 VanDerWaalsContact CB-CD2 3.47Å; K98-Y150 HydrophobicContact CB-CE2 3.95Å; K98-Y150 HydrophobicContact CB-CG 3.94Å; K98-Y150 HydrophobicContact CD-CD2 4.04Å; K98-Y150 HydrophobicContact CD-CE2 4.04Å; K98-Y150 HydrophobicContact CG-CD2 3.6Å; K98-Y150 HydrophobicContact CG-CE2 3.56Å; K98-Y150 HydrophobicContact CG-CG 4.47Å |
| 99 | I | 88.6 | Confident | 83.6 | Confident | 137 Ų | 137 | 59 Ų | 59 | 70% | 0.703 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -57.1 | -40.4 | -176.3 | -69.8 | 166 | 0 | 0 | 0 | 111.4 | N95 L97 | N95-I99 WeakPolarHBondContact O-CG1 3.05Å; N95-I99 PolarHBondContact O-N 2.89Å; L97-I99 PolarHBondContact O-N 3.36Å |
| 100 | N | 89.9 | Confident | 85.7 | Confident | 57 Ų | 57 | 57.2 Ų | 57.2 | 31% | 0.305 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -89.5 | -18 | -173.4 | -67 | -80.6 | 0 | 0 | 0 | 114.3 | F96 L97 K98 V269 | F96-N100 PolarHBondContact O-N 3.39Å; F96-N100 PolarHBondContact O-ND2 2.5Å; L97-N100 PolarHBondContact O-N 2.85Å; K98-N100 PolarHBondContact O-N 3.31Å; N100-V269 HydrophobicContact CB-CG2 3.36Å |
| 101 | L | 92.3 | Very high | 87.8 | Confident | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -121.7 | -7.5 | -171.6 | -60.8 | 175.9 | 0 | 0 | 0 | 115.3 | L97 K98 N103 Y104 I105 V108 A265 I266 V269 | L97-L101 HydrophobicContact CD2-CD1 4.28Å; L97-L101 VanDerWaalsContact O-CB 3.28Å; L97-L101 WeakPolarHBondContact O-CB 3.46Å; L97-L101 PolarHBondContact O-N 3.33Å; K98-L101 PolarHBondContact O-N 2.83Å; L101-N103 PolarHBondContact O-N 3.34Å; L101-Y104 PolarHBondContact O-N 3.05Å; L101-I105 HydrophobicContact CB-CB 4.01Å; L101-I105 HydrophobicContact CB-CG1 3.97Å; L101-I105 HydrophobicContact CD1-CG1 4.37Å; L101-I105 HydrophobicContact CD2-CG1 3.98Å; L101-I105 HydrophobicContact CG-CG1 4.33Å; L101-I105 PolarHBondContact O-N 3.02Å; L101-V108 HydrophobicContact CD1-CB 4.09Å; L101-V108 HydrophobicContact CD1-CG1 4.03Å; L101-V108 HydrophobicContact CD1-CG2 3.76Å; L101-A265 HydrophobicContact CD2-CB 3.97Å; L101-I266 HydrophobicContact CD2-CG1 4.45Å; L101-V269 HydrophobicContact CD1-CG2 4.28Å; L101-V269 HydrophobicContact CD2-CB 4.37Å; L101-V269 HydrophobicContact CD2-CG2 3.56Å; L101-V269 HydrophobicContact CG-CG2 3.78Å |
| 102 | L | 87.5 | Confident | 89.1 | Confident | 54 Ų | 54 | 46.1 Ų | 46.1 | 28% | 0.283 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -43.5 | -40.8 | -176.2 | 178.4 | 64.9 | 0 | 0 | 0 | 114.5 | K98 Y150 F154 | K98-L102 VanDerWaalsContact O-CB 3.24Å; K98-L102 WeakPolarHBondContact O-CB 3.31Å; K98-L102 PolarHBondContact O-N 2.8Å; L102-Y150 HydrophobicContact CD1-CE2 4.26Å; L102-Y150 WeakPolarHBondContact CD1-OH 3.47Å; L102-F154 HydrophobicContact CD1-CE2 3.77Å; L102-F154 HydrophobicContact CG-CE2 4.43Å |
| 103 | N | 88.5 | Confident | 89.3 | Confident | 85 Ų | 85 | 40.5 Ų | 40.5 | 46% | 0.455 | 20% | 0.198 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | -6.6 | -172.9 | -69.6 | -29.3 | 0 | 0 | 0 | 115 | L101 R257 | L101-N103 PolarHBondContact O-N 3.34Å; N103-R257 PolarHBondContact O-NE 2.89Å |
| 104 | Y | 92 | Very high | 89.1 | Confident | 85 Ų | 85 | 38.8 Ų | 38.8 | 33% | 0.333 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -127.6 | -27.9 | -168.6 | -61.7 | -74.7 | 0 | 0 | 0 | 113.5 | L101 R254 K261 C262 A265 | L101-Y104 PolarHBondContact O-N 3.05Å; Y104-R254 VanDerWaalsContact O-CB 3.28Å; Y104-R254 WeakPolarHBondContact O-CB 3.5Å; Y104-R254 WeakPolarHBondContact O-CG 3.44Å; Y104-R254 PolarHBondContact O-N 2.87Å; Y104-K261 HydrophobicContact CD1-CB 4.12Å; Y104-K261 HydrophobicContact CE1-CB 3.96Å; Y104-C262 PolarHBondContact O-SG 3.38Å; Y104-A265 HydrophobicContact CD1-CB 4.45Å; Y104-A265 HydrophobicContact CD2-CB 3.6Å; Y104-A265 HydrophobicContact CE2-CB 4.24Å; Y104-A265 HydrophobicContact CG-CB 3.72Å |
| 105 | I | 90.3 | Very high | 88.6 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.186 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 130.9 | -169 | -59.1 | -57.8 | 0 | 0 | 0 | 110.1 | L101 K107 V108 F252 C262 I266 | L101-I105 HydrophobicContact CB-CB 4.01Å; L101-I105 HydrophobicContact CB-CG1 3.97Å; L101-I105 HydrophobicContact CD1-CG1 4.37Å; L101-I105 HydrophobicContact CD2-CG1 3.98Å; L101-I105 HydrophobicContact CG-CG1 4.33Å; L101-I105 PolarHBondContact O-N 3.02Å; I105-K107 WeakPolarHBondContact CG2-O 3.37Å; I105-V108 HydrophobicContact CG2-CB 3.89Å; I105-F252 WeakPolarHBondContact CA-O 3.39Å; I105-F252 VanDerWaalsContact CG2-O 3.31Å; I105-F252 WeakPolarHBondContact CG2-O 3.32Å; I105-C262 HydrophobicContact CD1-CB 4.2Å; I105-I266 HydrophobicContact CD1-CD1 3.6Å; I105-I266 HydrophobicContact CD1-CG1 3.8Å; I105-I266 HydrophobicContact CG1-CD1 4.43Å; I105-I266 HydrophobicContact CG1-CG1 4.17Å |
| 106 | D | 87.8 | Confident | 88.2 | Confident | 38 Ų | 38 | 35.9 Ų | 35.9 | 20% | 0.203 | 17% | 0.174 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.7 | -41.9 | 176.7 | -83 | -32.6 | 0 | 0 | 0 | 111.2 | Y151 S152 F252 R254 | D106-Y151 CarbonylContact O-C 3.58Å; D106-Y151 WeakPolarHBondContact O-CA 3.49Å; D106-S152 PolarHBondContact O-N 2.83Å; D106-F252 PolarHBondContact N-O 3.25Å; D106-R254 VanDerWaalsContact OD1-CG 3.28Å; D106-R254 WeakPolarHBondContact OD1-CG 3.39Å; D106-R254 WeakPolarHBondContact OD2-CA 3.4Å |
| 107 | K | 90.4 | Very high | 87.1 | Confident | 60 Ų | 60 | 35.2 Ų | 35.2 | 26% | 0.261 | 17% | 0.173 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -143.7 | 133.9 | -178.1 | -45.5 | -169.8 | 176.9 | 179.6 | 0 | 109.5 | I105 F109 Y150 Y151 Y156 F252 | I105-K107 WeakPolarHBondContact CG2-O 3.37Å; K107-F109 HydrophobicContact CB-CE2 4.24Å; K107-Y150 CarbonylContact C-O 3.56Å; K107-Y150 WeakPolarHBondContact CA-O 3.13Å; K107-Y151 HydrophobicContact CB-CD1 3.8Å; K107-Y151 HydrophobicContact CB-CE1 3.95Å; K107-Y151 HydrophobicContact CD-CD1 3.88Å; K107-Y151 HydrophobicContact CD-CE1 4.08Å; K107-Y151 HydrophobicContact CG-CD1 3.71Å; K107-Y151 HydrophobicContact CG-CE1 4.18Å; K107-Y156 WeakPolarHBondContact CE-OH 3.24Å; K107-Y156 PolarHBondContact NZ-OH 2.86Å; K107-F252 HydrophobicContact CB-CB 4.19Å; K107-F252 HydrophobicContact CB-CD2 4.01Å; K107-F252 HydrophobicContact CB-CG 4.4Å; K107-F252 PolarHBondContact O-N 2.87Å |
| 108 | V | 92 | Very high | 85.8 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 19% | 0.193 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -136.2 | 143.7 | 175 | 62.8 | 0 | 0 | 0 | 0 | 110.8 | L97 L101 I105 Q149 Y150 L249 I250 | L97-V108 HydrophobicContact CB-CG1 3.93Å; L97-V108 HydrophobicContact CD1-CG1 4.11Å; L97-V108 HydrophobicContact CD1-CG2 4.5Å; L97-V108 HydrophobicContact CD2-CG2 4.36Å; L97-V108 HydrophobicContact CG-CG1 4.46Å; L101-V108 HydrophobicContact CD1-CB 4.09Å; L101-V108 HydrophobicContact CD1-CG1 4.03Å; L101-V108 HydrophobicContact CD1-CG2 3.76Å; I105-V108 HydrophobicContact CG2-CB 3.89Å; V108-Q149 CarbonylContact O-C 3.53Å; V108-Q149 VanDerWaalsContact O-CA 3.28Å; V108-Q149 WeakPolarHBondContact O-CA 3.02Å; V108-Y150 HydrophobicContact CG1-CD1 3.82Å; V108-Y150 HydrophobicContact CG1-CG 4.2Å; V108-Y150 PolarHBondContact N-O 2.85Å; V108-Y150 PolarHBondContact O-N 2.83Å; V108-L249 HydrophobicContact CG2-CD1 4.36Å; V108-L249 HydrophobicContact CG2-CD2 3.74Å; V108-L249 HydrophobicContact CG2-CG 3.87Å; V108-I250 CarbonylContact C-O 3.56Å; V108-I250 VanDerWaalsContact CA-O 3.28Å; V108-I250 WeakPolarHBondContact CA-O 3.27Å |
| 109 | F | 92.3 | Very high | 84.3 | Confident | 2 Ų | 2 | 40.2 Ų | 40.2 | 1% | 0.009 | 20% | 0.195 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 135.6 | 177.6 | -58 | -92.7 | 0 | 0 | 0 | 109.4 | K107 F111 I146 Q149 Y151 I167 P168 L249 I250 F252 | K107-F109 HydrophobicContact CB-CE2 4.24Å; F109-F111 HydrophobicContact CB-CD2 4.16Å; F109-F111 HydrophobicContact CB-CE2 3.33Å; F109-F111 HydrophobicContact CB-CZ 3.6Å; F109-F111 HydrophobicContact CD1-CZ 4.16Å; F109-F111 HydrophobicContact CG-CE2 4.2Å; F109-F111 HydrophobicContact CG-CZ 4.11Å; F109-I146 HydrophobicContact CD1-CD1 4.04Å; F109-Q149 HydrophobicContact CD1-CB 4.45Å; F109-Y151 HydrophobicContact CE1-CE1 4.2Å; F109-Y151 AromaticContact CE1-CZ 3.83Å; F109-Y151 WeakPolarHBondContact CE1-OH 3.3Å; F109-Y151 HydrophobicContact CE2-CE1 4.33Å; F109-Y151 AromaticContact CZ-CE1 3.7Å; F109-Y151 HydrophobicContact CZ-CE1 3.7Å; F109-Y151 AromaticContact CZ-CZ 3.82Å; F109-Y151 WeakPolarHBondContact CZ-OH 3.47Å; F109-I167 HydrophobicContact CD1-CG2 4.14Å; F109-I167 HydrophobicContact CE1-CB 4.04Å; F109-I167 HydrophobicContact CE1-CG1 4.02Å; F109-I167 HydrophobicContact CE1-CG2 3.95Å; F109-P168 HydrophobicContact CD1-CG 4.49Å; F109-P168 HydrophobicContact CD2-CG 3.89Å; F109-P168 VanDerWaalsContact CE1-CD 3.42Å; F109-P168 HydrophobicContact CE2-CG 4.05Å; F109-P168 HydrophobicContact CG-CG 4.12Å; F109-P168 VanDerWaalsContact CZ-CD 3.41Å; F109-P168 HydrophobicContact CZ-CG 4.38Å; F109-L249 CarbonylContact O-C 3.6Å; F109-L249 WeakPolarHBondContact O-CA 3.41Å; F109-I250 PolarHBondContact N-O 2.93Å; F109-I250 PolarHBondContact O-N 2.97Å; F109-F252 HydrophobicContact CD2-CD2 4.45Å; F109-F252 HydrophobicContact CD2-CE2 4.1Å; F109-F252 HydrophobicContact CE2-CD2 4.2Å; F109-F252 AromaticContact CE2-CE2 3.83Å; F109-F252 HydrophobicContact CE2-CE2 3.83Å |
| 110 | L | 92.5 | Very high | 82.6 | Confident | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.005 | 18% | 0.18 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.7 | 120.8 | 174.1 | -166.2 | 70.1 | 0 | 0 | 0 | 108.6 | W93 L97 I147 G148 V247 M248 L249 L273 | W93-L110 HydrophobicContact CB-CD2 3.75Å; W93-L110 HydrophobicContact CG-CD2 3.85Å; L97-L110 HydrophobicContact CD1-CB 3.89Å; L110-I147 HydrophobicContact CB-CG1 4.12Å; L110-I147 HydrophobicContact CD2-CD1 3.82Å; L110-I147 HydrophobicContact CD2-CG1 3.93Å; L110-I147 HydrophobicContact CG-CD1 3.89Å; L110-I147 HydrophobicContact CG-CG1 3.78Å; L110-I147 VanDerWaalsContact O-CG1 3.31Å; L110-I147 WeakPolarHBondContact O-CG1 3.35Å; L110-I147 PolarHBondContact O-N 3.01Å; L110-G148 PolarHBondContact N-O 3.22Å; L110-G148 PolarHBondContact O-N 3.48Å; L110-V247 HydrophobicContact CD1-CG1 3.3Å; L110-V247 HydrophobicContact CD2-CG1 4.24Å; L110-V247 HydrophobicContact CG-CG1 3.67Å; L110-M248 WeakPolarHBondContact CA-O 2.85Å; L110-L249 HydrophobicContact CD1-CB 3.73Å; L110-L249 HydrophobicContact CD1-CD1 4.22Å; L110-L249 HydrophobicContact CD1-CG 4.15Å; L110-L273 HydrophobicContact CD1-CD1 3.79Å; L110-L273 HydrophobicContact CD2-CD1 4.14Å; L110-L273 HydrophobicContact CD2-CD2 4.31Å |
| 111 | F | 90.9 | Very high | 80.3 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 140.6 | -177.5 | -59.9 | -79.7 | 0 | 0 | 0 | 111.1 | F109 I113 F144 N145 I146 I167 P168 V247 M248 I250 | F109-F111 HydrophobicContact CB-CD2 4.16Å; F109-F111 HydrophobicContact CB-CE2 3.33Å; F109-F111 HydrophobicContact CB-CZ 3.6Å; F109-F111 HydrophobicContact CD1-CZ 4.16Å; F109-F111 HydrophobicContact CG-CE2 4.2Å; F109-F111 HydrophobicContact CG-CZ 4.11Å; F111-I113 HydrophobicContact CB-CD1 3.88Å; F111-I113 HydrophobicContact CB-CG1 3.73Å; F111-F144 HydrophobicContact CB-CE2 4.25Å; F111-F144 HydrophobicContact CD1-CD2 4.37Å; F111-F144 HydrophobicContact CD1-CE1 4.11Å; F111-F144 AromaticContact CD1-CE2 3.54Å; F111-F144 HydrophobicContact CD1-CE2 3.54Å; F111-F144 AromaticContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD2-CE2 4.47Å; F111-F144 AromaticContact CE1-CE1 3.93Å; F111-F144 HydrophobicContact CE1-CE1 3.93Å; F111-F144 AromaticContact CE1-CE2 3.94Å; F111-F144 HydrophobicContact CE1-CE2 3.94Å; F111-F144 AromaticContact CE1-CZ 3.3Å; F111-F144 HydrophobicContact CE1-CZ 3.3Å; F111-F144 AromaticContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CZ 4.08Å; F111-F144 AromaticContact CZ-CZ 3.91Å; F111-F144 HydrophobicContact CZ-CZ 3.91Å; F111-N145 CarbonylContact C-O 3.57Å; F111-N145 VanDerWaalsContact CA-O 3.25Å; F111-N145 WeakPolarHBondContact CA-O 3.28Å; F111-I146 HydrophobicContact CD1-CB 4.23Å; F111-I146 HydrophobicContact CD1-CG1 4.41Å; F111-I146 HydrophobicContact CE1-CB 4.18Å; F111-I146 HydrophobicContact CE1-CD1 4.32Å; F111-I146 HydrophobicContact CE1-CG1 4.18Å; F111-I167 HydrophobicContact CE1-CG2 4.34Å; F111-I167 HydrophobicContact CZ-CG2 4.32Å; F111-P168 HydrophobicContact CE2-CB 4.23Å; F111-P168 HydrophobicContact CE2-CG 4.28Å; F111-P168 HydrophobicContact CZ-CB 3.95Å; F111-P168 HydrophobicContact CZ-CG 4.11Å; F111-V247 CarbonylContact O-C 3.45Å; F111-V247 VanDerWaalsContact O-CA 3.24Å; F111-V247 WeakPolarHBondContact O-CA 3.27Å; F111-M248 HydrophobicContact CD2-CE 4.33Å; F111-M248 PolarHBondContact N-O 3.23Å; F111-M248 PolarHBondContact O-N 2.85Å; F111-I250 HydrophobicContact CD2-CD1 4.32Å; F111-I250 HydrophobicContact CD2-CG1 4.5Å; F111-I250 HydrophobicContact CE2-CD1 3.85Å; F111-I250 HydrophobicContact CE2-CG1 4.27Å |
| 112 | H | 88.1 | Confident | 78 | Confident | 22 Ų | 22 | 48.1 Ų | 48.1 | 10% | 0.102 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 120.8 | 158.9 | -177.9 | -114.9 | 0 | 0 | 0 | 109 | L89 N145 I147 | L89-H112 HydrophobicContact CD1-CB 3.79Å; L89-H112 WeakPolarHBondContact CD1-CD2 3.13Å; H112-N145 HydrophobicContact CB-CB 4.37Å; H112-N145 PolarHBondContact N-O 2.81Å; H112-N145 PolarHBondContact O-N 2.99Å; H112-I147 HydrophobicContact CB-CD1 4.39Å; H112-I147 HydrophobicContact CB-CG2 3.95Å |
| 113 | I | 86 | Confident | 75.9 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.8 | 132.9 | -173.2 | -56.6 | -172.9 | 0 | 0 | 0 | 110.2 | F111 L115 I141 Q143 F144 Q245 F246 M248 | F111-I113 HydrophobicContact CB-CD1 3.88Å; F111-I113 HydrophobicContact CB-CG1 3.73Å; I113-L115 HydrophobicContact CG2-CD2 4.07Å; I113-L115 HydrophobicContact CG2-CG 4.19Å; I113-I141 HydrophobicContact CG2-CD1 4.29Å; I113-I141 HydrophobicContact CG2-CG1 3.99Å; I113-I141 HydrophobicContact CG2-CG2 4.02Å; I113-Q143 WeakPolarHBondContact CA-O 3.38Å; I113-F144 HydrophobicContact CD1-CD2 4.03Å; I113-F144 HydrophobicContact CD1-CE2 3.96Å; I113-F144 HydrophobicContact CG1-CD2 4.01Å; I113-F144 HydrophobicContact CG1-CE2 4.34Å; I113-Q245 WeakPolarHBondContact O-CA 3.39Å; I113-F246 HydrophobicContact CB-CD2 4.25Å; I113-F246 HydrophobicContact CB-CE2 3.77Å; I113-F246 HydrophobicContact CB-CZ 3.94Å; I113-F246 HydrophobicContact CD1-CE2 4.09Å; I113-F246 HydrophobicContact CG1-CE2 4.36Å; I113-F246 HydrophobicContact CG2-CE1 4.29Å; I113-F246 HydrophobicContact CG2-CE2 3.99Å; I113-F246 HydrophobicContact CG2-CZ 3.66Å; I113-F246 PolarHBondContact N-O 2.92Å; I113-F246 PolarHBondContact O-N 2.79Å; I113-M248 HydrophobicContact CD1-CB 3.86Å; I113-M248 HydrophobicContact CD1-CE 3.32Å; I113-M248 HydrophobicContact CD1-SD 4.14Å |
| 114 | S | 82.2 | Confident | 73.5 | Confident | 4 Ų | 4 | 56.7 Ų | 56.7 | 3% | 0.028 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 127.3 | 164.4 | 176.8 | 0 | 0 | 0 | 0 | 109.5 | I141 N142 Q143 L244 | S114-I141 CarbonylContact O-C 3.49Å; S114-I141 WeakPolarHBondContact O-CA 3.47Å; S114-N142 PolarHBondContact O-N 2.96Å; S114-Q143 PolarHBondContact N-O 2.8Å; S114-Q143 PolarHBondContact O-N 2.91Å; S114-L244 CarbonylContact C-O 3.55Å; S114-L244 WeakPolarHBondContact CA-O 3.21Å |
| 115 | L | 77.6 | Confident | 71.2 | Confident | 2 Ų | 2 | 56 Ų | 56 | 1% | 0.01 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 122.3 | 178.2 | -71.6 | -175.9 | 0 | 0 | 0 | 111.1 | I113 Y139 F140 I141 C177 G243 L244 F246 | I113-L115 HydrophobicContact CG2-CD2 4.07Å; I113-L115 HydrophobicContact CG2-CG 4.19Å; L115-Y139 HydrophobicContact CB-CD1 3.97Å; L115-Y139 HydrophobicContact CB-CG 4.12Å; L115-Y139 HydrophobicContact CD1-CD1 4.35Å; L115-Y139 HydrophobicContact CD1-CD2 4.21Å; L115-Y139 HydrophobicContact CD1-CG 3.88Å; L115-Y139 HydrophobicContact CG-CG 4.47Å; L115-F140 CarbonylContact C-O 3.27Å; L115-F140 WeakPolarHBondContact CA-O 3.34Å; L115-I141 HydrophobicContact CD2-CB 4.29Å; L115-I141 HydrophobicContact CD2-CG1 3.46Å; L115-I141 VanDerWaalsContact CD2-CG1 3.46Å; L115-C177 HydrophobicContact CD1-CB 4.03Å; L115-C177 HydrophobicContact CD2-CB 4.43Å; L115-G243 CarbonylContact O-C 3.57Å; L115-G243 VanDerWaalsContact O-C 3.27Å; L115-G243 WeakPolarHBondContact O-CA 3.33Å; L115-L244 HydrophobicContact CB-CB 4.16Å; L115-L244 PolarHBondContact N-O 2.86Å; L115-L244 PolarHBondContact O-N 3.18Å; L115-F246 HydrophobicContact CB-CE1 4.39Å; L115-F246 HydrophobicContact CD1-CE1 3.46Å; L115-F246 VanDerWaalsContact CD1-CE1 3.46Å; L115-F246 HydrophobicContact CD1-CZ 3.6Å; L115-F246 HydrophobicContact CG-CE1 3.6Å; L115-F246 HydrophobicContact CG-CZ 3.76Å |
| 116 | I | 74.6 | Confident | 68.7 | Low | 73 Ų | 73 | 65.3 Ų | 65.3 | 37% | 0.374 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 128.4 | 169.8 | -66.8 | 171 | 0 | 0 | 0 | 108.8 | Y139 F140 N142 | I116-Y139 WeakPolarHBondContact O-CA 2.99Å; I116-F140 PolarHBondContact N-O 3.41Å; I116-F140 PolarHBondContact O-N 2.88Å; I116-N142 HydrophobicContact CD1-CB 3.57Å; I116-N142 VanDerWaalsContact CD1-CG 3.46Å; I116-N142 HydrophobicContact CG1-CB 3.79Å |
| 117 | P | 65.5 | Low | 66.4 | Low | 20 Ų | 20 | 74 Ų | 74 | 13% | 0.13 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.1 | 134.8 | 175 | 24.4 | -30.8 | 0 | 0 | 0 | 111.7 | F119 Y136 Y139 | P117-F119 HydrophobicContact CB-CE2 4.46Å; P117-F119 HydrophobicContact CB-CZ 4.43Å; P117-F119 HydrophobicContact CG-CE2 4Å; P117-F119 HydrophobicContact CG-CZ 4.02Å; P117-Y136 HydrophobicContact CB-CD1 3.3Å; P117-Y136 HydrophobicContact CB-CE1 3.18Å; P117-Y136 HydrophobicContact CB-CG 4.38Å; P117-Y136 HydrophobicContact CG-CD1 4.4Å; P117-Y136 HydrophobicContact CG-CE1 3.83Å; P117-Y139 HydrophobicContact CB-CD1 4.11Å; P117-Y139 HydrophobicContact CB-CE1 3.91Å |
| 118 | K | 64.6 | Low | 64.2 | Low | 95 Ų | 95 | 73.9 Ų | 73.9 | 41% | 0.413 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87 | 113.9 | 162.7 | -161.2 | -169.4 | -162.1 | 177 | 0 | 108.7 | E137 S138 F140 | K118-E137 PolarHBondContact O-N 3.3Å; K118-S138 WeakPolarHBondContact CB-O 3.37Å; K118-S138 PolarHBondContact N-O 2.94Å; K118-F140 HydrophobicContact CB-CD2 4.15Å; K118-F140 HydrophobicContact CB-CE2 3.83Å; K118-F140 HydrophobicContact CD-CE2 3.51Å; K118-F140 HydrophobicContact CD-CZ 3.97Å; K118-F140 HydrophobicContact CG-CD2 4.46Å; K118-F140 HydrophobicContact CG-CE2 3.76Å |
| 119 | F | 57.3 | Low | 61.9 | Low | 109 Ų | 109 | 81.4 Ų | 81.4 | 48% | 0.478 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 133.1 | 173 | -66.7 | -77.8 | 0 | 0 | 0 | 110.1 | P117 L121 L132 Y136 | P117-F119 HydrophobicContact CB-CE2 4.46Å; P117-F119 HydrophobicContact CB-CZ 4.43Å; P117-F119 HydrophobicContact CG-CE2 4Å; P117-F119 HydrophobicContact CG-CZ 4.02Å; F119-L121 PolarHBondContact O-N 3.33Å; F119-L132 HydrophobicContact CE1-CD2 3.77Å; F119-Y136 HydrophobicContact CD1-CD1 4.45Å; F119-Y136 HydrophobicContact CD1-CE1 4.07Å; F119-Y136 HydrophobicContact CE1-CD1 4.25Å; F119-Y136 AromaticContact CE1-CE1 3.45Å; F119-Y136 HydrophobicContact CE1-CE1 3.45Å; F119-Y136 VanDerWaalsContact CE1-CE1 3.45Å; F119-Y136 AromaticContact CZ-CE1 3.88Å; F119-Y136 HydrophobicContact CZ-CE1 3.88Å |
| 120 | K | 51.5 | Low | 59.5 | Low | 89 Ų | 89 | 90 Ų | 90 | 39% | 0.387 | 44% | 0.436 | S | S | . | . | trans | -58.7 | 122.7 | 158.6 | -84.3 | -176.8 | 167.4 | 179.7 | 0 | 107.7 | H122 E137 | K120-H122 VanDerWaalsContact CD-NE2 3.35Å; K120-H122 WeakPolarHBondContact CD-NE2 3.35Å; K120-H122 PolarHBondContact O-N 2.79Å; K120-E137 HydrophobicContact CD-CG 3.82Å; K120-E137 WeakPolarHBondContact CD-OE1 3.37Å; K120-E137 WeakPolarHBondContact CE-OE1 3.47Å; K120-E137 HydrophobicContact CG-CB 4.14Å; K120-E137 HydrophobicContact CG-CG 3.41Å; K120-E137 VanDerWaalsContact CG-CG 3.41Å; K120-E137 WeakPolarHBondContact CG-OE1 3.11Å | ||
| 121 | L | 43.5 | Very low | 57 | Low | 165 Ų | 165 | 94.5 Ų | 94.5 | 86% | 0.864 | 46% | 0.457 | S | S | * | . | trans | -65.9 | 79.4 | 164.4 | -115.1 | 144.2 | 0 | 0 | 0 | 107.5 | F119 | F119-L121 PolarHBondContact O-N 3.33Š| ||
| 122 | H | 44 | Very low | 54.6 | Low | 106 Ų | 106 | 98 Ų | 98 | 49% | 0.491 | 48% | 0.475 | S | S | . | . | trans | -98.8 | 113.6 | 168.8 | -83.8 | -50.4 | 0 | 0 | 0 | 107.1 | K120 L124 I125 | K120-H122 VanDerWaalsContact CD-NE2 3.35Å; K120-H122 WeakPolarHBondContact CD-NE2 3.35Å; K120-H122 PolarHBondContact O-N 2.79Å; H122-L124 PolarHBondContact O-N 3.3Å; H122-I125 HydrophobicContact CB-CD1 3.55Å; H122-I125 HydrophobicContact CB-CG1 3.78Å | ||
| 123 | N | 41.9 | Very low | 52.4 | Low | 153 Ų | 153 | 102.8 Ų | 102.8 | 82% | 0.818 | 49% | 0.493 | S | S | * | . | S | Bend | trans | -58.2 | -2.9 | -176.7 | -80.5 | -13.2 | 0 | 0 | 0 | 115.5 | ||
| 124 | L | 38.7 | Very low | 50.4 | Low | 166 Ų | 166 | 112.1 Ų | 112.1 | 87% | 0.869 | 53% | 0.529 | S | S | * | . | trans | -154.3 | 84.5 | -174.7 | -74.7 | 165 | 0 | 0 | 0 | 110.5 | H122 | H122-L124 PolarHBondContact O-N 3.3Š| ||
| 125 | I | 44.1 | Very low | 48.3 | Very low | 71 Ų | 71 | 112.8 Ų | 112.8 | 36% | 0.364 | 53% | 0.534 | S | S | . | . | trans | -129 | 112.4 | 167.1 | -56.1 | -173.7 | 0 | 0 | 0 | 110 | H122 K127 H131 C135 | H122-I125 HydrophobicContact CB-CD1 3.55Å; H122-I125 HydrophobicContact CB-CG1 3.78Å; I125-K127 PolarHBondContact O-N 3.4Å; I125-H131 HydrophobicContact CG2-CB 4.43Å; I125-C135 HydrophobicContact CD1-CB 4.48Å; I125-C135 VanDerWaalsContact CD1-SG 3.51Å | ||
| 126 | K | 37.8 | Very low | 47.1 | Very low | 196 Ų | 196 | 115.1 Ų | 115.1 | 85% | 0.852 | 54% | 0.543 | S | S | * | . | trans | -60.1 | 121 | 170.9 | -76 | -179.7 | 175.9 | 178.9 | 0 | 109 | S128 | K126-S128 PolarHBondContact O-N 3.01Š| ||
| 127 | K | 38.8 | Very low | 46 | Very low | 219 Ų | 219 | 116 Ų | 116 | 95% | 0.952 | 55% | 0.546 | S | S | * | . | trans | -54.5 | 96.4 | 176.5 | -68 | 178.2 | 175.7 | -177 | 0 | 110.9 | I125 | I125-K127 PolarHBondContact O-N 3.4Š| ||
| 128 | S | 43.7 | Very low | 46 | Very low | 59 Ų | 59 | 116.6 Ų | 116.6 | 41% | 0.413 | 55% | 0.55 | S | S | . | * | trans | -129 | 139.1 | 154.9 | 77.7 | 0 | 0 | 0 | 0 | 108.8 | K126 K130 H131 L132 | K126-S128 PolarHBondContact O-N 3.01Å; S128-K130 PolarHBondContact O-N 3.37Å; S128-K130 VanDerWaalsContact O-N 3.17Å; S128-H131 WeakPolarHBondContact O-CA 3.3Å; S128-H131 VanDerWaalsContact O-CB 3.3Å; S128-H131 WeakPolarHBondContact O-CB 3.43Å; S128-H131 PolarHBondContact O-N 3.37Å; S128-L132 PolarHBondContact O-N 2.85Å | ||
| 129 | I | 45 | Very low | 46.3 | Very low | 158 Ų | 158 | 112.8 Ų | 112.8 | 81% | 0.81 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.3 | -30.5 | -174.2 | -65.1 | 166.2 | 0 | 0 | 0 | 111.4 | H131 | I129-H131 VanDerWaalsContact C-N 3.35Å |
| 130 | K | 41.5 | Very low | 47.3 | Very low | 183 Ų | 183 | 112 Ų | 112 | 80% | 0.796 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -68.3 | -30 | 172.3 | -86 | -177.4 | 174.5 | 177.6 | 0 | 113.5 | S128 | S128-K130 PolarHBondContact O-N 3.37Å; S128-K130 VanDerWaalsContact O-N 3.17Å |
| 131 | H | 39.5 | Very low | 48.8 | Very low | 94 Ų | 94 | 108 Ų | 108 | 44% | 0.435 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -71.7 | -34.8 | -179.6 | -130.9 | -54.4 | 0 | 0 | 0 | 112.1 | I125 S128 I129 Y133 Y134 C135 | I125-H131 HydrophobicContact CG2-CB 4.43Å; S128-H131 WeakPolarHBondContact O-CA 3.3Å; S128-H131 VanDerWaalsContact O-CB 3.3Å; S128-H131 WeakPolarHBondContact O-CB 3.43Å; S128-H131 PolarHBondContact O-N 3.37Å; I129-H131 VanDerWaalsContact C-N 3.35Å; H131-Y133 VanDerWaalsContact C-N 3.26Å; H131-Y133 PolarHBondContact O-N 3.27Å; H131-Y134 PolarHBondContact O-N 3.48Å; H131-C135 PolarHBondContact O-N 2.95Å; H131-C135 PolarHBondContact O-SG 2.77Å |
| 132 | L | 39.7 | Very low | 50.5 | Low | 74 Ų | 74 | 104.5 Ų | 104.5 | 39% | 0.387 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.4 | -37.5 | -179.9 | -73.9 | 162.7 | 0 | 0 | 0 | 112.4 | F119 S128 Y134 C135 Y136 | F119-L132 HydrophobicContact CE1-CD2 3.77Å; S128-L132 PolarHBondContact O-N 2.85Å; L132-Y134 PolarHBondContact O-N 3.39Å; L132-Y134 VanDerWaalsContact O-N 3.15Å; L132-C135 PolarHBondContact O-N 2.84Å; L132-C135 VanDerWaalsContact O-N 3.07Å; L132-Y136 WeakPolarHBondContact O-CD2 3.34Å; L132-Y136 WeakPolarHBondContact O-CE2 2.94Å |
| 133 | Y | 42.9 | Very low | 52.4 | Low | 122 Ų | 122 | 103.6 Ų | 103.6 | 48% | 0.478 | 49% | 0.491 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -29.7 | -178 | -165 | -95.4 | 0 | 0 | 0 | 113.7 | H131 R181 N206 | H131-Y133 VanDerWaalsContact C-N 3.26Å; H131-Y133 PolarHBondContact O-N 3.27Å; Y133-R181 PolarHBondContact O-NH2 2.76Å; Y133-R181 VanDerWaalsContact O-NH2 3.13Å; Y133-N206 PolarHBondContact OH-ND2 3.04Å |
| 134 | Y | 44.7 | Very low | 54.4 | Low | 196 Ų | 196 | 98.7 Ų | 98.7 | 77% | 0.769 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.5 | -9.8 | 179.3 | -69.1 | -76.2 | 0 | 0 | 0 | 114.1 | H131 L132 | H131-Y134 PolarHBondContact O-N 3.48Å; L132-Y134 PolarHBondContact O-N 3.39Å; L132-Y134 VanDerWaalsContact O-N 3.15Å |
| 135 | C | 37.8 | Very low | 56.8 | Low | 18 Ų | 18 | 95 Ų | 95 | 12% | 0.122 | 44% | 0.443 | C | S | . | . | trans | -94.1 | -0.1 | -174.5 | -65.9 | 0 | 0 | 0 | 0 | 114.3 | I125 H131 L132 | I125-C135 HydrophobicContact CD1-CB 4.48Å; I125-C135 VanDerWaalsContact CD1-SG 3.51Å; H131-C135 PolarHBondContact O-N 2.95Å; H131-C135 PolarHBondContact O-SG 2.77Å; L132-C135 PolarHBondContact O-N 2.84Å; L132-C135 VanDerWaalsContact O-N 3.07Å | ||
| 136 | Y | 52 | Low | 58.8 | Low | 52 Ų | 52 | 95.1 Ų | 95.1 | 20% | 0.204 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 123.2 | 178.5 | -61.1 | -59 | 0 | 0 | 0 | 111.3 | P117 F119 L132 | P117-Y136 HydrophobicContact CB-CD1 3.3Å; P117-Y136 HydrophobicContact CB-CE1 3.18Å; P117-Y136 HydrophobicContact CB-CG 4.38Å; P117-Y136 HydrophobicContact CG-CD1 4.4Å; P117-Y136 HydrophobicContact CG-CE1 3.83Å; F119-Y136 HydrophobicContact CD1-CD1 4.45Å; F119-Y136 HydrophobicContact CD1-CE1 4.07Å; F119-Y136 HydrophobicContact CE1-CD1 4.25Å; F119-Y136 AromaticContact CE1-CE1 3.45Å; F119-Y136 HydrophobicContact CE1-CE1 3.45Å; F119-Y136 VanDerWaalsContact CE1-CE1 3.45Å; F119-Y136 AromaticContact CZ-CE1 3.88Å; F119-Y136 HydrophobicContact CZ-CE1 3.88Å; L132-Y136 WeakPolarHBondContact O-CD2 3.34Å; L132-Y136 WeakPolarHBondContact O-CE2 2.94Å |
| 137 | E | 52.2 | Low | 61.2 | Low | 91 Ų | 91 | 86.4 Ų | 86.4 | 43% | 0.425 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.9 | -38.7 | 177.4 | -115.3 | 176.7 | -175.1 | 0 | 0 | 113.2 | K118 K120 W178 | K118-E137 PolarHBondContact O-N 3.3Å; K120-E137 HydrophobicContact CD-CG 3.82Å; K120-E137 WeakPolarHBondContact CD-OE1 3.37Å; K120-E137 WeakPolarHBondContact CE-OE1 3.47Å; K120-E137 HydrophobicContact CG-CB 4.14Å; K120-E137 HydrophobicContact CG-CG 3.41Å; K120-E137 VanDerWaalsContact CG-CG 3.41Å; K120-E137 WeakPolarHBondContact CG-OE1 3.11Å; E137-W178 VanDerWaalsContact C-CH2 3.41Å; E137-W178 WeakPolarHBondContact O-CH2 3.28Å; E137-W178 WeakPolarHBondContact O-CZ2 3.25Å |
| 138 | S | 65.1 | Low | 63.5 | Low | 33 Ų | 33 | 76.1 Ų | 76.1 | 23% | 0.231 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -168.2 | 162.6 | -174.9 | 43.8 | 0 | 0 | 0 | 0 | 108 | K118 | K118-S138 WeakPolarHBondContact CB-O 3.37Å; K118-S138 PolarHBondContact N-O 2.94Å |
| 139 | Y | 70.2 | Confident | 65.7 | Low | 14 Ų | 14 | 76.6 Ų | 76.6 | 6% | 0.055 | 36% | 0.358 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 148.2 | 165 | -64 | -84.2 | 0 | 0 | 0 | 108.5 | L115 I116 P117 E174 W178 R181 L244 | L115-Y139 HydrophobicContact CB-CD1 3.97Å; L115-Y139 HydrophobicContact CB-CG 4.12Å; L115-Y139 HydrophobicContact CD1-CD1 4.35Å; L115-Y139 HydrophobicContact CD1-CD2 4.21Å; L115-Y139 HydrophobicContact CD1-CG 3.88Å; L115-Y139 HydrophobicContact CG-CG 4.47Å; I116-Y139 WeakPolarHBondContact O-CA 2.99Å; P117-Y139 HydrophobicContact CB-CD1 4.11Å; P117-Y139 HydrophobicContact CB-CE1 3.91Å; Y139-E174 VanDerWaalsContact O-CD 3.27Å; Y139-E174 VanDerWaalsContact O-CG 3.27Å; Y139-E174 WeakPolarHBondContact O-CG 3.27Å; Y139-W178 AromaticContact CD2-CE3 3.81Å; Y139-W178 HydrophobicContact CD2-CE3 3.81Å; Y139-W178 AromaticContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CE2-CE3 4.15Å; Y139-W178 AromaticContact CE2-CZ3 3.73Å; Y139-W178 HydrophobicContact CE2-CZ3 3.73Å; Y139-R181 VanDerWaalsContact CE2-CD 3.46Å; Y139-R181 PolarHBondContact OH-NH1 3.25Å; Y139-R181 VanDerWaalsContact OH-NH1 3.1Å; Y139-L244 HydrophobicContact CD1-CD1 4.34Å; Y139-L244 HydrophobicContact CE1-CD1 3.61Å |
| 140 | F | 78.8 | Confident | 67.6 | Low | 94 Ų | 94 | 69.8 Ų | 69.8 | 41% | 0.412 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 138.9 | 164.1 | -67.4 | -69.3 | 0 | 0 | 0 | 109.9 | L115 I116 K118 N142 E174 | L115-F140 CarbonylContact C-O 3.27Å; L115-F140 WeakPolarHBondContact CA-O 3.34Å; I116-F140 PolarHBondContact N-O 3.41Å; I116-F140 PolarHBondContact O-N 2.88Å; K118-F140 HydrophobicContact CB-CD2 4.15Å; K118-F140 HydrophobicContact CB-CE2 3.83Å; K118-F140 HydrophobicContact CD-CE2 3.51Å; K118-F140 HydrophobicContact CD-CZ 3.97Å; K118-F140 HydrophobicContact CG-CD2 4.46Å; K118-F140 HydrophobicContact CG-CE2 3.76Å; F140-N142 PolarHBondContact O-N 2.88Å; F140-E174 WeakPolarHBondContact CA-OE2 3.24Å; F140-E174 VanDerWaalsContact CD1-OE1 3.24Å; F140-E174 WeakPolarHBondContact CD1-OE1 3.42Å |
| 141 | I | 81.8 | Confident | 69.6 | Low | 5 Ų | 5 | 62.7 Ų | 62.7 | 3% | 0.026 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.5 | 115.6 | 169.5 | -63.7 | 173.1 | 0 | 0 | 0 | 108.7 | I113 S114 L115 Q143 F144 K170 C173 E174 | I113-I141 HydrophobicContact CG2-CD1 4.29Å; I113-I141 HydrophobicContact CG2-CG1 3.99Å; I113-I141 HydrophobicContact CG2-CG2 4.02Å; S114-I141 CarbonylContact O-C 3.49Å; S114-I141 WeakPolarHBondContact O-CA 3.47Å; L115-I141 HydrophobicContact CD2-CB 4.29Å; L115-I141 HydrophobicContact CD2-CG1 3.46Å; L115-I141 VanDerWaalsContact CD2-CG1 3.46Å; I141-Q143 WeakPolarHBondContact CG2-O 3.24Å; I141-F144 HydrophobicContact CD1-CD2 4.11Å; I141-F144 HydrophobicContact CG2-CB 3.67Å; I141-F144 HydrophobicContact CG2-CD2 4.29Å; I141-F144 HydrophobicContact CG2-CG 4.38Å; I141-K170 HydrophobicContact CB-CG 4.19Å; I141-K170 HydrophobicContact CD1-CG 4.23Å; I141-K170 HydrophobicContact CG2-CG 4.4Å; I141-K170 WeakPolarHBondContact O-CE 3.33Å; I141-K170 PolarHBondContact O-NZ 2.78Å; I141-C173 HydrophobicContact CD1-CB 3.88Å; I141-E174 HydrophobicContact CD1-CB 3.88Å; I141-E174 HydrophobicContact CG1-CB 4.07Å; I141-E174 HydrophobicContact CG1-CG 4.31Å; I141-E174 PolarHBondContact N-OE2 3.37Å |
| 142 | N | 80.5 | Confident | 71.2 | Confident | 90 Ų | 90 | 58.5 Ų | 58.5 | 48% | 0.481 | 27% | 0.272 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.8 | -58.9 | 172.4 | -176.2 | 34.9 | 0 | 0 | 0 | 110.5 | S114 I116 F140 | S114-N142 PolarHBondContact O-N 2.96Å; I116-N142 HydrophobicContact CD1-CB 3.57Å; I116-N142 VanDerWaalsContact CD1-CG 3.46Å; I116-N142 HydrophobicContact CG1-CB 3.79Å; F140-N142 PolarHBondContact O-N 2.88Å |
| 143 | Q | 83 | Confident | 72.5 | Confident | 88 Ų | 88 | 62.6 Ų | 62.6 | 41% | 0.411 | 28% | 0.284 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.4 | 135.4 | 177.2 | -63.6 | -179.7 | -16.1 | 0 | 0 | 110.2 | I113 S114 I141 | I113-Q143 WeakPolarHBondContact CA-O 3.38Å; S114-Q143 PolarHBondContact N-O 2.8Å; S114-Q143 PolarHBondContact O-N 2.91Å; I141-Q143 WeakPolarHBondContact CG2-O 3.24Å |
| 144 | F | 85.3 | Confident | 73 | Confident | 49 Ų | 49 | 63 Ų | 63 | 22% | 0.215 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.4 | 95 | -178.2 | -173.3 | -111.5 | 0 | 0 | 0 | 109.7 | F111 I113 I141 K170 C173 | F111-F144 HydrophobicContact CB-CE2 4.25Å; F111-F144 HydrophobicContact CD1-CD2 4.37Å; F111-F144 HydrophobicContact CD1-CE1 4.11Å; F111-F144 AromaticContact CD1-CE2 3.54Å; F111-F144 HydrophobicContact CD1-CE2 3.54Å; F111-F144 AromaticContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD2-CE2 4.47Å; F111-F144 AromaticContact CE1-CE1 3.93Å; F111-F144 HydrophobicContact CE1-CE1 3.93Å; F111-F144 AromaticContact CE1-CE2 3.94Å; F111-F144 HydrophobicContact CE1-CE2 3.94Å; F111-F144 AromaticContact CE1-CZ 3.3Å; F111-F144 HydrophobicContact CE1-CZ 3.3Å; F111-F144 AromaticContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CZ 4.08Å; F111-F144 AromaticContact CZ-CZ 3.91Å; F111-F144 HydrophobicContact CZ-CZ 3.91Å; I113-F144 HydrophobicContact CD1-CD2 4.03Å; I113-F144 HydrophobicContact CD1-CE2 3.96Å; I113-F144 HydrophobicContact CG1-CD2 4.01Å; I113-F144 HydrophobicContact CG1-CE2 4.34Å; I141-F144 HydrophobicContact CD1-CD2 4.11Å; I141-F144 HydrophobicContact CG2-CB 3.67Å; I141-F144 HydrophobicContact CG2-CD2 4.29Å; I141-F144 HydrophobicContact CG2-CG 4.38Å; F144-K170 HydrophobicContact CB-CD 4.48Å; F144-K170 HydrophobicContact CB-CG 4.36Å; F144-K170 HydrophobicContact CD1-CB 4.09Å; F144-K170 HydrophobicContact CD1-CG 4.46Å; F144-K170 HydrophobicContact CE1-CB 4.41Å; F144-K170 HydrophobicContact CG-CB 4.41Å; F144-K170 HydrophobicContact CG-CG 4.31Å; F144-C173 HydrophobicContact CD2-CB 4.47Å; F144-C173 HydrophobicContact CE2-CB 3.63Å; F144-C173 HydrophobicContact CZ-CB 4.04Å; F144-C173 VanDerWaalsContact CZ-SG 3.57Å |
| 145 | N | 87.5 | Confident | 73.1 | Confident | 88 Ų | 88 | 59.9 Ų | 59.9 | 47% | 0.471 | 29% | 0.285 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.1 | 133.3 | -178.3 | -62.4 | -19.9 | 0 | 0 | 0 | 109.9 | F111 H112 | F111-N145 CarbonylContact C-O 3.57Å; F111-N145 VanDerWaalsContact CA-O 3.25Å; F111-N145 WeakPolarHBondContact CA-O 3.28Å; H112-N145 HydrophobicContact CB-CB 4.37Å; H112-N145 PolarHBondContact N-O 2.81Å; H112-N145 PolarHBondContact O-N 2.99Å |
| 146 | I | 87 | Confident | 73.4 | Confident | 74 Ų | 74 | 63.1 Ų | 63.1 | 38% | 0.379 | 30% | 0.295 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.8 | 127.2 | 167.4 | -165.1 | 166.8 | 0 | 0 | 0 | 108.6 | F109 F111 Q149 I167 | F109-I146 HydrophobicContact CD1-CD1 4.04Å; F111-I146 HydrophobicContact CD1-CB 4.23Å; F111-I146 HydrophobicContact CD1-CG1 4.41Å; F111-I146 HydrophobicContact CE1-CB 4.18Å; F111-I146 HydrophobicContact CE1-CD1 4.32Å; F111-I146 HydrophobicContact CE1-CG1 4.18Å; I146-Q149 HydrophobicContact CD1-CB 4.08Å; I146-Q149 HydrophobicContact CD1-CG 4.48Å; I146-I167 HydrophobicContact CD1-CG2 4.11Å |
| 147 | I | 88.8 | Confident | 73.1 | Confident | 14 Ų | 14 | 67.2 Ų | 67.2 | 7% | 0.072 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | -0.3 | -178.2 | 58.8 | 165.4 | 0 | 0 | 0 | 112.2 | L89 W93 L110 H112 V247 | L89-I147 HydrophobicContact CB-CG2 4.18Å; L89-I147 HydrophobicContact CD1-CD1 4.42Å; L89-I147 HydrophobicContact CD2-CD1 3.95Å; W93-I147 VanDerWaalsContact CD1-O 3.32Å; W93-I147 PolarHBondContact N-O 3.12Å; L110-I147 HydrophobicContact CB-CG1 4.12Å; L110-I147 HydrophobicContact CD2-CD1 3.82Å; L110-I147 HydrophobicContact CD2-CG1 3.93Å; L110-I147 HydrophobicContact CG-CD1 3.89Å; L110-I147 HydrophobicContact CG-CG1 3.78Å; L110-I147 VanDerWaalsContact O-CG1 3.31Å; L110-I147 WeakPolarHBondContact O-CG1 3.35Å; L110-I147 PolarHBondContact O-N 3.01Å; H112-I147 HydrophobicContact CB-CD1 4.39Å; H112-I147 HydrophobicContact CB-CG2 3.95Å; I147-V247 HydrophobicContact CD1-CG1 4.16Å; I147-V247 HydrophobicContact CD1-CG2 4.28Å |
| 148 | G | 86.9 | Confident | 72.7 | Confident | 2 Ų | 2 | 69.2 Ų | 69.2 | 2% | 0.021 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -177 | 146.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | L110 | L110-G148 PolarHBondContact N-O 3.22Å; L110-G148 PolarHBondContact O-N 3.48Å |
| 149 | Q | 89.9 | Confident | 71.6 | Confident | 69 Ų | 69 | 75.4 Ų | 75.4 | 32% | 0.322 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.8 | 146.7 | 175.9 | 60.5 | -176.4 | 6.8 | 0 | 0 | 111.1 | S94 V108 F109 I146 Y151 | S94-Q149 WeakPolarHBondContact CA-O 3.29Å; S94-Q149 WeakPolarHBondContact CB-O 3.3Å; S94-Q149 PolarHBondContact OG-N 2.77Å; S94-Q149 PolarHBondContact OG-O 2.87Å; V108-Q149 CarbonylContact O-C 3.53Å; V108-Q149 VanDerWaalsContact O-CA 3.28Å; V108-Q149 WeakPolarHBondContact O-CA 3.02Å; F109-Q149 HydrophobicContact CD1-CB 4.45Å; I146-Q149 HydrophobicContact CD1-CB 4.08Å; I146-Q149 HydrophobicContact CD1-CG 4.48Å; Q149-Y151 HydrophobicContact CB-CE2 4.17Å; Q149-Y151 HydrophobicContact CG-CE2 4.19Å; Q149-Y151 PolarHBondContact OE1-OH 2.95Å |
| 150 | Y | 84.8 | Confident | 70.2 | Confident | 16 Ų | 16 | 79.1 Ų | 79.1 | 6% | 0.063 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.1 | 141.6 | 174.2 | 158.1 | -97.4 | 0 | 0 | 0 | 110.6 | K98 L102 K107 V108 S152 | K98-Y150 HydrophobicContact CB-CD2 3.47Å; K98-Y150 VanDerWaalsContact CB-CD2 3.47Å; K98-Y150 HydrophobicContact CB-CE2 3.95Å; K98-Y150 HydrophobicContact CB-CG 3.94Å; K98-Y150 HydrophobicContact CD-CD2 4.04Å; K98-Y150 HydrophobicContact CD-CE2 4.04Å; K98-Y150 HydrophobicContact CG-CD2 3.6Å; K98-Y150 HydrophobicContact CG-CE2 3.56Å; K98-Y150 HydrophobicContact CG-CG 4.47Å; L102-Y150 HydrophobicContact CD1-CE2 4.26Å; L102-Y150 WeakPolarHBondContact CD1-OH 3.47Å; K107-Y150 CarbonylContact C-O 3.56Å; K107-Y150 WeakPolarHBondContact CA-O 3.13Å; V108-Y150 HydrophobicContact CG1-CD1 3.82Å; V108-Y150 HydrophobicContact CG1-CG 4.2Å; V108-Y150 PolarHBondContact N-O 2.85Å; V108-Y150 PolarHBondContact O-N 2.83Å; Y150-S152 VanDerWaalsContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CB 3.49Å |
| 151 | Y | 83.8 | Confident | 68.4 | Low | 34 Ų | 34 | 79.5 Ų | 79.5 | 13% | 0.133 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 130.2 | 177.5 | -54.3 | -82.2 | 0 | 0 | 0 | 109.9 | D106 K107 F109 Q149 I165 | D106-Y151 CarbonylContact O-C 3.58Å; D106-Y151 WeakPolarHBondContact O-CA 3.49Å; K107-Y151 HydrophobicContact CB-CD1 3.8Å; K107-Y151 HydrophobicContact CB-CE1 3.95Å; K107-Y151 HydrophobicContact CD-CD1 3.88Å; K107-Y151 HydrophobicContact CD-CE1 4.08Å; K107-Y151 HydrophobicContact CG-CD1 3.71Å; K107-Y151 HydrophobicContact CG-CE1 4.18Å; F109-Y151 HydrophobicContact CE1-CE1 4.2Å; F109-Y151 AromaticContact CE1-CZ 3.83Å; F109-Y151 WeakPolarHBondContact CE1-OH 3.3Å; F109-Y151 HydrophobicContact CE2-CE1 4.33Å; F109-Y151 AromaticContact CZ-CE1 3.7Å; F109-Y151 HydrophobicContact CZ-CE1 3.7Å; F109-Y151 AromaticContact CZ-CZ 3.82Å; F109-Y151 WeakPolarHBondContact CZ-OH 3.47Å; Q149-Y151 HydrophobicContact CB-CE2 4.17Å; Q149-Y151 HydrophobicContact CG-CE2 4.19Å; Q149-Y151 PolarHBondContact OE1-OH 2.95Å; Y151-I165 HydrophobicContact CE1-CG2 3.83Å; Y151-I165 HydrophobicContact CE2-CD1 4.39Å; Y151-I165 HydrophobicContact CE2-CG2 3.81Å; Y151-I165 WeakPolarHBondContact OH-CG2 3.41Å |
| 152 | S | 73.7 | Confident | 66.1 | Low | 5 Ų | 5 | 86.6 Ų | 86.6 | 4% | 0.035 | 43% | 0.426 | C | S | . | . | trans | -78.4 | 119.7 | 169 | 176.7 | 0 | 0 | 0 | 0 | 109.3 | D106 Y150 F154 | D106-S152 PolarHBondContact O-N 2.83Å; Y150-S152 VanDerWaalsContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CB 3.49Å; S152-F154 PolarHBondContact O-N 2.93Å; S152-F154 WeakPolarHBondContact OG-CD2 2.98Å | ||
| 153 | Y | 65.6 | Low | 64 | Low | 161 Ų | 161 | 89.2 Ų | 89.2 | 63% | 0.631 | 43% | 0.433 | S | S | * | . | trans | -81.8 | 4.2 | 174.7 | -72.9 | -81.7 | 0 | 0 | 0 | 113.2 | N155 Y156 L161 | Y153-N155 PolarHBondContact O-N 3Å; Y153-Y156 PolarHBondContact O-N 3.34Å; Y153-L161 HydrophobicContact CD1-CD2 4.48Å; Y153-L161 HydrophobicContact CE1-CD2 3.93Å | ||
| 154 | F | 54.6 | Low | 62.1 | Low | 131 Ų | 131 | 91.7 Ų | 91.7 | 58% | 0.575 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.6 | -3.3 | -165.1 | -81.8 | -71.4 | 0 | 0 | 0 | 116.3 | L102 S152 | L102-F154 HydrophobicContact CD1-CE2 3.77Å; L102-F154 HydrophobicContact CG-CE2 4.43Å; S152-F154 PolarHBondContact O-N 2.93Å; S152-F154 WeakPolarHBondContact OG-CD2 2.98Å |
| 155 | N | 45.7 | Very low | 60.7 | Low | 130 Ų | 130 | 93.7 Ų | 93.7 | 70% | 0.695 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -139.2 | 12.5 | -178.6 | -85.3 | -29.3 | 0 | 0 | 0 | 115.6 | Y153 | Y153-N155 PolarHBondContact O-N 3Š|
| 156 | Y | 45 | Very low | 59.7 | Low | 86 Ų | 86 | 95.5 Ų | 95.5 | 34% | 0.337 | 47% | 0.47 | S | S | . | . | trans | -97.1 | 108.5 | 177.5 | -71.5 | -74.2 | 0 | 0 | 0 | 110.5 | K107 Y153 N158 Q160 | K107-Y156 WeakPolarHBondContact CE-OH 3.24Å; K107-Y156 PolarHBondContact NZ-OH 2.86Å; Y153-Y156 PolarHBondContact O-N 3.34Å; Y156-N158 PolarHBondContact O-N 3.31Å; Y156-Q160 HydrophobicContact CD1-CB 4Å | ||
| 157 | N | 44.2 | Very low | 59.3 | Low | 138 Ų | 138 | 95.6 Ų | 95.6 | 74% | 0.738 | 47% | 0.471 | S | S | * | . | trans | -51.2 | 128.3 | 158.2 | -81.7 | -16.8 | 0 | 0 | 0 | 107.3 | N159 Q160 | N157-N159 PolarHBondContact O-N 3.48Å; N157-Q160 PolarHBondContact O-N 3.23Å | ||
| 158 | N | 44.1 | Very low | 59 | Low | 133 Ų | 133 | 95 Ų | 95 | 71% | 0.711 | 47% | 0.468 | S | S | * | . | G | 310 helix | trans | -49.5 | -15.3 | -173.2 | -79.2 | -22.3 | 0 | 0 | 0 | 115.2 | Y156 L161 | Y156-N158 PolarHBondContact O-N 3.31Å; N158-L161 HydrophobicContact CB-CD1 4.47Å |
| 159 | N | 42.2 | Very low | 59.1 | Low | 162 Ų | 162 | 98.3 Ų | 98.3 | 87% | 0.866 | 49% | 0.485 | S | S | * | . | G | 310 helix | trans | -83.4 | -2.2 | 175.1 | -68.1 | -8.3 | 0 | 0 | 0 | 115 | N157 | N157-N159 PolarHBondContact O-N 3.48Š|
| 160 | Q | 41.2 | Very low | 59 | Low | 92 Ų | 92 | 99.2 Ų | 99.2 | 43% | 0.43 | 49% | 0.488 | S | S | . | . | G | 310 helix | trans | -105.7 | 8.2 | 175 | -77.5 | -168.7 | -4.9 | 0 | 0 | 113.9 | Y156 N157 N162 F163 | Y156-Q160 HydrophobicContact CD1-CB 4Å; N157-Q160 PolarHBondContact O-N 3.23Å; Q160-N162 PolarHBondContact O-N 2.82Å; Q160-F163 HydrophobicContact CB-CD2 3.97Å; Q160-F163 HydrophobicContact CB-CE2 4.47Å; Q160-F163 HydrophobicContact CG-CD2 4.03Å; Q160-F163 HydrophobicContact CG-CE2 4.02Å; Q160-F163 PolarHBondContact O-N 2.86Å |
| 161 | L | 40.7 | Very low | 59.2 | Low | 102 Ų | 102 | 103.7 Ų | 103.7 | 53% | 0.534 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -11.1 | 178.3 | -90.2 | 156.4 | 0 | 0 | 0 | 114.2 | Y153 N158 | Y153-L161 HydrophobicContact CD1-CD2 4.48Å; Y153-L161 HydrophobicContact CE1-CD2 3.93Å; N158-L161 HydrophobicContact CB-CD1 4.47Å |
| 162 | N | 33.4 | Very low | 59.5 | Low | 155 Ų | 155 | 102.5 Ų | 102.5 | 83% | 0.829 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.3 | 5.6 | 172.5 | -76.4 | -11.2 | 0 | 0 | 0 | 115 | Q160 L164 | Q160-N162 PolarHBondContact O-N 2.82Å; N162-L164 PolarHBondContact O-N 2.84Å |
| 163 | F | 36.2 | Very low | 60.3 | Low | 144 Ų | 144 | 102.3 Ų | 102.3 | 63% | 0.632 | 51% | 0.508 | S | S | * | . | S | Bend | trans | -69.4 | 91.7 | 165.3 | -90.6 | -81.3 | 0 | 0 | 0 | 108.3 | Q160 I165 | Q160-F163 HydrophobicContact CB-CD2 3.97Å; Q160-F163 HydrophobicContact CB-CE2 4.47Å; Q160-F163 HydrophobicContact CG-CD2 4.03Å; Q160-F163 HydrophobicContact CG-CE2 4.02Å; Q160-F163 PolarHBondContact O-N 2.86Å; F163-I165 PolarHBondContact O-N 3.1Å |
| 164 | L | 44.3 | Very low | 61.4 | Low | 140 Ų | 140 | 96.6 Ų | 96.6 | 73% | 0.733 | 49% | 0.487 | S | S | * | . | trans | -18.4 | 116.4 | 168 | -125.2 | 86.6 | 0 | 0 | 0 | 109.8 | N162 N166 | N162-L164 PolarHBondContact O-N 2.84Å; L164-N166 PolarHBondContact O-N 3.29Å; L164-N166 PolarHBondContact O-OD1 3.07Å | ||
| 165 | I | 54.7 | Low | 63.1 | Low | 92 Ų | 92 | 94.2 Ų | 94.2 | 47% | 0.472 | 48% | 0.476 | S | S | . | . | trans | -57.6 | 96.4 | 170.1 | -63.1 | 175.1 | 0 | 0 | 0 | 106.2 | Y151 F163 I167 | Y151-I165 HydrophobicContact CE1-CG2 3.83Å; Y151-I165 HydrophobicContact CE2-CD1 4.39Å; Y151-I165 HydrophobicContact CE2-CG2 3.81Å; Y151-I165 WeakPolarHBondContact OH-CG2 3.41Å; F163-I165 PolarHBondContact O-N 3.1Å; I165-I167 HydrophobicContact CG2-CG1 3.88Å; I165-I167 PolarHBondContact O-N 3.15Å | ||
| 166 | N | 67 | Low | 65.2 | Low | 125 Ų | 125 | 88 Ų | 88 | 67% | 0.668 | 44% | 0.443 | S | S | * | . | trans | -77.3 | 81.1 | -179.1 | -78 | -13.2 | 0 | 0 | 0 | 107.9 | L164 | L164-N166 PolarHBondContact O-N 3.29Å; L164-N166 PolarHBondContact O-OD1 3.07Å | ||
| 167 | I | 77.6 | Confident | 67.3 | Low | 77 Ų | 77 | 84 Ų | 84 | 40% | 0.395 | 43% | 0.427 | S | S | . | . | P | Polyproline II helix | trans | -61.6 | 129 | 170.6 | -52.9 | -177.4 | 0 | 0 | 0 | 107.6 | F109 F111 I146 I165 N169 | F109-I167 HydrophobicContact CD1-CG2 4.14Å; F109-I167 HydrophobicContact CE1-CB 4.04Å; F109-I167 HydrophobicContact CE1-CG1 4.02Å; F109-I167 HydrophobicContact CE1-CG2 3.95Å; F111-I167 HydrophobicContact CE1-CG2 4.34Å; F111-I167 HydrophobicContact CZ-CG2 4.32Å; I146-I167 HydrophobicContact CD1-CG2 4.11Å; I165-I167 HydrophobicContact CG2-CG1 3.88Å; I165-I167 PolarHBondContact O-N 3.15Å; I167-N169 PolarHBondContact O-N 3.03Å; I167-N169 VanDerWaalsContact O-N 3.07Å |
| 168 | P | 84.2 | Confident | 69.2 | Low | 1 Ų | 1 | 79.2 Ų | 79.2 | 1% | 0.006 | 40% | 0.399 | C | S | . | . | P | Polyproline II helix | trans | -49.1 | 118 | 171.9 | -31.4 | 36.6 | 0 | 0 | 0 | 111.4 | F109 F111 W194 I250 | F109-P168 HydrophobicContact CD1-CG 4.49Å; F109-P168 HydrophobicContact CD2-CG 3.89Å; F109-P168 VanDerWaalsContact CE1-CD 3.42Å; F109-P168 HydrophobicContact CE2-CG 4.05Å; F109-P168 HydrophobicContact CG-CG 4.12Å; F109-P168 VanDerWaalsContact CZ-CD 3.41Å; F109-P168 HydrophobicContact CZ-CG 4.38Å; F111-P168 HydrophobicContact CE2-CB 4.23Å; F111-P168 HydrophobicContact CE2-CG 4.28Å; F111-P168 HydrophobicContact CZ-CB 3.95Å; F111-P168 HydrophobicContact CZ-CG 4.11Å; P168-W194 HydrophobicContact CB-CZ2 4Å; P168-W194 HydrophobicContact CG-CZ2 3.84Å; P168-I250 HydrophobicContact CB-CD1 4.2Å; P168-I250 HydrophobicContact CG-CD1 4.17Å |
| 169 | N | 87.2 | Confident | 71.3 | Confident | 72 Ų | 72 | 72.9 Ų | 72.9 | 39% | 0.385 | 37% | 0.365 | S | S | . | . | P | Polyproline II helix | trans | -72.8 | 159.5 | 179.1 | 67.4 | 60.4 | 0 | 0 | 0 | 110.9 | I167 N171 D172 C173 | I167-N169 PolarHBondContact O-N 3.03Å; I167-N169 VanDerWaalsContact O-N 3.07Å; N169-N171 VanDerWaalsContact C-N 3.31Å; N169-N171 PolarHBondContact O-N 3.41Å; N169-N171 PolarHBondContact OD1-N 2.9Å; N169-N171 VanDerWaalsContact OD1-N 3.16Å; N169-D172 PolarHBondContact ND2-OD2 3.35Å; N169-D172 PolarHBondContact O-N 3.38Å; N169-D172 WeakPolarHBondContact OD1-CB 3.11Å; N169-D172 PolarHBondContact OD1-N 3.48Å; N169-D172 PolarHBondContact OD1-OD2 3.12Å; N169-C173 PolarHBondContact O-N 3.26Å; N169-C173 PolarHBondContact O-SG 3.46Å |
| 170 | K | 89.6 | Confident | 73.5 | Confident | 87 Ų | 87 | 65.1 Ų | 65.1 | 38% | 0.378 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -54.3 | -43.9 | -179 | -175.9 | 179.7 | 176.3 | 177.3 | 0 | 112.7 | I141 F144 D172 C173 E174 | I141-K170 HydrophobicContact CB-CG 4.19Å; I141-K170 HydrophobicContact CD1-CG 4.23Å; I141-K170 HydrophobicContact CG2-CG 4.4Å; I141-K170 WeakPolarHBondContact O-CE 3.33Å; I141-K170 PolarHBondContact O-NZ 2.78Å; F144-K170 HydrophobicContact CB-CD 4.48Å; F144-K170 HydrophobicContact CB-CG 4.36Å; F144-K170 HydrophobicContact CD1-CB 4.09Å; F144-K170 HydrophobicContact CD1-CG 4.46Å; F144-K170 HydrophobicContact CE1-CB 4.41Å; F144-K170 HydrophobicContact CG-CB 4.41Å; F144-K170 HydrophobicContact CG-CG 4.31Å; K170-D172 PolarHBondContact O-N 3.04Å; K170-C173 PolarHBondContact O-N 2.94Å; K170-E174 PolarHBondContact O-N 2.84Å |
| 171 | N | 88.8 | Confident | 75.4 | Confident | 110 Ų | 110 | 61.8 Ų | 61.8 | 59% | 0.588 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -64.9 | -41.9 | -176.4 | -68.5 | -0.5 | 0 | 0 | 0 | 112.2 | N169 E174 K175 | N169-N171 VanDerWaalsContact C-N 3.31Å; N169-N171 PolarHBondContact O-N 3.41Å; N169-N171 PolarHBondContact OD1-N 2.9Å; N169-N171 VanDerWaalsContact OD1-N 3.16Å; N171-E174 PolarHBondContact O-N 3.17Å; N171-K175 WeakPolarHBondContact O-CG 2.76Å; N171-K175 PolarHBondContact O-N 2.95Å; N171-K175 VanDerWaalsContact O-N 3.08Å |
| 172 | D | 90.3 | Very high | 77.4 | Confident | 10 Ų | 10 | 58.6 Ų | 58.6 | 5% | 0.053 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -71.9 | -36.7 | 177.3 | -71 | -26.7 | 0 | 0 | 0 | 111.2 | N169 K170 E174 K175 L176 L193 W194 | N169-D172 PolarHBondContact ND2-OD2 3.35Å; N169-D172 PolarHBondContact O-N 3.38Å; N169-D172 WeakPolarHBondContact OD1-CB 3.11Å; N169-D172 PolarHBondContact OD1-N 3.48Å; N169-D172 PolarHBondContact OD1-OD2 3.12Å; K170-D172 PolarHBondContact O-N 3.04Å; D172-E174 VanDerWaalsContact C-N 3.29Å; D172-E174 PolarHBondContact O-N 2.93Å; D172-K175 PolarHBondContact O-N 3.24Å; D172-K175 IonicContact OD1-NZ 2.77Å; D172-K175 PolarHBondContact OD1-NZ 3.36Å; D172-L176 VanDerWaalsContact O-CB 3.27Å; D172-L176 WeakPolarHBondContact O-CB 3.26Å; D172-L176 PolarHBondContact O-N 3.42Å; D172-L193 HydrophobicContact CB-CD2 3.75Å; D172-L193 WeakPolarHBondContact O-CD2 3.37Å; D172-W194 WeakPolarHBondContact OD2-CA 3.31Å; D172-W194 VanDerWaalsContact OD2-CD1 3.29Å; D172-W194 PolarHBondContact OD2-N 3.06Å |
| 173 | C | 90.8 | Very high | 79.9 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.2 | -35.6 | 171.2 | -74.9 | 0 | 0 | 0 | 0 | 112.5 | I141 F144 N169 K170 L176 C177 M248 | I141-C173 HydrophobicContact CD1-CB 3.88Å; F144-C173 HydrophobicContact CD2-CB 4.47Å; F144-C173 HydrophobicContact CE2-CB 3.63Å; F144-C173 HydrophobicContact CZ-CB 4.04Å; F144-C173 VanDerWaalsContact CZ-SG 3.57Å; N169-C173 PolarHBondContact O-N 3.26Å; N169-C173 PolarHBondContact O-SG 3.46Å; K170-C173 PolarHBondContact O-N 2.94Å; C173-L176 PolarHBondContact O-N 3.28Å; C173-C177 WeakPolarHBondContact O-CB 2.94Å; C173-C177 PolarHBondContact O-N 2.94Å; C173-C177 PolarHBondContact O-SG 2.8Å; C173-M248 HydrophobicContact CB-CE 3.88Å |
| 174 | E | 88.6 | Confident | 82.1 | Confident | 42 Ų | 42 | 50.1 Ų | 50.1 | 20% | 0.196 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67 | -47.6 | 175.6 | -170.6 | 172.7 | 115.4 | 0 | 0 | 111.4 | Y139 F140 I141 K170 N171 D172 L176 C177 W178 | Y139-E174 VanDerWaalsContact O-CD 3.27Å; Y139-E174 VanDerWaalsContact O-CG 3.27Å; Y139-E174 WeakPolarHBondContact O-CG 3.27Å; F140-E174 WeakPolarHBondContact CA-OE2 3.24Å; F140-E174 VanDerWaalsContact CD1-OE1 3.24Å; F140-E174 WeakPolarHBondContact CD1-OE1 3.42Å; I141-E174 HydrophobicContact CD1-CB 3.88Å; I141-E174 HydrophobicContact CG1-CB 4.07Å; I141-E174 HydrophobicContact CG1-CG 4.31Å; I141-E174 PolarHBondContact N-OE2 3.37Å; K170-E174 PolarHBondContact O-N 2.84Å; N171-E174 PolarHBondContact O-N 3.17Å; D172-E174 VanDerWaalsContact C-N 3.29Å; D172-E174 PolarHBondContact O-N 2.93Å; E174-L176 VanDerWaalsContact C-N 3.27Å; E174-L176 PolarHBondContact O-N 3.3Å; E174-C177 WeakPolarHBondContact O-CB 3.42Å; E174-C177 PolarHBondContact O-N 3.22Å; E174-W178 PolarHBondContact O-N 2.85Å |
| 175 | K | 88.6 | Confident | 84 | Confident | 81 Ų | 81 | 47.9 Ų | 47.9 | 35% | 0.352 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -57 | -42 | 172.1 | -67.8 | 173.2 | -164.4 | 158.4 | 0 | 111.6 | N171 D172 W178 A179 L193 | N171-K175 WeakPolarHBondContact O-CG 2.76Å; N171-K175 PolarHBondContact O-N 2.95Å; N171-K175 VanDerWaalsContact O-N 3.08Å; D172-K175 PolarHBondContact O-N 3.24Å; D172-K175 IonicContact OD1-NZ 2.77Å; D172-K175 PolarHBondContact OD1-NZ 3.36Å; K175-W178 WeakPolarHBondContact O-CB 3.42Å; K175-W178 PolarHBondContact O-N 3.49Å; K175-A179 WeakPolarHBondContact O-CB 3.33Å; K175-A179 PolarHBondContact O-N 2.9Å; K175-L193 HydrophobicContact CB-CD2 3.98Å; K175-L193 HydrophobicContact CD-CD2 4.4Å |
| 176 | L | 90.7 | Very high | 85.4 | Confident | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.3 | -41.9 | 178.2 | 179.9 | 60 | 0 | 0 | 0 | 111.4 | D172 C173 E174 W178 A179 I180 L191 L193 L209 F225 A227 M248 I250 | D172-L176 VanDerWaalsContact O-CB 3.27Å; D172-L176 WeakPolarHBondContact O-CB 3.26Å; D172-L176 PolarHBondContact O-N 3.42Å; C173-L176 PolarHBondContact O-N 3.28Å; E174-L176 VanDerWaalsContact C-N 3.27Å; E174-L176 PolarHBondContact O-N 3.3Å; L176-W178 VanDerWaalsContact C-N 3.26Å; L176-W178 PolarHBondContact O-N 2.89Å; L176-A179 PolarHBondContact O-N 3.48Å; L176-I180 HydrophobicContact CD1-CD1 4.39Å; L176-I180 HydrophobicContact CD1-CG1 4.37Å; L176-I180 HydrophobicContact CG-CD1 4.19Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.48Å; L176-I180 PolarHBondContact O-N 3.14Å; L176-L191 HydrophobicContact CD1-CD2 4.34Å; L176-L193 HydrophobicContact CB-CD1 4.43Å; L176-L193 HydrophobicContact CB-CD2 4.33Å; L176-L193 HydrophobicContact CD1-CD1 4.15Å; L176-L209 HydrophobicContact CD1-CD2 4.11Å; L176-F225 HydrophobicContact CD1-CE2 3.9Å; L176-F225 HydrophobicContact CD1-CZ 4.13Å; L176-F225 HydrophobicContact CD2-CE2 4.43Å; L176-A227 HydrophobicContact CD1-CB 3.96Å; L176-A227 HydrophobicContact CD2-CB 3.68Å; L176-A227 HydrophobicContact CG-CB 4.09Å; L176-M248 HydrophobicContact CD2-CE 4.31Å; L176-M248 HydrophobicContact CD2-SD 4.27Å; L176-I250 HydrophobicContact CD2-CD1 3.56Å; L176-I250 HydrophobicContact CD2-CG1 4.08Å |
| 177 | C | 88.1 | Confident | 85.7 | Confident | 1 Ų | 1 | 47.5 Ų | 47.5 | 1% | 0.007 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.9 | -40 | 173.5 | -72.7 | 0 | 0 | 0 | 0 | 111.8 | L115 C173 E174 R181 R229 | L115-C177 HydrophobicContact CD1-CB 4.03Å; L115-C177 HydrophobicContact CD2-CB 4.43Å; C173-C177 WeakPolarHBondContact O-CB 2.94Å; C173-C177 PolarHBondContact O-N 2.94Å; C173-C177 PolarHBondContact O-SG 2.8Å; E174-C177 WeakPolarHBondContact O-CB 3.42Å; E174-C177 PolarHBondContact O-N 3.22Å; C177-R181 PolarHBondContact O-N 3.4Å; C177-R229 PolarHBondContact O-NH1 3.3Å |
| 178 | W | 85.2 | Confident | 85.4 | Confident | 37 Ų | 37 | 51.6 Ų | 51.6 | 14% | 0.14 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -66.9 | -44.9 | 174.2 | -165.9 | -115.3 | 0 | 0 | 0 | 112 | E137 Y139 E174 K175 L176 I180 R181 Q182 | E137-W178 VanDerWaalsContact C-CH2 3.41Å; E137-W178 WeakPolarHBondContact O-CH2 3.28Å; E137-W178 WeakPolarHBondContact O-CZ2 3.25Å; Y139-W178 AromaticContact CD2-CE3 3.81Å; Y139-W178 HydrophobicContact CD2-CE3 3.81Å; Y139-W178 AromaticContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CE2-CE3 4.15Å; Y139-W178 AromaticContact CE2-CZ3 3.73Å; Y139-W178 HydrophobicContact CE2-CZ3 3.73Å; E174-W178 PolarHBondContact O-N 2.85Å; K175-W178 WeakPolarHBondContact O-CB 3.42Å; K175-W178 PolarHBondContact O-N 3.49Å; L176-W178 VanDerWaalsContact C-N 3.26Å; L176-W178 PolarHBondContact O-N 2.89Å; W178-I180 VanDerWaalsContact C-N 3.34Å; W178-I180 PolarHBondContact O-N 2.87Å; W178-R181 PolarHBondContact O-N 2.9Å; W178-Q182 VanDerWaalsContact CZ2-CD 3.41Å; W178-Q182 HydrophobicContact CZ2-CG 4.34Å; W178-Q182 PolarHBondContact O-N 2.78Å |
| 179 | A | 88.3 | Confident | 84.7 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.9 | -38.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | K175 L176 R181 Q182 P183 Y186 L191 L209 | K175-A179 WeakPolarHBondContact O-CB 3.33Å; K175-A179 PolarHBondContact O-N 2.9Å; L176-A179 PolarHBondContact O-N 3.48Å; A179-R181 VanDerWaalsContact C-N 3.32Å; A179-R181 PolarHBondContact O-N 3.36Å; A179-Q182 CarbonylContact O-C 3.59Å; A179-P183 WeakPolarHBondContact O-CA 3.36Å; A179-P183 WeakPolarHBondContact O-CB 3.28Å; A179-P183 WeakPolarHBondContact O-CD 3.12Å; A179-Y186 VanDerWaalsContact CA-CE2 3.49Å; A179-Y186 HydrophobicContact CB-CD2 3.91Å; A179-Y186 HydrophobicContact CB-CE2 3.65Å; A179-L191 HydrophobicContact CB-CD1 3.87Å; A179-L191 HydrophobicContact CB-CD2 3.79Å; A179-L191 HydrophobicContact CB-CG 4.48Å; A179-L209 HydrophobicContact CB-CD1 3.8Å |
| 180 | I | 87.9 | Confident | 84.5 | Confident | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -67.3 | -33.8 | 175 | -60.3 | 160.9 | 0 | 0 | 0 | 111.1 | L176 W178 N206 L209 A227 R229 M248 | L176-I180 HydrophobicContact CD1-CD1 4.39Å; L176-I180 HydrophobicContact CD1-CG1 4.37Å; L176-I180 HydrophobicContact CG-CD1 4.19Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.48Å; L176-I180 PolarHBondContact O-N 3.14Å; W178-I180 VanDerWaalsContact C-N 3.34Å; W178-I180 PolarHBondContact O-N 2.87Å; I180-N206 PolarHBondContact O-N 3.18Å; I180-L209 HydrophobicContact CB-CB 4.46Å; I180-L209 HydrophobicContact CG1-CB 3.58Å; I180-L209 HydrophobicContact CG1-CD1 4.24Å; I180-A227 HydrophobicContact CD1-CB 4.2Å; I180-R229 HydrophobicContact CD1-CG 4.04Å; I180-R229 VanDerWaalsContact CG2-CZ 3.49Å; I180-M248 HydrophobicContact CD1-SD 4.43Å |
| 181 | R | 82 | Confident | 84.5 | Confident | 22 Ų | 22 | 47.2 Ų | 47.2 | 8% | 0.083 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -74 | -43.2 | 176.6 | -178.9 | 178.4 | 177.8 | 86.8 | -0 | 112.1 | Y133 Y139 C177 W178 A179 P183 N206 | Y133-R181 PolarHBondContact O-NH2 2.76Å; Y133-R181 VanDerWaalsContact O-NH2 3.13Å; Y139-R181 VanDerWaalsContact CE2-CD 3.46Å; Y139-R181 PolarHBondContact OH-NH1 3.25Å; Y139-R181 VanDerWaalsContact OH-NH1 3.1Å; C177-R181 PolarHBondContact O-N 3.4Å; W178-R181 PolarHBondContact O-N 2.9Å; A179-R181 VanDerWaalsContact C-N 3.32Å; A179-R181 PolarHBondContact O-N 3.36Å; R181-P183 VanDerWaalsContact C-CD 3.46Å; R181-N206 WeakPolarHBondContact CG-OD1 3.47Å |
| 182 | Q | 83.1 | Confident | 84.5 | Confident | 34 Ų | 34 | 46.8 Ų | 46.8 | 16% | 0.159 | 24% | 0.237 | C | C | . | . | trans | -129.6 | 63.4 | -172.8 | -59.2 | -169.8 | -10.9 | 0 | 0 | 111.7 | W178 A179 Y184 L185 | W178-Q182 VanDerWaalsContact CZ2-CD 3.41Å; W178-Q182 HydrophobicContact CZ2-CG 4.34Å; W178-Q182 PolarHBondContact O-N 2.78Å; A179-Q182 CarbonylContact O-C 3.59Å; Q182-Y184 HydrophobicContact CB-CD1 4.34Å; Q182-Y184 HydrophobicContact CB-CE1 3.71Å; Q182-Y184 HydrophobicContact CG-CE1 4.01Å; Q182-Y184 PolarHBondContact O-N 2.99Å; Q182-Y184 VanDerWaalsContact O-N 3.11Å; Q182-Y184 PolarHBondContact OE1-OH 2.84Å; Q182-L185 HydrophobicContact CB-CD1 3.91Å; Q182-L185 HydrophobicContact CB-CG 4.11Å; Q182-L185 PolarHBondContact O-N 2.99Å; Q182-L185 VanDerWaalsContact O-N 3.17Å | ||
| 183 | P | 84.7 | Confident | 84.5 | Confident | 10 Ų | 10 | 46.3 Ų | 46.3 | 7% | 0.065 | 23% | 0.234 | C | C | . | . | G | 310 helix | trans | -61.9 | -26.4 | -175.1 | 24.3 | -35.3 | 0 | 0 | 0 | 112.9 | A179 R181 L185 Y186 I200 A203 Y205 | A179-P183 WeakPolarHBondContact O-CA 3.36Å; A179-P183 WeakPolarHBondContact O-CB 3.28Å; A179-P183 WeakPolarHBondContact O-CD 3.12Å; R181-P183 VanDerWaalsContact C-CD 3.46Å; P183-L185 PolarHBondContact O-N 2.98Å; P183-Y186 PolarHBondContact O-N 2.86Å; P183-Y186 VanDerWaalsContact O-N 3.14Å; P183-I200 HydrophobicContact CB-CD1 4.22Å; P183-A203 HydrophobicContact CB-CB 3.53Å; P183-A203 HydrophobicContact CG-CB 3.69Å; P183-Y205 HydrophobicContact CG-CD1 3.85Å; P183-Y205 HydrophobicContact CG-CE1 3.54Å |
| 184 | Y | 83.5 | Confident | 84.3 | Confident | 111 Ų | 111 | 48.9 Ų | 48.9 | 44% | 0.435 | 24% | 0.244 | S | C | . | . | G | 310 helix | trans | -61.6 | -26.4 | 179.6 | 62.2 | -92.4 | 0 | 0 | 0 | 113.7 | Q182 Y186 Y205 | Q182-Y184 HydrophobicContact CB-CD1 4.34Å; Q182-Y184 HydrophobicContact CB-CE1 3.71Å; Q182-Y184 HydrophobicContact CG-CE1 4.01Å; Q182-Y184 PolarHBondContact O-N 2.99Å; Q182-Y184 VanDerWaalsContact O-N 3.11Å; Q182-Y184 PolarHBondContact OE1-OH 2.84Å; Y184-Y186 PolarHBondContact O-N 2.87Å; Y184-Y205 HydrophobicContact CD1-CE1 4.24Å |
| 185 | L | 83.1 | Confident | 84.1 | Confident | 93 Ų | 93 | 50.5 Ų | 50.5 | 49% | 0.487 | 27% | 0.272 | S | S | . | . | G | 310 helix | trans | -67.2 | -20.7 | 178.1 | -68 | -177.8 | 0 | 0 | 0 | 113.1 | Q182 P183 | Q182-L185 HydrophobicContact CB-CD1 3.91Å; Q182-L185 HydrophobicContact CB-CG 4.11Å; Q182-L185 PolarHBondContact O-N 2.99Å; Q182-L185 VanDerWaalsContact O-N 3.17Å; P183-L185 PolarHBondContact O-N 2.98Å |
| 186 | Y | 84.8 | Confident | 84.1 | Confident | 46 Ų | 46 | 50.9 Ų | 50.9 | 18% | 0.18 | 27% | 0.274 | C | S | . | . | G | 310 helix | trans | -104.6 | 1.8 | -173.2 | -62.3 | -86.7 | 0 | 0 | 0 | 113.3 | A179 P183 Y184 N188 G190 L191 I200 | A179-Y186 VanDerWaalsContact CA-CE2 3.49Å; A179-Y186 HydrophobicContact CB-CD2 3.91Å; A179-Y186 HydrophobicContact CB-CE2 3.65Å; P183-Y186 PolarHBondContact O-N 2.86Å; P183-Y186 VanDerWaalsContact O-N 3.14Å; Y184-Y186 PolarHBondContact O-N 2.87Å; Y186-N188 VanDerWaalsContact C-N 3.28Å; Y186-N188 PolarHBondContact O-N 2.81Å; Y186-G190 PolarHBondContact O-N 2.8Å; Y186-G190 VanDerWaalsContact O-N 3.07Å; Y186-L191 HydrophobicContact CD1-CB 4.19Å; Y186-L191 HydrophobicContact CD1-CD1 3.77Å; Y186-L191 HydrophobicContact CE1-CD1 3.57Å; Y186-L191 HydrophobicContact CG-CD1 4.42Å; Y186-I200 HydrophobicContact CG-CD1 4.38Å |
| 187 | K | 73.6 | Confident | 84 | Confident | 163 Ų | 163 | 55 Ų | 55 | 71% | 0.709 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | -39.8 | -176.4 | -78.2 | -177.7 | 176.3 | -174.7 | 0 | 113.5 | ||
| 188 | N | 70.8 | Confident | 84.2 | Confident | 163 Ų | 163 | 55.1 Ų | 55.1 | 87% | 0.872 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.9 | -26.8 | -173.4 | -62.3 | -10.6 | 0 | 0 | 0 | 113.1 | Y186 | Y186-N188 VanDerWaalsContact C-N 3.28Å; Y186-N188 PolarHBondContact O-N 2.81Å |
| 189 | G | 69.7 | Low | 84.5 | Confident | 53 Ų | 53 | 59.8 Ų | 59.8 | 55% | 0.546 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92 | -17.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | K197 | G189-K197 WeakPolarHBondContact O-CE 3.35Š|
| 190 | G | 82.9 | Confident | 84.6 | Confident | 15 Ų | 15 | 61.7 Ų | 61.7 | 16% | 0.155 | 32% | 0.32 | C | S | . | . | trans | 66 | 170.7 | -163.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y186 Y198 | Y186-G190 PolarHBondContact O-N 2.8Å; Y186-G190 VanDerWaalsContact O-N 3.07Å; G190-Y198 CarbonylContact C-O 3.59Å; G190-Y198 WeakPolarHBondContact CA-O 3.33Å | ||
| 191 | L | 88.8 | Confident | 84.7 | Confident | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 110.9 | -176.2 | 177.1 | 57.9 | 0 | 0 | 0 | 108.7 | L176 A179 Y186 L193 Y198 L209 | L176-L191 HydrophobicContact CD1-CD2 4.34Å; A179-L191 HydrophobicContact CB-CD1 3.87Å; A179-L191 HydrophobicContact CB-CD2 3.79Å; A179-L191 HydrophobicContact CB-CG 4.48Å; Y186-L191 HydrophobicContact CD1-CB 4.19Å; Y186-L191 HydrophobicContact CD1-CD1 3.77Å; Y186-L191 HydrophobicContact CE1-CD1 3.57Å; Y186-L191 HydrophobicContact CG-CD1 4.42Å; L191-L193 HydrophobicContact CD1-CD1 4.3Å; L191-L193 HydrophobicContact CD1-CD2 4.32Å; L191-L193 HydrophobicContact CD1-CG 4.13Å; L191-L193 HydrophobicContact CD2-CD1 3.55Å; L191-L193 HydrophobicContact CD2-CG 4.26Å; L191-L193 HydrophobicContact CG-CD1 3.64Å; L191-L193 HydrophobicContact CG-CD2 4.46Å; L191-L193 HydrophobicContact CG-CG 3.77Å; L191-L193 PolarHBondContact O-N 2.83Å; L191-Y198 PolarHBondContact N-O 3.11Å; L191-Y198 WeakPolarHBondContact O-CB 3.42Å; L191-Y198 PolarHBondContact O-N 3.25Å; L191-L209 HydrophobicContact CD2-CD1 4.5Å; L191-L209 HydrophobicContact CD2-CD2 4.3Å |
| 192 | L | 89.3 | Confident | 85 | Confident | 102 Ų | 102 | 65.6 Ų | 65.6 | 53% | 0.534 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 106.7 | 179.1 | -172 | 74.6 | 0 | 0 | 0 | 110.3 | K196 | L192-K196 WeakPolarHBondContact CA-O 3.27Å |
| 193 | L | 90 | Very high | 85.2 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.8 | 140.8 | 179.1 | -64 | 170.8 | 0 | 0 | 0 | 109.6 | D172 K175 L176 L191 G195 K196 Y198 F225 | D172-L193 HydrophobicContact CB-CD2 3.75Å; D172-L193 WeakPolarHBondContact O-CD2 3.37Å; K175-L193 HydrophobicContact CB-CD2 3.98Å; K175-L193 HydrophobicContact CD-CD2 4.4Å; L176-L193 HydrophobicContact CB-CD1 4.43Å; L176-L193 HydrophobicContact CB-CD2 4.33Å; L176-L193 HydrophobicContact CD1-CD1 4.15Å; L191-L193 HydrophobicContact CD1-CD1 4.3Å; L191-L193 HydrophobicContact CD1-CD2 4.32Å; L191-L193 HydrophobicContact CD1-CG 4.13Å; L191-L193 HydrophobicContact CD2-CD1 3.55Å; L191-L193 HydrophobicContact CD2-CG 4.26Å; L191-L193 HydrophobicContact CG-CD1 3.64Å; L191-L193 HydrophobicContact CG-CD2 4.46Å; L191-L193 HydrophobicContact CG-CG 3.77Å; L191-L193 PolarHBondContact O-N 2.83Å; L193-G195 PolarHBondContact O-N 3.13Å; L193-G195 VanDerWaalsContact O-N 3.1Å; L193-K196 PolarHBondContact N-O 3.05Å; L193-K196 CarbonylContact O-C 3.56Å; L193-K196 PolarHBondContact O-N 3.34Å; L193-Y198 HydrophobicContact CB-CD2 4.06Å; L193-Y198 HydrophobicContact CB-CE2 4.12Å; L193-Y198 WeakPolarHBondContact O-CE2 3.45Å; L193-F225 HydrophobicContact CD1-CE1 4.22Å; L193-F225 HydrophobicContact CD1-CZ 3.74Å |
| 194 | W | 87.5 | Confident | 85.3 | Confident | 53 Ų | 53 | 66.5 Ų | 66.5 | 20% | 0.201 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 54.2 | 35.7 | 173.2 | -43.3 | -47.4 | 0 | 0 | 0 | 113.3 | P168 D172 K196 Y198 F225 I250 F252 | P168-W194 HydrophobicContact CB-CZ2 4Å; P168-W194 HydrophobicContact CG-CZ2 3.84Å; D172-W194 WeakPolarHBondContact OD2-CA 3.31Å; D172-W194 VanDerWaalsContact OD2-CD1 3.29Å; D172-W194 PolarHBondContact OD2-N 3.06Å; W194-K196 PolarHBondContact O-N 3.48Å; W194-Y198 AromaticContact CE3-CE2 3.89Å; W194-Y198 HydrophobicContact CE3-CE2 3.89Å; W194-Y198 AromaticContact CE3-CZ 3.87Å; W194-Y198 HydrophobicContact CZ3-CE2 4.26Å; W194-F225 HydrophobicContact CH2-CD1 4.13Å; W194-F225 HydrophobicContact CH2-CD2 4.25Å; W194-F225 HydrophobicContact CH2-CE1 4.15Å; W194-F225 HydrophobicContact CH2-CE2 4.32Å; W194-F225 HydrophobicContact CH2-CG 4.17Å; W194-F225 HydrophobicContact CH2-CZ 4.26Å; W194-F225 AromaticContact CZ3-CD1 3.74Å; W194-F225 HydrophobicContact CZ3-CD1 3.74Å; W194-F225 AromaticContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CG 4.18Å; W194-F225 HydrophobicContact CZ3-CZ 4.37Å; W194-I250 HydrophobicContact CH2-CG2 3.9Å; W194-I250 HydrophobicContact CZ2-CD1 4.23Å; W194-I250 HydrophobicContact CZ2-CG2 4.22Å; W194-F252 HydrophobicContact CD2-CZ 4.31Å; W194-F252 AromaticContact CE3-CE1 3.91Å; W194-F252 HydrophobicContact CE3-CE1 3.91Å; W194-F252 AromaticContact CE3-CZ 3.7Å; W194-F252 HydrophobicContact CE3-CZ 3.7Å; W194-F252 AromaticContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE2 4.1Å; W194-F252 AromaticContact CH2-CZ 3.32Å; W194-F252 HydrophobicContact CH2-CZ 3.32Å; W194-F252 AromaticContact CZ2-CZ 3.98Å; W194-F252 HydrophobicContact CZ2-CZ 3.98Å; W194-F252 AromaticContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE2 4.33Å; W194-F252 AromaticContact CZ3-CZ 3.18Å; W194-F252 HydrophobicContact CZ3-CZ 3.18Å |
| 195 | G | 84.5 | Confident | 84.9 | Confident | 77 Ų | 77 | 67.7 Ų | 67.7 | 79% | 0.794 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.5 | 5.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | L193 | L193-G195 PolarHBondContact O-N 3.13Å; L193-G195 VanDerWaalsContact O-N 3.1Å |
| 196 | K | 87.3 | Confident | 84.5 | Confident | 88 Ų | 88 | 66.1 Ų | 66.1 | 38% | 0.383 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 147.7 | -177.1 | -68.9 | 174.1 | 165.9 | -146.2 | 0 | 111.2 | L192 L193 W194 Y198 E213 | L192-K196 WeakPolarHBondContact CA-O 3.27Å; L193-K196 PolarHBondContact N-O 3.05Å; L193-K196 CarbonylContact O-C 3.56Å; L193-K196 PolarHBondContact O-N 3.34Å; W194-K196 PolarHBondContact O-N 3.48Å; K196-Y198 HydrophobicContact CB-CD2 4.34Å; K196-Y198 HydrophobicContact CB-CE2 3.66Å; K196-Y198 WeakPolarHBondContact O-CD2 3.38Å; K196-E213 HydrophobicContact CD-CG 4.34Å; K196-E213 VanDerWaalsContact CD-OE1 3.28Å; K196-E213 WeakPolarHBondContact CD-OE1 3.35Å; K196-E213 WeakPolarHBondContact CE-OE1 3.28Å; K196-E213 IonicContact NZ-OE1 2.88Å; K196-E213 PolarHBondContact NZ-OE1 3.45Å; K196-E213 IonicContact NZ-OE2 3.01Å; K196-E213 PolarHBondContact NZ-OE2 3.13Å |
| 197 | K | 89.4 | Confident | 84.6 | Confident | 86 Ų | 86 | 66 Ų | 66 | 37% | 0.374 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 134.3 | 174.8 | -167.7 | -177.9 | -176.8 | -139 | 0 | 108.8 | G189 E214 | G189-K197 WeakPolarHBondContact O-CE 3.35Å; K197-E214 HydrophobicContact CB-CB 4.46Å; K197-E214 VanDerWaalsContact CD-OE2 3.25Å; K197-E214 WeakPolarHBondContact CD-OE2 3.29Å; K197-E214 WeakPolarHBondContact CE-OE2 3.46Å; K197-E214 IonicContact NZ-OE2 2.72Å; K197-E214 PolarHBondContact NZ-OE2 3.38Å; K197-E214 PolarHBondContact O-N 3.02Å |
| 198 | Y | 91.7 | Very high | 85.4 | Confident | 5 Ų | 5 | 58.2 Ų | 58.2 | 2% | 0.02 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 139.4 | 178.8 | -71.6 | -93.7 | 0 | 0 | 0 | 111.1 | G190 L191 L193 W194 K196 A211 I212 E213 F225 | G190-Y198 CarbonylContact C-O 3.59Å; G190-Y198 WeakPolarHBondContact CA-O 3.33Å; L191-Y198 PolarHBondContact N-O 3.11Å; L191-Y198 WeakPolarHBondContact O-CB 3.42Å; L191-Y198 PolarHBondContact O-N 3.25Å; L193-Y198 HydrophobicContact CB-CD2 4.06Å; L193-Y198 HydrophobicContact CB-CE2 4.12Å; L193-Y198 WeakPolarHBondContact O-CE2 3.45Å; W194-Y198 AromaticContact CE3-CE2 3.89Å; W194-Y198 HydrophobicContact CE3-CE2 3.89Å; W194-Y198 AromaticContact CE3-CZ 3.87Å; W194-Y198 HydrophobicContact CZ3-CE2 4.26Å; K196-Y198 HydrophobicContact CB-CD2 4.34Å; K196-Y198 HydrophobicContact CB-CE2 3.66Å; K196-Y198 WeakPolarHBondContact O-CD2 3.38Å; Y198-A211 HydrophobicContact CD1-CB 4.46Å; Y198-I212 CarbonylContact C-O 3.55Å; Y198-I212 VanDerWaalsContact CA-O 3.3Å; Y198-I212 WeakPolarHBondContact CA-O 3.42Å; Y198-I212 VanDerWaalsContact CD1-C 3.48Å; Y198-E213 HydrophobicContact CD1-CB 4.17Å; Y198-E213 VanDerWaalsContact CD1-N 3.3Å; Y198-E213 HydrophobicContact CE1-CB 3.83Å; Y198-F225 AromaticContact CD1-CD1 3.8Å; Y198-F225 HydrophobicContact CD1-CD1 3.8Å; Y198-F225 AromaticContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD2-CE1 4.34Å; Y198-F225 AromaticContact CE1-CD1 3.69Å; Y198-F225 HydrophobicContact CE1-CD1 3.69Å; Y198-F225 AromaticContact CE1-CE1 3.78Å; Y198-F225 HydrophobicContact CE1-CE1 3.78Å; Y198-F225 AromaticContact CG-CE1 3.84Å; Y198-F225 HydrophobicContact CG-CE1 3.84Å |
| 199 | R | 90.8 | Very high | 86.5 | Confident | 134 Ų | 134 | 50.4 Ų | 50.4 | 51% | 0.506 | 27% | 0.269 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 124.9 | 168.9 | -167.7 | 174.2 | 63.5 | 176.7 | -0 | 109.5 | L201 A211 I212 E214 | R199-L201 PolarHBondContact O-N 3.41Å; R199-A211 CarbonylContact O-C 3.58Å; R199-A211 WeakPolarHBondContact O-CA 3.44Å; R199-A211 WeakPolarHBondContact O-CB 3.44Å; R199-I212 HydrophobicContact CB-CG2 4.17Å; R199-I212 PolarHBondContact N-O 3.47Å; R199-I212 PolarHBondContact O-N 3.22Å; R199-E214 HydrophobicContact CB-CG 3.7Å; R199-E214 WeakPolarHBondContact CB-OE1 3.4Å |
| 200 | I | 91 | Very high | 87.7 | Confident | 41 Ų | 41 | 48.7 Ų | 48.7 | 21% | 0.21 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -68.3 | 121.8 | 172.4 | -59.7 | 174.4 | 0 | 0 | 0 | 108.4 | P183 Y186 A203 L209 | P183-I200 HydrophobicContact CB-CD1 4.22Å; Y186-I200 HydrophobicContact CG-CD1 4.38Å; I200-A203 HydrophobicContact CG2-CB 4.27Å; I200-L209 HydrophobicContact CD1-CD1 3.75Å; I200-L209 HydrophobicContact CG1-CD1 4.08Å; I200-L209 HydrophobicContact CG1-CD2 4.41Å; I200-L209 HydrophobicContact CG1-CG 4.39Å; I200-L209 HydrophobicContact CG2-CD1 4.41Å; I200-L209 HydrophobicContact CG2-CG 4.2Å |
| 201 | L | 90 | Very high | 88.1 | Confident | 53 Ų | 53 | 48 Ų | 48 | 28% | 0.277 | 24% | 0.24 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | -42 | 174.5 | -65.7 | -179.3 | 0 | 0 | 0 | 111 | R199 M210 I212 T224 | R199-L201 PolarHBondContact O-N 3.41Å; L201-M210 HydrophobicContact CB-CE 3.82Å; L201-M210 HydrophobicContact CD1-CE 3.94Å; L201-M210 HydrophobicContact CD1-CG 4.49Å; L201-M210 PolarHBondContact N-O 3.07Å; L201-I212 HydrophobicContact CD1-CB 3.92Å; L201-I212 HydrophobicContact CD1-CG2 3.99Å; L201-I212 HydrophobicContact CD2-CG2 3.68Å; L201-I212 HydrophobicContact CG-CB 4.22Å; L201-I212 HydrophobicContact CG-CG2 3.83Å; L201-T224 HydrophobicContact CD1-CG2 4.48Å |
| 202 | Y | 89.3 | Confident | 88.3 | Confident | 51 Ų | 51 | 49 Ų | 49 | 20% | 0.2 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.2 | 147.5 | -177.5 | 169.4 | -99.8 | 0 | 0 | 0 | 110 | D204 L209 M210 | Y202-D204 HydrophobicContact CE1-CB 4.11Å; Y202-D204 WeakPolarHBondContact OH-CB 3.3Å; Y202-L209 WeakPolarHBondContact O-CA 3.22Å; Y202-M210 PolarHBondContact N-O 2.97Å; Y202-M210 PolarHBondContact O-N 3.2Å |
| 203 | A | 87.4 | Confident | 88.3 | Confident | 25 Ų | 25 | 45.5 Ų | 45.5 | 21% | 0.207 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -146.5 | 132.1 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110 | P183 I200 T208 | P183-A203 HydrophobicContact CB-CB 3.53Å; P183-A203 HydrophobicContact CG-CB 3.69Å; I200-A203 HydrophobicContact CG2-CB 4.27Å; A203-T208 CarbonylContact C-O 3.49Å; A203-T208 VanDerWaalsContact CA-O 3.27Å; A203-T208 WeakPolarHBondContact CA-O 3.47Å |
| 204 | D | 85.4 | Confident | 88.1 | Confident | 37 Ų | 37 | 48.9 Ų | 48.9 | 20% | 0.198 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 114.1 | 164.2 | -165.3 | 0.9 | 0 | 0 | 0 | 107.9 | P12 Y202 N206 Q207 T208 | P12-D204 VanDerWaalsContact CB-OD2 3.26Å; P12-D204 WeakPolarHBondContact CB-OD2 3.41Å; Y202-D204 HydrophobicContact CE1-CB 4.11Å; Y202-D204 WeakPolarHBondContact OH-CB 3.3Å; D204-N206 PolarHBondContact O-N 3.37Å; D204-Q207 HydrophobicContact CB-CB 4.44Å; D204-Q207 PolarHBondContact O-N 3.15Å; D204-T208 PolarHBondContact N-O 3.23Å; D204-T208 PolarHBondContact O-N 2.9Å; D204-T208 VanDerWaalsContact O-N 3.11Å |
| 205 | Y | 74.8 | Confident | 87.4 | Confident | 136 Ų | 136 | 48.2 Ų | 48.2 | 53% | 0.533 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -51.6 | 126.9 | -170.9 | -72.6 | -81.8 | 0 | 0 | 0 | 110.8 | P183 Y184 Q207 | P183-Y205 HydrophobicContact CG-CD1 3.85Å; P183-Y205 HydrophobicContact CG-CE1 3.54Å; Y184-Y205 HydrophobicContact CD1-CE1 4.24Å; Y205-Q207 PolarHBondContact O-N 3.11Å |
| 206 | N | 75.7 | Confident | 86.4 | Confident | 60 Ų | 60 | 48.7 Ų | 48.7 | 32% | 0.321 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.5 | -12.1 | -176.7 | -64.9 | -37.7 | 0 | 0 | 0 | 117.4 | Y133 I180 R181 D204 R229 | Y133-N206 PolarHBondContact OH-ND2 3.04Å; I180-N206 PolarHBondContact O-N 3.18Å; R181-N206 WeakPolarHBondContact CG-OD1 3.47Å; D204-N206 PolarHBondContact O-N 3.37Å; N206-R229 VanDerWaalsContact O-CZ 3.31Å; N206-R229 PolarHBondContact O-NE 3Å; N206-R229 PolarHBondContact O-NH2 3.08Å |
| 207 | Q | 86.3 | Confident | 85.1 | Confident | 43 Ų | 43 | 51 Ų | 51 | 20% | 0.201 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.5 | -59.1 | -173.9 | -169.8 | 175.7 | -15.4 | 0 | 0 | 113.8 | D204 Y205 T228 R229 | D204-Q207 HydrophobicContact CB-CB 4.44Å; D204-Q207 PolarHBondContact O-N 3.15Å; Y205-Q207 PolarHBondContact O-N 3.11Å; Q207-T228 CarbonylContact O-C 3.5Å; Q207-T228 WeakPolarHBondContact O-CA 3.37Å; Q207-R229 PolarHBondContact O-N 3Å |
| 208 | T | 91.3 | Very high | 83.6 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.6 | 145.2 | -167.4 | -58.3 | 0 | 0 | 0 | 0 | 111 | A203 D204 T226 A227 T228 M267 | A203-T208 CarbonylContact C-O 3.49Å; A203-T208 VanDerWaalsContact CA-O 3.27Å; A203-T208 WeakPolarHBondContact CA-O 3.47Å; D204-T208 PolarHBondContact N-O 3.23Å; D204-T208 PolarHBondContact O-N 2.9Å; D204-T208 VanDerWaalsContact O-N 3.11Å; T208-T226 HydrophobicContact CG2-CG2 3.62Å; T208-A227 CarbonylContact C-O 3.55Å; T208-A227 VanDerWaalsContact CA-O 3.28Å; T208-A227 WeakPolarHBondContact CA-O 3.28Å; T208-T228 PolarHBondContact OG1-OG1 2.91Å; T208-M267 HydrophobicContact CG2-CE 3.81Å |
| 209 | L | 93.5 | Very high | 82.2 | Confident | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 134.4 | 171.7 | -179.6 | 151.9 | 0 | 0 | 0 | 109.1 | L176 A179 I180 L191 I200 Y202 A211 F225 T226 A227 | L176-L209 HydrophobicContact CD1-CD2 4.11Å; A179-L209 HydrophobicContact CB-CD1 3.8Å; I180-L209 HydrophobicContact CB-CB 4.46Å; I180-L209 HydrophobicContact CG1-CB 3.58Å; I180-L209 HydrophobicContact CG1-CD1 4.24Å; L191-L209 HydrophobicContact CD2-CD1 4.5Å; L191-L209 HydrophobicContact CD2-CD2 4.3Å; I200-L209 HydrophobicContact CD1-CD1 3.75Å; I200-L209 HydrophobicContact CG1-CD1 4.08Å; I200-L209 HydrophobicContact CG1-CD2 4.41Å; I200-L209 HydrophobicContact CG1-CG 4.39Å; I200-L209 HydrophobicContact CG2-CD1 4.41Å; I200-L209 HydrophobicContact CG2-CG 4.2Å; Y202-L209 WeakPolarHBondContact O-CA 3.22Å; L209-A211 HydrophobicContact CD2-CB 3.88Å; L209-F225 HydrophobicContact CD2-CE2 4.12Å; L209-F225 HydrophobicContact CD2-CZ 4.14Å; L209-T226 CarbonylContact O-C 3.5Å; L209-T226 WeakPolarHBondContact O-CA 3.49Å; L209-A227 PolarHBondContact N-O 3.47Å; L209-A227 PolarHBondContact O-N 3.3Å |
| 210 | M | 94.1 | Very high | 80.8 | Confident | 16 Ų | 16 | 60.6 Ų | 60.6 | 8% | 0.079 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 132.2 | 172 | -174.3 | 174.2 | 69.7 | 0 | 0 | 108.8 | L201 Y202 T224 F225 | L201-M210 HydrophobicContact CB-CE 3.82Å; L201-M210 HydrophobicContact CD1-CE 3.94Å; L201-M210 HydrophobicContact CD1-CG 4.49Å; L201-M210 PolarHBondContact N-O 3.07Å; Y202-M210 PolarHBondContact N-O 2.97Å; Y202-M210 PolarHBondContact O-N 3.2Å; M210-T224 HydrophobicContact CG-CG2 4.11Å; M210-T224 HydrophobicContact SD-CG2 4.42Å; M210-F225 WeakPolarHBondContact CA-O 3.13Å; M210-F225 WeakPolarHBondContact CG-O 3.35Å |
| 211 | A | 93.1 | Very high | 79.6 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.1 | 151.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112 | Y198 R199 L209 T224 F225 | Y198-A211 HydrophobicContact CD1-CB 4.46Å; R199-A211 CarbonylContact O-C 3.58Å; R199-A211 WeakPolarHBondContact O-CA 3.44Å; R199-A211 WeakPolarHBondContact O-CB 3.44Å; L209-A211 HydrophobicContact CD2-CB 3.88Å; A211-T224 WeakPolarHBondContact O-CA 3.43Å; A211-F225 HydrophobicContact CB-CD1 4.41Å; A211-F225 HydrophobicContact CB-CE1 3.75Å; A211-F225 HydrophobicContact CB-CZ 3.86Å; A211-F225 PolarHBondContact N-O 2.84Å; A211-F225 PolarHBondContact O-N 3.16Å |
| 212 | I | 91.4 | Very high | 78.9 | Confident | 23 Ų | 23 | 63.6 Ų | 63.6 | 12% | 0.118 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 139.1 | 178.4 | -170.7 | 166.4 | 0 | 0 | 0 | 109.6 | Y198 R199 L201 E214 L222 T224 | Y198-I212 CarbonylContact C-O 3.55Å; Y198-I212 VanDerWaalsContact CA-O 3.3Å; Y198-I212 WeakPolarHBondContact CA-O 3.42Å; Y198-I212 VanDerWaalsContact CD1-C 3.48Å; R199-I212 HydrophobicContact CB-CG2 4.17Å; R199-I212 PolarHBondContact N-O 3.47Å; R199-I212 PolarHBondContact O-N 3.22Å; L201-I212 HydrophobicContact CD1-CB 3.92Å; L201-I212 HydrophobicContact CD1-CG2 3.99Å; L201-I212 HydrophobicContact CD2-CG2 3.68Å; L201-I212 HydrophobicContact CG-CB 4.22Å; L201-I212 HydrophobicContact CG-CG2 3.83Å; I212-E214 PolarHBondContact O-N 3.24Å; I212-L222 HydrophobicContact CD1-CB 3.98Å; I212-L222 HydrophobicContact CD1-CD1 4.14Å; I212-L222 HydrophobicContact CG1-CB 3.77Å; I212-L222 HydrophobicContact CG1-CD1 4.3Å; I212-T224 WeakPolarHBondContact CG1-OG1 3.28Å |
| 213 | E | 90 | Very high | 78.8 | Confident | 28 Ų | 28 | 62.4 Ų | 62.4 | 13% | 0.131 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -55.6 | 132.4 | 174.4 | -176.4 | 174.4 | 175.1 | 0 | 0 | 110.4 | K196 Y198 L222 S223 | K196-E213 HydrophobicContact CD-CG 4.34Å; K196-E213 VanDerWaalsContact CD-OE1 3.28Å; K196-E213 WeakPolarHBondContact CD-OE1 3.35Å; K196-E213 WeakPolarHBondContact CE-OE1 3.28Å; K196-E213 IonicContact NZ-OE1 2.88Å; K196-E213 PolarHBondContact NZ-OE1 3.45Å; K196-E213 IonicContact NZ-OE2 3.01Å; K196-E213 PolarHBondContact NZ-OE2 3.13Å; Y198-E213 HydrophobicContact CD1-CB 4.17Å; Y198-E213 VanDerWaalsContact CD1-N 3.3Å; Y198-E213 HydrophobicContact CE1-CB 3.83Å; E213-L222 HydrophobicContact CB-CB 4.36Å; E213-L222 HydrophobicContact CB-CD2 4.41Å; E213-L222 HydrophobicContact CG-CD2 4.48Å; E213-L222 WeakPolarHBondContact O-CD1 3.43Å; E213-L222 WeakPolarHBondContact O-CD2 3.27Å; E213-S223 PolarHBondContact N-O 3.47Å; E213-S223 WeakPolarHBondContact OE2-CB 2.76Å; E213-S223 PolarHBondContact OE2-N 2.9Å |
| 214 | E | 85.1 | Confident | 79 | Confident | 70 Ų | 70 | 61.6 Ų | 61.6 | 33% | 0.327 | 34% | 0.335 | S | S | . | . | trans | -93.9 | 116.7 | 166.9 | -67.8 | -169.4 | 154 | 0 | 0 | 108 | K197 R199 I212 | K197-E214 HydrophobicContact CB-CB 4.46Å; K197-E214 VanDerWaalsContact CD-OE2 3.25Å; K197-E214 WeakPolarHBondContact CD-OE2 3.29Å; K197-E214 WeakPolarHBondContact CE-OE2 3.46Å; K197-E214 IonicContact NZ-OE2 2.72Å; K197-E214 PolarHBondContact NZ-OE2 3.38Å; K197-E214 PolarHBondContact O-N 3.02Å; R199-E214 HydrophobicContact CB-CG 3.7Å; R199-E214 WeakPolarHBondContact CB-OE1 3.4Å; I212-E214 PolarHBondContact O-N 3.24Å | ||
| 215 | S | 73.2 | Confident | 79.5 | Confident | 39 Ų | 39 | 59.8 Ų | 59.8 | 27% | 0.273 | 33% | 0.326 | S | S | . | . | trans | -113.7 | 133 | 168 | 139.3 | 0 | 0 | 0 | 0 | 109.5 | V217 N218 | S215-V217 VanDerWaalsContact C-N 3.27Å; S215-V217 PolarHBondContact OG-N 3.21Å; S215-N218 WeakPolarHBondContact CB-O 3.15Å; S215-N218 VanDerWaalsContact OG-C 3.23Å; S215-N218 WeakPolarHBondContact OG-CA 3.06Å; S215-N218 PolarHBondContact OG-N 2.73Å; S215-N218 PolarHBondContact OG-O 2.85Å | ||
| 216 | G | 62.9 | Low | 80.5 | Confident | 88 Ų | 88 | 53.3 Ų | 53.3 | 91% | 0.907 | 30% | 0.3 | S | S | * | . | S | Bend | trans | -76.9 | -13.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 217 | V | 61.1 | Low | 81.4 | Confident | 135 Ų | 135 | 50.5 Ų | 50.5 | 82% | 0.818 | 29% | 0.285 | S | S | * | . | S | Bend | trans | -118.4 | -46.2 | -167.5 | -171.3 | 0 | 0 | 0 | 0 | 111.8 | S215 | S215-V217 VanDerWaalsContact C-N 3.27Å; S215-V217 PolarHBondContact OG-N 3.21Å |
| 218 | N | 57.4 | Low | 81.7 | Confident | 107 Ų | 107 | 48.4 Ų | 48.4 | 57% | 0.572 | 28% | 0.275 | S | S | * | . | trans | -120.9 | 111.8 | 179.6 | -77 | -17.9 | 0 | 0 | 0 | 111 | S215 L222 | S215-N218 WeakPolarHBondContact CB-O 3.15Å; S215-N218 VanDerWaalsContact OG-C 3.23Å; S215-N218 WeakPolarHBondContact OG-CA 3.06Å; S215-N218 PolarHBondContact OG-N 2.73Å; S215-N218 PolarHBondContact OG-O 2.85Å; N218-L222 WeakPolarHBondContact O-CD2 3.19Å | ||
| 219 | K | 63.5 | Low | 81.7 | Confident | 188 Ų | 188 | 49.8 Ų | 49.8 | 82% | 0.817 | 28% | 0.281 | S | S | * | . | trans | -80.7 | -6.7 | 170.6 | -67.1 | -177.3 | 179.6 | 176.8 | 0 | 113 | ||||
| 220 | I | 60.9 | Low | 81.4 | Confident | 133 Ų | 133 | 50.4 Ų | 50.4 | 68% | 0.682 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.9 | 135.1 | -179.3 | -56.5 | 173 | 0 | 0 | 0 | 107.7 | ||
| 221 | N | 65.8 | Low | 80.7 | Confident | 114 Ų | 114 | 54.9 Ų | 54.9 | 61% | 0.61 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.3 | 38.2 | 178.1 | -55.7 | -16.6 | 0 | 0 | 0 | 115.5 | S223 Q255 | N221-S223 PolarHBondContact O-N 3.35Å; N221-Q255 PolarHBondContact O-NE2 3.07Å; N221-Q255 PolarHBondContact OD1-OE1 3.01Å |
| 222 | L | 76 | Confident | 79.6 | Confident | 42 Ų | 42 | 55.9 Ų | 55.9 | 22% | 0.22 | 31% | 0.31 | C | S | . | . | P | Polyproline II helix | trans | -66.3 | 131.4 | 172.1 | -59.9 | 175.1 | 0 | 0 | 0 | 110.4 | I212 E213 N218 T224 | I212-L222 HydrophobicContact CD1-CB 3.98Å; I212-L222 HydrophobicContact CD1-CD1 4.14Å; I212-L222 HydrophobicContact CG1-CB 3.77Å; I212-L222 HydrophobicContact CG1-CD1 4.3Å; E213-L222 HydrophobicContact CB-CB 4.36Å; E213-L222 HydrophobicContact CB-CD2 4.41Å; E213-L222 HydrophobicContact CG-CD2 4.48Å; E213-L222 WeakPolarHBondContact O-CD1 3.43Å; E213-L222 WeakPolarHBondContact O-CD2 3.27Å; N218-L222 WeakPolarHBondContact O-CD2 3.19Å; L222-T224 PolarHBondContact O-N 2.82Å |
| 223 | S | 86.8 | Confident | 78.2 | Confident | 26 Ų | 26 | 58.5 Ų | 58.5 | 18% | 0.182 | 33% | 0.328 | C | S | . | . | P | Polyproline II helix | trans | -74.6 | 118.6 | 176.3 | -176.5 | 0 | 0 | 0 | 0 | 110.4 | E213 N221 F252 | E213-S223 PolarHBondContact N-O 3.47Å; E213-S223 WeakPolarHBondContact OE2-CB 2.76Å; E213-S223 PolarHBondContact OE2-N 2.9Å; N221-S223 PolarHBondContact O-N 3.35Å; S223-F252 WeakPolarHBondContact OG-CD1 3.44Å |
| 224 | T | 91.7 | Very high | 76.6 | Confident | 8 Ų | 8 | 59.7 Ų | 59.7 | 5% | 0.049 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.2 | 140 | 167.8 | -58.4 | 0 | 0 | 0 | 0 | 109.8 | L201 M210 A211 I212 L222 H253 Q259 | L201-T224 HydrophobicContact CD1-CG2 4.48Å; M210-T224 HydrophobicContact CG-CG2 4.11Å; M210-T224 HydrophobicContact SD-CG2 4.42Å; A211-T224 WeakPolarHBondContact O-CA 3.43Å; I212-T224 WeakPolarHBondContact CG1-OG1 3.28Å; L222-T224 PolarHBondContact O-N 2.82Å; T224-H253 PolarHBondContact O-N 3.3Å; T224-Q259 PolarHBondContact OG1-NE2 2.8Å |
| 225 | F | 94.7 | Very high | 74.6 | Confident | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 152.9 | 170.5 | 77 | -92.4 | 0 | 0 | 0 | 111.5 | L176 L193 W194 Y198 L209 M210 A211 A227 I250 G251 F252 | L176-F225 HydrophobicContact CD1-CE2 3.9Å; L176-F225 HydrophobicContact CD1-CZ 4.13Å; L176-F225 HydrophobicContact CD2-CE2 4.43Å; L193-F225 HydrophobicContact CD1-CE1 4.22Å; L193-F225 HydrophobicContact CD1-CZ 3.74Å; W194-F225 HydrophobicContact CH2-CD1 4.13Å; W194-F225 HydrophobicContact CH2-CD2 4.25Å; W194-F225 HydrophobicContact CH2-CE1 4.15Å; W194-F225 HydrophobicContact CH2-CE2 4.32Å; W194-F225 HydrophobicContact CH2-CG 4.17Å; W194-F225 HydrophobicContact CH2-CZ 4.26Å; W194-F225 AromaticContact CZ3-CD1 3.74Å; W194-F225 HydrophobicContact CZ3-CD1 3.74Å; W194-F225 AromaticContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CG 4.18Å; W194-F225 HydrophobicContact CZ3-CZ 4.37Å; Y198-F225 AromaticContact CD1-CD1 3.8Å; Y198-F225 HydrophobicContact CD1-CD1 3.8Å; Y198-F225 AromaticContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD2-CE1 4.34Å; Y198-F225 AromaticContact CE1-CD1 3.69Å; Y198-F225 HydrophobicContact CE1-CD1 3.69Å; Y198-F225 AromaticContact CE1-CE1 3.78Å; Y198-F225 HydrophobicContact CE1-CE1 3.78Å; Y198-F225 AromaticContact CG-CE1 3.84Å; Y198-F225 HydrophobicContact CG-CE1 3.84Å; L209-F225 HydrophobicContact CD2-CE2 4.12Å; L209-F225 HydrophobicContact CD2-CZ 4.14Å; M210-F225 WeakPolarHBondContact CA-O 3.13Å; M210-F225 WeakPolarHBondContact CG-O 3.35Å; A211-F225 HydrophobicContact CB-CD1 4.41Å; A211-F225 HydrophobicContact CB-CE1 3.75Å; A211-F225 HydrophobicContact CB-CZ 3.86Å; A211-F225 PolarHBondContact N-O 2.84Å; A211-F225 PolarHBondContact O-N 3.16Å; F225-A227 HydrophobicContact CD2-CB 4.23Å; F225-A227 HydrophobicContact CE2-CB 3.98Å; F225-I250 HydrophobicContact CD2-CG2 4.15Å; F225-G251 CarbonylContact C-O 3.56Å; F225-G251 VanDerWaalsContact CA-O 3.23Å; F225-G251 WeakPolarHBondContact CA-O 3.36Å; F225-F252 HydrophobicContact CB-CD1 3.9Å; F225-F252 HydrophobicContact CB-CE1 4.13Å; F225-F252 HydrophobicContact CB-CG 4.24Å |
| 226 | T | 95.3 | Very high | 73.3 | Confident | 0 Ų | 0 | 69.1 Ų | 69.1 | 0% | 0 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 131.9 | 164.5 | -58.6 | 0 | 0 | 0 | 0 | 108.8 | T208 L209 I250 G251 H253 N263 I266 | T208-T226 HydrophobicContact CG2-CG2 3.62Å; L209-T226 CarbonylContact O-C 3.5Å; L209-T226 WeakPolarHBondContact O-CA 3.49Å; T226-I250 WeakPolarHBondContact O-CA 3.38Å; T226-G251 PolarHBondContact N-O 2.88Å; T226-G251 PolarHBondContact O-N 3.49Å; T226-H253 PolarHBondContact OG1-NE2 3.13Å; T226-N263 WeakPolarHBondContact CG2-OD1 3.47Å; T226-N263 PolarHBondContact OG1-OD1 2.92Å; T226-I266 HydrophobicContact CG2-CD1 4.45Å; T226-I266 HydrophobicContact CG2-CG2 4.17Å |
| 227 | A | 95 | Very high | 72.5 | Confident | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 131 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | L176 I180 T208 L209 F225 L249 I250 | L176-A227 HydrophobicContact CD1-CB 3.96Å; L176-A227 HydrophobicContact CD2-CB 3.68Å; L176-A227 HydrophobicContact CG-CB 4.09Å; I180-A227 HydrophobicContact CD1-CB 4.2Å; T208-A227 CarbonylContact C-O 3.55Å; T208-A227 VanDerWaalsContact CA-O 3.28Å; T208-A227 WeakPolarHBondContact CA-O 3.28Å; L209-A227 PolarHBondContact N-O 3.47Å; L209-A227 PolarHBondContact O-N 3.3Å; F225-A227 HydrophobicContact CD2-CB 4.23Å; F225-A227 HydrophobicContact CE2-CB 3.98Å; A227-L249 CarbonylContact C-O 3.56Å; A227-L249 VanDerWaalsContact CA-O 3.27Å; A227-L249 WeakPolarHBondContact CA-O 3.46Å; A227-I250 HydrophobicContact CB-CG1 4.26Å |
| 228 | T | 93.6 | Very high | 71.5 | Confident | 0 Ų | 0 | 70.3 Ų | 70.3 | 0% | 0 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.2 | 142.7 | -175.2 | -176.8 | 0 | 0 | 0 | 0 | 110.9 | Q207 T208 M248 L249 I266 M270 | Q207-T228 CarbonylContact O-C 3.5Å; Q207-T228 WeakPolarHBondContact O-CA 3.37Å; T208-T228 PolarHBondContact OG1-OG1 2.91Å; T228-M248 CarbonylContact O-C 3.58Å; T228-M248 WeakPolarHBondContact O-CA 3.48Å; T228-L249 HydrophobicContact CG2-CB 3.95Å; T228-L249 HydrophobicContact CG2-CD2 4.39Å; T228-L249 PolarHBondContact N-O 3.49Å; T228-L249 PolarHBondContact O-N 3.45Å; T228-I266 HydrophobicContact CG2-CG2 3.74Å; T228-M270 HydrophobicContact CG2-CE 3.92Å; T228-M270 HydrophobicContact CG2-CG 3.29Å; T228-M270 HydrophobicContact CG2-SD 3.73Å |
| 229 | R | 90.2 | Very high | 70.6 | Confident | 28 Ų | 28 | 76.5 Ų | 76.5 | 11% | 0.106 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 135.8 | -173.7 | -59.4 | -174 | -68 | -161.1 | -1 | 110.5 | C177 I180 N206 Q207 F246 V247 M248 | C177-R229 PolarHBondContact O-NH1 3.3Å; I180-R229 HydrophobicContact CD1-CG 4.04Å; I180-R229 VanDerWaalsContact CG2-CZ 3.49Å; N206-R229 VanDerWaalsContact O-CZ 3.31Å; N206-R229 PolarHBondContact O-NE 3Å; N206-R229 PolarHBondContact O-NH2 3.08Å; Q207-R229 PolarHBondContact O-N 3Å; R229-F246 HydrophobicContact CB-CD2 4.02Å; R229-F246 HydrophobicContact CB-CG 4.48Å; R229-F246 VanDerWaalsContact CD-CE2 3.48Å; R229-F246 HydrophobicContact CG-CD2 3.88Å; R229-F246 HydrophobicContact CG-CE2 3.95Å; R229-V247 CarbonylContact C-O 3.5Å; R229-V247 WeakPolarHBondContact CA-O 3.04Å; R229-M248 HydrophobicContact CG-CB 4.42Å; R229-M248 HydrophobicContact CG-CG 4.18Å; R229-M248 HydrophobicContact CG-SD 4.4Å |
| 230 | L | 87.1 | Confident | 69.4 | Low | 13 Ų | 13 | 69.5 Ų | 69.5 | 7% | 0.068 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 111.5 | 170.8 | 177.5 | 67.5 | 0 | 0 | 0 | 108.5 | I232 F246 V247 M270 L273 R274 L277 | L230-I232 PolarHBondContact O-N 3.4Å; L230-F246 CarbonylContact O-C 3.54Å; L230-F246 VanDerWaalsContact O-CA 3.27Å; L230-F246 WeakPolarHBondContact O-CA 3.34Å; L230-F246 WeakPolarHBondContact O-CB 3.46Å; L230-V247 PolarHBondContact N-O 3.18Å; L230-V247 PolarHBondContact O-N 3.39Å; L230-M270 HydrophobicContact CB-CE 3.44Å; L230-M270 VanDerWaalsContact CB-CE 3.44Å; L230-L273 HydrophobicContact CD2-CB 4.23Å; L230-R274 HydrophobicContact CD1-CB 3.85Å; L230-R274 HydrophobicContact CD1-CG 3.87Å; L230-R274 HydrophobicContact CD2-CB 3.93Å; L230-L277 HydrophobicContact CD2-CD1 3.79Å |
| 231 | Q | 80.3 | Confident | 68.9 | Low | 111 Ų | 111 | 72.5 Ų | 72.5 | 52% | 0.519 | 35% | 0.351 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60 | 132.5 | 172.7 | -173.3 | 173.3 | 2.5 | 0 | 0 | 109.5 | ||
| 232 | I | 70.4 | Confident | 68.1 | Low | 20 Ų | 20 | 72.2 Ų | 72.2 | 10% | 0.103 | 35% | 0.346 | C | S | . | . | trans | -83 | 124.3 | 172 | -62.1 | 169.8 | 0 | 0 | 0 | 106.3 | L89 L230 N234 Q245 V247 | L89-I232 HydrophobicContact CD1-CD1 4.38Å; L230-I232 PolarHBondContact O-N 3.4Å; I232-N234 PolarHBondContact O-N 2.85Å; I232-N234 VanDerWaalsContact O-N 3.12Å; I232-Q245 PolarHBondContact N-O 2.98Å; I232-V247 HydrophobicContact CD1-CG2 3.93Å; I232-V247 HydrophobicContact CG1-CG2 4.1Å | ||
| 233 | P | 60.2 | Low | 67.4 | Low | 78 Ų | 78 | 70.6 Ų | 70.6 | 51% | 0.506 | 34% | 0.339 | S | S | . | . | trans | -63.9 | 115.9 | 170.1 | 27.2 | -32.1 | 0 | 0 | 0 | 107.9 | T278 | P233-T278 HydrophobicContact CG-CG2 4.16Š| ||
| 234 | N | 56.9 | Low | 66.7 | Low | 53 Ų | 53 | 71.5 Ų | 71.5 | 28% | 0.283 | 34% | 0.341 | S | S | . | . | trans | -119.5 | 121.3 | 166.5 | -175.2 | -3.2 | 0 | 0 | 0 | 106.9 | I232 E236 Y237 | I232-N234 PolarHBondContact O-N 2.85Å; I232-N234 VanDerWaalsContact O-N 3.12Å; N234-E236 PolarHBondContact O-N 3.38Å; N234-E236 PolarHBondContact OD1-N 2.83Å; N234-E236 VanDerWaalsContact OD1-N 3.1Å; N234-Y237 WeakPolarHBondContact O-CB 3.23Å; N234-Y237 PolarHBondContact O-N 3.35Å | ||
| 235 | E | 44.7 | Very low | 66 | Low | 180 Ų | 180 | 73.6 Ų | 73.6 | 84% | 0.841 | 35% | 0.35 | S | S | * | . | G | 310 helix | trans | -60.6 | -27.6 | 178.8 | -66.5 | -170.2 | 159 | 0 | 0 | 111.8 | Y237 | E235-Y237 VanDerWaalsContact C-N 3.26Å; E235-Y237 PolarHBondContact O-N 3.26Å |
| 236 | E | 44.8 | Very low | 65.6 | Low | 128 Ų | 128 | 74.1 Ų | 74.1 | 60% | 0.598 | 35% | 0.353 | S | S | * | . | G | 310 helix | trans | -73 | -18.5 | 177 | -64.4 | -179.7 | 154.2 | 0 | 0 | 113 | N234 L238 R239 S240 | N234-E236 PolarHBondContact O-N 3.38Å; N234-E236 PolarHBondContact OD1-N 2.83Å; N234-E236 VanDerWaalsContact OD1-N 3.1Å; E236-L238 PolarHBondContact O-N 3Å; E236-L238 VanDerWaalsContact O-N 3.11Å; E236-R239 PolarHBondContact O-N 3.36Å; E236-S240 PolarHBondContact O-N 3.35Å; E236-S240 PolarHBondContact O-OG 2.96Å |
| 237 | Y | 46.6 | Very low | 65.3 | Low | 85 Ų | 85 | 74.2 Ų | 74.2 | 33% | 0.333 | 35% | 0.354 | S | S | . | . | G | 310 helix | trans | -62.9 | -23.8 | -175.3 | -169.3 | -97.5 | 0 | 0 | 0 | 113.6 | N234 E235 R239 L244 | N234-Y237 WeakPolarHBondContact O-CB 3.23Å; N234-Y237 PolarHBondContact O-N 3.35Å; E235-Y237 VanDerWaalsContact C-N 3.26Å; E235-Y237 PolarHBondContact O-N 3.26Å; Y237-R239 PolarHBondContact O-N 2.73Å; Y237-L244 HydrophobicContact CE2-CD2 4.38Å; Y237-L244 WeakPolarHBondContact OH-CD2 3.5Å; Y237-L244 WeakPolarHBondContact OH-CG 3.42Å |
| 238 | L | 39.6 | Very low | 65.1 | Low | 162 Ų | 162 | 74.2 Ų | 74.2 | 85% | 0.848 | 35% | 0.354 | S | S | * | . | G | 310 helix | trans | -72 | -11.2 | 176.9 | -75 | 167.2 | 0 | 0 | 0 | 113 | E236 | E236-L238 PolarHBondContact O-N 3Å; E236-L238 VanDerWaalsContact O-N 3.11Å |
| 239 | R | 38.3 | Very low | 65.2 | Low | 238 Ų | 238 | 74.2 Ų | 74.2 | 90% | 0.898 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.4 | -16.3 | -168.8 | -68.9 | -172.7 | 176.8 | -179.5 | 1.1 | 115.9 | E236 Y237 | E236-R239 PolarHBondContact O-N 3.36Å; Y237-R239 PolarHBondContact O-N 2.73Å |
| 240 | S | 38.8 | Very low | 65.4 | Low | 40 Ų | 40 | 72.9 Ų | 72.9 | 28% | 0.28 | 35% | 0.349 | S | S | . | . | trans | -111.1 | 148.2 | -170.8 | 58.2 | 0 | 0 | 0 | 0 | 113.1 | E236 E242 | E236-S240 PolarHBondContact O-N 3.35Å; E236-S240 PolarHBondContact O-OG 2.96Å; S240-E242 VanDerWaalsContact CB-OE2 3.23Å; S240-E242 WeakPolarHBondContact CB-OE2 3.16Å; S240-E242 PolarHBondContact O-N 2.85Å; S240-E242 VanDerWaalsContact OG-CB 3.29Å; S240-E242 WeakPolarHBondContact OG-CB 3.35Å; S240-E242 VanDerWaalsContact OG-CD 3.26Å; S240-E242 WeakPolarHBondContact OG-CG 3.47Å; S240-E242 PolarHBondContact OG-OE2 2.89Å | ||
| 241 | E | 49.3 | Very low | 65.8 | Low | 197 Ų | 197 | 72.3 Ų | 72.3 | 92% | 0.921 | 35% | 0.345 | S | S | * | . | S | Bend | trans | -64.8 | 11.7 | 164.3 | -62.3 | -177 | 157.3 | 0 | 0 | 112 | ||
| 242 | E | 50.6 | Low | 66.4 | Low | 108 Ų | 108 | 68.1 Ų | 68.1 | 51% | 0.505 | 33% | 0.326 | S | S | . | . | P | Polyproline II helix | trans | -79 | 142.1 | -173 | -66.9 | 163.7 | 169.2 | 0 | 0 | 110.4 | S240 | S240-E242 VanDerWaalsContact CB-OE2 3.23Å; S240-E242 WeakPolarHBondContact CB-OE2 3.16Å; S240-E242 PolarHBondContact O-N 2.85Å; S240-E242 VanDerWaalsContact OG-CB 3.29Å; S240-E242 WeakPolarHBondContact OG-CB 3.35Å; S240-E242 VanDerWaalsContact OG-CD 3.26Å; S240-E242 WeakPolarHBondContact OG-CG 3.47Å; S240-E242 PolarHBondContact OG-OE2 2.89Å |
| 243 | G | 60.5 | Low | 67.5 | Low | 7 Ų | 7 | 67.6 Ų | 67.6 | 7% | 0.072 | 32% | 0.322 | C | S | . | . | P | Polyproline II helix | trans | -56.5 | 158.7 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | L115 Q245 | L115-G243 CarbonylContact O-C 3.57Å; L115-G243 VanDerWaalsContact O-C 3.27Å; L115-G243 WeakPolarHBondContact O-CA 3.33Å; G243-Q245 PolarHBondContact O-N 2.89Å |
| 244 | L | 71.9 | Confident | 68.8 | Low | 45 Ų | 45 | 65.1 Ų | 65.1 | 24% | 0.236 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.4 | 118.6 | 170.5 | -79.7 | 156.2 | 0 | 0 | 0 | 109.9 | S114 L115 Y139 Y237 F246 | S114-L244 CarbonylContact C-O 3.55Å; S114-L244 WeakPolarHBondContact CA-O 3.21Å; L115-L244 HydrophobicContact CB-CB 4.16Å; L115-L244 PolarHBondContact N-O 2.86Å; L115-L244 PolarHBondContact O-N 3.18Å; Y139-L244 HydrophobicContact CD1-CD1 4.34Å; Y139-L244 HydrophobicContact CE1-CD1 3.61Å; Y237-L244 HydrophobicContact CE2-CD2 4.38Å; Y237-L244 WeakPolarHBondContact OH-CD2 3.5Å; Y237-L244 WeakPolarHBondContact OH-CG 3.42Å; L244-F246 HydrophobicContact CB-CD1 4.46Å; L244-F246 HydrophobicContact CB-CE1 4.44Å |
| 245 | Q | 78 | Confident | 70.2 | Confident | 52 Ų | 52 | 67.5 Ų | 67.5 | 24% | 0.243 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 130.8 | 175 | -64.1 | -176.6 | 3.5 | 0 | 0 | 111.1 | I113 I232 G243 | I113-Q245 WeakPolarHBondContact O-CA 3.39Å; I232-Q245 PolarHBondContact N-O 2.98Å; G243-Q245 PolarHBondContact O-N 2.89Å |
| 246 | F | 85 | Confident | 72.1 | Confident | 12 Ų | 12 | 63.3 Ų | 63.3 | 5% | 0.053 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.1 | 160.9 | 178.2 | 53.2 | -88.2 | 0 | 0 | 0 | 112 | I113 L115 R229 L230 L244 M248 | I113-F246 HydrophobicContact CB-CD2 4.25Å; I113-F246 HydrophobicContact CB-CE2 3.77Å; I113-F246 HydrophobicContact CB-CZ 3.94Å; I113-F246 HydrophobicContact CD1-CE2 4.09Å; I113-F246 HydrophobicContact CG1-CE2 4.36Å; I113-F246 HydrophobicContact CG2-CE1 4.29Å; I113-F246 HydrophobicContact CG2-CE2 3.99Å; I113-F246 HydrophobicContact CG2-CZ 3.66Å; I113-F246 PolarHBondContact N-O 2.92Å; I113-F246 PolarHBondContact O-N 2.79Å; L115-F246 HydrophobicContact CB-CE1 4.39Å; L115-F246 HydrophobicContact CD1-CE1 3.46Å; L115-F246 VanDerWaalsContact CD1-CE1 3.46Å; L115-F246 HydrophobicContact CD1-CZ 3.6Å; L115-F246 HydrophobicContact CG-CE1 3.6Å; L115-F246 HydrophobicContact CG-CZ 3.76Å; R229-F246 HydrophobicContact CB-CD2 4.02Å; R229-F246 HydrophobicContact CB-CG 4.48Å; R229-F246 VanDerWaalsContact CD-CE2 3.48Å; R229-F246 HydrophobicContact CG-CD2 3.88Å; R229-F246 HydrophobicContact CG-CE2 3.95Å; L230-F246 CarbonylContact O-C 3.54Å; L230-F246 VanDerWaalsContact O-CA 3.27Å; L230-F246 WeakPolarHBondContact O-CA 3.34Å; L230-F246 WeakPolarHBondContact O-CB 3.46Å; L244-F246 HydrophobicContact CB-CD1 4.46Å; L244-F246 HydrophobicContact CB-CE1 4.44Å; F246-M248 HydrophobicContact CD2-CB 4.12Å; F246-M248 HydrophobicContact CE2-CB 4.05Å |
| 247 | V | 89 | Confident | 74 | Confident | 2 Ų | 2 | 62.3 Ų | 62.3 | 1% | 0.012 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.1 | 131.6 | 163.1 | 178.7 | 0 | 0 | 0 | 0 | 108.7 | L110 F111 I147 R229 L230 I232 L277 | L110-V247 HydrophobicContact CD1-CG1 3.3Å; L110-V247 HydrophobicContact CD2-CG1 4.24Å; L110-V247 HydrophobicContact CG-CG1 3.67Å; F111-V247 CarbonylContact O-C 3.45Å; F111-V247 VanDerWaalsContact O-CA 3.24Å; F111-V247 WeakPolarHBondContact O-CA 3.27Å; I147-V247 HydrophobicContact CD1-CG1 4.16Å; I147-V247 HydrophobicContact CD1-CG2 4.28Å; R229-V247 CarbonylContact C-O 3.5Å; R229-V247 WeakPolarHBondContact CA-O 3.04Å; L230-V247 PolarHBondContact N-O 3.18Å; L230-V247 PolarHBondContact O-N 3.39Å; I232-V247 HydrophobicContact CD1-CG2 3.93Å; I232-V247 HydrophobicContact CG1-CG2 4.1Å; V247-L277 HydrophobicContact CG2-CD1 4.03Å |
| 248 | M | 92.3 | Very high | 76 | Confident | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 123 | 174.2 | -175.3 | 167.2 | 72.2 | 0 | 0 | 110.4 | L110 F111 I113 C173 L176 I180 T228 R229 F246 I250 | L110-M248 WeakPolarHBondContact CA-O 2.85Å; F111-M248 HydrophobicContact CD2-CE 4.33Å; F111-M248 PolarHBondContact N-O 3.23Å; F111-M248 PolarHBondContact O-N 2.85Å; I113-M248 HydrophobicContact CD1-CB 3.86Å; I113-M248 HydrophobicContact CD1-CE 3.32Å; I113-M248 HydrophobicContact CD1-SD 4.14Å; C173-M248 HydrophobicContact CB-CE 3.88Å; L176-M248 HydrophobicContact CD2-CE 4.31Å; L176-M248 HydrophobicContact CD2-SD 4.27Å; I180-M248 HydrophobicContact CD1-SD 4.43Å; T228-M248 CarbonylContact O-C 3.58Å; T228-M248 WeakPolarHBondContact O-CA 3.48Å; R229-M248 HydrophobicContact CG-CB 4.42Å; R229-M248 HydrophobicContact CG-CG 4.18Å; R229-M248 HydrophobicContact CG-SD 4.4Å; F246-M248 HydrophobicContact CD2-CB 4.12Å; F246-M248 HydrophobicContact CE2-CB 4.05Å; M248-I250 HydrophobicContact CE-CD1 3.85Å; M248-I250 HydrophobicContact CE-CG1 4.25Å; M248-I250 HydrophobicContact CG-CG1 4.25Å |
| 249 | L | 94.6 | Very high | 78.4 | Confident | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 125.9 | 172.4 | -172.4 | 160.1 | 0 | 0 | 0 | 109 | L97 V108 F109 L110 A227 T228 I266 V269 M270 L273 | L97-L249 HydrophobicContact CD2-CD1 4.07Å; V108-L249 HydrophobicContact CG2-CD1 4.36Å; V108-L249 HydrophobicContact CG2-CD2 3.74Å; V108-L249 HydrophobicContact CG2-CG 3.87Å; F109-L249 CarbonylContact O-C 3.6Å; F109-L249 WeakPolarHBondContact O-CA 3.41Å; L110-L249 HydrophobicContact CD1-CB 3.73Å; L110-L249 HydrophobicContact CD1-CD1 4.22Å; L110-L249 HydrophobicContact CD1-CG 4.15Å; A227-L249 CarbonylContact C-O 3.56Å; A227-L249 VanDerWaalsContact CA-O 3.27Å; A227-L249 WeakPolarHBondContact CA-O 3.46Å; T228-L249 HydrophobicContact CG2-CB 3.95Å; T228-L249 HydrophobicContact CG2-CD2 4.39Å; T228-L249 PolarHBondContact N-O 3.49Å; T228-L249 PolarHBondContact O-N 3.45Å; L249-I266 HydrophobicContact CD2-CG1 4.31Å; L249-I266 HydrophobicContact CD2-CG2 3.74Å; L249-V269 HydrophobicContact CD1-CB 4.42Å; L249-V269 HydrophobicContact CD1-CG1 3.71Å; L249-M270 HydrophobicContact CB-CE 4.5Å; L249-M270 HydrophobicContact CB-SD 3.51Å; L249-M270 VanDerWaalsContact CB-SD 3.51Å; L249-M270 HydrophobicContact CD1-CG 4.38Å; L249-M270 HydrophobicContact CD1-SD 3.77Å; L249-M270 HydrophobicContact CG-SD 4.27Å; L249-L273 HydrophobicContact CD1-CD1 4.41Å |
| 250 | I | 95.2 | Very high | 80.9 | Confident | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 25% | 0.248 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -115.8 | 113.6 | 171.6 | -52.3 | -179.8 | 0 | 0 | 0 | 107.9 | V108 F109 F111 P168 L176 W194 F225 T226 A227 M248 F252 | V108-I250 CarbonylContact C-O 3.56Å; V108-I250 VanDerWaalsContact CA-O 3.28Å; V108-I250 WeakPolarHBondContact CA-O 3.27Å; F109-I250 PolarHBondContact N-O 2.93Å; F109-I250 PolarHBondContact O-N 2.97Å; F111-I250 HydrophobicContact CD2-CD1 4.32Å; F111-I250 HydrophobicContact CD2-CG1 4.5Å; F111-I250 HydrophobicContact CE2-CD1 3.85Å; F111-I250 HydrophobicContact CE2-CG1 4.27Å; P168-I250 HydrophobicContact CB-CD1 4.2Å; P168-I250 HydrophobicContact CG-CD1 4.17Å; L176-I250 HydrophobicContact CD2-CD1 3.56Å; L176-I250 HydrophobicContact CD2-CG1 4.08Å; W194-I250 HydrophobicContact CH2-CG2 3.9Å; W194-I250 HydrophobicContact CZ2-CD1 4.23Å; W194-I250 HydrophobicContact CZ2-CG2 4.22Å; F225-I250 HydrophobicContact CD2-CG2 4.15Å; T226-I250 WeakPolarHBondContact O-CA 3.38Å; A227-I250 HydrophobicContact CB-CG1 4.26Å; M248-I250 HydrophobicContact CE-CD1 3.85Å; M248-I250 HydrophobicContact CE-CG1 4.25Å; M248-I250 HydrophobicContact CG-CG1 4.25Å; I250-F252 HydrophobicContact CG2-CD2 4.48Å; I250-F252 HydrophobicContact CG2-CE2 3.96Å; I250-F252 HydrophobicContact CG2-CZ 4.5Å |
| 251 | G | 94.3 | Very high | 83.4 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 123.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | F225 T226 | F225-G251 CarbonylContact C-O 3.56Å; F225-G251 VanDerWaalsContact CA-O 3.23Å; F225-G251 WeakPolarHBondContact CA-O 3.36Å; T226-G251 PolarHBondContact N-O 2.88Å; T226-G251 PolarHBondContact O-N 3.49Å |
| 252 | F | 93.1 | Very high | 85.5 | Confident | 24 Ų | 24 | 45 Ų | 45 | 11% | 0.105 | 21% | 0.211 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 118.4 | 175.4 | -69 | -95.8 | 0 | 0 | 0 | 110.2 | I105 D106 K107 F109 W194 S223 F225 I250 | I105-F252 WeakPolarHBondContact CA-O 3.39Å; I105-F252 VanDerWaalsContact CG2-O 3.31Å; I105-F252 WeakPolarHBondContact CG2-O 3.32Å; D106-F252 PolarHBondContact N-O 3.25Å; K107-F252 HydrophobicContact CB-CB 4.19Å; K107-F252 HydrophobicContact CB-CD2 4.01Å; K107-F252 HydrophobicContact CB-CG 4.4Å; K107-F252 PolarHBondContact O-N 2.87Å; F109-F252 HydrophobicContact CD2-CD2 4.45Å; F109-F252 HydrophobicContact CD2-CE2 4.1Å; F109-F252 HydrophobicContact CE2-CD2 4.2Å; F109-F252 AromaticContact CE2-CE2 3.83Å; F109-F252 HydrophobicContact CE2-CE2 3.83Å; W194-F252 HydrophobicContact CD2-CZ 4.31Å; W194-F252 AromaticContact CE3-CE1 3.91Å; W194-F252 HydrophobicContact CE3-CE1 3.91Å; W194-F252 AromaticContact CE3-CZ 3.7Å; W194-F252 HydrophobicContact CE3-CZ 3.7Å; W194-F252 AromaticContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE2 4.1Å; W194-F252 AromaticContact CH2-CZ 3.32Å; W194-F252 HydrophobicContact CH2-CZ 3.32Å; W194-F252 AromaticContact CZ2-CZ 3.98Å; W194-F252 HydrophobicContact CZ2-CZ 3.98Å; W194-F252 AromaticContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE2 4.33Å; W194-F252 AromaticContact CZ3-CZ 3.18Å; W194-F252 HydrophobicContact CZ3-CZ 3.18Å; S223-F252 WeakPolarHBondContact OG-CD1 3.44Å; F225-F252 HydrophobicContact CB-CD1 3.9Å; F225-F252 HydrophobicContact CB-CE1 4.13Å; F225-F252 HydrophobicContact CB-CG 4.24Å; I250-F252 HydrophobicContact CG2-CD2 4.48Å; I250-F252 HydrophobicContact CG2-CE2 3.96Å; I250-F252 HydrophobicContact CG2-CZ 4.5Å |
| 253 | H | 92.8 | Very high | 87.5 | Confident | 8 Ų | 8 | 41.2 Ų | 41.2 | 4% | 0.037 | 19% | 0.194 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 141.8 | -172.6 | -66.1 | -161.1 | 0 | 0 | 0 | 110.6 | T224 T226 C262 | T224-H253 PolarHBondContact O-N 3.3Å; T226-H253 PolarHBondContact OG1-NE2 3.13Å; H253-C262 HydrophobicContact CB-CB 3.92Å; H253-C262 VanDerWaalsContact CG-CB 3.44Å; H253-C262 VanDerWaalsContact ND1-CB 3.34Å; H253-C262 WeakPolarHBondContact ND1-CB 3.19Å |
| 254 | R | 89.1 | Confident | 89 | Confident | 26 Ų | 26 | 43.8 Ų | 43.8 | 10% | 0.098 | 22% | 0.215 | C | C | . | . | P | Polyproline II helix | trans | -62.5 | 134.7 | 164.3 | -84.3 | -179.7 | 70.9 | 145.6 | 3.7 | 110.6 | Y104 D106 D256 R257 | Y104-R254 VanDerWaalsContact O-CB 3.28Å; Y104-R254 WeakPolarHBondContact O-CB 3.5Å; Y104-R254 WeakPolarHBondContact O-CG 3.44Å; Y104-R254 PolarHBondContact O-N 2.87Å; D106-R254 VanDerWaalsContact OD1-CG 3.28Å; D106-R254 WeakPolarHBondContact OD1-CG 3.39Å; D106-R254 WeakPolarHBondContact OD2-CA 3.4Å; R254-D256 VanDerWaalsContact C-N 3.33Å; R254-D256 WeakPolarHBondContact CB-OD1 3.42Å; R254-D256 IonicContact CZ-OD1 2.77Å; R254-D256 IonicContact CZ-OD2 3.66Å; R254-D256 IonicContact NE-OD1 3.35Å; R254-D256 PolarHBondContact NE-OD1 2.81Å; R254-D256 IonicContact NE-OD2 2.73Å; R254-D256 IonicContact NH2-OD1 3.53Å; R254-D256 PolarHBondContact NH2-OD1 2.78Å; R254-D256 IonicContact NH2-OD2 3.59Å; R254-D256 PolarHBondContact NH2-OD2 2.77Å; R254-R257 HydrophobicContact CB-CB 4.09Å; R254-R257 HydrophobicContact CB-CG 3.79Å; R254-R257 PolarHBondContact O-N 3Å |
| 255 | Q | 85.2 | Confident | 90 | Very high | 104 Ų | 104 | 42.5 Ų | 42.5 | 49% | 0.486 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -25.3 | -179.6 | -63.8 | -174.1 | -15.4 | 0 | 0 | 113.2 | N221 R257 | N221-Q255 PolarHBondContact O-NE2 3.07Å; N221-Q255 PolarHBondContact OD1-OE1 3.01Å; Q255-R257 PolarHBondContact O-N 3.2Å |
| 256 | D | 84.5 | Confident | 90.8 | Very high | 92 Ų | 92 | 40 Ų | 40 | 49% | 0.492 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 10.2 | 177.8 | 68.5 | -40 | 0 | 0 | 0 | 113.4 | R254 | R254-D256 VanDerWaalsContact C-N 3.33Å; R254-D256 WeakPolarHBondContact CB-OD1 3.42Å; R254-D256 IonicContact CZ-OD1 2.77Å; R254-D256 IonicContact CZ-OD2 3.66Å; R254-D256 IonicContact NE-OD1 3.35Å; R254-D256 PolarHBondContact NE-OD1 2.81Å; R254-D256 IonicContact NE-OD2 2.73Å; R254-D256 IonicContact NH2-OD1 3.53Å; R254-D256 PolarHBondContact NH2-OD1 2.78Å; R254-D256 IonicContact NH2-OD2 3.59Å; R254-D256 PolarHBondContact NH2-OD2 2.77Å |
| 257 | R | 86.2 | Confident | 91.1 | Very high | 107 Ų | 107 | 40.7 Ų | 40.7 | 40% | 0.404 | 20% | 0.203 | S | C | . | . | S | Bend | trans | -124.5 | 149.1 | -178.6 | -64.4 | -60.1 | -166.6 | -163.5 | -2.4 | 111.1 | N103 R254 Q255 Q259 C262 | N103-R257 PolarHBondContact O-NE 2.89Å; R254-R257 HydrophobicContact CB-CB 4.09Å; R254-R257 HydrophobicContact CB-CG 3.79Å; R254-R257 PolarHBondContact O-N 3Å; Q255-R257 PolarHBondContact O-N 3.2Å; R257-Q259 PolarHBondContact O-N 3.43Å; R257-C262 VanDerWaalsContact CB-SG 3.55Å |
| 258 | E | 88.7 | Confident | 91.3 | Very high | 112 Ų | 112 | 42.1 Ų | 42.1 | 52% | 0.523 | 22% | 0.218 | S | C | . | . | trans | -63 | 132.9 | 172.2 | -69.6 | 160.8 | -142.2 | 0 | 0 | 110.5 | D260 K261 C262 | E258-D260 PolarHBondContact O-N 3.44Å; E258-K261 HydrophobicContact CB-CB 4.4Å; E258-K261 HydrophobicContact CB-CD 4.14Å; E258-K261 HydrophobicContact CB-CG 4.18Å; E258-K261 WeakPolarHBondContact O-CB 3.4Å; E258-K261 PolarHBondContact O-N 2.94Å; E258-K261 IonicContact OE1-NZ 3.67Å; E258-K261 PolarHBondContact OE1-NZ 2.84Å; E258-K261 WeakPolarHBondContact OE2-CD 3.34Å; E258-K261 WeakPolarHBondContact OE2-CE 3.19Å; E258-K261 IonicContact OE2-NZ 2.85Å; E258-K261 PolarHBondContact OE2-NZ 2.91Å; E258-C262 PolarHBondContact O-N 3.29Å; E258-C262 VanDerWaalsContact O-N 3.13Å; E258-C262 PolarHBondContact O-SG 2.82Å | ||
| 259 | Q | 89.6 | Confident | 91.3 | Very high | 77 Ų | 77 | 42.2 Ų | 42.2 | 36% | 0.36 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -55.7 | -38 | -178.6 | -66.6 | 180 | -12.1 | 0 | 0 | 112.3 | T224 R257 K261 C262 N263 | T224-Q259 PolarHBondContact OG1-NE2 2.8Å; R257-Q259 PolarHBondContact O-N 3.43Å; Q259-K261 VanDerWaalsContact C-N 3.33Å; Q259-K261 PolarHBondContact O-N 2.74Å; Q259-C262 PolarHBondContact O-N 3.1Å; Q259-N263 WeakPolarHBondContact O-CB 3.28Å; Q259-N263 PolarHBondContact O-N 2.85Å |
| 260 | D | 89.4 | Confident | 91.1 | Very high | 70 Ų | 70 | 42.5 Ų | 42.5 | 37% | 0.374 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -63.2 | -38.4 | 178 | -70.2 | -23.4 | 0 | 0 | 0 | 112.2 | E258 N263 A264 | E258-D260 PolarHBondContact O-N 3.44Å; D260-N263 PolarHBondContact O-N 2.88Å; D260-A264 VanDerWaalsContact O-CB 3.3Å; D260-A264 WeakPolarHBondContact O-CB 3.4Å; D260-A264 PolarHBondContact O-N 3.42Å |
| 261 | K | 92.9 | Very high | 90.7 | Very high | 98 Ų | 98 | 45.6 Ų | 45.6 | 43% | 0.426 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -69.5 | -40.9 | 176.9 | -69.3 | 177.3 | 177.7 | 152.8 | 0 | 111.3 | Y104 E258 Q259 A264 A265 | Y104-K261 HydrophobicContact CD1-CB 4.12Å; Y104-K261 HydrophobicContact CE1-CB 3.96Å; E258-K261 HydrophobicContact CB-CB 4.4Å; E258-K261 HydrophobicContact CB-CD 4.14Å; E258-K261 HydrophobicContact CB-CG 4.18Å; E258-K261 WeakPolarHBondContact O-CB 3.4Å; E258-K261 PolarHBondContact O-N 2.94Å; E258-K261 IonicContact OE1-NZ 3.67Å; E258-K261 PolarHBondContact OE1-NZ 2.84Å; E258-K261 WeakPolarHBondContact OE2-CD 3.34Å; E258-K261 WeakPolarHBondContact OE2-CE 3.19Å; E258-K261 IonicContact OE2-NZ 2.85Å; E258-K261 PolarHBondContact OE2-NZ 2.91Å; Q259-K261 VanDerWaalsContact C-N 3.33Å; Q259-K261 PolarHBondContact O-N 2.74Å; K261-A264 PolarHBondContact O-N 3.24Å; K261-A265 PolarHBondContact O-N 3.37Å |
| 262 | C | 92.9 | Very high | 90.5 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62 | -45.6 | 174.5 | -62.7 | 0 | 0 | 0 | 0 | 111.7 | Y104 I105 H253 R257 E258 Q259 A265 I266 | Y104-C262 PolarHBondContact O-SG 3.38Å; I105-C262 HydrophobicContact CD1-CB 4.2Å; H253-C262 HydrophobicContact CB-CB 3.92Å; H253-C262 VanDerWaalsContact CG-CB 3.44Å; H253-C262 VanDerWaalsContact ND1-CB 3.34Å; H253-C262 WeakPolarHBondContact ND1-CB 3.19Å; R257-C262 VanDerWaalsContact CB-SG 3.55Å; E258-C262 PolarHBondContact O-N 3.29Å; E258-C262 VanDerWaalsContact O-N 3.13Å; E258-C262 PolarHBondContact O-SG 2.82Å; Q259-C262 PolarHBondContact O-N 3.1Å; C262-A265 PolarHBondContact O-N 2.91Å; C262-I266 PolarHBondContact O-N 2.93Å; C262-I266 VanDerWaalsContact O-N 3.11Å |
| 263 | N | 92.2 | Very high | 90.1 | Very high | 29 Ų | 29 | 47.6 Ų | 47.6 | 16% | 0.155 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65 | -43.1 | 178.1 | -169.7 | 61 | 0 | 0 | 0 | 111.9 | T226 Q259 D260 A265 I266 M267 | T226-N263 WeakPolarHBondContact CG2-OD1 3.47Å; T226-N263 PolarHBondContact OG1-OD1 2.92Å; Q259-N263 WeakPolarHBondContact O-CB 3.28Å; Q259-N263 PolarHBondContact O-N 2.85Å; D260-N263 PolarHBondContact O-N 2.88Å; N263-A265 VanDerWaalsContact C-N 3.32Å; N263-A265 PolarHBondContact O-N 2.89Å; N263-I266 PolarHBondContact O-N 3.29Å; N263-M267 WeakPolarHBondContact O-CG 3.43Å; N263-M267 PolarHBondContact O-N 3.14Å |
| 264 | A | 92.1 | Very high | 89.7 | Confident | 62 Ų | 62 | 51.6 Ų | 51.6 | 51% | 0.512 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60 | -40.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | D260 K261 M267 G268 | D260-A264 VanDerWaalsContact O-CB 3.3Å; D260-A264 WeakPolarHBondContact O-CB 3.4Å; D260-A264 PolarHBondContact O-N 3.42Å; K261-A264 PolarHBondContact O-N 3.24Å; A264-M267 PolarHBondContact O-N 3.47Å; A264-G268 PolarHBondContact O-N 3.41Å |
| 265 | A | 93.6 | Very high | 89.3 | Confident | 17 Ų | 17 | 56 Ų | 56 | 14% | 0.14 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | L101 Y104 K261 C262 N263 G268 V269 | L101-A265 HydrophobicContact CD2-CB 3.97Å; Y104-A265 HydrophobicContact CD1-CB 4.45Å; Y104-A265 HydrophobicContact CD2-CB 3.6Å; Y104-A265 HydrophobicContact CE2-CB 4.24Å; Y104-A265 HydrophobicContact CG-CB 3.72Å; K261-A265 PolarHBondContact O-N 3.37Å; C262-A265 PolarHBondContact O-N 2.91Å; N263-A265 VanDerWaalsContact C-N 3.32Å; N263-A265 PolarHBondContact O-N 2.89Å; A265-G268 PolarHBondContact O-N 3.42Å; A265-V269 WeakPolarHBondContact O-CG2 3.41Å; A265-V269 PolarHBondContact O-N 3.3Å |
| 266 | I | 93.8 | Very high | 89.1 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.1 | -47.3 | 175.8 | -72.8 | 172 | 0 | 0 | 0 | 111.2 | L101 I105 T226 T228 L249 C262 N263 G268 V269 M270 | L101-I266 HydrophobicContact CD2-CG1 4.45Å; I105-I266 HydrophobicContact CD1-CD1 3.6Å; I105-I266 HydrophobicContact CD1-CG1 3.8Å; I105-I266 HydrophobicContact CG1-CD1 4.43Å; I105-I266 HydrophobicContact CG1-CG1 4.17Å; T226-I266 HydrophobicContact CG2-CD1 4.45Å; T226-I266 HydrophobicContact CG2-CG2 4.17Å; T228-I266 HydrophobicContact CG2-CG2 3.74Å; L249-I266 HydrophobicContact CD2-CG1 4.31Å; L249-I266 HydrophobicContact CD2-CG2 3.74Å; C262-I266 PolarHBondContact O-N 2.93Å; C262-I266 VanDerWaalsContact O-N 3.11Å; N263-I266 PolarHBondContact O-N 3.29Å; I266-G268 PolarHBondContact O-N 3.26Å; I266-V269 PolarHBondContact O-N 3.23Å; I266-M270 WeakPolarHBondContact O-CG 3.4Å; I266-M270 PolarHBondContact O-N 3.11Å |
| 267 | M | 92.6 | Very high | 88.6 | Confident | 26 Ų | 26 | 53.7 Ų | 53.7 | 13% | 0.128 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.9 | -42.2 | 178.8 | -66.9 | -58.9 | -143.6 | 0 | 0 | 111.7 | T208 N263 A264 V269 M270 D271 | T208-M267 HydrophobicContact CG2-CE 3.81Å; N263-M267 WeakPolarHBondContact O-CG 3.43Å; N263-M267 PolarHBondContact O-N 3.14Å; A264-M267 PolarHBondContact O-N 3.47Å; M267-V269 VanDerWaalsContact C-N 3.31Å; M267-V269 PolarHBondContact O-N 3.17Å; M267-M270 WeakPolarHBondContact O-CB 3.46Å; M267-M270 PolarHBondContact O-N 3.24Å; M267-M270 VanDerWaalsContact O-N 3.12Å; M267-D271 PolarHBondContact O-N 2.85Å |
| 268 | G | 92.2 | Very high | 87.6 | Confident | 32 Ų | 32 | 50.8 Ų | 50.8 | 33% | 0.33 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.3 | -40.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A264 A265 I266 D271 L272 | A264-G268 PolarHBondContact O-N 3.41Å; A265-G268 PolarHBondContact O-N 3.42Å; I266-G268 PolarHBondContact O-N 3.26Å; G268-D271 PolarHBondContact O-N 2.82Å; G268-L272 WeakPolarHBondContact O-CG 3.21Å; G268-L272 PolarHBondContact O-N 3.25Å |
| 269 | V | 91.4 | Very high | 86 | Confident | 3 Ų | 3 | 49.6 Ų | 49.6 | 2% | 0.018 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.9 | -40.7 | 174.1 | 170 | 0 | 0 | 0 | 0 | 112.2 | F96 L97 N100 L101 L249 A265 I266 M267 D271 L272 L273 | F96-V269 HydrophobicContact CE1-CG1 3.75Å; F96-V269 HydrophobicContact CZ-CG1 4.34Å; L97-V269 HydrophobicContact CD2-CG1 3.99Å; N100-V269 HydrophobicContact CB-CG2 3.36Å; L101-V269 HydrophobicContact CD1-CG2 4.28Å; L101-V269 HydrophobicContact CD2-CB 4.37Å; L101-V269 HydrophobicContact CD2-CG2 3.56Å; L101-V269 HydrophobicContact CG-CG2 3.78Å; L249-V269 HydrophobicContact CD1-CB 4.42Å; L249-V269 HydrophobicContact CD1-CG1 3.71Å; A265-V269 WeakPolarHBondContact O-CG2 3.41Å; A265-V269 PolarHBondContact O-N 3.3Å; I266-V269 PolarHBondContact O-N 3.23Å; M267-V269 VanDerWaalsContact C-N 3.31Å; M267-V269 PolarHBondContact O-N 3.17Å; V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 2.75Å; V269-L272 PolarHBondContact O-N 2.94Å; V269-L273 HydrophobicContact CG1-CD1 4.16Å; V269-L273 HydrophobicContact CG1-CG 4.44Å; V269-L273 WeakPolarHBondContact O-CG 3.18Å; V269-L273 PolarHBondContact O-N 3.48Å |
| 270 | M | 90.5 | Very high | 83.7 | Confident | 5 Ų | 5 | 54.2 Ų | 54.2 | 3% | 0.025 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -64.7 | -37.1 | 176.2 | -71.1 | -56.9 | -76.5 | 0 | 0 | 112.8 | T228 L230 L249 I266 M267 L273 R274 | T228-M270 HydrophobicContact CG2-CE 3.92Å; T228-M270 HydrophobicContact CG2-CG 3.29Å; T228-M270 HydrophobicContact CG2-SD 3.73Å; L230-M270 HydrophobicContact CB-CE 3.44Å; L230-M270 VanDerWaalsContact CB-CE 3.44Å; L249-M270 HydrophobicContact CB-CE 4.5Å; L249-M270 HydrophobicContact CB-SD 3.51Å; L249-M270 VanDerWaalsContact CB-SD 3.51Å; L249-M270 HydrophobicContact CD1-CG 4.38Å; L249-M270 HydrophobicContact CD1-SD 3.77Å; L249-M270 HydrophobicContact CG-SD 4.27Å; I266-M270 WeakPolarHBondContact O-CG 3.4Å; I266-M270 PolarHBondContact O-N 3.11Å; M267-M270 WeakPolarHBondContact O-CB 3.46Å; M267-M270 PolarHBondContact O-N 3.24Å; M267-M270 VanDerWaalsContact O-N 3.12Å; M270-L273 PolarHBondContact O-N 2.79Å; M270-L273 HydrophobicContact SD-CD1 3.9Å; M270-R274 WeakPolarHBondContact O-CB 3.3Å; M270-R274 PolarHBondContact O-N 3.41Å |
| 271 | D | 88.2 | Confident | 81.1 | Confident | 66 Ų | 66 | 59 Ų | 59 | 35% | 0.353 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -67.4 | -39.4 | 174.4 | -73.1 | -26.2 | 0 | 0 | 0 | 111.5 | M267 G268 V269 R274 K275 | M267-D271 PolarHBondContact O-N 2.85Å; G268-D271 PolarHBondContact O-N 2.82Å; V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 2.75Å; D271-R274 PolarHBondContact O-N 2.77Å; D271-R274 IonicContact OD1-CZ 2.85Å; D271-R274 IonicContact OD1-NH1 2.75Å; D271-R274 PolarHBondContact OD1-NH1 3.48Å; D271-R274 IonicContact OD1-NH2 3.99Å; D271-K275 VanDerWaalsContact O-CG 3.3Å; D271-K275 WeakPolarHBondContact O-CG 3.44Å; D271-K275 PolarHBondContact O-N 3.25Å |
| 272 | L | 89 | Confident | 78.1 | Confident | 65 Ų | 65 | 66.5 Ų | 66.5 | 34% | 0.34 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.8 | -41.9 | 172.5 | -70.6 | 173.7 | 0 | 0 | 0 | 112.2 | F96 G268 V269 K275 K276 | F96-L272 HydrophobicContact CE2-CB 4.25Å; F96-L272 HydrophobicContact CE2-CD1 4.47Å; F96-L272 HydrophobicContact CZ-CB 3.77Å; F96-L272 HydrophobicContact CZ-CD1 4.4Å; G268-L272 WeakPolarHBondContact O-CG 3.21Å; G268-L272 PolarHBondContact O-N 3.25Å; V269-L272 PolarHBondContact O-N 2.94Å; L272-K275 PolarHBondContact O-N 3.39Å; L272-K276 WeakPolarHBondContact O-CG 3.36Å; L272-K276 PolarHBondContact O-N 2.84Å |
| 273 | L | 86.3 | Confident | 77.4 | Confident | 1 Ų | 1 | 69.9 Ų | 69.9 | 1% | 0.005 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 174 | -76.4 | 171.6 | 0 | 0 | 0 | 111 | W93 F96 L110 L230 L249 V269 M270 K275 K276 L277 | W93-L273 HydrophobicContact CD2-CD2 4.04Å; W93-L273 HydrophobicContact CE3-CD2 3.58Å; W93-L273 HydrophobicContact CH2-CD2 4.13Å; W93-L273 HydrophobicContact CZ3-CD2 3.63Å; F96-L273 HydrophobicContact CD1-CD2 4.16Å; F96-L273 HydrophobicContact CE1-CD1 4.42Å; F96-L273 HydrophobicContact CE1-CD2 3.58Å; F96-L273 HydrophobicContact CE1-CG 3.7Å; F96-L273 HydrophobicContact CZ-CD2 4.19Å; F96-L273 HydrophobicContact CZ-CG 4.18Å; L110-L273 HydrophobicContact CD1-CD1 3.79Å; L110-L273 HydrophobicContact CD2-CD1 4.14Å; L110-L273 HydrophobicContact CD2-CD2 4.31Å; L230-L273 HydrophobicContact CD2-CB 4.23Å; L249-L273 HydrophobicContact CD1-CD1 4.41Å; V269-L273 HydrophobicContact CG1-CD1 4.16Å; V269-L273 HydrophobicContact CG1-CG 4.44Å; V269-L273 WeakPolarHBondContact O-CG 3.18Å; V269-L273 PolarHBondContact O-N 3.48Å; M270-L273 PolarHBondContact O-N 2.79Å; M270-L273 HydrophobicContact SD-CD1 3.9Å; L273-K275 PolarHBondContact O-N 2.77Å; L273-K276 PolarHBondContact O-N 3.36Å; L273-K276 VanDerWaalsContact O-N 3.12Å; L273-L277 WeakPolarHBondContact O-CB 3.25Å; L273-L277 VanDerWaalsContact O-CG 3.3Å; L273-L277 WeakPolarHBondContact O-CG 3.44Å; L273-L277 PolarHBondContact O-N 2.81Å |
| 274 | R | 83.6 | Confident | 76.6 | Confident | 91 Ų | 91 | 72 Ų | 72 | 34% | 0.343 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -54.6 | -53.4 | 175.4 | -174.7 | -178.3 | -61.9 | 128.7 | 3.2 | 110.5 | L230 M270 D271 K276 L277 T278 | L230-R274 HydrophobicContact CD1-CB 3.85Å; L230-R274 HydrophobicContact CD1-CG 3.87Å; L230-R274 HydrophobicContact CD2-CB 3.93Å; M270-R274 WeakPolarHBondContact O-CB 3.3Å; M270-R274 PolarHBondContact O-N 3.41Å; D271-R274 PolarHBondContact O-N 2.77Å; D271-R274 IonicContact OD1-CZ 2.85Å; D271-R274 IonicContact OD1-NH1 2.75Å; D271-R274 PolarHBondContact OD1-NH1 3.48Å; D271-R274 IonicContact OD1-NH2 3.99Å; R274-K276 PolarHBondContact O-N 3.25Å; R274-L277 PolarHBondContact O-N 2.62Å; R274-L277 VanDerWaalsContact O-N 3.13Å; R274-T278 HydrophobicContact CG-CG2 4.23Å; R274-T278 PolarHBondContact O-N 2.78Å; R274-T278 PolarHBondContact O-OG1 3.07Å |
| 275 | K | 81.6 | Confident | 75.8 | Confident | 119 Ų | 119 | 72.6 Ų | 72.6 | 52% | 0.517 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -59.3 | -30.1 | 178.9 | -67.5 | 176.6 | -179.5 | 179.9 | 0 | 113.7 | D271 L272 L273 Y280 | D271-K275 VanDerWaalsContact O-CG 3.3Å; D271-K275 WeakPolarHBondContact O-CG 3.44Å; D271-K275 PolarHBondContact O-N 3.25Å; L272-K275 PolarHBondContact O-N 3.39Å; L273-K275 PolarHBondContact O-N 2.77Å; K275-Y280 HydrophobicContact CB-CE2 4.21Å; K275-Y280 HydrophobicContact CG-CE2 4Å |
| 276 | K | 80.3 | Confident | 74.7 | Confident | 132 Ų | 132 | 75.8 Ų | 75.8 | 57% | 0.574 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -83 | -29.3 | 177.6 | -77.2 | 179.4 | 172.2 | -81.1 | 0 | 113.5 | W93 F96 L272 L273 R274 | W93-K276 HydrophobicContact CH2-CB 4.09Å; W93-K276 HydrophobicContact CH2-CD 3.85Å; W93-K276 HydrophobicContact CZ3-CD 3.62Å; F96-K276 HydrophobicContact CE2-CD 4.2Å; L272-K276 WeakPolarHBondContact O-CG 3.36Å; L272-K276 PolarHBondContact O-N 2.84Å; L273-K276 PolarHBondContact O-N 3.36Å; L273-K276 VanDerWaalsContact O-N 3.12Å; R274-K276 PolarHBondContact O-N 3.25Å |
| 277 | L | 73.5 | Confident | 73.5 | Confident | 15 Ų | 15 | 80.6 Ų | 80.6 | 8% | 0.079 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -90.2 | -30.2 | -178 | -69.5 | 171.8 | 0 | 0 | 0 | 112.8 | F87 L89 L230 V247 L273 R274 | F87-L277 WeakPolarHBondContact CZ-O 2.9Å; L89-L277 HydrophobicContact CD2-CD2 4.35Å; L230-L277 HydrophobicContact CD2-CD1 3.79Å; V247-L277 HydrophobicContact CG2-CD1 4.03Å; L273-L277 WeakPolarHBondContact O-CB 3.25Å; L273-L277 VanDerWaalsContact O-CG 3.3Å; L273-L277 WeakPolarHBondContact O-CG 3.44Å; L273-L277 PolarHBondContact O-N 2.81Å; R274-L277 PolarHBondContact O-N 2.62Å; R274-L277 VanDerWaalsContact O-N 3.13Å |
| 278 | T | 66.1 | Low | 72.2 | Confident | 46 Ų | 46 | 84.2 Ų | 84.2 | 28% | 0.282 | 41% | 0.414 | S | S | . | . | S | Bend | trans | -88.1 | 115.3 | 170.4 | 61.3 | 0 | 0 | 0 | 0 | 108 | P233 R274 Y280 | P233-T278 HydrophobicContact CG-CG2 4.16Å; R274-T278 HydrophobicContact CG-CG2 4.23Å; R274-T278 PolarHBondContact O-N 2.78Å; R274-T278 PolarHBondContact O-OG1 3.07Å; T278-Y280 PolarHBondContact O-N 2.72Å; T278-Y280 VanDerWaalsContact O-N 3.11Å |
| 279 | S | 53.5 | Low | 70.8 | Confident | 87 Ų | 87 | 87.9 Ų | 87.9 | 61% | 0.608 | 42% | 0.421 | S | S | * | . | trans | -55.4 | 120.5 | 161.5 | 42.2 | 0 | 0 | 0 | 0 | 107.1 | E281 | S279-E281 PolarHBondContact O-N 3.41Š| ||
| 280 | Y | 41.4 | Very low | 69.2 | Low | 174 Ų | 174 | 94.5 Ų | 94.5 | 68% | 0.682 | 45% | 0.451 | S | S | * | . | trans | -69.4 | 79 | 162.9 | -91.1 | -89.7 | 0 | 0 | 0 | 106.6 | K275 T278 | K275-Y280 HydrophobicContact CB-CE2 4.21Å; K275-Y280 HydrophobicContact CG-CE2 4Å; T278-Y280 PolarHBondContact O-N 2.72Å; T278-Y280 VanDerWaalsContact O-N 3.11Å | ||
| 281 | E | 34.8 | Very low | 67.5 | Low | 172 Ų | 172 | 101.9 Ų | 101.9 | 80% | 0.804 | 49% | 0.487 | S | S | * | . | trans | -94.1 | 87.6 | 155.7 | -71.3 | -171.7 | 170.7 | 0 | 0 | 106.2 | S279 | S279-E281 PolarHBondContact O-N 3.41Š| ||
| 282 | M | 31.3 | Very low | 65.6 | Low | 255 Ų | 255 | 105.2 Ų | 105.2 | 100% | 1.256 | 50% | 0.499 | S | S | * | . | trans | -121.6 | 0 | 151 | -86.8 | -164.1 | -179 | 0 | 0 | 107.4 |
Retrieved 282 of 282 residues in 72.5 ms
(Link to these results)