| 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 | 30 | Very low | 28.6 | Very low | 248 Ų | 248 | 147.6 Ų | 147.6 | 100% | 1.222 | 83% | 0.829 | S | S | * | * | 0 | 93.2 | 0 | -80.4 | 177 | 174.8 | 0 | 0 | 107.6 | |||||
| 2 | A | 25.2 | Very low | 28.9 | Very low | 93 Ų | 93 | 145.7 Ų | 145.7 | 77% | 0.769 | 83% | 0.827 | S | S | * | * | trans | -77.3 | 132.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 3 | R | 24.9 | Very low | 29.5 | Very low | 254 Ų | 254 | 143.6 Ų | 143.6 | 96% | 0.958 | 81% | 0.812 | S | S | * | * | trans | -103.1 | 91.6 | 165.6 | -78.3 | -174.4 | 172.6 | -179.8 | -1.5 | 107.7 | ||||
| 4 | T | 31.2 | Very low | 29.8 | Very low | 136 Ų | 136 | 140 Ų | 140 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | -80.9 | 112.9 | 164.5 | 48.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 5 | G | 26.2 | Very low | 30.5 | Very low | 64 Ų | 64 | 136 Ų | 136 | 66% | 0.66 | 76% | 0.764 | S | S | * | * | trans | -107.4 | 138.5 | 166.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 6 | F | 26.9 | Very low | 31 | Very low | 191 Ų | 191 | 138.1 Ų | 138.1 | 84% | 0.838 | 77% | 0.766 | S | S | * | * | trans | 87 | 66.4 | -176.7 | -64.1 | -85.1 | 0 | 0 | 0 | 117.1 | ||||
| 7 | C | 28.5 | Very low | 31 | Very low | 123 Ų | 123 | 140.4 Ų | 140.4 | 83% | 0.831 | 77% | 0.766 | S | S | * | * | trans | -85.1 | 90.1 | 138.6 | -80.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 8 | D | 27.8 | Very low | 30.8 | Very low | 133 Ų | 133 | 142.6 Ų | 142.6 | 71% | 0.711 | 77% | 0.767 | S | S | * | * | trans | -91.6 | 112.5 | 151.5 | -85.9 | -28 | 0 | 0 | 0 | 107.2 | K10 | D8-K10 VanDerWaalsContact C-N 3.33Å; D8-K10 PolarHBondContact O-N 3.49Å | ||
| 9 | S | 28 | Very low | 30.9 | Very low | 120 Ų | 120 | 139.5 Ų | 139.5 | 84% | 0.839 | 76% | 0.763 | S | S | * | * | trans | -68.8 | 88.6 | 179.7 | -57.3 | 0 | 0 | 0 | 0 | 109.2 | A11 | S9-A11 PolarHBondContact O-N 3.42Š| ||
| 10 | K | 35.4 | Very low | 30.8 | Very low | 180 Ų | 180 | 140.5 Ų | 140.5 | 78% | 0.783 | 77% | 0.767 | S | S | * | * | trans | -70.4 | 112.3 | 164.5 | -84.4 | -175.8 | 179 | 177.7 | 0 | 108 | D8 | D8-K10 VanDerWaalsContact C-N 3.33Å; D8-K10 PolarHBondContact O-N 3.49Å | ||
| 11 | A | 30.5 | Very low | 30.8 | Very low | 82 Ų | 82 | 142 Ų | 142 | 68% | 0.678 | 77% | 0.769 | S | S | * | * | trans | -55.8 | 150.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | S9 L13 | S9-A11 PolarHBondContact O-N 3.42Å; A11-L13 PolarHBondContact O-N 3.34Å | ||
| 12 | P | 31.9 | Very low | 30.9 | Very low | 124 Ų | 124 | 141.6 Ų | 141.6 | 81% | 0.805 | 75% | 0.754 | S | S | * | * | trans | -55.3 | 139 | 174 | 23.1 | -32 | 0 | 0 | 0 | 110.1 | D14 | P12-D14 PolarHBondContact O-N 3.39Š| ||
| 13 | L | 36.7 | Very low | 31.3 | Very low | 119 Ų | 119 | 145.5 Ų | 145.5 | 62% | 0.623 | 75% | 0.749 | S | S | * | * | trans | -59.7 | 93.9 | 177.6 | -82.2 | 153.6 | 0 | 0 | 0 | 110 | A11 L15 | A11-L13 PolarHBondContact O-N 3.34Å; L13-L15 VanDerWaalsContact C-N 3.27Å; L13-L15 PolarHBondContact O-N 3.43Å | ||
| 14 | D | 33.9 | Very low | 31.5 | Very low | 93 Ų | 93 | 137.7 Ų | 137.7 | 50% | 0.497 | 74% | 0.739 | S | S | . | * | trans | -76.3 | 83.2 | 168.2 | -166.5 | 0 | 0 | 0 | 0 | 108.5 | P12 H16 K17 | P12-D14 PolarHBondContact O-N 3.39Å; D14-H16 PolarHBondContact O-N 3.13Å; D14-H16 PolarHBondContact OD1-N 3.32Å; D14-K17 PolarHBondContact O-N 3.45Å | ||
| 15 | L | 40.3 | Very low | 31.6 | Very low | 80 Ų | 80 | 136.9 Ų | 136.9 | 42% | 0.419 | 74% | 0.736 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -57.8 | -15.2 | 177.7 | -79.3 | 160.5 | 0 | 0 | 0 | 112.6 | L13 | L13-L15 VanDerWaalsContact C-N 3.27Å; L13-L15 PolarHBondContact O-N 3.43Å |
| 16 | H | 38.2 | Very low | 32.6 | Very low | 169 Ų | 169 | 136.6 Ų | 136.6 | 78% | 0.782 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -17.5 | -176.9 | -85.6 | -72.6 | 0 | 0 | 0 | 115.2 | D14 | D14-H16 PolarHBondContact O-N 3.13Å; D14-H16 PolarHBondContact OD1-N 3.32Å |
| 17 | K | 31.6 | Very low | 33.7 | Very low | 178 Ų | 178 | 133.4 Ų | 133.4 | 77% | 0.774 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -105.6 | -5.9 | -172 | -91 | -175.9 | 178.7 | 172.3 | 0 | 116.9 | D14 | D14-K17 PolarHBondContact O-N 3.45Š|
| 18 | K | 28.1 | Very low | 34.4 | Very low | 180 Ų | 180 | 130.5 Ų | 130.5 | 78% | 0.783 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -113.8 | 7.4 | 176.4 | -94.3 | -175.3 | 177.3 | 177.2 | 0 | 114.2 | D20 | K18-D20 VanDerWaalsContact C-N 3.32Å; K18-D20 PolarHBondContact O-N 3.22Å |
| 19 | A | 31.4 | Very low | 35.2 | Very low | 83 Ų | 83 | 125.2 Ų | 125.2 | 69% | 0.686 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -74.4 | -17.2 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 20 | D | 29.6 | Very low | 35.6 | Very low | 159 Ų | 159 | 122.8 Ų | 122.8 | 85% | 0.85 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -110.2 | -5.5 | -161.3 | -126 | -8.8 | 0 | 0 | 0 | 117 | K18 | K18-D20 VanDerWaalsContact C-N 3.32Å; K18-D20 PolarHBondContact O-N 3.22Å |
| 21 | E | 31 | Very low | 35.6 | Very low | 172 Ų | 172 | 120.9 Ų | 120.9 | 80% | 0.804 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -138.2 | 108.7 | -179.4 | -67.7 | -175.5 | 175.4 | 0 | 0 | 111.5 | ||
| 22 | R | 31.6 | Very low | 36 | Very low | 241 Ų | 241 | 119.7 Ų | 119.7 | 91% | 0.909 | 63% | 0.626 | S | S | * | * | S | Bend | trans | 91.5 | 53.5 | 168.9 | -48 | 176.6 | -170.5 | -169.4 | 1.6 | 118.3 | ||
| 23 | R | 34.5 | Very low | 36.1 | Very low | 174 Ų | 174 | 116.1 Ų | 116.1 | 66% | 0.657 | 60% | 0.603 | S | S | * | * | trans | -136.3 | 140.6 | 157.7 | -69.7 | -171.5 | -157.5 | -151.8 | 8.8 | 112.6 | ||||
| 24 | A | 28.7 | Very low | 35.8 | Very low | 91 Ų | 91 | 113.2 Ų | 113.2 | 75% | 0.752 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 136.8 | 159.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | L26 | A24-L26 PolarHBondContact O-N 3.09Š|
| 25 | P | 33.8 | Very low | 35.4 | Very low | 118 Ų | 118 | 115.5 Ų | 115.5 | 77% | 0.766 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 136.7 | -177.7 | 21.5 | -29.9 | 0 | 0 | 0 | 110 | R27 | P25-R27 PolarHBondContact O-N 2.93Š|
| 26 | L | 46.4 | Very low | 35 | Very low | 58 Ų | 58 | 117.2 Ų | 117.2 | 30% | 0.304 | 64% | 0.635 | S | S | . | * | P | Polyproline II helix | trans | -48.9 | 127.2 | 162.9 | -71.7 | 169.5 | 0 | 0 | 0 | 106.4 | A24 T28 Q168 L172 L229 | A24-L26 PolarHBondContact O-N 3.09Å; L26-T28 PolarHBondContact O-N 3.48Å; L26-Q168 HydrophobicContact CD2-CB 4.09Å; L26-L172 HydrophobicContact CD1-CD2 4.07Å; L26-L229 HydrophobicContact CD1-CD2 4.4Å |
| 27 | R | 49.2 | Very low | 34.3 | Very low | 125 Ų | 125 | 118.4 Ų | 118.4 | 47% | 0.472 | 64% | 0.641 | S | S | . | * | trans | -57 | 115.1 | 177 | -76.1 | -169.5 | -179.5 | -157.6 | 3.7 | 107.2 | P25 W29 E357 | P25-R27 PolarHBondContact O-N 2.93Å; R27-W29 PolarHBondContact O-N 3.08Å; R27-E357 IonicContact NH1-OE2 3.85Å; R27-E357 PolarHBondContact NH1-OE2 3.35Å; R27-E357 PolarHBondContact NH2-O 3.49Å; R27-E357 VanDerWaalsContact NH2-O 3.15Å | ||
| 28 | T | 43.3 | Very low | 34.1 | Very low | 62 Ų | 62 | 115.9 Ų | 115.9 | 38% | 0.38 | 64% | 0.641 | S | S | . | * | trans | -66.8 | 116.7 | 177.8 | 41.6 | 0 | 0 | 0 | 0 | 107.9 | L26 A30 N31 | L26-T28 PolarHBondContact O-N 3.48Å; T28-A30 PolarHBondContact O-N 2.94Å; T28-N31 PolarHBondContact O-N 3.2Å; T28-N31 PolarHBondContact OG1-ND2 3.03Å; T28-N31 VanDerWaalsContact OG1-ND2 3.07Å | ||
| 29 | W | 44.1 | Very low | 33.9 | Very low | 21 Ų | 21 | 116.5 Ų | 116.5 | 8% | 0.08 | 65% | 0.646 | C | S | . | * | G | 310 helix | trans | -50.6 | -32.4 | 178.2 | 176 | -98.5 | 0 | 0 | 0 | 112.3 | R27 N31 A32 T158 I161 L162 V198 L201 Q202 | R27-W29 PolarHBondContact O-N 3.08Å; W29-N31 PolarHBondContact O-N 3.41Å; W29-N31 VanDerWaalsContact O-N 3.14Å; W29-A32 PolarHBondContact O-N 3.06Å; W29-A32 VanDerWaalsContact O-N 3.16Å; W29-T158 HydrophobicContact CH2-CG2 3.77Å; W29-T158 HydrophobicContact CZ2-CG2 4.37Å; W29-I161 HydrophobicContact CE3-CG2 4.19Å; W29-I161 HydrophobicContact CZ3-CB 4.49Å; W29-I161 HydrophobicContact CZ3-CG2 3.95Å; W29-L162 HydrophobicContact CE3-CD1 4.2Å; W29-L162 HydrophobicContact CH2-CB 4.21Å; W29-L162 HydrophobicContact CH2-CD1 3.94Å; W29-L162 HydrophobicContact CZ3-CB 3.91Å; W29-L162 HydrophobicContact CZ3-CD1 3.7Å; W29-L162 HydrophobicContact CZ3-CG 4.43Å; W29-V198 HydrophobicContact CZ2-CG1 4.38Å; W29-L201 HydrophobicContact CH2-CB 4.23Å; W29-L201 HydrophobicContact CH2-CD1 3.93Å; W29-L201 HydrophobicContact CZ2-CB 3.86Å; W29-L201 HydrophobicContact CZ2-CD1 3.91Å; W29-Q202 HydrophobicContact CB-CG 4.38Å; W29-Q202 HydrophobicContact CD2-CB 4.31Å; W29-Q202 HydrophobicContact CG-CB 4.06Å; W29-Q202 HydrophobicContact CG-CG 4.44Å |
| 30 | A | 38.2 | Very low | 33.5 | Very low | 70 Ų | 70 | 121.3 Ų | 121.3 | 58% | 0.579 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -55.9 | -26.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | T28 | T28-A30 PolarHBondContact O-N 2.94Š|
| 31 | N | 34.7 | Very low | 33.4 | Very low | 139 Ų | 139 | 119 Ų | 119 | 74% | 0.743 | 65% | 0.651 | S | S | * | * | G | 310 helix | trans | -86.5 | -8.6 | -177.3 | -70.1 | -10.6 | 0 | 0 | 0 | 113.9 | T28 W29 | T28-N31 PolarHBondContact O-N 3.2Å; T28-N31 PolarHBondContact OG1-ND2 3.03Å; T28-N31 VanDerWaalsContact OG1-ND2 3.07Å; W29-N31 PolarHBondContact O-N 3.41Å; W29-N31 VanDerWaalsContact O-N 3.14Å |
| 32 | A | 37.8 | Very low | 33.1 | Very low | 57 Ų | 57 | 122.5 Ų | 122.5 | 47% | 0.471 | 66% | 0.657 | S | S | . | * | S | Bend | trans | -97 | -10.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | W29 I161 | W29-A32 PolarHBondContact O-N 3.06Å; W29-A32 VanDerWaalsContact O-N 3.16Å; A32-I161 HydrophobicContact CB-CD1 4.43Å |
| 33 | C | 34.9 | Very low | 32.9 | Very low | 49 Ų | 49 | 118 Ų | 118 | 33% | 0.331 | 66% | 0.656 | S | S | . | * | S | Bend | trans | -120.9 | 127.8 | 174.4 | -72.8 | 0 | 0 | 0 | 0 | 108.5 | ||
| 34 | G | 30.1 | Very low | 32.3 | Very low | 58 Ų | 58 | 113.8 Ų | 113.8 | 60% | 0.598 | 66% | 0.659 | S | S | * | * | trans | -53.7 | 163.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | V36 | G34-V36 PolarHBondContact O-N 3.2Š| ||
| 35 | P | 25.5 | Very low | 32.1 | Very low | 142 Ų | 142 | 115.9 Ų | 115.9 | 92% | 0.922 | 67% | 0.665 | S | S | * | * | trans | -58.3 | 130.6 | -167.5 | 22.8 | -32.5 | 0 | 0 | 0 | 112 | ||||
| 36 | V | 31.5 | Very low | 31.7 | Very low | 115 Ų | 115 | 116.8 Ų | 116.8 | 70% | 0.697 | 67% | 0.668 | S | S | * | * | trans | -111.7 | 117.6 | 175.6 | -178.7 | 0 | 0 | 0 | 0 | 108.3 | G34 | G34-V36 PolarHBondContact O-N 3.2Š| ||
| 37 | E | 23.4 | Very low | 30.6 | Very low | 194 Ų | 194 | 123.7 Ų | 123.7 | 91% | 0.907 | 70% | 0.695 | S | S | * | * | trans | -68.6 | 128.8 | 171.9 | -66.8 | -178.3 | 160.7 | 0 | 0 | 109.9 | ||||
| 38 | V | 28.1 | Very low | 29.4 | Very low | 126 Ų | 126 | 125.7 Ų | 125.7 | 76% | 0.764 | 71% | 0.714 | S | S | * | * | trans | -97.4 | 113.5 | 178.4 | 177.5 | 0 | 0 | 0 | 0 | 108.6 | E40 | V38-E40 PolarHBondContact O-N 3.26Š| ||
| 39 | E | 23.8 | Very low | 28.5 | Very low | 193 Ų | 193 | 131.7 Ų | 131.7 | 90% | 0.902 | 74% | 0.737 | S | S | * | * | trans | -77.3 | 109.6 | 167.4 | -110.9 | -176.5 | 159.6 | 0 | 0 | 109.7 | S41 | E39-S41 PolarHBondContact O-N 3.19Š| ||
| 40 | E | 23.8 | Very low | 27.6 | Very low | 184 Ų | 184 | 139.2 Ų | 139.2 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | trans | -71.8 | 116.9 | 171.3 | -77.4 | -175.1 | 150.4 | 0 | 0 | 110.8 | V38 | V38-E40 PolarHBondContact O-N 3.26Š| ||
| 41 | S | 26.3 | Very low | 27.1 | Very low | 111 Ų | 111 | 144.4 Ų | 144.4 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -111.1 | 116.5 | 162.7 | 52.9 | 0 | 0 | 0 | 0 | 110.6 | E39 | E39-S41 PolarHBondContact O-N 3.19Š| ||
| 42 | R | 25.4 | Very low | 26.7 | Very low | 244 Ų | 244 | 146 Ų | 146 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | trans | -64.5 | 130.7 | -179 | -67.1 | 173.9 | 170.3 | 176 | -3.8 | 111.4 | ||||
| 43 | T | 26.6 | Very low | 25.9 | Very low | 146 Ų | 146 | 153.2 Ų | 153.2 | 90% | 0.896 | 80% | 0.803 | S | S | * | * | trans | -139.6 | 142.2 | 160.9 | 27.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 44 | A | 22.9 | Very low | 25.3 | Very low | 87 Ų | 87 | 162.7 Ų | 162.7 | 72% | 0.719 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 165.8 | -163 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 45 | P | 23.7 | Very low | 25 | Very low | 134 Ų | 134 | 166.2 Ų | 166.2 | 87% | 0.87 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 132 | -167.4 | 32.2 | -31 | 0 | 0 | 0 | 111.9 | ||
| 46 | V | 26 | Very low | 24.9 | Very low | 138 Ų | 138 | 171.2 Ų | 171.2 | 84% | 0.836 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -102 | 132.4 | 172.3 | 177.7 | 0 | 0 | 0 | 0 | 109.1 | ||
| 47 | K | 22.8 | Very low | 24.5 | Very low | 202 Ų | 202 | 176.1 Ų | 176.1 | 88% | 0.878 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 138.7 | -178.7 | -77.5 | 176 | 173.7 | 178.2 | 0 | 112.1 | ||
| 48 | I | 24.8 | Very low | 24.5 | Very low | 167 Ų | 167 | 173.2 Ų | 173.2 | 86% | 0.856 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 121.6 | 174.6 | -61.5 | 167.4 | 0 | 0 | 0 | 108.4 | ||
| 49 | E | 24.8 | Very low | 24.2 | Very low | 188 Ų | 188 | 172.8 Ų | 172.8 | 88% | 0.879 | 84% | 0.84 | S | S | * | * | trans | -104.2 | 143.4 | 164.8 | -86.8 | -177 | 162.1 | 0 | 0 | 110.4 | ||||
| 50 | Q | 24.1 | Very low | 24.2 | Very low | 180 Ų | 180 | 170 Ų | 170 | 84% | 0.841 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -72 | 137.8 | -167.6 | -70.4 | 175.2 | -25.4 | 0 | 0 | 113 | H52 | Q50-H52 PolarHBondContact O-N 3.03Š|
| 51 | E | 27.6 | Very low | 24.2 | Very low | 179 Ų | 179 | 170.4 Ų | 170.4 | 84% | 0.836 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 119.8 | 175.7 | -71 | 179.5 | 155.1 | 0 | 0 | 111.5 | R53 | E51-R53 PolarHBondContact O-N 3.36Š|
| 52 | H | 26.3 | Very low | 24.2 | Very low | 171 Ų | 171 | 171.2 Ų | 171.2 | 79% | 0.792 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 116.1 | 168.2 | -76 | -64.6 | 0 | 0 | 0 | 110.7 | Q50 W54 | Q50-H52 PolarHBondContact O-N 3.03Å; H52-W54 PolarHBondContact O-N 3.4Å |
| 53 | R | 21.8 | Very low | 24.1 | Very low | 209 Ų | 209 | 164.7 Ų | 164.7 | 79% | 0.789 | 83% | 0.83 | S | S | * | * | trans | -60.9 | 115.2 | 172.6 | -176.7 | -171.9 | -72.2 | -171 | -4 | 110.8 | E51 E55 | E51-R53 PolarHBondContact O-N 3.36Å; R53-E55 VanDerWaalsContact CD-OE1 3.25Å; R53-E55 WeakPolarHBondContact CD-OE1 3.25Å; R53-E55 HydrophobicContact CG-CG 4.16Å; R53-E55 IonicContact NH1-OE1 3.55Å; R53-E55 PolarHBondContact O-N 3.32Å | ||
| 54 | W | 23 | Very low | 24.1 | Very low | 248 Ų | 248 | 166.3 Ų | 166.3 | 94% | 0.939 | 83% | 0.828 | S | S | * | * | trans | -84.5 | 96.4 | 171.8 | -70.7 | 90.6 | 0 | 0 | 0 | 110.5 | H52 | H52-W54 PolarHBondContact O-N 3.4Š| ||
| 55 | E | 22.6 | Very low | 24.2 | Very low | 132 Ų | 132 | 167.8 Ų | 167.8 | 62% | 0.617 | 83% | 0.828 | S | S | * | * | trans | -91.8 | 112.9 | 165.8 | -74.2 | 178.4 | -168 | 0 | 0 | 109.2 | R53 R57 | R53-E55 VanDerWaalsContact CD-OE1 3.25Å; R53-E55 WeakPolarHBondContact CD-OE1 3.25Å; R53-E55 HydrophobicContact CG-CG 4.16Å; R53-E55 IonicContact NH1-OE1 3.55Å; R53-E55 PolarHBondContact O-N 3.32Å; E55-R57 PolarHBondContact O-N 3.38Å | ||
| 56 | R | 24 | Very low | 24.4 | Very low | 248 Ų | 248 | 168.1 Ų | 168.1 | 94% | 0.936 | 82% | 0.821 | S | S | * | * | trans | -83.2 | 112 | 169.4 | -86.7 | -162.7 | -80.5 | -174.1 | -4.8 | 109.6 | ||||
| 57 | R | 22.4 | Very low | 24.6 | Very low | 218 Ų | 218 | 169.4 Ų | 169.4 | 82% | 0.823 | 82% | 0.821 | S | S | * | * | trans | -83.4 | 132.9 | 161.8 | -66.6 | -179.1 | 179.9 | -179.9 | -0.4 | 108.9 | E55 | E55-R57 PolarHBondContact O-N 3.38Š| ||
| 58 | P | 22.9 | Very low | 24.7 | Very low | 132 Ų | 132 | 167.8 Ų | 167.8 | 86% | 0.857 | 82% | 0.819 | S | S | * | * | trans | -75.6 | 128.5 | 173.8 | 29.7 | -29 | 0 | 0 | 0 | 108.9 | ||||
| 59 | S | 23.2 | Very low | 24.6 | Very low | 117 Ų | 117 | 163.4 Ų | 163.4 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -107.7 | 119.7 | 163.1 | 52.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 60 | T | 23.4 | Very low | 24.6 | Very low | 134 Ų | 134 | 164.4 Ų | 164.4 | 82% | 0.822 | 82% | 0.816 | S | S | * | * | trans | -68.4 | 122.3 | 165.7 | 28.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 61 | Q | 24.1 | Very low | 24.6 | Very low | 194 Ų | 194 | 164.1 Ų | 164.1 | 91% | 0.907 | 82% | 0.815 | S | S | * | * | trans | -168.1 | 134.7 | 139.7 | -106.7 | 167.5 | 13 | 0 | 0 | 111.7 | ||||
| 62 | T | 25 | Very low | 24.5 | Very low | 127 Ų | 127 | 164.4 Ų | 164.4 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | trans | -59.7 | 146.7 | 177 | 37.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 63 | S | 25.1 | Very low | 24.4 | Very low | 107 Ų | 107 | 163.3 Ų | 163.3 | 75% | 0.748 | 82% | 0.816 | S | S | * | * | 142.7 | 113.7 | 123.4 | -70.4 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 64 | E | 26.4 | Very low | 24.5 | Very low | 181 Ų | 181 | 158.3 Ų | 158.3 | 85% | 0.846 | 81% | 0.813 | S | S | * | * | 61 | 126 | 123 | -106.4 | 178.8 | -156 | 0 | 0 | 123.1 | |||||
| 65 | V | 24.2 | Very low | 24.6 | Very low | 118 Ų | 118 | 157.6 Ų | 157.6 | 72% | 0.715 | 81% | 0.81 | S | S | * | * | trans | 77.8 | 120.9 | 151.3 | -157 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 66 | I | 28.2 | Very low | 24.7 | Very low | 141 Ų | 141 | 157.3 Ų | 157.3 | 72% | 0.723 | 82% | 0.817 | S | S | * | * | 178.6 | 124 | 106.1 | -79.2 | 163.5 | 0 | 0 | 0 | 109.6 | M68 | I66-M68 HydrophobicContact CG2-CG 4.16Š| |||
| 67 | I | 29.5 | Very low | 24.7 | Very low | 165 Ų | 165 | 151.5 Ų | 151.5 | 85% | 0.846 | 81% | 0.813 | S | S | * | * | trans | -81.4 | 129 | 167.1 | -64.1 | 171.3 | 0 | 0 | 0 | 108.4 | ||||
| 68 | M | 26 | Very low | 24.7 | Very low | 168 Ų | 168 | 151 Ų | 151 | 83% | 0.828 | 82% | 0.817 | S | S | * | * | trans | -141.1 | 116.8 | 156.6 | -74.4 | -163.9 | -75.4 | 0 | 0 | 105.6 | I66 | I66-M68 HydrophobicContact CG2-CG 4.16Š| ||
| 69 | G | 23 | Very low | 24.8 | Very low | 74 Ų | 74 | 149.6 Ų | 149.6 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | 96.4 | 71 | 54.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 70 | F | 24.3 | Very low | 24.9 | Very low | 210 Ų | 210 | 148.9 Ų | 148.9 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 123.6 | 177.9 | -98.1 | -91.5 | 0 | 0 | 0 | 110.2 | ||
| 71 | H | 23.1 | Very low | 25.1 | Very low | 173 Ų | 173 | 150.7 Ų | 150.7 | 80% | 0.801 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -85 | 124.2 | 175 | -143.4 | -82.5 | 0 | 0 | 0 | 108.4 | ||
| 72 | E | 26.8 | Very low | 25.1 | Very low | 186 Ų | 186 | 144.3 Ų | 144.3 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 118.1 | 172.4 | -75.2 | -177.1 | 147.3 | 0 | 0 | 110 | ||
| 73 | D | 24.3 | Very low | 25.1 | Very low | 147 Ų | 147 | 143.3 Ų | 143.3 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | trans | -99.1 | 100.4 | 162.8 | -90.2 | -12.7 | 0 | 0 | 0 | 109.5 | R75 | D73-R75 PolarHBondContact O-N 2.63Š| ||
| 74 | S | 24.2 | Very low | 25.2 | Very low | 104 Ų | 104 | 145 Ų | 145 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -58.6 | 116 | 168.1 | 165.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 75 | R | 25.1 | Very low | 25.3 | Very low | 234 Ų | 234 | 144.5 Ų | 144.5 | 88% | 0.883 | 81% | 0.81 | S | S | * | * | trans | -117.1 | 101.1 | 159.4 | -73.3 | -172.4 | -175.2 | -179.2 | 3.2 | 109.3 | D73 C77 | D73-R75 PolarHBondContact O-N 2.63Å; R75-C77 PolarHBondContact O-N 3.18Å | ||
| 76 | T | 23.8 | Very low | 25.9 | Very low | 125 Ų | 125 | 146.2 Ų | 146.2 | 77% | 0.767 | 82% | 0.815 | S | S | * | * | trans | -66.2 | 114.7 | 168.9 | 46.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 77 | C | 24.1 | Very low | 26.4 | Very low | 126 Ų | 126 | 144.1 Ų | 144.1 | 85% | 0.851 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 120 | 160.3 | -79.3 | 0 | 0 | 0 | 0 | 108.7 | R75 A79 | R75-C77 PolarHBondContact O-N 3.18Å; C77-A79 PolarHBondContact O-N 3.35Å |
| 78 | K | 22 | Very low | 26.6 | Very low | 207 Ų | 207 | 141.2 Ų | 141.2 | 90% | 0.9 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 121.7 | 177.7 | -69.5 | 177.5 | 174.6 | 179.7 | 0 | 109.8 | ||
| 79 | A | 24.9 | Very low | 27 | Very low | 103 Ų | 103 | 138.1 Ų | 138.1 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 128.1 | 165.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | C77 | C77-A79 PolarHBondContact O-N 3.35Š|
| 80 | A | 26.2 | Very low | 27.7 | Very low | 102 Ų | 102 | 140.3 Ų | 140.3 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -85 | 132.4 | 166.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||
| 81 | D | 26.3 | Very low | 28.4 | Very low | 173 Ų | 173 | 140.3 Ų | 140.3 | 93% | 0.925 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 134.6 | -179.3 | -159.6 | 9 | 0 | 0 | 0 | 111.7 | ||
| 82 | G | 24.3 | Very low | 29.2 | Very low | 59 Ų | 59 | 136.2 Ų | 136.2 | 61% | 0.608 | 76% | 0.759 | S | S | * | * | trans | -178.3 | 91.1 | -175.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | V84 | G82-V84 PolarHBondContact O-N 3.39Š| ||
| 83 | S | 25.2 | Very low | 29.7 | Very low | 107 Ų | 107 | 133.3 Ų | 133.3 | 75% | 0.748 | 75% | 0.745 | S | S | * | * | trans | -0 | 107 | 164.9 | 55.7 | 0 | 0 | 0 | 0 | 116.3 | E85 | S83-E85 PolarHBondContact O-N 2.94Š| ||
| 84 | V | 27.6 | Very low | 30.3 | Very low | 141 Ų | 141 | 134 Ų | 134 | 86% | 0.855 | 75% | 0.749 | S | S | * | * | trans | -66 | 102.4 | 164.2 | 178.9 | 0 | 0 | 0 | 0 | 107.4 | G82 | G82-V84 PolarHBondContact O-N 3.39Š| ||
| 85 | E | 29 | Very low | 31.1 | Very low | 172 Ų | 172 | 134.5 Ų | 134.5 | 80% | 0.804 | 74% | 0.743 | S | S | * | * | trans | -71.5 | 126.1 | 163.3 | -69.6 | -165 | 157.6 | 0 | 0 | 108.7 | S83 P87 | S83-E85 PolarHBondContact O-N 2.94Å; E85-P87 VanDerWaalsContact O-CD 3.29Å; E85-P87 WeakPolarHBondContact O-CD 3.36Å | ||
| 86 | D | 35.4 | Very low | 31.8 | Very low | 153 Ų | 153 | 131 Ų | 131 | 82% | 0.818 | 74% | 0.737 | S | S | * | * | trans | -58.9 | 118.3 | 179 | -119.9 | -24.7 | 0 | 0 | 0 | 111.4 | V88 | D86-V88 PolarHBondContact O-N 3.03Å; D86-V88 VanDerWaalsContact O-N 3.13Å | ||
| 87 | P | 38.7 | Very low | 32.6 | Very low | 98 Ų | 98 | 128.3 Ų | 128.3 | 64% | 0.636 | 73% | 0.734 | S | S | * | * | trans | -83.8 | 91.6 | 175.1 | -7.2 | 25.7 | 0 | 0 | 0 | 111.2 | E85 | E85-P87 VanDerWaalsContact O-CD 3.29Å; E85-P87 WeakPolarHBondContact O-CD 3.36Å | ||
| 88 | V | 33.8 | Very low | 33.5 | Very low | 104 Ų | 104 | 126.5 Ų | 126.5 | 63% | 0.63 | 72% | 0.715 | S | S | * | * | trans | 38.3 | 84.2 | 134.9 | -172.8 | 0 | 0 | 0 | 0 | 117 | D86 L90 | D86-V88 PolarHBondContact O-N 3.03Å; D86-V88 VanDerWaalsContact O-N 3.13Å; V88-L90 VanDerWaalsContact C-N 3.25Å; V88-L90 HydrophobicContact CG1-CB 3.56Å; V88-L90 HydrophobicContact CG1-CD1 3.42Å; V88-L90 VanDerWaalsContact CG1-CD1 3.42Å; V88-L90 HydrophobicContact CG1-CG 3.49Å; V88-L90 VanDerWaalsContact CG1-CG 3.49Å; V88-L90 PolarHBondContact O-N 2.87Å; V88-L90 VanDerWaalsContact O-N 3.16Å | ||
| 89 | L | 35.6 | Very low | 34.7 | Very low | 102 Ų | 102 | 124.8 Ų | 124.8 | 53% | 0.534 | 71% | 0.71 | S | S | . | * | trans | -72.9 | 64.3 | 153.7 | -77.9 | 163.3 | 0 | 0 | 0 | 111.3 | L92 | L89-L92 HydrophobicContact CD2-CD1 4.05Š| ||
| 90 | L | 36.3 | Very low | 35.9 | Very low | 120 Ų | 120 | 123 Ų | 123 | 63% | 0.628 | 69% | 0.691 | S | S | * | * | trans | -91 | 11.1 | 179.9 | -88.4 | 174.1 | 0 | 0 | 0 | 116.3 | V88 | V88-L90 VanDerWaalsContact C-N 3.25Å; V88-L90 HydrophobicContact CG1-CB 3.56Å; V88-L90 HydrophobicContact CG1-CD1 3.42Å; V88-L90 VanDerWaalsContact CG1-CD1 3.42Å; V88-L90 HydrophobicContact CG1-CG 3.49Å; V88-L90 VanDerWaalsContact CG1-CG 3.49Å; V88-L90 PolarHBondContact O-N 2.87Å; V88-L90 VanDerWaalsContact O-N 3.16Å | ||
| 91 | Y | 40.4 | Very low | 36.8 | Very low | 211 Ų | 211 | 122.2 Ų | 122.2 | 83% | 0.827 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -127.2 | 13.2 | 173.1 | -89.2 | -84.4 | 0 | 0 | 0 | 115.7 | ||
| 92 | L | 38.8 | Very low | 38 | Very low | 86 Ų | 86 | 119.6 Ų | 119.6 | 45% | 0.45 | 65% | 0.654 | S | S | . | * | trans | -119.6 | 21.3 | 175 | -75.3 | 171.7 | 0 | 0 | 0 | 113.6 | L89 D94 L95 | L89-L92 HydrophobicContact CD2-CD1 4.05Å; L92-D94 PolarHBondContact O-N 3.19Å; L92-L95 HydrophobicContact CD2-CD1 4.34Å; L92-L95 PolarHBondContact O-N 3.43Å | ||
| 93 | H | 37.6 | Very low | 39.8 | Very low | 125 Ų | 125 | 121.8 Ų | 121.8 | 58% | 0.579 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.5 | -9.1 | -171.8 | -136.4 | -70.7 | 0 | 0 | 0 | 114.8 | Q96 | H93-Q96 PolarHBondContact CE1-NE2 3.06Š|
| 94 | D | 36.9 | Very low | 41.8 | Very low | 163 Ų | 163 | 121.3 Ų | 121.3 | 87% | 0.872 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.8 | 6.4 | 177.8 | -76.9 | -22.1 | 0 | 0 | 0 | 114.6 | L92 | L92-D94 PolarHBondContact O-N 3.19Š|
| 95 | L | 42.3 | Very low | 43.9 | Very low | 113 Ų | 113 | 117 Ų | 117 | 59% | 0.592 | 62% | 0.618 | S | S | * | * | trans | -123.5 | 46.8 | 179.3 | -69.4 | 171.2 | 0 | 0 | 0 | 112.7 | L92 G97 | L92-L95 HydrophobicContact CD2-CD1 4.34Å; L92-L95 PolarHBondContact O-N 3.43Å; L95-G97 PolarHBondContact O-N 3.06Å | ||
| 96 | Q | 38 | Very low | 46.4 | Very low | 162 Ų | 162 | 112.7 Ų | 112.7 | 76% | 0.757 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | 14.2 | 179.3 | -72.7 | -175.8 | -21.8 | 0 | 0 | 115.7 | H93 | H93-Q96 PolarHBondContact CE1-NE2 3.06Š|
| 97 | G | 41.3 | Very low | 48.7 | Very low | 68 Ų | 68 | 108.6 Ų | 108.6 | 70% | 0.701 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.7 | -7.8 | -174.7 | 0 | 0 | 0 | 0 | 0 | 117.3 | L95 | L95-G97 PolarHBondContact O-N 3.06Š|
| 98 | L | 42.5 | Very low | 51.1 | Low | 87 Ų | 87 | 108 Ų | 108 | 46% | 0.455 | 58% | 0.579 | S | S | . | * | trans | -135.8 | 76 | -163.5 | -69.9 | 164.3 | 0 | 0 | 0 | 113.9 | S100 L101 | L98-S100 PolarHBondContact O-N 3.25Å; L98-S100 VanDerWaalsContact O-N 3.13Å; L98-L101 HydrophobicContact CB-CB 4.04Å; L98-L101 HydrophobicContact CB-CD1 3.74Å; L98-L101 HydrophobicContact CB-CG 3.79Å; L98-L101 HydrophobicContact CD1-CD1 3.35Å; L98-L101 HydrophobicContact CD1-CG 4.02Å; L98-L101 HydrophobicContact CG-CD1 4.13Å; L98-L101 HydrophobicContact CG-CG 4.41Å; L98-L101 PolarHBondContact O-N 2.93Å | ||
| 99 | H | 47.3 | Very low | 53.7 | Low | 172 Ų | 172 | 104 Ų | 104 | 80% | 0.796 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -56.2 | -23.9 | 167.8 | -76.9 | 74.1 | 0 | 0 | 0 | 112.9 | T103 | H99-T103 PolarHBondContact O-OG1 2.98Å |
| 100 | S | 50.3 | Low | 56.3 | Low | 65 Ų | 65 | 104.1 Ų | 104.1 | 46% | 0.455 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.7 | -25.6 | 173.1 | 50.3 | 0 | 0 | 0 | 0 | 114 | L98 T103 L104 | L98-S100 PolarHBondContact O-N 3.25Å; L98-S100 VanDerWaalsContact O-N 3.13Å; S100-T103 WeakPolarHBondContact CA-OG1 3.42Å; S100-T103 PolarHBondContact O-OG1 3.23Å; S100-L104 WeakPolarHBondContact O-CD1 3.49Å; S100-L104 VanDerWaalsContact O-CG 3.28Å; S100-L104 WeakPolarHBondContact O-CG 3.33Å |
| 101 | L | 45.9 | Very low | 59 | Low | 85 Ų | 85 | 102.8 Ų | 102.8 | 45% | 0.445 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -76.5 | -41.7 | 176.8 | -77.6 | 179.2 | 0 | 0 | 0 | 111.2 | L98 T103 L104 V105 | L98-L101 HydrophobicContact CB-CB 4.04Å; L98-L101 HydrophobicContact CB-CD1 3.74Å; L98-L101 HydrophobicContact CB-CG 3.79Å; L98-L101 HydrophobicContact CD1-CD1 3.35Å; L98-L101 HydrophobicContact CD1-CG 4.02Å; L98-L101 HydrophobicContact CG-CD1 4.13Å; L98-L101 HydrophobicContact CG-CG 4.41Å; L98-L101 PolarHBondContact O-N 2.93Å; L101-T103 PolarHBondContact O-N 3.15Å; L101-L104 PolarHBondContact O-N 2.9Å; L101-V105 WeakPolarHBondContact O-CG2 3.25Å; L101-V105 PolarHBondContact O-N 2.91Å |
| 102 | H | 51.7 | Low | 61.5 | Low | 119 Ų | 119 | 94.5 Ų | 94.5 | 55% | 0.551 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.2 | -28.9 | 179.8 | -162.6 | -85.6 | 0 | 0 | 0 | 113.1 | ||
| 103 | T | 60.4 | Low | 64.1 | Low | 104 Ų | 104 | 90.4 Ų | 90.4 | 64% | 0.638 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -78.6 | -24.1 | 174.5 | 35.3 | 0 | 0 | 0 | 0 | 113.3 | H99 S100 L101 | H99-T103 PolarHBondContact O-OG1 2.98Å; S100-T103 WeakPolarHBondContact CA-OG1 3.42Å; S100-T103 PolarHBondContact O-OG1 3.23Å; L101-T103 PolarHBondContact O-N 3.15Å |
| 104 | L | 67.3 | Low | 66.8 | Low | 98 Ų | 98 | 85.7 Ų | 85.7 | 51% | 0.513 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -89.1 | -25.7 | 178.7 | -69.4 | 170.3 | 0 | 0 | 0 | 113.2 | S100 L101 S107 L108 | S100-L104 WeakPolarHBondContact O-CD1 3.49Å; S100-L104 VanDerWaalsContact O-CG 3.28Å; S100-L104 WeakPolarHBondContact O-CG 3.33Å; L101-L104 PolarHBondContact O-N 2.9Å; L104-S107 PolarHBondContact O-N 3.42Å; L104-S107 PolarHBondContact O-OG 3.5Å; L104-L108 PolarHBondContact O-N 2.78Å |
| 105 | V | 73.1 | Confident | 69.5 | Low | 49 Ų | 49 | 80.4 Ų | 80.4 | 30% | 0.297 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -50.3 | -46.6 | -179.5 | 176 | 0 | 0 | 0 | 0 | 112.8 | L101 S107 L108 L109 L327 | L101-V105 WeakPolarHBondContact O-CG2 3.25Å; L101-V105 PolarHBondContact O-N 2.91Å; V105-S107 VanDerWaalsContact C-N 3.34Å; V105-S107 PolarHBondContact O-N 3.42Å; V105-L108 PolarHBondContact O-N 3.34Å; V105-L109 VanDerWaalsContact O-CB 3.23Å; V105-L109 WeakPolarHBondContact O-CB 3.4Å; V105-L109 PolarHBondContact O-N 3.13Å; V105-L327 HydrophobicContact CG1-CD1 4.03Å |
| 106 | P | 80.3 | Confident | 71.9 | Confident | 82 Ų | 82 | 75.1 Ų | 75.1 | 53% | 0.532 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.1 | -38.9 | 179.8 | -23.4 | 35 | 0 | 0 | 0 | 113.3 | R110 | P106-R110 WeakPolarHBondContact O-CB 3.44Å; P106-R110 PolarHBondContact O-N 3.14Å |
| 107 | S | 85.1 | Confident | 74.6 | Confident | 68 Ų | 68 | 67.5 Ų | 67.5 | 48% | 0.476 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -71.1 | -38.2 | 178.4 | 63.3 | 0 | 0 | 0 | 0 | 112.5 | L104 V105 H111 | L104-S107 PolarHBondContact O-N 3.42Å; L104-S107 PolarHBondContact O-OG 3.5Å; V105-S107 VanDerWaalsContact C-N 3.34Å; V105-S107 PolarHBondContact O-N 3.42Å; S107-H111 WeakPolarHBondContact O-CB 3.44Å; S107-H111 PolarHBondContact O-N 2.94Å |
| 108 | L | 88.3 | Confident | 77 | Confident | 84 Ų | 84 | 68.1 Ų | 68.1 | 44% | 0.44 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.8 | -45.4 | 175.9 | -179.8 | 62.4 | 0 | 0 | 0 | 111.1 | L104 V105 R110 H111 E112 L327 | L104-L108 PolarHBondContact O-N 2.78Å; V105-L108 PolarHBondContact O-N 3.34Å; L108-R110 VanDerWaalsContact C-N 3.32Å; L108-R110 PolarHBondContact O-N 2.98Å; L108-H111 PolarHBondContact O-N 3.19Å; L108-E112 HydrophobicContact CD1-CG 4.24Å; L108-E112 WeakPolarHBondContact O-CG 3.39Å; L108-E112 PolarHBondContact O-N 3.07Å; L108-L327 HydrophobicContact CD2-CD1 4.39Å; L108-L327 HydrophobicContact CD2-CD2 4.22Å; L108-L327 HydrophobicContact CG-CD1 4.4Å; L108-L327 HydrophobicContact CG-CD2 3.98Å |
| 109 | L | 88.3 | Confident | 79.3 | Confident | 21 Ų | 21 | 69 Ų | 69 | 11% | 0.11 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -57.8 | -47.6 | 176.3 | 176.9 | 63.9 | 0 | 0 | 0 | 110.7 | V105 H111 E112 V113 L327 I331 | V105-L109 VanDerWaalsContact O-CB 3.23Å; V105-L109 WeakPolarHBondContact O-CB 3.4Å; V105-L109 PolarHBondContact O-N 3.13Å; L109-H111 VanDerWaalsContact C-N 3.35Å; L109-H111 PolarHBondContact O-N 2.86Å; L109-E112 PolarHBondContact O-N 2.93Å; L109-V113 HydrophobicContact CD1-CG2 4.15Å; L109-V113 HydrophobicContact CG-CG2 4.45Å; L109-V113 WeakPolarHBondContact O-CB 3.33Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.41Å; L109-V113 PolarHBondContact O-N 2.8Å; L109-L327 HydrophobicContact CB-CD1 3.86Å; L109-L327 HydrophobicContact CB-CG 4.49Å; L109-L327 HydrophobicContact CD1-CD1 4.24Å; L109-L327 HydrophobicContact CD1-CG 4.07Å; L109-I331 HydrophobicContact CD1-CD1 4.02Å; L109-I331 HydrophobicContact CD1-CG1 3.67Å; L109-I331 HydrophobicContact CD2-CG1 4.1Å; L109-I331 HydrophobicContact CG-CG1 4.4Å |
| 110 | R | 91.3 | Very high | 81.4 | Confident | 105 Ų | 105 | 63.5 Ų | 63.5 | 40% | 0.396 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -55.4 | -51.6 | 175 | 172.4 | 169.6 | 179.6 | 165.6 | 6.5 | 111.2 | P106 L108 E112 V113 E114 W130 | P106-R110 WeakPolarHBondContact O-CB 3.44Å; P106-R110 PolarHBondContact O-N 3.14Å; L108-R110 VanDerWaalsContact C-N 3.32Å; L108-R110 PolarHBondContact O-N 2.98Å; R110-E112 VanDerWaalsContact C-N 3.34Å; R110-E112 PolarHBondContact O-N 3.21Å; R110-V113 PolarHBondContact O-N 2.83Å; R110-E114 HydrophobicContact CG-CG 4.27Å; R110-E114 WeakPolarHBondContact CG-OE1 3.46Å; R110-E114 IonicContact CZ-OE1 3.21Å; R110-E114 IonicContact NE-OE1 2.74Å; R110-E114 PolarHBondContact NE-OE1 3.01Å; R110-E114 IonicContact NH2-OE1 3.5Å; R110-E114 PolarHBondContact NH2-OE1 2.98Å; R110-E114 VanDerWaalsContact O-CG 3.24Å; R110-E114 WeakPolarHBondContact O-CG 3.36Å; R110-E114 PolarHBondContact O-N 3.14Å; R110-W130 HydrophobicContact CB-CD2 4.21Å; R110-W130 HydrophobicContact CB-CE3 3.9Å; R110-W130 HydrophobicContact CB-CH2 4.09Å; R110-W130 HydrophobicContact CB-CZ2 4.4Å; R110-W130 HydrophobicContact CB-CZ3 3.85Å; R110-W130 HydrophobicContact CG-CB 4.47Å; R110-W130 HydrophobicContact CG-CD2 3.68Å; R110-W130 HydrophobicContact CG-CE3 3.62Å; R110-W130 HydrophobicContact CG-CG 4.07Å; R110-W130 HydrophobicContact CG-CZ3 4.12Å |
| 111 | H | 92.7 | Very high | 83.2 | Confident | 91 Ų | 91 | 67.4 Ų | 67.4 | 42% | 0.421 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -58 | -44.9 | -179.6 | -178.1 | 73.4 | 0 | 0 | 0 | 112.8 | S107 L108 L109 E114 M115 R126 | S107-H111 WeakPolarHBondContact O-CB 3.44Å; S107-H111 PolarHBondContact O-N 2.94Å; L108-H111 PolarHBondContact O-N 3.19Å; L109-H111 VanDerWaalsContact C-N 3.35Å; L109-H111 PolarHBondContact O-N 2.86Å; H111-E114 PolarHBondContact O-N 2.82Å; H111-M115 WeakPolarHBondContact O-CB 3.35Å; H111-M115 WeakPolarHBondContact O-CG 3.5Å; H111-M115 PolarHBondContact O-N 3.33Å; H111-R126 PolarHBondContact CE1-NH2 3.41Å; H111-R126 VanDerWaalsContact CE1-NH2 3.29Å |
| 112 | E | 93.3 | Very high | 85.1 | Confident | 38 Ų | 38 | 65.6 Ų | 65.6 | 18% | 0.178 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -68.1 | -37.9 | 179.9 | -70.5 | -76.3 | -177.7 | 0 | 0 | 111.8 | L108 L109 R110 M115 A116 V269 R271 L327 | L108-E112 HydrophobicContact CD1-CG 4.24Å; L108-E112 WeakPolarHBondContact O-CG 3.39Å; L108-E112 PolarHBondContact O-N 3.07Å; L109-E112 PolarHBondContact O-N 2.93Å; R110-E112 VanDerWaalsContact C-N 3.34Å; R110-E112 PolarHBondContact O-N 3.21Å; E112-M115 PolarHBondContact O-N 2.8Å; E112-A116 WeakPolarHBondContact O-CB 3.36Å; E112-A116 PolarHBondContact O-N 3.42Å; E112-V269 HydrophobicContact CB-CG1 4.21Å; E112-V269 HydrophobicContact CB-CG2 4.44Å; E112-R271 IonicContact OE1-NH2 3.56Å; E112-R271 PolarHBondContact OE1-NH2 3.14Å; E112-R271 VanDerWaalsContact OE1-NH2 3.14Å; E112-L327 HydrophobicContact CB-CD2 4.09Å; E112-L327 HydrophobicContact CG-CD2 3.72Å |
| 113 | V | 93.2 | Very high | 86.8 | Confident | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 172.7 | 166.4 | 0 | 0 | 0 | 0 | 111.2 | L109 R110 A116 L117 W130 F133 L265 V269 I331 | L109-V113 HydrophobicContact CD1-CG2 4.15Å; L109-V113 HydrophobicContact CG-CG2 4.45Å; L109-V113 WeakPolarHBondContact O-CB 3.33Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.41Å; L109-V113 PolarHBondContact O-N 2.8Å; R110-V113 PolarHBondContact O-N 2.83Å; V113-A116 PolarHBondContact O-N 2.9Å; V113-L117 HydrophobicContact CG1-CD1 4.18Å; V113-L117 WeakPolarHBondContact O-CG 3.49Å; V113-L117 PolarHBondContact O-N 3.32Å; V113-W130 HydrophobicContact CB-CE3 4.41Å; V113-W130 HydrophobicContact CB-CZ3 4.07Å; V113-W130 HydrophobicContact CG1-CE3 4.15Å; V113-W130 HydrophobicContact CG1-CZ3 4.07Å; V113-W130 HydrophobicContact CG2-CZ3 4.34Å; V113-F133 HydrophobicContact CG1-CB 3.98Å; V113-F133 HydrophobicContact CG1-CD1 4.04Å; V113-F133 HydrophobicContact CG1-CD2 3.95Å; V113-F133 HydrophobicContact CG1-CE2 4.48Å; V113-F133 HydrophobicContact CG1-CG 3.71Å; V113-L265 HydrophobicContact CG1-CD1 4.25Å; V113-L265 HydrophobicContact CG1-CD2 4.31Å; V113-V269 HydrophobicContact CG2-CG2 4.14Å; V113-I331 HydrophobicContact CG2-CD1 4.26Å |
| 114 | E | 94 | Very high | 87.9 | Confident | 26 Ų | 26 | 68.4 Ų | 68.4 | 12% | 0.121 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 177.5 | -65.8 | 176 | 170.4 | 0 | 0 | 111.4 | R110 H111 E118 R126 A129 W130 | R110-E114 HydrophobicContact CG-CG 4.27Å; R110-E114 WeakPolarHBondContact CG-OE1 3.46Å; R110-E114 IonicContact CZ-OE1 3.21Å; R110-E114 IonicContact NE-OE1 2.74Å; R110-E114 PolarHBondContact NE-OE1 3.01Å; R110-E114 IonicContact NH2-OE1 3.5Å; R110-E114 PolarHBondContact NH2-OE1 2.98Å; R110-E114 VanDerWaalsContact O-CG 3.24Å; R110-E114 WeakPolarHBondContact O-CG 3.36Å; R110-E114 PolarHBondContact O-N 3.14Å; H111-E114 PolarHBondContact O-N 2.82Å; E114-E118 PolarHBondContact O-N 3.13Å; E114-E118 VanDerWaalsContact O-N 3.14Å; E114-R126 HydrophobicContact CB-CG 4.39Å; E114-A129 HydrophobicContact CB-CB 3.94Å; E114-A129 HydrophobicContact CG-CB 3.75Å; E114-W130 HydrophobicContact CG-CB 4.35Å |
| 115 | M | 92.7 | Very high | 88.9 | Confident | 52 Ų | 52 | 67.5 Ų | 67.5 | 26% | 0.256 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -59.4 | -45 | 173.2 | -79.8 | -59.8 | -49.4 | 0 | 0 | 111.7 | H111 E112 E118 N119 R126 | H111-M115 WeakPolarHBondContact O-CB 3.35Å; H111-M115 WeakPolarHBondContact O-CG 3.5Å; H111-M115 PolarHBondContact O-N 3.33Å; E112-M115 PolarHBondContact O-N 2.8Å; M115-E118 PolarHBondContact O-N 3.27Å; M115-N119 WeakPolarHBondContact O-CB 3.26Å; M115-N119 PolarHBondContact O-N 3.48Å; M115-N119 PolarHBondContact O-ND2 3.39Å; M115-N119 VanDerWaalsContact O-ND2 3.17Å; M115-R126 PolarHBondContact SD-NH1 2.99Å; M115-R126 PolarHBondContact SD-NH2 3.32Å |
| 116 | A | 93.9 | Very high | 89.6 | Confident | 2 Ų | 2 | 68.6 Ų | 68.6 | 2% | 0.017 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.2 | -41.9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | E112 V113 E118 N119 L120 L265 S268 V269 | E112-A116 WeakPolarHBondContact O-CB 3.36Å; E112-A116 PolarHBondContact O-N 3.42Å; V113-A116 PolarHBondContact O-N 2.9Å; A116-E118 VanDerWaalsContact C-N 3.34Å; A116-E118 PolarHBondContact O-N 3.43Å; A116-N119 PolarHBondContact O-N 3.06Å; A116-L120 VanDerWaalsContact O-CB 3.31Å; A116-L120 WeakPolarHBondContact O-CB 3.41Å; A116-L120 WeakPolarHBondContact O-CD1 3.43Å; A116-L120 WeakPolarHBondContact O-CG 3.42Å; A116-L120 PolarHBondContact O-N 3.09Å; A116-L265 HydrophobicContact CB-CD1 3.59Å; A116-S268 WeakPolarHBondContact CB-OG 3.38Å; A116-V269 HydrophobicContact CB-CG2 3.95Å |
| 117 | L | 93.2 | Very high | 90.1 | Very high | 2 Ų | 2 | 69 Ų | 69 | 1% | 0.01 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.2 | -42.6 | 174.7 | -75.1 | 172.8 | 0 | 0 | 0 | 112.2 | V113 D121 L122 I123 A129 F133 L265 | V113-L117 HydrophobicContact CG1-CD1 4.18Å; V113-L117 WeakPolarHBondContact O-CG 3.49Å; V113-L117 PolarHBondContact O-N 3.32Å; L117-D121 PolarHBondContact O-N 3.25Å; L117-L122 HydrophobicContact CD2-CB 4.01Å; L117-L122 HydrophobicContact CD2-CD1 3.88Å; L117-L122 PolarHBondContact O-N 3.26Å; L117-L122 VanDerWaalsContact O-N 3.09Å; L117-I123 HydrophobicContact CB-CD1 3.78Å; L117-I123 HydrophobicContact CB-CG1 4.08Å; L117-I123 HydrophobicContact CB-CG2 4.06Å; L117-I123 HydrophobicContact CD1-CG2 4.42Å; L117-A129 HydrophobicContact CD1-CB 4.06Å; L117-A129 VanDerWaalsContact CD1-O 3.22Å; L117-A129 WeakPolarHBondContact CD1-O 3.45Å; L117-F133 HydrophobicContact CD1-CB 4.18Å; L117-L265 HydrophobicContact CD2-CD1 4.08Å; L117-L265 HydrophobicContact CG-CD1 3.92Å |
| 118 | E | 91.9 | Very high | 90.5 | Very high | 81 Ų | 81 | 72.5 Ų | 72.5 | 38% | 0.379 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63 | -48.9 | 175.7 | -174.6 | 175.3 | -169.2 | 0 | 0 | 111 | E114 M115 A116 L120 D121 I123 R126 | E114-E118 PolarHBondContact O-N 3.13Å; E114-E118 VanDerWaalsContact O-N 3.14Å; M115-E118 PolarHBondContact O-N 3.27Å; A116-E118 VanDerWaalsContact C-N 3.34Å; A116-E118 PolarHBondContact O-N 3.43Å; E118-L120 VanDerWaalsContact C-N 3.26Å; E118-L120 PolarHBondContact O-N 2.98Å; E118-D121 PolarHBondContact O-N 3.13Å; E118-D121 VanDerWaalsContact O-N 3.09Å; E118-I123 HydrophobicContact CB-CD1 4.24Å; E118-I123 HydrophobicContact CB-CG1 4.42Å; E118-R126 WeakPolarHBondContact OE2-CD 3.27Å; E118-R126 IonicContact OE2-CZ 3.83Å; E118-R126 IonicContact OE2-NE 2.99Å; E118-R126 IonicContact OE2-NH1 3.14Å; E118-R126 PolarHBondContact OE2-NH1 3.22Å |
| 119 | N | 91.6 | Very high | 90.6 | Very high | 105 Ų | 105 | 68.5 Ų | 68.5 | 56% | 0.561 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -66 | -25.3 | -179.1 | -71.5 | -26.8 | 0 | 0 | 0 | 114.1 | M115 A116 D121 | M115-N119 WeakPolarHBondContact O-CB 3.26Å; M115-N119 PolarHBondContact O-N 3.48Å; M115-N119 PolarHBondContact O-ND2 3.39Å; M115-N119 VanDerWaalsContact O-ND2 3.17Å; A116-N119 PolarHBondContact O-N 3.06Å; N119-D121 VanDerWaalsContact C-N 3.29Å |
| 120 | L | 90.9 | Very high | 90.8 | Very high | 56 Ų | 56 | 69.8 Ų | 69.8 | 29% | 0.293 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | 3.4 | 177.7 | -69.2 | 169.4 | 0 | 0 | 0 | 112.5 | A116 E118 L122 L264 | A116-L120 VanDerWaalsContact O-CB 3.31Å; A116-L120 WeakPolarHBondContact O-CB 3.41Å; A116-L120 WeakPolarHBondContact O-CD1 3.43Å; A116-L120 WeakPolarHBondContact O-CG 3.42Å; A116-L120 PolarHBondContact O-N 3.09Å; E118-L120 VanDerWaalsContact C-N 3.26Å; E118-L120 PolarHBondContact O-N 2.98Å; L120-L122 HydrophobicContact CB-CD1 3.93Å; L120-L122 HydrophobicContact CB-CG 3.84Å; L120-L122 HydrophobicContact CD1-CD1 4.03Å; L120-L122 PolarHBondContact O-N 2.95Å; L120-L122 VanDerWaalsContact O-N 3.12Å; L120-L264 HydrophobicContact CD1-CB 3.89Å; L120-L264 HydrophobicContact CD2-CB 4.13Å |
| 121 | D | 88.9 | Confident | 90.8 | Very high | 147 Ų | 147 | 69.5 Ų | 69.5 | 79% | 0.786 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 27.1 | -174.4 | -62.1 | -50.1 | 0 | 0 | 0 | 113 | L117 E118 N119 I123 | L117-D121 PolarHBondContact O-N 3.25Å; E118-D121 PolarHBondContact O-N 3.13Å; E118-D121 VanDerWaalsContact O-N 3.09Å; N119-D121 VanDerWaalsContact C-N 3.29Å; D121-I123 VanDerWaalsContact C-N 3.26Å |
| 122 | L | 85.4 | Confident | 90.8 | Very high | 48 Ų | 48 | 68.9 Ų | 68.9 | 25% | 0.251 | 33% | 0.326 | S | S | . | . | trans | -80.8 | -11.9 | 177.9 | -69.6 | 175.4 | 0 | 0 | 0 | 112.2 | L117 L120 H261 | L117-L122 HydrophobicContact CD2-CB 4.01Å; L117-L122 HydrophobicContact CD2-CD1 3.88Å; L117-L122 PolarHBondContact O-N 3.26Å; L117-L122 VanDerWaalsContact O-N 3.09Å; L120-L122 HydrophobicContact CB-CD1 3.93Å; L120-L122 HydrophobicContact CB-CG 3.84Å; L120-L122 HydrophobicContact CD1-CD1 4.03Å; L120-L122 PolarHBondContact O-N 2.95Å; L120-L122 VanDerWaalsContact O-N 3.12Å; L122-H261 HydrophobicContact CD1-CB 4.49Å | ||
| 123 | I | 87.4 | Confident | 90.8 | Very high | 13 Ų | 13 | 67.5 Ų | 67.5 | 7% | 0.067 | 32% | 0.319 | C | S | . | . | trans | -138.2 | 150 | -179 | 64.2 | 174 | 0 | 0 | 0 | 110.6 | L117 E118 D121 A129 M132 | L117-I123 HydrophobicContact CB-CD1 3.78Å; L117-I123 HydrophobicContact CB-CG1 4.08Å; L117-I123 HydrophobicContact CB-CG2 4.06Å; L117-I123 HydrophobicContact CD1-CG2 4.42Å; E118-I123 HydrophobicContact CB-CD1 4.24Å; E118-I123 HydrophobicContact CB-CG1 4.42Å; D121-I123 VanDerWaalsContact C-N 3.26Å; I123-A129 HydrophobicContact CD1-CB 3.38Å; I123-M132 HydrophobicContact CB-SD 4.39Å; I123-M132 HydrophobicContact CG2-CE 3.69Å; I123-M132 HydrophobicContact CG2-SD 3.59Å; I123-M132 VanDerWaalsContact CG2-SD 3.59Å | ||
| 124 | W | 82.5 | Confident | 90.7 | Very high | 268 Ų | 268 | 70.7 Ų | 70.7 | 100% | 1.015 | 34% | 0.336 | S | S | * | . | S | Bend | trans | -93.3 | -32.6 | 173.7 | -65.4 | 97.3 | 0 | 0 | 0 | 112.8 | ||
| 125 | D | 88.4 | Confident | 90.6 | Very high | 79 Ų | 79 | 73 Ų | 73 | 42% | 0.422 | 35% | 0.349 | S | S | . | . | trans | -132.7 | 122.8 | -177.6 | -172.8 | -13.8 | 0 | 0 | 0 | 109.8 | T127 Y128 | D125-T127 VanDerWaalsContact CG-OG1 3.24Å; D125-T127 PolarHBondContact O-N 3.38Å; D125-T127 WeakPolarHBondContact OD1-CG2 3.39Å; D125-T127 PolarHBondContact OD1-N 2.86Å; D125-T127 PolarHBondContact OD1-OG1 3.36Å; D125-T127 VanDerWaalsContact OD1-OG1 3.09Å; D125-T127 PolarHBondContact OD2-OG1 3.06Å; D125-Y128 HydrophobicContact CB-CD2 4.01Å; D125-Y128 HydrophobicContact CB-CE2 4.41Å; D125-Y128 PolarHBondContact O-N 2.99Å | ||
| 126 | R | 89.4 | Confident | 90.5 | Very high | 73 Ų | 73 | 71.5 Ų | 71.5 | 28% | 0.275 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | -61.3 | -26.4 | -179.1 | -167.8 | 178.8 | -172.1 | 146.3 | -2 | 113.1 | H111 E114 M115 E118 Y128 A129 | H111-R126 PolarHBondContact CE1-NH2 3.41Å; H111-R126 VanDerWaalsContact CE1-NH2 3.29Å; E114-R126 HydrophobicContact CB-CG 4.39Å; M115-R126 PolarHBondContact SD-NH1 2.99Å; M115-R126 PolarHBondContact SD-NH2 3.32Å; E118-R126 WeakPolarHBondContact OE2-CD 3.27Å; E118-R126 IonicContact OE2-CZ 3.83Å; E118-R126 IonicContact OE2-NE 2.99Å; E118-R126 IonicContact OE2-NH1 3.14Å; E118-R126 PolarHBondContact OE2-NH1 3.22Å; R126-Y128 PolarHBondContact O-N 2.87Å; R126-Y128 VanDerWaalsContact O-N 3.13Å; R126-A129 WeakPolarHBondContact O-CB 3.24Å; R126-A129 PolarHBondContact O-N 2.98Å |
| 127 | T | 90.6 | Very high | 90.4 | Very high | 91 Ų | 91 | 73.5 Ų | 73.5 | 56% | 0.558 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -60.3 | -26.3 | 179.7 | 59.4 | 0 | 0 | 0 | 0 | 112.8 | D125 | D125-T127 VanDerWaalsContact CG-OG1 3.24Å; D125-T127 PolarHBondContact O-N 3.38Å; D125-T127 WeakPolarHBondContact OD1-CG2 3.39Å; D125-T127 PolarHBondContact OD1-N 2.86Å; D125-T127 PolarHBondContact OD1-OG1 3.36Å; D125-T127 VanDerWaalsContact OD1-OG1 3.09Å; D125-T127 PolarHBondContact OD2-OG1 3.06Å |
| 128 | Y | 91.8 | Very high | 90.3 | Very high | 141 Ų | 141 | 80.6 Ų | 80.6 | 55% | 0.553 | 38% | 0.378 | S | S | * | . | G | 310 helix | trans | -97.8 | -4 | 179.7 | -60.4 | -78.9 | 0 | 0 | 0 | 113.6 | D125 R126 W130 D131 M132 | D125-Y128 HydrophobicContact CB-CD2 4.01Å; D125-Y128 HydrophobicContact CB-CE2 4.41Å; D125-Y128 PolarHBondContact O-N 2.99Å; R126-Y128 PolarHBondContact O-N 2.87Å; R126-Y128 VanDerWaalsContact O-N 3.13Å; Y128-W130 PolarHBondContact O-N 3.49Å; Y128-D131 PolarHBondContact O-N 3.3Å; Y128-M132 WeakPolarHBondContact O-CB 3.49Å; Y128-M132 VanDerWaalsContact O-CG 3.32Å; Y128-M132 WeakPolarHBondContact O-CG 3.18Å; Y128-M132 PolarHBondContact O-N 2.85Å |
| 129 | A | 91.9 | Very high | 90.2 | Very high | 0 Ų | 0 | 77.8 Ų | 77.8 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -55.9 | -49.2 | -171.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E114 L117 I123 R126 M132 F133 | E114-A129 HydrophobicContact CB-CB 3.94Å; E114-A129 HydrophobicContact CG-CB 3.75Å; L117-A129 HydrophobicContact CD1-CB 4.06Å; L117-A129 VanDerWaalsContact CD1-O 3.22Å; L117-A129 WeakPolarHBondContact CD1-O 3.45Å; I123-A129 HydrophobicContact CD1-CB 3.38Å; R126-A129 WeakPolarHBondContact O-CB 3.24Å; R126-A129 PolarHBondContact O-N 2.98Å; A129-M132 PolarHBondContact O-N 3.36Å; A129-F133 PolarHBondContact O-N 3.38Å |
| 130 | W | 91.4 | Very high | 90.2 | Very high | 48 Ų | 48 | 73 Ų | 73 | 18% | 0.182 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -67.8 | -40.7 | 179.9 | -170.7 | -110 | 0 | 0 | 0 | 112.5 | R110 V113 E114 Y128 M132 F133 L134 | R110-W130 HydrophobicContact CB-CD2 4.21Å; R110-W130 HydrophobicContact CB-CE3 3.9Å; R110-W130 HydrophobicContact CB-CH2 4.09Å; R110-W130 HydrophobicContact CB-CZ2 4.4Å; R110-W130 HydrophobicContact CB-CZ3 3.85Å; R110-W130 HydrophobicContact CG-CB 4.47Å; R110-W130 HydrophobicContact CG-CD2 3.68Å; R110-W130 HydrophobicContact CG-CE3 3.62Å; R110-W130 HydrophobicContact CG-CG 4.07Å; R110-W130 HydrophobicContact CG-CZ3 4.12Å; V113-W130 HydrophobicContact CB-CE3 4.41Å; V113-W130 HydrophobicContact CB-CZ3 4.07Å; V113-W130 HydrophobicContact CG1-CE3 4.15Å; V113-W130 HydrophobicContact CG1-CZ3 4.07Å; V113-W130 HydrophobicContact CG2-CZ3 4.34Å; E114-W130 HydrophobicContact CG-CB 4.35Å; Y128-W130 PolarHBondContact O-N 3.49Å; W130-M132 VanDerWaalsContact C-N 3.34Å; W130-M132 PolarHBondContact O-N 3.33Å; W130-F133 AromaticContact CE3-CD1 3.94Å; W130-F133 HydrophobicContact CE3-CD1 3.94Å; W130-F133 HydrophobicContact CH2-CD1 4.08Å; W130-F133 HydrophobicContact CH2-CE1 4.06Å; W130-F133 AromaticContact CZ3-CD1 3.65Å; W130-F133 HydrophobicContact CZ3-CD1 3.65Å; W130-F133 AromaticContact CZ3-CE1 3.94Å; W130-F133 HydrophobicContact CZ3-CE1 3.94Å; W130-F133 PolarHBondContact O-N 3.32Å; W130-L134 HydrophobicContact CZ2-CD2 4.31Å; W130-L134 WeakPolarHBondContact O-CG 3.4Å; W130-L134 PolarHBondContact O-N 2.98Å |
| 131 | D | 91.9 | Very high | 90 | Very high | 98 Ų | 98 | 75.7 Ų | 75.7 | 52% | 0.524 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -65.7 | -39.9 | 178.6 | -65.9 | -26.9 | 0 | 0 | 0 | 111.3 | Y128 L134 D135 | Y128-D131 PolarHBondContact O-N 3.3Å; D131-L134 PolarHBondContact O-N 3.39Å; D131-D135 WeakPolarHBondContact O-CB 3.47Å; D131-D135 PolarHBondContact O-N 2.77Å |
| 132 | M | 92.4 | Very high | 89.8 | Confident | 79 Ų | 79 | 74.8 Ų | 74.8 | 39% | 0.389 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | 172.8 | -73.9 | -179.8 | 64 | 0 | 0 | 111.7 | I123 Y128 A129 W130 L134 D135 M136 | I123-M132 HydrophobicContact CB-SD 4.39Å; I123-M132 HydrophobicContact CG2-CE 3.69Å; I123-M132 HydrophobicContact CG2-SD 3.59Å; I123-M132 VanDerWaalsContact CG2-SD 3.59Å; Y128-M132 WeakPolarHBondContact O-CB 3.49Å; Y128-M132 VanDerWaalsContact O-CG 3.32Å; Y128-M132 WeakPolarHBondContact O-CG 3.18Å; Y128-M132 PolarHBondContact O-N 2.85Å; A129-M132 PolarHBondContact O-N 3.36Å; W130-M132 VanDerWaalsContact C-N 3.34Å; W130-M132 PolarHBondContact O-N 3.33Å; M132-L134 PolarHBondContact O-N 3.2Å; M132-D135 PolarHBondContact O-N 3.17Å; M132-M136 WeakPolarHBondContact O-CB 3.36Å; M132-M136 VanDerWaalsContact O-CG 3.29Å; M132-M136 WeakPolarHBondContact O-CG 3.35Å; M132-M136 PolarHBondContact O-N 2.85Å |
| 133 | F | 92.4 | Very high | 89.4 | Confident | 9 Ų | 9 | 74 Ų | 74 | 4% | 0.039 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.2 | -46.4 | 175 | 173.3 | -110.1 | 0 | 0 | 0 | 111.7 | V113 L117 A129 W130 D135 M136 M137 L265 I331 | V113-F133 HydrophobicContact CG1-CB 3.98Å; V113-F133 HydrophobicContact CG1-CD1 4.04Å; V113-F133 HydrophobicContact CG1-CD2 3.95Å; V113-F133 HydrophobicContact CG1-CE2 4.48Å; V113-F133 HydrophobicContact CG1-CG 3.71Å; L117-F133 HydrophobicContact CD1-CB 4.18Å; A129-F133 PolarHBondContact O-N 3.38Å; W130-F133 AromaticContact CE3-CD1 3.94Å; W130-F133 HydrophobicContact CE3-CD1 3.94Å; W130-F133 HydrophobicContact CH2-CD1 4.08Å; W130-F133 HydrophobicContact CH2-CE1 4.06Å; W130-F133 AromaticContact CZ3-CD1 3.65Å; W130-F133 HydrophobicContact CZ3-CD1 3.65Å; W130-F133 AromaticContact CZ3-CE1 3.94Å; W130-F133 HydrophobicContact CZ3-CE1 3.94Å; W130-F133 PolarHBondContact O-N 3.32Å; F133-D135 VanDerWaalsContact C-N 3.31Å; F133-D135 PolarHBondContact O-N 3.19Å; F133-M136 WeakPolarHBondContact O-CB 3.42Å; F133-M136 PolarHBondContact O-N 3.4Å; F133-M137 HydrophobicContact CD2-CG 4.27Å; F133-M137 HydrophobicContact CE1-CG 4.1Å; F133-M137 HydrophobicContact CE2-CG 3.82Å; F133-M137 HydrophobicContact CE2-SD 4.15Å; F133-M137 HydrophobicContact CZ-CG 3.72Å; F133-M137 HydrophobicContact CZ-SD 4.16Å; F133-M137 WeakPolarHBondContact O-CB 3.32Å; F133-M137 VanDerWaalsContact O-CG 3.31Å; F133-M137 WeakPolarHBondContact O-CG 3.41Å; F133-M137 PolarHBondContact O-N 3.48Å; F133-L265 HydrophobicContact CD2-CD2 3.52Å; F133-L265 HydrophobicContact CE2-CD2 3.54Å; F133-I331 HydrophobicContact CZ-CG2 4.08Å |
| 134 | L | 91.9 | Very high | 89.1 | Confident | 66 Ų | 66 | 75.9 Ų | 75.9 | 35% | 0.346 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -62.4 | -39.4 | 176.5 | -70.3 | -179.6 | 0 | 0 | 0 | 111.9 | W130 D131 M132 M137 R138 | W130-L134 HydrophobicContact CZ2-CD2 4.31Å; W130-L134 WeakPolarHBondContact O-CG 3.4Å; W130-L134 PolarHBondContact O-N 2.98Å; D131-L134 PolarHBondContact O-N 3.39Å; M132-L134 PolarHBondContact O-N 3.2Å; L134-M137 PolarHBondContact O-N 3.44Å; L134-R138 WeakPolarHBondContact O-CB 3.35Å; L134-R138 PolarHBondContact O-N 3.49Å |
| 135 | D | 91.6 | Very high | 89.2 | Confident | 74 Ų | 74 | 64.4 Ų | 64.4 | 40% | 0.396 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -67.6 | -43 | 176.3 | -168.7 | 65.7 | 0 | 0 | 0 | 112.1 | D131 M132 F133 M137 R138 T139 | D131-D135 WeakPolarHBondContact O-CB 3.47Å; D131-D135 PolarHBondContact O-N 2.77Å; M132-D135 PolarHBondContact O-N 3.17Å; F133-D135 VanDerWaalsContact C-N 3.31Å; F133-D135 PolarHBondContact O-N 3.19Å; D135-M137 VanDerWaalsContact C-N 3.28Å; D135-M137 PolarHBondContact O-N 2.91Å; D135-R138 PolarHBondContact O-N 3.3Å; D135-R138 VanDerWaalsContact O-N 3.14Å; D135-R138 IonicContact OD1-NH1 3.46Å; D135-R138 PolarHBondContact OD1-NH1 3.45Å; D135-T139 WeakPolarHBondContact O-CB 3.33Å; D135-T139 VanDerWaalsContact O-CG2 3.31Å; D135-T139 WeakPolarHBondContact O-CG2 3.4Å; D135-T139 PolarHBondContact O-N 2.97Å; D135-T139 PolarHBondContact O-OG1 2.77Å; D135-T139 WeakPolarHBondContact OD2-CG2 3.29Å |
| 136 | M | 91.5 | Very high | 88.9 | Confident | 22 Ų | 22 | 66.4 Ų | 66.4 | 11% | 0.108 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -55.6 | -45.7 | 171.4 | -73.3 | 172.9 | 62.9 | 0 | 0 | 111 | M132 F133 R138 T139 Q140 H261 F262 | M132-M136 WeakPolarHBondContact O-CB 3.36Å; M132-M136 VanDerWaalsContact O-CG 3.29Å; M132-M136 WeakPolarHBondContact O-CG 3.35Å; M132-M136 PolarHBondContact O-N 2.85Å; F133-M136 WeakPolarHBondContact O-CB 3.42Å; F133-M136 PolarHBondContact O-N 3.4Å; M136-R138 VanDerWaalsContact C-N 3.3Å; M136-R138 PolarHBondContact O-N 3.24Å; M136-T139 PolarHBondContact O-OG1 3.39Å; M136-Q140 WeakPolarHBondContact O-CG 3.28Å; M136-Q140 PolarHBondContact O-N 2.86Å; M136-H261 HydrophobicContact CE-CB 3.74Å; M136-F262 HydrophobicContact CB-CE1 4.17Å; M136-F262 HydrophobicContact CB-CZ 4.01Å; M136-F262 HydrophobicContact CE-CD1 4.46Å; M136-F262 HydrophobicContact CE-CE1 4.14Å; M136-F262 HydrophobicContact CE-CE2 4.46Å; M136-F262 HydrophobicContact CE-CZ 4.16Å |
| 137 | M | 90.9 | Very high | 88.7 | Confident | 43 Ų | 43 | 65.7 Ų | 65.7 | 21% | 0.212 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -64.9 | -32.9 | 179.4 | -73.6 | -63.8 | -70.2 | 0 | 0 | 112.8 | F133 L134 D135 Q140 F262 V299 | F133-M137 HydrophobicContact CD2-CG 4.27Å; F133-M137 HydrophobicContact CE1-CG 4.1Å; F133-M137 HydrophobicContact CE2-CG 3.82Å; F133-M137 HydrophobicContact CE2-SD 4.15Å; F133-M137 HydrophobicContact CZ-CG 3.72Å; F133-M137 HydrophobicContact CZ-SD 4.16Å; F133-M137 WeakPolarHBondContact O-CB 3.32Å; F133-M137 VanDerWaalsContact O-CG 3.31Å; F133-M137 WeakPolarHBondContact O-CG 3.41Å; F133-M137 PolarHBondContact O-N 3.48Å; L134-M137 PolarHBondContact O-N 3.44Å; D135-M137 VanDerWaalsContact C-N 3.28Å; D135-M137 PolarHBondContact O-N 2.91Å; M137-Q140 VanDerWaalsContact O-CG 3.23Å; M137-Q140 WeakPolarHBondContact O-CG 3.48Å; M137-Q140 PolarHBondContact O-NE2 3.34Å; M137-Q140 PolarHBondContact SD-NE2 3.36Å; M137-F262 HydrophobicContact CG-CE1 4.41Å; M137-F262 HydrophobicContact SD-CD1 4.2Å; M137-F262 HydrophobicContact SD-CE1 3.64Å; M137-V299 HydrophobicContact CE-CG2 4.29Å; M137-V299 HydrophobicContact SD-CB 4.49Å; M137-V299 HydrophobicContact SD-CG2 4.04Å |
| 138 | R | 90.9 | Very high | 88.4 | Confident | 152 Ų | 152 | 62.9 Ų | 62.9 | 57% | 0.574 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -81.2 | -47.1 | 178.9 | -170.5 | -170.5 | -59.3 | 125.8 | -1.6 | 112.5 | L134 D135 M136 Q140 M141 | L134-R138 WeakPolarHBondContact O-CB 3.35Å; L134-R138 PolarHBondContact O-N 3.49Å; D135-R138 PolarHBondContact O-N 3.3Å; D135-R138 VanDerWaalsContact O-N 3.14Å; D135-R138 IonicContact OD1-NH1 3.46Å; D135-R138 PolarHBondContact OD1-NH1 3.45Å; M136-R138 VanDerWaalsContact C-N 3.3Å; M136-R138 PolarHBondContact O-N 3.24Å; R138-Q140 PolarHBondContact O-N 3.48Å; R138-M141 WeakPolarHBondContact O-CB 3.43Å; R138-M141 PolarHBondContact O-N 2.81Å |
| 139 | T | 90.3 | Very high | 87.9 | Confident | 22 Ų | 22 | 61.3 Ų | 61.3 | 14% | 0.135 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -69.2 | -32.3 | -173 | 51.8 | 0 | 0 | 0 | 0 | 112.3 | D135 M136 M141 Q142 Y143 | D135-T139 WeakPolarHBondContact O-CB 3.33Å; D135-T139 VanDerWaalsContact O-CG2 3.31Å; D135-T139 WeakPolarHBondContact O-CG2 3.4Å; D135-T139 PolarHBondContact O-N 2.97Å; D135-T139 PolarHBondContact O-OG1 2.77Å; D135-T139 WeakPolarHBondContact OD2-CG2 3.29Å; M136-T139 PolarHBondContact O-OG1 3.39Å; T139-M141 PolarHBondContact O-N 3.39Å; T139-M141 VanDerWaalsContact O-N 3.08Å; T139-Q142 WeakPolarHBondContact O-CB 3.31Å; T139-Q142 PolarHBondContact O-N 2.79Å; T139-Y143 WeakPolarHBondContact O-CD2 3.37Å |
| 140 | Q | 90.7 | Very high | 87.2 | Confident | 3 Ų | 3 | 63.2 Ų | 63.2 | 1% | 0.014 | 33% | 0.325 | C | S | . | . | G | 310 helix | trans | -56 | -28.7 | 175.5 | 65.8 | 174.6 | -38 | 0 | 0 | 113.3 | M136 M137 R138 Q142 Y143 F262 P298 | M136-Q140 WeakPolarHBondContact O-CG 3.28Å; M136-Q140 PolarHBondContact O-N 2.86Å; M137-Q140 VanDerWaalsContact O-CG 3.23Å; M137-Q140 WeakPolarHBondContact O-CG 3.48Å; M137-Q140 PolarHBondContact O-NE2 3.34Å; M137-Q140 PolarHBondContact SD-NE2 3.36Å; R138-Q140 PolarHBondContact O-N 3.48Å; Q140-Q142 VanDerWaalsContact C-N 3.25Å; Q140-Q142 PolarHBondContact O-N 3.14Å; Q140-Y143 PolarHBondContact O-N 3.45Å; Q140-F262 HydrophobicContact CB-CZ 4.42Å; Q140-F262 HydrophobicContact CG-CZ 4.49Å; Q140-P298 HydrophobicContact CB-CG 4.11Å |
| 141 | M | 87.4 | Confident | 86.6 | Confident | 113 Ų | 113 | 63 Ų | 63 | 56% | 0.557 | 33% | 0.33 | S | S | * | . | G | 310 helix | trans | -67.6 | -26.1 | 178.6 | -58.1 | -59.7 | -66 | 0 | 0 | 112.5 | R138 T139 Y143 L297 | R138-M141 WeakPolarHBondContact O-CB 3.43Å; R138-M141 PolarHBondContact O-N 2.81Å; T139-M141 PolarHBondContact O-N 3.39Å; T139-M141 VanDerWaalsContact O-N 3.08Å; M141-Y143 PolarHBondContact O-N 2.7Å; M141-L297 HydrophobicContact CE-CD1 3.97Å; M141-L297 HydrophobicContact CE-CD2 4.4Å; M141-L297 HydrophobicContact SD-CD1 3.34Å; M141-L297 WeakPolarHBondContact SD-CD1 3.46Å; M141-L297 HydrophobicContact SD-CD2 3.72Å; M141-L297 HydrophobicContact SD-CG 4.18Å |
| 142 | Q | 84.4 | Confident | 85.6 | Confident | 128 Ų | 128 | 70.2 Ų | 70.2 | 60% | 0.598 | 35% | 0.35 | S | S | * | . | G | 310 helix | trans | -73.6 | -20.3 | -178.7 | -57.1 | 179.8 | 16.1 | 0 | 0 | 112.3 | T139 Q140 | T139-Q142 WeakPolarHBondContact O-CB 3.31Å; T139-Q142 PolarHBondContact O-N 2.79Å; Q140-Q142 VanDerWaalsContact C-N 3.25Å; Q140-Q142 PolarHBondContact O-N 3.14Å |
| 143 | Y | 78.3 | Confident | 84.8 | Confident | 33 Ų | 33 | 73.5 Ų | 73.5 | 13% | 0.129 | 36% | 0.364 | C | S | . | . | G | 310 helix | trans | -108.5 | 6.6 | -171.5 | -62.6 | -58.7 | 0 | 0 | 0 | 113.2 | T139 Q140 M141 H185 D253 S255 | T139-Y143 WeakPolarHBondContact O-CD2 3.37Å; Q140-Y143 PolarHBondContact O-N 3.45Å; M141-Y143 PolarHBondContact O-N 2.7Å; Y143-H185 AromaticContact CD1-CE1 3.8Å; Y143-H185 AromaticContact CD1-NE2 3.88Å; Y143-H185 AromaticContact CG-CE1 3.9Å; Y143-D253 WeakPolarHBondContact CE1-OD2 3.35Å; Y143-D253 PolarHBondContact OH-OD1 2.88Å; Y143-D253 VanDerWaalsContact OH-OD1 3.13Å; Y143-D253 PolarHBondContact OH-OD2 3.47Å; Y143-S255 VanDerWaalsContact CZ-O 3.3Å; Y143-S255 WeakPolarHBondContact OH-CB 2.94Å |
| 144 | S | 80.4 | Confident | 84.2 | Confident | 52 Ų | 52 | 74 Ų | 74 | 36% | 0.364 | 37% | 0.366 | S | S | . | . | trans | -70.1 | 134.3 | 173.7 | -165.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 145 | F | 84.6 | Confident | 83.8 | Confident | 27 Ų | 27 | 74.5 Ų | 74.5 | 12% | 0.118 | 37% | 0.372 | C | S | . | . | trans | -90.5 | 140.1 | 177 | -66.9 | -77.6 | 0 | 0 | 0 | 111.2 | N147 N188 R189 V294 | F145-N147 VanDerWaalsContact C-N 3.29Å; F145-N147 PolarHBondContact O-N 2.94Å; F145-N188 HydrophobicContact CE2-CB 3.96Å; F145-N188 HydrophobicContact CZ-CB 3.71Å; F145-R189 HydrophobicContact CE1-CG 3.95Å; F145-R189 HydrophobicContact CZ-CG 3.65Å; F145-V294 HydrophobicContact CD2-CG2 3.46Å; F145-V294 VanDerWaalsContact CD2-CG2 3.46Å; F145-V294 WeakPolarHBondContact CD2-O 3.07Å; F145-V294 HydrophobicContact CE2-CG2 3.67Å; F145-V294 HydrophobicContact CG-CG2 4.2Å | ||
| 146 | P | 82.2 | Confident | 83.5 | Confident | 120 Ų | 120 | 76 Ų | 76 | 78% | 0.779 | 38% | 0.38 | S | S | * | . | S | Bend | trans | -71.4 | -23.1 | -176.5 | 27.8 | -36 | 0 | 0 | 0 | 113.8 | ||
| 147 | N | 84.7 | Confident | 83.2 | Confident | 59 Ų | 59 | 78 Ų | 78 | 32% | 0.316 | 40% | 0.4 | S | S | . | . | trans | -152.5 | 166.3 | -178.5 | 58.5 | 15.6 | 0 | 0 | 0 | 110.1 | F145 D149 R192 V295 | F145-N147 VanDerWaalsContact C-N 3.29Å; F145-N147 PolarHBondContact O-N 2.94Å; N147-D149 VanDerWaalsContact C-N 3.29Å; N147-D149 HydrophobicContact CB-CB 4.47Å; N147-D149 PolarHBondContact ND2-OD2 2.99Å; N147-R192 PolarHBondContact O-NH1 2.81Å; N147-R192 PolarHBondContact O-NH2 2.79Å; N147-R192 PolarHBondContact OD1-NH1 2.82Å; N147-V295 WeakPolarHBondContact O-CG1 3.39Å | ||
| 148 | A | 84.3 | Confident | 83 | Confident | 31 Ų | 31 | 77.2 Ų | 77.2 | 26% | 0.256 | 40% | 0.398 | S | S | . | . | trans | -89.5 | 4.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L150 V294 V295 | A148-L150 PolarHBondContact O-N 3.47Å; A148-V294 HydrophobicContact CB-CG1 4.02Å; A148-V295 HydrophobicContact CB-CG1 4.17Å | ||
| 149 | D | 81.8 | Confident | 82.9 | Confident | 109 Ų | 109 | 70.9 Ų | 70.9 | 58% | 0.583 | 37% | 0.374 | S | S | * | . | P | Polyproline II helix | trans | -62.5 | 125.2 | -170.6 | -59.5 | -17.7 | 0 | 0 | 0 | 111.6 | N147 | N147-D149 VanDerWaalsContact C-N 3.29Å; N147-D149 HydrophobicContact CB-CB 4.47Å; N147-D149 PolarHBondContact ND2-OD2 2.99Å |
| 150 | L | 77.4 | Confident | 82.8 | Confident | 39 Ų | 39 | 70.7 Ų | 70.7 | 20% | 0.204 | 37% | 0.374 | C | S | . | . | P | Polyproline II helix | trans | -86.8 | 152 | 169.5 | -63.7 | 172.2 | 0 | 0 | 0 | 110 | A148 F154 D156 R159 | A148-L150 PolarHBondContact O-N 3.47Å; L150-F154 HydrophobicContact CB-CB 4.03Å; L150-F154 HydrophobicContact CD1-CB 4.43Å; L150-D156 WeakPolarHBondContact CD1-OD1 3.23Å; L150-R159 HydrophobicContact CD1-CB 4.08Å; L150-R159 HydrophobicContact CD1-CG 4.46Å |
| 151 | P | 77.8 | Confident | 82.8 | Confident | 44 Ų | 44 | 73.2 Ų | 73.2 | 29% | 0.286 | 39% | 0.387 | S | S | . | . | P | Polyproline II helix | trans | -55.6 | 144.2 | 170.9 | -17.1 | 24.6 | 0 | 0 | 0 | 110.8 | H153 F154 L191 | P151-H153 PolarHBondContact O-N 3.28Å; P151-F154 HydrophobicContact CB-CD2 3.6Å; P151-F154 HydrophobicContact CB-CE2 3.96Å; P151-F154 HydrophobicContact CG-CD2 3.62Å; P151-F154 HydrophobicContact CG-CE2 3.93Å; P151-F154 WeakPolarHBondContact O-CB 3.4Å; P151-F154 PolarHBondContact O-N 3.32Å; P151-L191 WeakPolarHBondContact CG-O 3.46Å |
| 152 | R | 71.6 | Confident | 83.1 | Confident | 249 Ų | 249 | 68 Ų | 68 | 94% | 0.94 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.3 | -24.3 | -167.4 | -67.7 | -176.1 | 178.8 | -178.9 | -1 | 117 | F154 | R152-F154 VanDerWaalsContact C-N 3.34Š|
| 153 | H | 75.6 | Confident | 83.6 | Confident | 148 Ų | 148 | 61.9 Ų | 61.9 | 69% | 0.685 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | 1.8 | -179.7 | -50 | -62.6 | 0 | 0 | 0 | 113.4 | P151 | P151-H153 PolarHBondContact O-N 3.28Š|
| 154 | F | 79.6 | Confident | 84.3 | Confident | 21 Ų | 21 | 60.6 Ų | 60.6 | 9% | 0.092 | 33% | 0.328 | C | S | . | . | trans | -116.1 | 124.4 | -179.2 | -59.7 | -58.7 | 0 | 0 | 0 | 109.7 | L150 P151 R152 L191 V196 V198 L201 | L150-F154 HydrophobicContact CB-CB 4.03Å; L150-F154 HydrophobicContact CD1-CB 4.43Å; P151-F154 HydrophobicContact CB-CD2 3.6Å; P151-F154 HydrophobicContact CB-CE2 3.96Å; P151-F154 HydrophobicContact CG-CD2 3.62Å; P151-F154 HydrophobicContact CG-CE2 3.93Å; P151-F154 WeakPolarHBondContact O-CB 3.4Å; P151-F154 PolarHBondContact O-N 3.32Å; R152-F154 VanDerWaalsContact C-N 3.34Å; F154-L191 HydrophobicContact CD2-CD2 4.49Å; F154-L191 HydrophobicContact CE2-CD2 4.09Å; F154-L191 HydrophobicContact CZ-CD2 4.3Å; F154-V196 VanDerWaalsContact CZ-O 3.32Å; F154-V196 WeakPolarHBondContact CZ-O 3.34Å; F154-V198 HydrophobicContact CD1-CG2 4.39Å; F154-V198 HydrophobicContact CE1-CG2 4.06Å; F154-L201 HydrophobicContact CD1-CD1 3.48Å; F154-L201 VanDerWaalsContact CD1-CD1 3.48Å; F154-L201 HydrophobicContact CD1-CD2 4.08Å; F154-L201 HydrophobicContact CD1-CG 4.1Å; F154-L201 HydrophobicContact CE1-CD1 3.23Å; F154-L201 HydrophobicContact CE1-CD2 3.39Å; F154-L201 HydrophobicContact CE1-CG 3.36Å; F154-L201 HydrophobicContact CZ-CD1 4.31Å; F154-L201 HydrophobicContact CZ-CD2 3.64Å; F154-L201 HydrophobicContact CZ-CG 4.01Å | ||
| 155 | T | 85 | Confident | 85.1 | Confident | 76 Ų | 76 | 58.7 Ų | 58.7 | 47% | 0.466 | 31% | 0.313 | S | S | . | . | trans | -99.7 | 159.9 | 174.7 | 68.8 | 0 | 0 | 0 | 0 | 110 | A157 T158 R159 | T155-A157 PolarHBondContact O-N 3.4Å; T155-T158 PolarHBondContact O-N 2.96Å; T155-T158 PolarHBondContact OG1-N 3.08Å; T155-T158 VanDerWaalsContact OG1-N 3.1Å; T155-T158 PolarHBondContact OG1-OG1 3.28Å; T155-R159 PolarHBondContact O-N 3.2Å | ||
| 156 | D | 83.9 | Confident | 85.7 | Confident | 104 Ų | 104 | 57.5 Ų | 57.5 | 56% | 0.556 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -58.1 | -34.4 | 172.9 | -69.1 | -26.2 | 0 | 0 | 0 | 111.9 | L150 R159 A160 A291 | L150-D156 WeakPolarHBondContact CD1-OD1 3.23Å; D156-R159 WeakPolarHBondContact O-CB 3.22Å; D156-R159 PolarHBondContact O-N 3.19Å; D156-A160 WeakPolarHBondContact O-CB 3.33Å; D156-A160 PolarHBondContact O-N 3.45Å; D156-A291 VanDerWaalsContact OD1-CB 3.27Å; D156-A291 WeakPolarHBondContact OD1-CB 3.46Å |
| 157 | A | 85.5 | Confident | 86.4 | Confident | 64 Ų | 64 | 51.8 Ų | 51.8 | 53% | 0.529 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -64.3 | -47.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | T155 R159 A160 I161 | T155-A157 PolarHBondContact O-N 3.4Å; A157-R159 VanDerWaalsContact C-N 3.26Å; A157-R159 PolarHBondContact O-N 3.36Å; A157-A160 PolarHBondContact O-N 3.34Å; A157-I161 WeakPolarHBondContact O-CG1 3.37Å; A157-I161 PolarHBondContact O-N 3.44Å; A157-I161 VanDerWaalsContact O-N 3.08Å |
| 158 | T | 87.1 | Confident | 86.9 | Confident | 28 Ų | 28 | 51.1 Ų | 51.1 | 17% | 0.172 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.9 | -39.2 | 175.6 | -49.5 | 0 | 0 | 0 | 0 | 111.1 | W29 T155 L162 L201 | W29-T158 HydrophobicContact CH2-CG2 3.77Å; W29-T158 HydrophobicContact CZ2-CG2 4.37Å; T155-T158 PolarHBondContact O-N 2.96Å; T155-T158 PolarHBondContact OG1-N 3.08Å; T155-T158 VanDerWaalsContact OG1-N 3.1Å; T155-T158 PolarHBondContact OG1-OG1 3.28Å; T158-L162 WeakPolarHBondContact O-CB 3.22Å; T158-L162 PolarHBondContact O-N 3.17Å; T158-L162 VanDerWaalsContact O-N 3.08Å; T158-L201 HydrophobicContact CG2-CD1 3.81Å |
| 159 | R | 88.4 | Confident | 87.5 | Confident | 19 Ų | 19 | 49.7 Ų | 49.7 | 7% | 0.072 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.6 | -47.1 | 176.8 | -163.7 | -166.7 | 79.4 | 82.6 | -0.3 | 111.2 | L150 T155 D156 A157 I161 L162 V163 L288 L289 E290 | L150-R159 HydrophobicContact CD1-CB 4.08Å; L150-R159 HydrophobicContact CD1-CG 4.46Å; T155-R159 PolarHBondContact O-N 3.2Å; D156-R159 WeakPolarHBondContact O-CB 3.22Å; D156-R159 PolarHBondContact O-N 3.19Å; A157-R159 VanDerWaalsContact C-N 3.26Å; A157-R159 PolarHBondContact O-N 3.36Å; R159-I161 VanDerWaalsContact C-N 3.35Å; R159-I161 PolarHBondContact O-N 3.24Å; R159-L162 WeakPolarHBondContact O-CB 3.32Å; R159-L162 PolarHBondContact O-N 2.84Å; R159-L162 VanDerWaalsContact O-N 3.13Å; R159-V163 HydrophobicContact CG-CG2 4.28Å; R159-V163 WeakPolarHBondContact O-CG2 3.37Å; R159-V163 PolarHBondContact O-N 3.23Å; R159-L288 VanDerWaalsContact CZ-O 3.27Å; R159-L288 PolarHBondContact NH1-O 3.12Å; R159-L288 PolarHBondContact NH2-O 3.32Å; R159-L289 PolarHBondContact NH2-O 3.41Å; R159-E290 VanDerWaalsContact NH2-N 3.15Å |
| 160 | A | 88.6 | Confident | 88.3 | Confident | 18 Ų | 18 | 44.5 Ų | 44.5 | 15% | 0.149 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.6 | -45.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | D156 A157 L162 V163 E164 T358 | D156-A160 WeakPolarHBondContact O-CB 3.33Å; D156-A160 PolarHBondContact O-N 3.45Å; A157-A160 PolarHBondContact O-N 3.34Å; A160-L162 VanDerWaalsContact C-N 3.31Å; A160-L162 PolarHBondContact O-N 3.45Å; A160-V163 PolarHBondContact O-N 2.74Å; A160-E164 VanDerWaalsContact O-CB 3.22Å; A160-E164 WeakPolarHBondContact O-CB 3.24Å; A160-E164 PolarHBondContact O-N 3.05Å; A160-T358 HydrophobicContact CB-CG2 4.25Å |
| 161 | I | 91.3 | Very high | 89.2 | Confident | 55 Ų | 55 | 46.5 Ų | 46.5 | 28% | 0.282 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -60.9 | -40.8 | 175.7 | -65.1 | 165.3 | 0 | 0 | 0 | 111.3 | W29 A32 A157 R159 W165 T358 | W29-I161 HydrophobicContact CE3-CG2 4.19Å; W29-I161 HydrophobicContact CZ3-CB 4.49Å; W29-I161 HydrophobicContact CZ3-CG2 3.95Å; A32-I161 HydrophobicContact CB-CD1 4.43Å; A157-I161 WeakPolarHBondContact O-CG1 3.37Å; A157-I161 PolarHBondContact O-N 3.44Å; A157-I161 VanDerWaalsContact O-N 3.08Å; R159-I161 VanDerWaalsContact C-N 3.35Å; R159-I161 PolarHBondContact O-N 3.24Å; I161-W165 WeakPolarHBondContact O-CB 3.46Å; I161-W165 PolarHBondContact O-N 3Å; I161-T358 HydrophobicContact CG1-CG2 4.49Å |
| 162 | L | 92.9 | Very high | 90 | Very high | 3 Ų | 3 | 46.5 Ų | 46.5 | 2% | 0.016 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -67.4 | -45.1 | 179.2 | -171.1 | 66.7 | 0 | 0 | 0 | 111.9 | W29 T158 R159 A160 W165 I166 L187 L201 S205 | W29-L162 HydrophobicContact CE3-CD1 4.2Å; W29-L162 HydrophobicContact CH2-CB 4.21Å; W29-L162 HydrophobicContact CH2-CD1 3.94Å; W29-L162 HydrophobicContact CZ3-CB 3.91Å; W29-L162 HydrophobicContact CZ3-CD1 3.7Å; W29-L162 HydrophobicContact CZ3-CG 4.43Å; T158-L162 WeakPolarHBondContact O-CB 3.22Å; T158-L162 PolarHBondContact O-N 3.17Å; T158-L162 VanDerWaalsContact O-N 3.08Å; R159-L162 WeakPolarHBondContact O-CB 3.32Å; R159-L162 PolarHBondContact O-N 2.84Å; R159-L162 VanDerWaalsContact O-N 3.13Å; A160-L162 VanDerWaalsContact C-N 3.31Å; A160-L162 PolarHBondContact O-N 3.45Å; L162-W165 PolarHBondContact O-N 3Å; L162-I166 HydrophobicContact CG-CD1 4.47Å; L162-I166 VanDerWaalsContact O-CG1 3.31Å; L162-I166 WeakPolarHBondContact O-CG1 3.33Å; L162-I166 PolarHBondContact O-N 3.16Å; L162-L187 HydrophobicContact CD2-CD2 4.2Å; L162-L201 HydrophobicContact CD1-CB 4.15Å; L162-L201 HydrophobicContact CD2-CB 4.07Å; L162-L201 HydrophobicContact CD2-CD1 4.23Å; L162-L201 HydrophobicContact CD2-CD2 4.07Å; L162-L201 HydrophobicContact CD2-CG 4.37Å; L162-S205 VanDerWaalsContact CD1-OG 3.29Å; L162-S205 WeakPolarHBondContact CD1-OG 3.38Å; L162-S205 VanDerWaalsContact CD2-OG 3.24Å; L162-S205 WeakPolarHBondContact CD2-OG 3.36Å; L162-S205 VanDerWaalsContact CG-OG 3.28Å; L162-S205 WeakPolarHBondContact CG-OG 3.34Å |
| 163 | V | 94 | Very high | 91.2 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.4 | -46.5 | 177.1 | 176.9 | 0 | 0 | 0 | 0 | 110.7 | R159 A160 W165 I166 I167 M184 L288 L289 | R159-V163 HydrophobicContact CG-CG2 4.28Å; R159-V163 WeakPolarHBondContact O-CG2 3.37Å; R159-V163 PolarHBondContact O-N 3.23Å; A160-V163 PolarHBondContact O-N 2.74Å; V163-W165 VanDerWaalsContact C-N 3.28Å; V163-W165 PolarHBondContact O-N 2.64Å; V163-I166 WeakPolarHBondContact O-CB 3.42Å; V163-I166 PolarHBondContact O-N 3.4Å; V163-I166 VanDerWaalsContact O-N 3.11Å; V163-I167 HydrophobicContact CG1-CD1 3.91Å; V163-I167 HydrophobicContact CG1-CG1 4.4Å; V163-I167 WeakPolarHBondContact O-CG1 3.37Å; V163-I167 PolarHBondContact O-N 3.33Å; V163-M184 HydrophobicContact CB-CE 4.29Å; V163-M184 HydrophobicContact CG1-CE 4.08Å; V163-M184 HydrophobicContact CG1-SD 4.18Å; V163-M184 HydrophobicContact CG2-CE 3.4Å; V163-M184 VanDerWaalsContact CG2-CE 3.4Å; V163-M184 HydrophobicContact CG2-SD 4.24Å; V163-L288 HydrophobicContact CG1-CB 4.03Å; V163-L289 HydrophobicContact CB-CD2 4.09Å; V163-L289 HydrophobicContact CG1-CD2 3.97Å; V163-L289 HydrophobicContact CG1-CG 4.25Å |
| 164 | E | 94.4 | Very high | 92.2 | Very high | 7 Ų | 7 | 34.8 Ų | 34.8 | 3% | 0.033 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -50.9 | -49 | 173.3 | 171.2 | 72 | -173.8 | 0 | 0 | 111.2 | A160 I167 Q168 L289 T358 C359 A360 | A160-E164 VanDerWaalsContact O-CB 3.22Å; A160-E164 WeakPolarHBondContact O-CB 3.24Å; A160-E164 PolarHBondContact O-N 3.05Å; E164-I167 PolarHBondContact O-N 3.46Å; E164-Q168 WeakPolarHBondContact O-CG 3.43Å; E164-Q168 PolarHBondContact O-N 2.91Å; E164-Q168 PolarHBondContact OE1-NE2 3.13Å; E164-L289 HydrophobicContact CB-CD2 4.48Å; E164-T358 HydrophobicContact CB-CG2 3.7Å; E164-T358 VanDerWaalsContact CD-CA 3.49Å; E164-T358 HydrophobicContact CG-CG2 3.97Å; E164-T358 WeakPolarHBondContact OE2-CA 3.33Å; E164-C359 PolarHBondContact OE1-N 3.07Å; E164-C359 VanDerWaalsContact OE1-N 3.15Å; E164-C359 PolarHBondContact OE2-N 3.14Å; E164-C359 VanDerWaalsContact OE2-N 3.14Å; E164-A360 HydrophobicContact CG-CB 4.45Å; E164-A360 WeakPolarHBondContact OE1-CA 3.47Å; E164-A360 WeakPolarHBondContact OE1-CB 3.48Å; E164-A360 PolarHBondContact OE1-N 3.36Å; E164-A360 VanDerWaalsContact OE2-CB 3.28Å; E164-A360 WeakPolarHBondContact OE2-CB 3.45Å; E164-A360 PolarHBondContact OE2-N 2.9Å |
| 165 | W | 95.6 | Very high | 93 | Very high | 11 Ų | 11 | 34.7 Ų | 34.7 | 4% | 0.042 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -63.5 | -41.9 | 178.1 | 177.2 | 81.1 | 0 | 0 | 0 | 112.5 | I161 L162 V163 I167 Q168 V169 Q202 M206 M230 | I161-W165 WeakPolarHBondContact O-CB 3.46Å; I161-W165 PolarHBondContact O-N 3Å; L162-W165 PolarHBondContact O-N 3Å; V163-W165 VanDerWaalsContact C-N 3.28Å; V163-W165 PolarHBondContact O-N 2.64Å; W165-I167 VanDerWaalsContact C-N 3.31Å; W165-I167 PolarHBondContact O-N 3.46Å; W165-Q168 PolarHBondContact O-N 3.26Å; W165-V169 HydrophobicContact CD2-CG2 4.01Å; W165-V169 HydrophobicContact CE3-CG2 4.49Å; W165-V169 HydrophobicContact CH2-CG2 4.27Å; W165-V169 HydrophobicContact CZ2-CG2 3.72Å; W165-V169 WeakPolarHBondContact O-CG2 3.22Å; W165-V169 PolarHBondContact O-N 2.91Å; W165-Q202 HydrophobicContact CD2-CG 4.35Å; W165-Q202 HydrophobicContact CE3-CG 4.18Å; W165-Q202 HydrophobicContact CH2-CG 3.41Å; W165-Q202 VanDerWaalsContact CH2-CG 3.41Å; W165-Q202 HydrophobicContact CZ2-CG 3.63Å; W165-Q202 VanDerWaalsContact CZ2-NE2 3.31Å; W165-Q202 HydrophobicContact CZ3-CG 3.74Å; W165-M206 HydrophobicContact CH2-CB 4.09Å; W165-M206 HydrophobicContact CH2-CE 3.61Å; W165-M206 HydrophobicContact CZ2-CE 3.95Å; W165-M206 HydrophobicContact CZ3-CB 4.49Å; W165-M230 HydrophobicContact CH2-CG 3.96Å; W165-M230 HydrophobicContact CH2-SD 4.37Å; W165-M230 HydrophobicContact CZ2-CG 3.94Å |
| 166 | I | 97.6 | Very high | 93.6 | Very high | 2 Ų | 2 | 36.5 Ų | 36.5 | 1% | 0.01 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.3 | -43.6 | 175.7 | -66.9 | 164.8 | 0 | 0 | 0 | 110.7 | L162 V163 Q168 V169 H170 L180 M184 L187 | L162-I166 HydrophobicContact CG-CD1 4.47Å; L162-I166 VanDerWaalsContact O-CG1 3.31Å; L162-I166 WeakPolarHBondContact O-CG1 3.33Å; L162-I166 PolarHBondContact O-N 3.16Å; V163-I166 WeakPolarHBondContact O-CB 3.42Å; V163-I166 PolarHBondContact O-N 3.4Å; V163-I166 VanDerWaalsContact O-N 3.11Å; I166-Q168 VanDerWaalsContact C-N 3.35Å; I166-Q168 PolarHBondContact O-N 3.49Å; I166-V169 PolarHBondContact O-N 3.09Å; I166-H170 WeakPolarHBondContact O-CB 3.31Å; I166-H170 PolarHBondContact O-N 2.9Å; I166-L180 HydrophobicContact CG2-CD1 3.81Å; I166-M184 HydrophobicContact CD1-SD 3.77Å; I166-M184 HydrophobicContact CG2-SD 4.3Å; I166-L187 HydrophobicContact CD1-CD2 3.51Å |
| 167 | I | 96.8 | Very high | 94.1 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.2 | -43.8 | 178.4 | -66.5 | 172.1 | 0 | 0 | 0 | 110.3 | V163 E164 W165 V169 H170 E171 L180 A360 T361 | V163-I167 HydrophobicContact CG1-CD1 3.91Å; V163-I167 HydrophobicContact CG1-CG1 4.4Å; V163-I167 WeakPolarHBondContact O-CG1 3.37Å; V163-I167 PolarHBondContact O-N 3.33Å; E164-I167 PolarHBondContact O-N 3.46Å; W165-I167 VanDerWaalsContact C-N 3.31Å; W165-I167 PolarHBondContact O-N 3.46Å; I167-V169 PolarHBondContact O-N 3.32Å; I167-H170 PolarHBondContact O-N 2.75Å; I167-E171 WeakPolarHBondContact O-CG 3.47Å; I167-E171 PolarHBondContact O-N 2.94Å; I167-L180 HydrophobicContact CG1-CD1 4.04Å; I167-L180 HydrophobicContact CG1-CD2 4.09Å; I167-A360 HydrophobicContact CB-CB 4.37Å; I167-A360 HydrophobicContact CG2-CB 3.94Å; I167-T361 WeakPolarHBondContact CD1-OG1 3.32Å |
| 168 | Q | 96.3 | Very high | 94.6 | Very high | 46 Ų | 46 | 31.9 Ų | 31.9 | 22% | 0.215 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.3 | -42.5 | 176.4 | -67.7 | 174 | 2.1 | 0 | 0 | 112.6 | L26 E164 W165 I166 L172 A360 | L26-Q168 HydrophobicContact CD2-CB 4.09Å; E164-Q168 WeakPolarHBondContact O-CG 3.43Å; E164-Q168 PolarHBondContact O-N 2.91Å; E164-Q168 PolarHBondContact OE1-NE2 3.13Å; W165-Q168 PolarHBondContact O-N 3.26Å; I166-Q168 VanDerWaalsContact C-N 3.35Å; I166-Q168 PolarHBondContact O-N 3.49Å; Q168-L172 WeakPolarHBondContact O-CB 3.24Å; Q168-L172 PolarHBondContact O-N 3.45Å; Q168-A360 HydrophobicContact CG-CB 3.65Å |
| 169 | V | 97.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -67.9 | -42.5 | 177.8 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | W165 I166 I167 L172 L173 M206 L209 L229 | W165-V169 HydrophobicContact CD2-CG2 4.01Å; W165-V169 HydrophobicContact CE3-CG2 4.49Å; W165-V169 HydrophobicContact CH2-CG2 4.27Å; W165-V169 HydrophobicContact CZ2-CG2 3.72Å; W165-V169 WeakPolarHBondContact O-CG2 3.22Å; W165-V169 PolarHBondContact O-N 2.91Å; I166-V169 PolarHBondContact O-N 3.09Å; I167-V169 PolarHBondContact O-N 3.32Å; V169-L172 PolarHBondContact O-N 3.21Å; V169-L173 HydrophobicContact CG1-CD1 3.84Å; V169-L173 HydrophobicContact CG1-CG 4.39Å; V169-L173 WeakPolarHBondContact O-CG 3.22Å; V169-L173 PolarHBondContact O-N 2.97Å; V169-M206 HydrophobicContact CG1-CE 3.8Å; V169-M206 HydrophobicContact CG1-SD 4.42Å; V169-M206 HydrophobicContact CG2-CE 4.49Å; V169-L209 HydrophobicContact CB-CD2 4.3Å; V169-L209 HydrophobicContact CG1-CD2 3.72Å; V169-L229 HydrophobicContact CG1-CD1 4.07Å |
| 170 | H | 97.6 | Very high | 95.7 | Very high | 1 Ų | 1 | 29.7 Ų | 29.7 | 1% | 0.005 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -56.6 | -48.4 | 175 | 166.2 | -94.1 | 0 | 0 | 0 | 111.3 | I166 I167 L172 L173 Q174 F175 Q176 L180 L209 | I166-H170 WeakPolarHBondContact O-CB 3.31Å; I166-H170 PolarHBondContact O-N 2.9Å; I167-H170 PolarHBondContact O-N 2.75Å; H170-L172 PolarHBondContact O-N 2.98Å; H170-L173 PolarHBondContact O-N 2.8Å; H170-Q174 PolarHBondContact O-N 3.27Å; H170-F175 PolarHBondContact CE1-O 3.37Å; H170-F175 PolarHBondContact NE2-O 2.89Å; H170-F175 VanDerWaalsContact NE2-O 3.1Å; H170-F175 PolarHBondContact O-N 2.95Å; H170-Q176 PolarHBondContact NE2-O 3.24Å; H170-L180 HydrophobicContact CB-CD1 4.24Å; H170-L209 HydrophobicContact CB-CD1 4.42Å |
| 171 | E | 95.7 | Very high | 96.1 | Very high | 81 Ų | 81 | 29 Ų | 29 | 38% | 0.379 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -64.5 | -37.2 | 176.2 | -72.5 | -67.7 | 117.1 | 0 | 0 | 112.7 | I167 L173 Q174 K364 | I167-E171 WeakPolarHBondContact O-CG 3.47Å; I167-E171 PolarHBondContact O-N 2.94Å; E171-L173 VanDerWaalsContact C-N 3.35Å; E171-Q174 PolarHBondContact O-N 3.33Å; E171-K364 VanDerWaalsContact CD-CD 3.47Å; E171-K364 HydrophobicContact CG-CD 4.02Å; E171-K364 HydrophobicContact CG-CG 4.46Å; E171-K364 VanDerWaalsContact OE1-CD 3.31Å; E171-K364 WeakPolarHBondContact OE1-CD 3.21Å; E171-K364 WeakPolarHBondContact OE1-CE 3.43Å; E171-K364 IonicContact OE1-NZ 3.06Å; E171-K364 PolarHBondContact OE1-NZ 2.91Å |
| 172 | L | 96.3 | Very high | 96.4 | Very high | 43 Ų | 43 | 26.5 Ų | 26.5 | 23% | 0.225 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -65.3 | -38.7 | 176.3 | 169.8 | 61.7 | 0 | 0 | 0 | 112 | L26 Q168 V169 H170 Q174 L229 | L26-L172 HydrophobicContact CD1-CD2 4.07Å; Q168-L172 WeakPolarHBondContact O-CB 3.24Å; Q168-L172 PolarHBondContact O-N 3.45Å; V169-L172 PolarHBondContact O-N 3.21Å; H170-L172 PolarHBondContact O-N 2.98Å; L172-Q174 VanDerWaalsContact C-N 3.28Å; L172-L229 HydrophobicContact CD2-CD2 3.32Å; L172-L229 HydrophobicContact CG-CD2 4.34Å |
| 173 | L | 96.1 | Very high | 96.7 | Very high | 13 Ų | 13 | 26.4 Ų | 26.4 | 7% | 0.068 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -78.3 | -13 | 176.7 | -68.2 | 172.4 | 0 | 0 | 0 | 113 | V169 H170 E171 F175 L209 P221 L226 L229 | V169-L173 HydrophobicContact CG1-CD1 3.84Å; V169-L173 HydrophobicContact CG1-CG 4.39Å; V169-L173 WeakPolarHBondContact O-CG 3.22Å; V169-L173 PolarHBondContact O-N 2.97Å; H170-L173 PolarHBondContact O-N 2.8Å; E171-L173 VanDerWaalsContact C-N 3.35Å; L173-F175 VanDerWaalsContact C-N 3.27Å; L173-F175 HydrophobicContact CB-CD1 4.12Å; L173-F175 HydrophobicContact CB-CD2 3.89Å; L173-F175 HydrophobicContact CB-CE1 4.03Å; L173-F175 HydrophobicContact CB-CE2 3.8Å; L173-F175 HydrophobicContact CB-CG 4.06Å; L173-F175 HydrophobicContact CB-CZ 3.87Å; L173-F175 HydrophobicContact CD1-CD2 4.1Å; L173-F175 HydrophobicContact CD1-CE2 3.4Å; L173-F175 VanDerWaalsContact CD1-CE2 3.4Å; L173-F175 HydrophobicContact CD1-CZ 3.79Å; L173-F175 HydrophobicContact CG-CE2 4.19Å; L173-F175 HydrophobicContact CG-CZ 4.3Å; L173-F175 PolarHBondContact O-N 3.47Å; L173-L209 HydrophobicContact CD1-CD2 4.34Å; L173-P221 HydrophobicContact CD2-CB 4.24Å; L173-P221 HydrophobicContact CD2-CG 4.16Å; L173-L226 HydrophobicContact CD1-CD2 4.42Å; L173-L229 HydrophobicContact CD1-CD1 4.21Å; L173-L229 HydrophobicContact CD2-CD1 3.96Å; L173-L229 HydrophobicContact CG-CD1 4.22Å |
| 174 | Q | 96 | Very high | 96.8 | Very high | 139 Ų | 139 | 26.6 Ų | 26.6 | 65% | 0.65 | 13% | 0.125 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 58.7 | 37.2 | -179.3 | -51.2 | -168.7 | -40.7 | 0 | 0 | 113.3 | H170 E171 L172 | H170-Q174 PolarHBondContact O-N 3.27Å; E171-Q174 PolarHBondContact O-N 3.33Å; L172-Q174 VanDerWaalsContact C-N 3.28Å |
| 175 | F | 97.4 | Very high | 96.9 | Very high | 19 Ų | 19 | 26.7 Ų | 26.7 | 8% | 0.083 | 13% | 0.126 | C | C | . | . | trans | -74.1 | 158.8 | 174.3 | -69 | -23.1 | 0 | 0 | 0 | 111.7 | H170 L173 T179 L209 A213 E217 P221 | H170-F175 PolarHBondContact CE1-O 3.37Å; H170-F175 PolarHBondContact NE2-O 2.89Å; H170-F175 VanDerWaalsContact NE2-O 3.1Å; H170-F175 PolarHBondContact O-N 2.95Å; L173-F175 VanDerWaalsContact C-N 3.27Å; L173-F175 HydrophobicContact CB-CD1 4.12Å; L173-F175 HydrophobicContact CB-CD2 3.89Å; L173-F175 HydrophobicContact CB-CE1 4.03Å; L173-F175 HydrophobicContact CB-CE2 3.8Å; L173-F175 HydrophobicContact CB-CG 4.06Å; L173-F175 HydrophobicContact CB-CZ 3.87Å; L173-F175 HydrophobicContact CD1-CD2 4.1Å; L173-F175 HydrophobicContact CD1-CE2 3.4Å; L173-F175 VanDerWaalsContact CD1-CE2 3.4Å; L173-F175 HydrophobicContact CD1-CZ 3.79Å; L173-F175 HydrophobicContact CG-CE2 4.19Å; L173-F175 HydrophobicContact CG-CZ 4.3Å; L173-F175 PolarHBondContact O-N 3.47Å; F175-T179 HydrophobicContact CB-CG2 4.06Å; F175-T179 HydrophobicContact CD2-CG2 3.88Å; F175-T179 HydrophobicContact CG-CG2 4.19Å; F175-L209 HydrophobicContact CD2-CD1 4.28Å; F175-L209 HydrophobicContact CE2-CG 4.44Å; F175-A213 HydrophobicContact CD2-CB 4.13Å; F175-A213 HydrophobicContact CE1-CB 4.29Å; F175-A213 HydrophobicContact CE2-CB 3.53Å; F175-A213 HydrophobicContact CZ-CB 3.63Å; F175-E217 WeakPolarHBondContact CA-OE1 3.48Å; F175-E217 HydrophobicContact CB-CG 4.38Å; F175-E217 VanDerWaalsContact CB-OE1 3.24Å; F175-E217 WeakPolarHBondContact CB-OE1 3.37Å; F175-E217 HydrophobicContact CD1-CB 4.49Å; F175-E217 HydrophobicContact CD1-CG 3.61Å; F175-E217 HydrophobicContact CE1-CG 3.97Å; F175-E217 HydrophobicContact CG-CG 3.99Å; F175-P221 HydrophobicContact CZ-CG 4.14Å | ||
| 176 | Q | 96 | Very high | 96.9 | Very high | 113 Ų | 113 | 26.1 Ų | 26.1 | 53% | 0.528 | 12% | 0.124 | S | C | . | . | trans | -65.7 | 156.7 | 173.9 | -58.2 | -56.4 | -41.6 | 0 | 0 | 111.3 | H170 E178 T179 E217 | H170-Q176 PolarHBondContact NE2-O 3.24Å; Q176-E178 VanDerWaalsContact C-N 3.26Å; Q176-E178 WeakPolarHBondContact CB-OE2 3.39Å; Q176-E178 PolarHBondContact O-N 2.92Å; Q176-T179 VanDerWaalsContact O-CB 3.31Å; Q176-T179 WeakPolarHBondContact O-CB 3.37Å; Q176-T179 PolarHBondContact O-N 3.31Å; Q176-E217 PolarHBondContact N-OE1 3.38Å | ||
| 177 | E | 96.4 | Very high | 96.9 | Very high | 31 Ų | 31 | 26.1 Ų | 26.1 | 15% | 0.145 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.9 | -33.6 | -176.5 | -60.9 | -174.8 | 111.5 | 0 | 0 | 111.4 | T179 L180 Y181 L260 R281 Y365 | E177-T179 VanDerWaalsContact C-N 3.26Å; E177-T179 PolarHBondContact O-N 2.9Å; E177-L180 WeakPolarHBondContact O-CB 3.42Å; E177-L180 PolarHBondContact O-N 2.88Å; E177-Y181 VanDerWaalsContact O-CD2 3.22Å; E177-Y181 WeakPolarHBondContact O-CD2 3.44Å; E177-Y181 PolarHBondContact O-N 3.15Å; E177-Y181 VanDerWaalsContact O-N 3.15Å; E177-L260 HydrophobicContact CB-CD2 3.43Å; E177-L260 VanDerWaalsContact CB-CD2 3.43Å; E177-L260 HydrophobicContact CG-CD2 4.39Å; E177-R281 IonicContact OE2-NE 3.37Å; E177-R281 PolarHBondContact OE2-NE 2.8Å; E177-Y365 PolarHBondContact OE1-OH 2.94Å |
| 178 | E | 95.9 | Very high | 96.7 | Very high | 41 Ų | 41 | 27.3 Ų | 27.3 | 19% | 0.192 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -54.6 | -42.5 | 174.9 | -66.8 | 76.3 | -169.7 | 0 | 0 | 111.4 | Q176 L180 Y181 L182 H261 | Q176-E178 VanDerWaalsContact C-N 3.26Å; Q176-E178 WeakPolarHBondContact CB-OE2 3.39Å; Q176-E178 PolarHBondContact O-N 2.92Å; E178-L180 VanDerWaalsContact C-N 3.3Å; E178-L180 PolarHBondContact O-N 2.56Å; E178-Y181 PolarHBondContact O-N 2.81Å; E178-L182 WeakPolarHBondContact O-CB 3.24Å; E178-L182 PolarHBondContact O-N 3.28Å; E178-H261 VanDerWaalsContact CG-NE2 3.33Å; E178-H261 WeakPolarHBondContact CG-NE2 3.36Å; E178-H261 IonicContact OE1-NE2 2.98Å |
| 179 | T | 98.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -59.4 | -40.3 | 176.8 | -58.6 | 0 | 0 | 0 | 0 | 111.5 | F175 Q176 E177 A183 L209 A212 A213 E216 E217 | F175-T179 HydrophobicContact CB-CG2 4.06Å; F175-T179 HydrophobicContact CD2-CG2 3.88Å; F175-T179 HydrophobicContact CG-CG2 4.19Å; Q176-T179 VanDerWaalsContact O-CB 3.31Å; Q176-T179 WeakPolarHBondContact O-CB 3.37Å; Q176-T179 PolarHBondContact O-N 3.31Å; E177-T179 VanDerWaalsContact C-N 3.26Å; E177-T179 PolarHBondContact O-N 2.9Å; T179-A183 VanDerWaalsContact O-CB 3.22Å; T179-A183 WeakPolarHBondContact O-CB 3.48Å; T179-A183 PolarHBondContact O-N 3.48Å; T179-L209 HydrophobicContact CG2-CD1 4.13Å; T179-A212 HydrophobicContact CG2-CB 3.99Å; T179-A212 VanDerWaalsContact O-CB 3.32Å; T179-A212 WeakPolarHBondContact O-CB 3.36Å; T179-A213 HydrophobicContact CG2-CB 4.06Å; T179-E216 WeakPolarHBondContact OG1-CB 3.24Å; T179-E217 HydrophobicContact CG2-CG 4.34Å; T179-E217 PolarHBondContact OG1-OE1 2.92Å |
| 180 | L | 98.4 | Very high | 96.4 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -66.2 | -48.5 | 176.9 | 176.7 | 62.6 | 0 | 0 | 0 | 111.4 | I166 I167 H170 E177 E178 L182 A183 M184 E285 L288 | I166-L180 HydrophobicContact CG2-CD1 3.81Å; I167-L180 HydrophobicContact CG1-CD1 4.04Å; I167-L180 HydrophobicContact CG1-CD2 4.09Å; H170-L180 HydrophobicContact CB-CD1 4.24Å; E177-L180 WeakPolarHBondContact O-CB 3.42Å; E177-L180 PolarHBondContact O-N 2.88Å; E178-L180 VanDerWaalsContact C-N 3.3Å; E178-L180 PolarHBondContact O-N 2.56Å; L180-L182 VanDerWaalsContact C-N 3.34Å; L180-L182 PolarHBondContact O-N 2.92Å; L180-A183 WeakPolarHBondContact O-CB 3.33Å; L180-A183 PolarHBondContact O-N 3.41Å; L180-M184 HydrophobicContact CD1-CG 4.29Å; L180-M184 WeakPolarHBondContact O-CG 3.5Å; L180-M184 PolarHBondContact O-N 3.47Å; L180-E285 HydrophobicContact CD2-CG 4.21Å; L180-L288 HydrophobicContact CD2-CD1 3.94Å; L180-L288 HydrophobicContact CG-CD1 4Å |
| 181 | Y | 97.9 | Very high | 96.1 | Very high | 5 Ų | 5 | 27.1 Ų | 27.1 | 2% | 0.02 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -62.6 | -41.6 | -180 | -76.2 | -72.9 | 0 | 0 | 0 | 111.9 | E177 E178 M184 H185 P258 P259 L260 L284 E285 L288 | E177-Y181 VanDerWaalsContact O-CD2 3.22Å; E177-Y181 WeakPolarHBondContact O-CD2 3.44Å; E177-Y181 PolarHBondContact O-N 3.15Å; E177-Y181 VanDerWaalsContact O-N 3.15Å; E178-Y181 PolarHBondContact O-N 2.81Å; Y181-M184 PolarHBondContact O-N 3.46Å; Y181-H185 WeakPolarHBondContact O-CB 3.42Å; Y181-H185 PolarHBondContact O-N 2.9Å; Y181-P258 HydrophobicContact CG-CB 4.43Å; Y181-P259 HydrophobicContact CD1-CG 3.58Å; Y181-P259 HydrophobicContact CE1-CG 3.71Å; Y181-P259 HydrophobicContact CG-CG 4.31Å; Y181-L260 HydrophobicContact CD2-CB 3.98Å; Y181-L260 HydrophobicContact CD2-CD2 4.39Å; Y181-L260 HydrophobicContact CE2-CB 3.83Å; Y181-L260 HydrophobicContact CE2-CD2 4.22Å; Y181-L260 HydrophobicContact CE2-CG 4.46Å; Y181-L284 HydrophobicContact CE1-CD2 4.29Å; Y181-L284 HydrophobicContact CE1-CG 4.12Å; Y181-L284 WeakPolarHBondContact OH-CD2 3.33Å; Y181-L284 WeakPolarHBondContact OH-CG 3.29Å; Y181-E285 PolarHBondContact OH-N 3.1Å; Y181-L288 HydrophobicContact CD1-CD1 4.34Å; Y181-L288 HydrophobicContact CD1-CD2 3.9Å; Y181-L288 HydrophobicContact CE1-CD1 4.08Å; Y181-L288 HydrophobicContact CE1-CD2 3.92Å; Y181-L288 HydrophobicContact CE1-CG 4.15Å |
| 182 | L | 97.9 | Very high | 95.8 | Very high | 1 Ų | 1 | 27.3 Ų | 27.3 | 1% | 0.005 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -64 | -45.6 | 173.9 | 176.1 | 62.4 | 0 | 0 | 0 | 111.3 | E178 L180 M184 H185 L186 A212 K215 E216 L254 F256 | E178-L182 WeakPolarHBondContact O-CB 3.24Å; E178-L182 PolarHBondContact O-N 3.28Å; L180-L182 VanDerWaalsContact C-N 3.34Å; L180-L182 PolarHBondContact O-N 2.92Å; L182-M184 VanDerWaalsContact C-N 3.29Å; L182-M184 PolarHBondContact O-N 3.13Å; L182-H185 WeakPolarHBondContact O-CB 3.28Å; L182-H185 PolarHBondContact O-N 3.38Å; L182-H185 VanDerWaalsContact O-N 3.15Å; L182-L186 HydrophobicContact CD1-CD1 4.22Å; L182-L186 HydrophobicContact CD1-CD2 4.25Å; L182-L186 HydrophobicContact CD1-CG 3.99Å; L182-L186 HydrophobicContact CG-CD1 4.11Å; L182-L186 HydrophobicContact CG-CG 4.29Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.36Å; L182-L186 PolarHBondContact O-N 3.25Å; L182-A212 HydrophobicContact CB-CB 3.97Å; L182-A212 HydrophobicContact CD2-CB 3.76Å; L182-A212 HydrophobicContact CG-CB 3.72Å; L182-K215 HydrophobicContact CD2-CB 4.08Å; L182-K215 HydrophobicContact CD2-CD 3.72Å; L182-K215 HydrophobicContact CD2-CG 4.3Å; L182-E216 HydrophobicContact CD2-CG 3.88Å; L182-L254 WeakPolarHBondContact CD1-O 3.31Å; L182-F256 HydrophobicContact CD1-CB 3.82Å; L182-F256 HydrophobicContact CD1-CD1 4.44Å |
| 183 | A | 98.3 | Very high | 95.6 | Very high | 2 Ų | 2 | 29.8 Ų | 29.8 | 2% | 0.017 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -56.6 | -44.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | T179 L180 L186 L187 L209 A212 | T179-A183 VanDerWaalsContact O-CB 3.22Å; T179-A183 WeakPolarHBondContact O-CB 3.48Å; T179-A183 PolarHBondContact O-N 3.48Å; L180-A183 WeakPolarHBondContact O-CB 3.33Å; L180-A183 PolarHBondContact O-N 3.41Å; A183-L186 PolarHBondContact O-N 3.04Å; A183-L187 WeakPolarHBondContact O-CB 3.31Å; A183-L187 PolarHBondContact O-N 3.36Å; A183-L209 HydrophobicContact CB-CB 4.15Å; A183-L209 HydrophobicContact CB-CD1 3.77Å; A183-A212 HydrophobicContact CB-CB 3.87Å |
| 184 | M | 96.8 | Very high | 95.4 | Very high | 3 Ų | 3 | 30.1 Ų | 30.1 | 2% | 0.015 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65.5 | -40.5 | 177.1 | -71.7 | -51.3 | -52.6 | 0 | 0 | 112.4 | V163 I166 L180 Y181 L182 L187 N188 L288 | V163-M184 HydrophobicContact CB-CE 4.29Å; V163-M184 HydrophobicContact CG1-CE 4.08Å; V163-M184 HydrophobicContact CG1-SD 4.18Å; V163-M184 HydrophobicContact CG2-CE 3.4Å; V163-M184 VanDerWaalsContact CG2-CE 3.4Å; V163-M184 HydrophobicContact CG2-SD 4.24Å; I166-M184 HydrophobicContact CD1-SD 3.77Å; I166-M184 HydrophobicContact CG2-SD 4.3Å; L180-M184 HydrophobicContact CD1-CG 4.29Å; L180-M184 WeakPolarHBondContact O-CG 3.5Å; L180-M184 PolarHBondContact O-N 3.47Å; Y181-M184 PolarHBondContact O-N 3.46Å; L182-M184 VanDerWaalsContact C-N 3.29Å; L182-M184 PolarHBondContact O-N 3.13Å; M184-L187 HydrophobicContact CE-CD2 4.12Å; M184-L187 PolarHBondContact O-N 2.99Å; M184-L187 HydrophobicContact SD-CD2 4.32Å; M184-N188 WeakPolarHBondContact O-CB 3.48Å; M184-N188 VanDerWaalsContact O-CG 3.29Å; M184-N188 PolarHBondContact O-N 3.41Å; M184-N188 PolarHBondContact O-ND2 2.91Å; M184-N188 VanDerWaalsContact O-ND2 3.13Å; M184-L288 HydrophobicContact CB-CD2 4.11Å; M184-L288 HydrophobicContact CG-CD1 4.15Å; M184-L288 HydrophobicContact CG-CD2 4.11Å |
| 185 | H | 95.7 | Very high | 95.1 | Very high | 9 Ų | 9 | 33 Ų | 33 | 4% | 0.042 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.7 | -48.4 | 173.2 | 173.9 | 72.5 | 0 | 0 | 0 | 111.7 | Y143 Y181 L182 L187 N188 R189 F256 | Y143-H185 AromaticContact CD1-CE1 3.8Å; Y143-H185 AromaticContact CD1-NE2 3.88Å; Y143-H185 AromaticContact CG-CE1 3.9Å; Y181-H185 WeakPolarHBondContact O-CB 3.42Å; Y181-H185 PolarHBondContact O-N 2.9Å; L182-H185 WeakPolarHBondContact O-CB 3.28Å; L182-H185 PolarHBondContact O-N 3.38Å; L182-H185 VanDerWaalsContact O-N 3.15Å; H185-L187 PolarHBondContact O-N 3.16Å; H185-N188 PolarHBondContact O-N 3.39Å; H185-R189 WeakPolarHBondContact CE1-CD 3.45Å; H185-R189 WeakPolarHBondContact NE2-CD 3.46Å; H185-R189 PolarHBondContact NE2-NH1 3.33Å; H185-R189 PolarHBondContact O-N 3.19Å; H185-F256 HydrophobicContact CB-CD1 3.76Å; H185-F256 HydrophobicContact CB-CD2 4Å; H185-F256 HydrophobicContact CB-CE1 3.77Å; H185-F256 HydrophobicContact CB-CE2 4.03Å; H185-F256 HydrophobicContact CB-CG 3.88Å; H185-F256 HydrophobicContact CB-CZ 3.92Å; H185-F256 AromaticContact CD2-CD2 3.75Å; H185-F256 AromaticContact CD2-CG 3.7Å; H185-F256 AromaticContact CE1-CD2 3.67Å; H185-F256 AromaticContact CG-CD2 3.41Å; H185-F256 VanDerWaalsContact CG-CD2 3.41Å; H185-F256 AromaticContact CG-CE2 3.73Å; H185-F256 AromaticContact CG-CG 3.57Å; H185-F256 AromaticContact ND1-CD2 3.36Å; H185-F256 WeakPolarHBondContact ND1-CD2 3.48Å; H185-F256 AromaticContact ND1-CE2 3.46Å; H185-F256 WeakPolarHBondContact ND1-CE2 3.29Å; H185-F256 AromaticContact NE2-CD2 3.93Å |
| 186 | L | 97.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -63 | -40.3 | 178.2 | -64.2 | 179.4 | 0 | 0 | 0 | 112 | L182 A183 R189 S190 C208 L211 A212 L250 L254 | L182-L186 HydrophobicContact CD1-CD1 4.22Å; L182-L186 HydrophobicContact CD1-CD2 4.25Å; L182-L186 HydrophobicContact CD1-CG 3.99Å; L182-L186 HydrophobicContact CG-CD1 4.11Å; L182-L186 HydrophobicContact CG-CG 4.29Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.36Å; L182-L186 PolarHBondContact O-N 3.25Å; A183-L186 PolarHBondContact O-N 3.04Å; L186-R189 PolarHBondContact O-N 3.46Å; L186-S190 VanDerWaalsContact O-CB 3.23Å; L186-S190 WeakPolarHBondContact O-CB 3.36Å; L186-S190 PolarHBondContact O-N 3.09Å; L186-S190 PolarHBondContact O-OG 3.37Å; L186-C208 HydrophobicContact CB-CB 4.12Å; L186-L211 HydrophobicContact CD1-CB 4.04Å; L186-A212 HydrophobicContact CD1-CB 4.44Å; L186-L250 HydrophobicContact CB-CD1 4.49Å; L186-L250 HydrophobicContact CD2-CD1 3.69Å; L186-L254 HydrophobicContact CD1-CD2 4.13Å; L186-L254 HydrophobicContact CD2-CB 4.39Å; L186-L254 HydrophobicContact CD2-CD2 3.56Å |
| 187 | L | 95.8 | Very high | 94.4 | Very high | 2 Ų | 2 | 30.4 Ų | 30.4 | 1% | 0.01 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.4 | -49.9 | 176 | 176.5 | 60.8 | 0 | 0 | 0 | 111.2 | L162 I166 A183 M184 H185 R189 S190 L191 L204 C208 | L162-L187 HydrophobicContact CD2-CD2 4.2Å; I166-L187 HydrophobicContact CD1-CD2 3.51Å; A183-L187 WeakPolarHBondContact O-CB 3.31Å; A183-L187 PolarHBondContact O-N 3.36Å; M184-L187 HydrophobicContact CE-CD2 4.12Å; M184-L187 PolarHBondContact O-N 2.99Å; M184-L187 HydrophobicContact SD-CD2 4.32Å; H185-L187 PolarHBondContact O-N 3.16Å; L187-R189 VanDerWaalsContact C-N 3.33Å; L187-R189 PolarHBondContact O-N 2.91Å; L187-S190 PolarHBondContact O-N 3.21Å; L187-S190 VanDerWaalsContact O-N 3.16Å; L187-L191 HydrophobicContact CD1-CD1 4.15Å; L187-L191 HydrophobicContact CD1-CG 4.1Å; L187-L191 HydrophobicContact CG-CD1 4.14Å; L187-L191 WeakPolarHBondContact O-CG 3.45Å; L187-L191 PolarHBondContact O-N 3.2Å; L187-L204 HydrophobicContact CD1-CD2 3.73Å; L187-L204 HydrophobicContact CD1-CG 3.89Å; L187-C208 HydrophobicContact CB-CB 4.19Å |
| 188 | N | 93.1 | Very high | 94 | Very high | 25 Ų | 25 | 30.9 Ų | 30.9 | 13% | 0.134 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61.1 | -40.1 | 180 | -73.4 | -33.2 | 0 | 0 | 0 | 112.2 | F145 M184 H185 V294 | F145-N188 HydrophobicContact CE2-CB 3.96Å; F145-N188 HydrophobicContact CZ-CB 3.71Å; M184-N188 WeakPolarHBondContact O-CB 3.48Å; M184-N188 VanDerWaalsContact O-CG 3.29Å; M184-N188 PolarHBondContact O-N 3.41Å; M184-N188 PolarHBondContact O-ND2 2.91Å; M184-N188 VanDerWaalsContact O-ND2 3.13Å; H185-N188 PolarHBondContact O-N 3.39Å; N188-V294 HydrophobicContact CB-CG2 4.17Å |
| 189 | R | 93.8 | Very high | 93.7 | Very high | 30 Ų | 30 | 31.8 Ų | 31.8 | 11% | 0.113 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -66.1 | -44.5 | 173.4 | -71.9 | -179.7 | 63.2 | 178.2 | 4.1 | 111.8 | F145 H185 L186 L187 L191 R192 Q193 L250 D253 | F145-R189 HydrophobicContact CE1-CG 3.95Å; F145-R189 HydrophobicContact CZ-CG 3.65Å; H185-R189 WeakPolarHBondContact CE1-CD 3.45Å; H185-R189 WeakPolarHBondContact NE2-CD 3.46Å; H185-R189 PolarHBondContact NE2-NH1 3.33Å; H185-R189 PolarHBondContact O-N 3.19Å; L186-R189 PolarHBondContact O-N 3.46Å; L187-R189 VanDerWaalsContact C-N 3.33Å; L187-R189 PolarHBondContact O-N 2.91Å; R189-L191 PolarHBondContact O-N 2.71Å; R189-R192 PolarHBondContact O-N 3.28Å; R189-Q193 WeakPolarHBondContact O-CG 3.23Å; R189-Q193 PolarHBondContact O-N 3.41Å; R189-L250 HydrophobicContact CB-CD2 3.56Å; R189-D253 IonicContact CZ-OD2 3.71Å; R189-D253 PolarHBondContact NH1-O 2.94Å; R189-D253 VanDerWaalsContact NH1-O 3.14Å; R189-D253 IonicContact NH1-OD2 2.78Å; R189-D253 PolarHBondContact NH1-OD2 3.46Å; R189-D253 IonicContact NH2-OD2 2.93Å; R189-D253 PolarHBondContact NH2-OD2 3.21Å |
| 190 | S | 94.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.3 | -40.8 | -177.8 | -62.6 | 0 | 0 | 0 | 0 | 112.2 | L186 L187 R192 Q193 L194 | L186-S190 VanDerWaalsContact O-CB 3.23Å; L186-S190 WeakPolarHBondContact O-CB 3.36Å; L186-S190 PolarHBondContact O-N 3.09Å; L186-S190 PolarHBondContact O-OG 3.37Å; L187-S190 PolarHBondContact O-N 3.21Å; L187-S190 VanDerWaalsContact O-N 3.16Å; S190-R192 PolarHBondContact O-N 2.97Å; S190-Q193 PolarHBondContact O-N 2.88Å; S190-Q193 VanDerWaalsContact O-N 3.17Å; S190-L194 VanDerWaalsContact O-CB 3.27Å; S190-L194 WeakPolarHBondContact O-CB 3.33Å; S190-L194 PolarHBondContact O-N 3.37Å |
| 191 | L | 91.6 | Very high | 93.2 | Very high | 12 Ų | 12 | 34.5 Ų | 34.5 | 6% | 0.063 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.5 | -27.1 | 177.6 | -73.2 | 172.1 | 0 | 0 | 0 | 113.3 | P151 F154 L187 R189 L201 L204 | P151-L191 WeakPolarHBondContact CG-O 3.46Å; F154-L191 HydrophobicContact CD2-CD2 4.49Å; F154-L191 HydrophobicContact CE2-CD2 4.09Å; F154-L191 HydrophobicContact CZ-CD2 4.3Å; L187-L191 HydrophobicContact CD1-CD1 4.15Å; L187-L191 HydrophobicContact CD1-CG 4.1Å; L187-L191 HydrophobicContact CG-CD1 4.14Å; L187-L191 WeakPolarHBondContact O-CG 3.45Å; L187-L191 PolarHBondContact O-N 3.2Å; R189-L191 PolarHBondContact O-N 2.71Å; L191-L201 HydrophobicContact CD2-CD2 3.65Å; L191-L204 HydrophobicContact CD2-CD2 3.74Å; L191-L204 HydrophobicContact CG-CD2 4.2Å |
| 192 | R | 88.9 | Confident | 93.1 | Very high | 86 Ų | 86 | 34.6 Ų | 34.6 | 33% | 0.325 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -85.2 | -27.8 | 178 | -64 | 179.1 | -169.9 | -129.1 | -1.9 | 113.3 | N147 R189 S190 | N147-R192 PolarHBondContact O-NH1 2.81Å; N147-R192 PolarHBondContact O-NH2 2.79Å; N147-R192 PolarHBondContact OD1-NH1 2.82Å; R189-R192 PolarHBondContact O-N 3.28Å; S190-R192 PolarHBondContact O-N 2.97Å |
| 193 | Q | 91.3 | Very high | 93 | Very high | 95 Ų | 95 | 34.8 Ų | 34.8 | 44% | 0.444 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -100 | -23 | -174.5 | -63.6 | -179.6 | 6.2 | 0 | 0 | 112.9 | R189 S190 A249 | R189-Q193 WeakPolarHBondContact O-CG 3.23Å; R189-Q193 PolarHBondContact O-N 3.41Å; S190-Q193 PolarHBondContact O-N 2.88Å; S190-Q193 VanDerWaalsContact O-N 3.17Å; Q193-A249 HydrophobicContact CB-CB 4.31Å; Q193-A249 PolarHBondContact OE1-O 3.16Å |
| 194 | L | 91.9 | Very high | 93 | Very high | 20 Ų | 20 | 34.7 Ų | 34.7 | 11% | 0.105 | 18% | 0.178 | C | C | . | . | S | Bend | trans | -111.8 | 132.1 | -176.7 | -61.6 | -178.4 | 0 | 0 | 0 | 111.4 | S190 V196 L204 K245 V246 A249 | S190-L194 VanDerWaalsContact O-CB 3.27Å; S190-L194 WeakPolarHBondContact O-CB 3.33Å; S190-L194 PolarHBondContact O-N 3.37Å; L194-V196 HydrophobicContact CB-CG2 3.7Å; L194-V196 PolarHBondContact O-N 3.07Å; L194-L204 HydrophobicContact CD1-CD1 4.29Å; L194-K245 HydrophobicContact CD1-CG 4.14Å; L194-K245 HydrophobicContact CD2-CD 4.35Å; L194-K245 HydrophobicContact CD2-CG 3.86Å; L194-V246 HydrophobicContact CD1-CG2 3.94Å; L194-A249 HydrophobicContact CD1-CB 4.42Å; L194-A249 HydrophobicContact CD2-CB 3.45Å; L194-A249 VanDerWaalsContact CD2-CB 3.45Å; L194-A249 HydrophobicContact CG-CB 3.94Å |
| 195 | K | 90.5 | Very high | 93 | Very high | 198 Ų | 198 | 34.5 Ų | 34.5 | 86% | 0.861 | 18% | 0.178 | S | C | * | . | trans | -75.7 | 113.1 | 160.7 | -62.9 | -178.6 | -177.9 | 179.3 | 0 | 108.1 | K245 | K195-K245 PolarHBondContact O-NZ 2.93Š| ||
| 196 | V | 89.4 | Confident | 93.1 | Very high | 18 Ų | 18 | 34.1 Ų | 34.1 | 11% | 0.109 | 18% | 0.176 | C | C | . | . | trans | -131.4 | 136.6 | -179.9 | -174.7 | 0 | 0 | 0 | 0 | 107.7 | F154 L194 N200 L204 | F154-V196 VanDerWaalsContact CZ-O 3.32Å; F154-V196 WeakPolarHBondContact CZ-O 3.34Å; L194-V196 HydrophobicContact CB-CG2 3.7Å; L194-V196 PolarHBondContact O-N 3.07Å; V196-N200 HydrophobicContact CG1-CB 3.67Å; V196-L204 HydrophobicContact CG1-CB 4.49Å; V196-L204 HydrophobicContact CG1-CD2 4.47Å; V196-L204 HydrophobicContact CG2-CD2 4.18Å | ||
| 197 | S | 90.2 | Very high | 93.2 | Very high | 60 Ų | 60 | 34.1 Ų | 34.1 | 42% | 0.42 | 18% | 0.176 | S | C | . | . | trans | -79.8 | 157.9 | 174.4 | 57.6 | 0 | 0 | 0 | 0 | 110.7 | A199 N200 L201 | S197-A199 PolarHBondContact O-N 3.43Å; S197-N200 PolarHBondContact O-N 2.9Å; S197-N200 PolarHBondContact OG-ND2 2.78Å; S197-L201 PolarHBondContact O-N 3.09Å | ||
| 198 | V | 87.7 | Confident | 93.3 | Very high | 42 Ų | 42 | 34.1 Ų | 34.1 | 26% | 0.255 | 18% | 0.176 | S | C | . | . | G | 310 helix | trans | -53.6 | -39.8 | 175.1 | -179.5 | 0 | 0 | 0 | 0 | 111.4 | W29 F154 N200 L201 | W29-V198 HydrophobicContact CZ2-CG1 4.38Å; F154-V198 HydrophobicContact CD1-CG2 4.39Å; F154-V198 HydrophobicContact CE1-CG2 4.06Å; V198-N200 PolarHBondContact O-N 3.38Å; V198-N200 VanDerWaalsContact O-N 3.09Å; V198-L201 HydrophobicContact CG1-CD1 4.47Å; V198-L201 WeakPolarHBondContact O-CB 3.48Å; V198-L201 PolarHBondContact O-N 3.48Å |
| 199 | A | 89.1 | Confident | 93.6 | Very high | 59 Ų | 59 | 33 Ų | 33 | 49% | 0.488 | 17% | 0.17 | S | C | . | . | G | 310 helix | trans | -64.5 | -9.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | S197 Y234 | S197-A199 PolarHBondContact O-N 3.43Å; A199-Y234 PolarHBondContact O-OH 3.02Å |
| 200 | N | 93.3 | Very high | 93.8 | Very high | 54 Ų | 54 | 32.1 Ų | 32.1 | 29% | 0.289 | 17% | 0.167 | S | C | . | . | G | 310 helix | trans | -116.3 | 7.3 | 178.4 | -74.8 | -56.6 | 0 | 0 | 0 | 112.9 | V196 S197 V198 L203 L204 M242 | V196-N200 HydrophobicContact CG1-CB 3.67Å; S197-N200 PolarHBondContact O-N 2.9Å; S197-N200 PolarHBondContact OG-ND2 2.78Å; V198-N200 PolarHBondContact O-N 3.38Å; V198-N200 VanDerWaalsContact O-N 3.09Å; N200-L203 PolarHBondContact O-N 3.12Å; N200-L204 PolarHBondContact O-N 3.44Å; N200-M242 HydrophobicContact CB-CE 4.34Å |
| 201 | L | 92.6 | Very high | 94.1 | Very high | 3 Ų | 3 | 32.4 Ų | 32.4 | 2% | 0.016 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.7 | -42 | 179.4 | -84.4 | -179.1 | 0 | 0 | 0 | 113.2 | W29 F154 T158 L162 L191 S197 V198 L203 L204 S205 | W29-L201 HydrophobicContact CH2-CB 4.23Å; W29-L201 HydrophobicContact CH2-CD1 3.93Å; W29-L201 HydrophobicContact CZ2-CB 3.86Å; W29-L201 HydrophobicContact CZ2-CD1 3.91Å; F154-L201 HydrophobicContact CD1-CD1 3.48Å; F154-L201 VanDerWaalsContact CD1-CD1 3.48Å; F154-L201 HydrophobicContact CD1-CD2 4.08Å; F154-L201 HydrophobicContact CD1-CG 4.1Å; F154-L201 HydrophobicContact CE1-CD1 3.23Å; F154-L201 HydrophobicContact CE1-CD2 3.39Å; F154-L201 HydrophobicContact CE1-CG 3.36Å; F154-L201 HydrophobicContact CZ-CD1 4.31Å; F154-L201 HydrophobicContact CZ-CD2 3.64Å; F154-L201 HydrophobicContact CZ-CG 4.01Å; T158-L201 HydrophobicContact CG2-CD1 3.81Å; L162-L201 HydrophobicContact CD1-CB 4.15Å; L162-L201 HydrophobicContact CD2-CB 4.07Å; L162-L201 HydrophobicContact CD2-CD1 4.23Å; L162-L201 HydrophobicContact CD2-CD2 4.07Å; L162-L201 HydrophobicContact CD2-CG 4.37Å; L191-L201 HydrophobicContact CD2-CD2 3.65Å; S197-L201 PolarHBondContact O-N 3.09Å; V198-L201 HydrophobicContact CG1-CD1 4.47Å; V198-L201 WeakPolarHBondContact O-CB 3.48Å; V198-L201 PolarHBondContact O-N 3.48Å; L201-L203 VanDerWaalsContact C-N 3.31Å; L201-L203 PolarHBondContact O-N 3.28Å; L201-L204 PolarHBondContact O-N 3.02Å; L201-S205 WeakPolarHBondContact O-CB 3.44Å; L201-S205 PolarHBondContact O-N 3.26Å; L201-S205 PolarHBondContact O-OG 3.27Å |
| 202 | Q | 95.3 | Very high | 94.4 | Very high | 8 Ų | 8 | 31.9 Ų | 31.9 | 4% | 0.037 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.3 | -44.4 | 177.9 | -169.5 | -174.6 | 34.4 | 0 | 0 | 110.3 | W29 W165 S205 M206 M230 Y234 | W29-Q202 HydrophobicContact CB-CG 4.38Å; W29-Q202 HydrophobicContact CD2-CB 4.31Å; W29-Q202 HydrophobicContact CG-CB 4.06Å; W29-Q202 HydrophobicContact CG-CG 4.44Å; W165-Q202 HydrophobicContact CD2-CG 4.35Å; W165-Q202 HydrophobicContact CE3-CG 4.18Å; W165-Q202 HydrophobicContact CH2-CG 3.41Å; W165-Q202 VanDerWaalsContact CH2-CG 3.41Å; W165-Q202 HydrophobicContact CZ2-CG 3.63Å; W165-Q202 VanDerWaalsContact CZ2-NE2 3.31Å; W165-Q202 HydrophobicContact CZ3-CG 3.74Å; Q202-S205 PolarHBondContact O-N 3.45Å; Q202-M206 WeakPolarHBondContact O-CB 3.41Å; Q202-M206 PolarHBondContact O-N 2.94Å; Q202-M230 HydrophobicContact CG-CG 4.27Å; Q202-M230 HydrophobicContact CG-SD 4.33Å; Q202-Y234 HydrophobicContact CB-CE2 4.18Å |
| 203 | L | 97.6 | Very high | 94.8 | Very high | 4 Ų | 4 | 27.8 Ų | 27.8 | 2% | 0.021 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.6 | -47.3 | 174.4 | -176.5 | 61.3 | 0 | 0 | 0 | 112.6 | N200 L201 S205 M206 V207 M230 Y234 Q238 L239 M242 | N200-L203 PolarHBondContact O-N 3.12Å; L201-L203 VanDerWaalsContact C-N 3.31Å; L201-L203 PolarHBondContact O-N 3.28Å; L203-S205 VanDerWaalsContact C-N 3.27Å; L203-S205 PolarHBondContact O-N 3.1Å; L203-M206 PolarHBondContact O-N 3.38Å; L203-V207 WeakPolarHBondContact O-CB 3.49Å; L203-V207 WeakPolarHBondContact O-CG2 3.31Å; L203-V207 PolarHBondContact O-N 3.29Å; L203-M230 HydrophobicContact CD1-CE 4.05Å; L203-M230 HydrophobicContact CD1-SD 4.42Å; L203-Y234 HydrophobicContact CB-CD1 4Å; L203-Y234 HydrophobicContact CB-CD2 3.96Å; L203-Y234 HydrophobicContact CB-CE1 3.83Å; L203-Y234 HydrophobicContact CB-CE2 3.8Å; L203-Y234 HydrophobicContact CB-CG 4.04Å; L203-Y234 HydrophobicContact CD1-CD1 4.36Å; L203-Y234 HydrophobicContact CD1-CD2 4.09Å; L203-Y234 HydrophobicContact CD1-CG 3.85Å; L203-Y234 HydrophobicContact CD2-CD1 3.8Å; L203-Y234 HydrophobicContact CD2-CE1 4.2Å; L203-Y234 HydrophobicContact CD2-CG 4.16Å; L203-Y234 HydrophobicContact CG-CD1 4.27Å; L203-Y234 HydrophobicContact CG-CG 4.23Å; L203-Q238 HydrophobicContact CD2-CB 4.18Å; L203-L239 HydrophobicContact CD1-CB 4.05Å; L203-L239 HydrophobicContact CD1-CG 4.31Å; L203-M242 HydrophobicContact CD2-CB 4.02Å; L203-M242 HydrophobicContact CD2-CE 4.14Å; L203-M242 HydrophobicContact CD2-CG 4.44Å; L203-M242 HydrophobicContact CG-CB 4.11Å; L203-M242 HydrophobicContact CG-CE 4.47Å; L203-M242 HydrophobicContact CG-CG 4.21Å |
| 204 | L | 97.5 | Very high | 95.2 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -57.7 | -44.5 | 177.3 | 175.6 | 66.3 | 0 | 0 | 0 | 111 | L187 L191 L194 V196 N200 L201 V207 C208 M242 V246 | L187-L204 HydrophobicContact CD1-CD2 3.73Å; L187-L204 HydrophobicContact CD1-CG 3.89Å; L191-L204 HydrophobicContact CD2-CD2 3.74Å; L191-L204 HydrophobicContact CG-CD2 4.2Å; L194-L204 HydrophobicContact CD1-CD1 4.29Å; V196-L204 HydrophobicContact CG1-CB 4.49Å; V196-L204 HydrophobicContact CG1-CD2 4.47Å; V196-L204 HydrophobicContact CG2-CD2 4.18Å; N200-L204 PolarHBondContact O-N 3.44Å; L201-L204 PolarHBondContact O-N 3.02Å; L204-V207 PolarHBondContact O-N 2.98Å; L204-C208 PolarHBondContact O-N 3.38Å; L204-C208 PolarHBondContact O-SG 3.49Å; L204-M242 HydrophobicContact CD1-SD 4.14Å; L204-V246 HydrophobicContact CD1-CG2 3.51Å |
| 205 | S | 97.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -66.7 | -45.5 | -177.8 | -61.9 | 0 | 0 | 0 | 0 | 112.1 | L162 L201 Q202 L203 V207 C208 L209 | L162-S205 VanDerWaalsContact CD1-OG 3.29Å; L162-S205 WeakPolarHBondContact CD1-OG 3.38Å; L162-S205 VanDerWaalsContact CD2-OG 3.24Å; L162-S205 WeakPolarHBondContact CD2-OG 3.36Å; L162-S205 VanDerWaalsContact CG-OG 3.28Å; L162-S205 WeakPolarHBondContact CG-OG 3.34Å; L201-S205 WeakPolarHBondContact O-CB 3.44Å; L201-S205 PolarHBondContact O-N 3.26Å; L201-S205 PolarHBondContact O-OG 3.27Å; Q202-S205 PolarHBondContact O-N 3.45Å; L203-S205 VanDerWaalsContact C-N 3.27Å; L203-S205 PolarHBondContact O-N 3.1Å; S205-V207 VanDerWaalsContact C-N 3.28Å; S205-V207 PolarHBondContact O-N 3.12Å; S205-C208 PolarHBondContact O-N 3.14Å; S205-L209 PolarHBondContact O-N 3.3Å |
| 206 | M | 98.3 | Very high | 95.6 | Very high | 1 Ų | 1 | 25.4 Ų | 25.4 | 1% | 0.005 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -58.8 | -41.8 | 173.5 | -176.9 | 56.7 | 79.5 | 0 | 0 | 111.5 | W165 V169 Q202 L203 L209 F210 L226 L229 M230 L239 | W165-M206 HydrophobicContact CH2-CB 4.09Å; W165-M206 HydrophobicContact CH2-CE 3.61Å; W165-M206 HydrophobicContact CZ2-CE 3.95Å; W165-M206 HydrophobicContact CZ3-CB 4.49Å; V169-M206 HydrophobicContact CG1-CE 3.8Å; V169-M206 HydrophobicContact CG1-SD 4.42Å; V169-M206 HydrophobicContact CG2-CE 4.49Å; Q202-M206 WeakPolarHBondContact O-CB 3.41Å; Q202-M206 PolarHBondContact O-N 2.94Å; L203-M206 PolarHBondContact O-N 3.38Å; M206-L209 PolarHBondContact O-N 3.22Å; M206-F210 WeakPolarHBondContact O-CB 3.22Å; M206-F210 PolarHBondContact O-N 2.87Å; M206-L226 HydrophobicContact CG-CB 4.32Å; M206-L226 HydrophobicContact SD-CB 4.27Å; M206-L226 HydrophobicContact SD-CD2 3.8Å; M206-L226 HydrophobicContact SD-CG 4.46Å; M206-L229 HydrophobicContact CE-CB 3.82Å; M206-L229 HydrophobicContact CE-CD1 4.15Å; M206-M230 HydrophobicContact CB-CE 4.18Å; M206-M230 HydrophobicContact CB-SD 3.54Å; M206-M230 VanDerWaalsContact CB-SD 3.54Å; M206-M230 HydrophobicContact CE-CG 3.95Å; M206-M230 HydrophobicContact CE-SD 4.43Å; M206-M230 HydrophobicContact CG-CE 3.86Å; M206-M230 HydrophobicContact CG-CG 4.49Å; M206-M230 HydrophobicContact CG-SD 3.78Å; M206-L239 HydrophobicContact CG-CD1 4.46Å |
| 207 | V | 98.6 | Very high | 96 | Very high | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.9 | -41.4 | 176.3 | 162.8 | 0 | 0 | 0 | 0 | 112 | L203 L204 S205 L209 F210 L211 L239 M242 E243 V246 | L203-V207 WeakPolarHBondContact O-CB 3.49Å; L203-V207 WeakPolarHBondContact O-CG2 3.31Å; L203-V207 PolarHBondContact O-N 3.29Å; L204-V207 PolarHBondContact O-N 2.98Å; S205-V207 VanDerWaalsContact C-N 3.28Å; S205-V207 PolarHBondContact O-N 3.12Å; V207-L209 VanDerWaalsContact C-N 3.33Å; V207-F210 PolarHBondContact O-N 3.17Å; V207-L211 HydrophobicContact CG1-CD1 4.1Å; V207-L211 HydrophobicContact CG1-CG 4.42Å; V207-L211 WeakPolarHBondContact O-CB 3.42Å; V207-L211 WeakPolarHBondContact O-CG 3.16Å; V207-L211 PolarHBondContact O-N 3.48Å; V207-L239 HydrophobicContact CG2-CD2 4.25Å; V207-L239 HydrophobicContact CG2-CG 4.02Å; V207-M242 HydrophobicContact CB-CG 4.21Å; V207-M242 HydrophobicContact CG1-CG 4.32Å; V207-M242 HydrophobicContact CG2-CB 3.98Å; V207-M242 HydrophobicContact CG2-CG 3.93Å; V207-E243 VanDerWaalsContact CG1-CA 3.43Å; V207-E243 HydrophobicContact CG1-CB 4.01Å; V207-V246 HydrophobicContact CG1-CB 4.26Å; V207-V246 HydrophobicContact CG1-CG2 3.92Å |
| 208 | C | 98.6 | Very high | 96.2 | Very high | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.007 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.6 | -41.1 | 176.2 | -65.9 | 0 | 0 | 0 | 0 | 111.3 | L186 L187 L204 S205 L211 A212 | L186-C208 HydrophobicContact CB-CB 4.12Å; L187-C208 HydrophobicContact CB-CB 4.19Å; L204-C208 PolarHBondContact O-N 3.38Å; L204-C208 PolarHBondContact O-SG 3.49Å; S205-C208 PolarHBondContact O-N 3.14Å; C208-L211 PolarHBondContact O-N 2.91Å; C208-A212 WeakPolarHBondContact O-CB 3.21Å; C208-A212 PolarHBondContact O-N 2.99Å |
| 209 | L | 98.6 | Very high | 96.5 | Very high | 3 Ų | 3 | 33 Ų | 33 | 2% | 0.016 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.1 | -41.6 | 173.8 | -175.9 | 62.1 | 0 | 0 | 0 | 112.1 | V169 H170 L173 F175 T179 A183 S205 M206 V207 A212 A213 | V169-L209 HydrophobicContact CB-CD2 4.3Å; V169-L209 HydrophobicContact CG1-CD2 3.72Å; H170-L209 HydrophobicContact CB-CD1 4.42Å; L173-L209 HydrophobicContact CD1-CD2 4.34Å; F175-L209 HydrophobicContact CD2-CD1 4.28Å; F175-L209 HydrophobicContact CE2-CG 4.44Å; T179-L209 HydrophobicContact CG2-CD1 4.13Å; A183-L209 HydrophobicContact CB-CB 4.15Å; A183-L209 HydrophobicContact CB-CD1 3.77Å; S205-L209 PolarHBondContact O-N 3.3Å; M206-L209 PolarHBondContact O-N 3.22Å; V207-L209 VanDerWaalsContact C-N 3.33Å; L209-A212 PolarHBondContact O-N 2.94Å; L209-A213 WeakPolarHBondContact O-CB 3.37Å; L209-A213 PolarHBondContact O-N 3.37Å |
| 210 | F | 98.6 | Very high | 96.9 | Very high | 11 Ų | 11 | 34 Ų | 34 | 5% | 0.048 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.9 | -38.6 | 178.3 | -174.8 | -137.4 | 0 | 0 | 0 | 112.9 | M206 V207 A213 K214 V223 L226 L239 E243 | M206-F210 WeakPolarHBondContact O-CB 3.22Å; M206-F210 PolarHBondContact O-N 2.87Å; V207-F210 PolarHBondContact O-N 3.17Å; F210-A213 PolarHBondContact O-N 3.15Å; F210-K214 HydrophobicContact CE1-CD 4.43Å; F210-K214 HydrophobicContact CE2-CG 4.4Å; F210-K214 HydrophobicContact CZ-CD 4.46Å; F210-K214 WeakPolarHBondContact O-CG 3.21Å; F210-K214 PolarHBondContact O-N 3.38Å; F210-V223 HydrophobicContact CE1-CG2 4.24Å; F210-V223 HydrophobicContact CZ-CG2 4.2Å; F210-L226 HydrophobicContact CB-CD1 3.91Å; F210-L226 HydrophobicContact CD1-CD1 3.86Å; F210-L226 HydrophobicContact CD2-CD1 3.53Å; F210-L226 HydrophobicContact CE1-CD1 4.15Å; F210-L226 HydrophobicContact CE2-CD1 3.86Å; F210-L226 HydrophobicContact CG-CD1 3.5Å; F210-L226 HydrophobicContact CZ-CD1 4.14Å; F210-L239 HydrophobicContact CD1-CD2 4.21Å; F210-L239 HydrophobicContact CE1-CD2 4.43Å; F210-E243 WeakPolarHBondContact CD1-OE1 3.4Å |
| 211 | L | 98.7 | Very high | 96.9 | Very high | 6 Ų | 6 | 32.4 Ų | 32.4 | 3% | 0.031 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.9 | -41.1 | 173.5 | -76.4 | 176 | 0 | 0 | 0 | 111.8 | L186 V207 C208 K214 K215 E243 V246 L247 | L186-L211 HydrophobicContact CD1-CB 4.04Å; V207-L211 HydrophobicContact CG1-CD1 4.1Å; V207-L211 HydrophobicContact CG1-CG 4.42Å; V207-L211 WeakPolarHBondContact O-CB 3.42Å; V207-L211 WeakPolarHBondContact O-CG 3.16Å; V207-L211 PolarHBondContact O-N 3.48Å; C208-L211 PolarHBondContact O-N 2.91Å; L211-K214 PolarHBondContact O-N 2.81Å; L211-K215 PolarHBondContact O-N 2.95Å; L211-E243 HydrophobicContact CD2-CG 3.8Å; L211-E243 HydrophobicContact CG-CG 4.28Å; L211-V246 HydrophobicContact CD1-CB 4.01Å; L211-V246 HydrophobicContact CD1-CG1 3.53Å; L211-L247 HydrophobicContact CD1-CD2 4.24Å; L211-L247 HydrophobicContact CD1-CG 4.17Å; L211-L247 HydrophobicContact CD2-CD1 4.02Å; L211-L247 HydrophobicContact CD2-CD2 3.85Å; L211-L247 HydrophobicContact CD2-CG 3.93Å |
| 212 | A | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.2 | -45.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | T179 L182 A183 L186 C208 L209 K214 K215 E216 | T179-A212 HydrophobicContact CG2-CB 3.99Å; T179-A212 VanDerWaalsContact O-CB 3.32Å; T179-A212 WeakPolarHBondContact O-CB 3.36Å; L182-A212 HydrophobicContact CB-CB 3.97Å; L182-A212 HydrophobicContact CD2-CB 3.76Å; L182-A212 HydrophobicContact CG-CB 3.72Å; A183-A212 HydrophobicContact CB-CB 3.87Å; L186-A212 HydrophobicContact CD1-CB 4.44Å; C208-A212 WeakPolarHBondContact O-CB 3.21Å; C208-A212 PolarHBondContact O-N 2.99Å; L209-A212 PolarHBondContact O-N 2.94Å; A212-K214 VanDerWaalsContact C-N 3.33Å; A212-K214 PolarHBondContact O-N 3.39Å; A212-K215 WeakPolarHBondContact O-CB 3.44Å; A212-K215 PolarHBondContact O-N 3.49Å; A212-E216 PolarHBondContact O-N 3.24Å |
| 213 | A | 98.3 | Very high | 97.1 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.7 | -42.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | F175 T179 L209 F210 K215 E216 E217 L220 | F175-A213 HydrophobicContact CD2-CB 4.13Å; F175-A213 HydrophobicContact CE1-CB 4.29Å; F175-A213 HydrophobicContact CE2-CB 3.53Å; F175-A213 HydrophobicContact CZ-CB 3.63Å; T179-A213 HydrophobicContact CG2-CB 4.06Å; L209-A213 WeakPolarHBondContact O-CB 3.37Å; L209-A213 PolarHBondContact O-N 3.37Å; F210-A213 PolarHBondContact O-N 3.15Å; A213-K215 PolarHBondContact O-N 3.04Å; A213-K215 VanDerWaalsContact O-N 3.13Å; A213-E216 PolarHBondContact O-N 2.77Å; A213-E217 HydrophobicContact CB-CB 4.43Å; A213-E217 HydrophobicContact CB-CG 3.97Å; A213-E217 WeakPolarHBondContact O-CA 3.45Å; A213-E217 VanDerWaalsContact O-CB 3.24Å; A213-E217 WeakPolarHBondContact O-CB 3.49Å; A213-E217 PolarHBondContact O-N 3.42Å; A213-L220 VanDerWaalsContact C-CD2 3.43Å; A213-L220 HydrophobicContact CB-CD2 3.75Å; A213-L220 WeakPolarHBondContact O-CD2 3.31Å |
| 214 | K | 98 | Very high | 97 | Very high | 93 Ų | 93 | 42.6 Ų | 42.6 | 40% | 0.404 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -58.8 | -25.3 | 174.7 | -80.9 | 179.3 | 179.8 | -179.5 | 0 | 114 | F210 L211 A212 L220 E243 | F210-K214 HydrophobicContact CE1-CD 4.43Å; F210-K214 HydrophobicContact CE2-CG 4.4Å; F210-K214 HydrophobicContact CZ-CD 4.46Å; F210-K214 WeakPolarHBondContact O-CG 3.21Å; F210-K214 PolarHBondContact O-N 3.38Å; L211-K214 PolarHBondContact O-N 2.81Å; A212-K214 VanDerWaalsContact C-N 3.33Å; A212-K214 PolarHBondContact O-N 3.39Å; K214-L220 HydrophobicContact CB-CD1 4.47Å; K214-L220 HydrophobicContact CG-CD1 3.71Å; K214-L220 HydrophobicContact CG-CD2 4.27Å; K214-E243 IonicContact NZ-OE1 2.63Å; K214-E243 PolarHBondContact NZ-OE1 3.3Å; K214-E243 IonicContact NZ-OE2 3.38Å; K214-E243 PolarHBondContact NZ-OE2 3.47Å |
| 215 | K | 96.7 | Very high | 97 | Very high | 91 Ų | 91 | 43.2 Ų | 43.2 | 40% | 0.396 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -88.1 | -42.1 | 179.4 | -175.9 | 176 | 164 | -154.5 | 0 | 111.9 | L182 L211 A212 A213 L254 | L182-K215 HydrophobicContact CD2-CB 4.08Å; L182-K215 HydrophobicContact CD2-CD 3.72Å; L182-K215 HydrophobicContact CD2-CG 4.3Å; L211-K215 PolarHBondContact O-N 2.95Å; A212-K215 WeakPolarHBondContact O-CB 3.44Å; A212-K215 PolarHBondContact O-N 3.49Å; A213-K215 PolarHBondContact O-N 3.04Å; A213-K215 VanDerWaalsContact O-N 3.13Å; K215-L254 HydrophobicContact CD-CB 4.17Å; K215-L254 PolarHBondContact NZ-O 2.9Å |
| 216 | E | 95.4 | Very high | 96.9 | Very high | 80 Ų | 80 | 43.3 Ų | 43.3 | 37% | 0.374 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -104.3 | -25.9 | -168.7 | -55.5 | -58.5 | 156.3 | 0 | 0 | 113.7 | T179 L182 A212 A213 | T179-E216 WeakPolarHBondContact OG1-CB 3.24Å; L182-E216 HydrophobicContact CD2-CG 3.88Å; A212-E216 PolarHBondContact O-N 3.24Å; A213-E216 PolarHBondContact O-N 2.77Å |
| 217 | E | 97.1 | Very high | 96.8 | Very high | 33 Ų | 33 | 43.6 Ų | 43.6 | 15% | 0.154 | 23% | 0.234 | C | C | . | . | trans | -99.1 | 141.2 | -171.7 | -57.4 | -67.2 | 161.7 | 0 | 0 | 112.9 | F175 Q176 T179 A213 L220 | F175-E217 WeakPolarHBondContact CA-OE1 3.48Å; F175-E217 HydrophobicContact CB-CG 4.38Å; F175-E217 VanDerWaalsContact CB-OE1 3.24Å; F175-E217 WeakPolarHBondContact CB-OE1 3.37Å; F175-E217 HydrophobicContact CD1-CB 4.49Å; F175-E217 HydrophobicContact CD1-CG 3.61Å; F175-E217 HydrophobicContact CE1-CG 3.97Å; F175-E217 HydrophobicContact CG-CG 3.99Å; Q176-E217 PolarHBondContact N-OE1 3.38Å; T179-E217 HydrophobicContact CG2-CG 4.34Å; T179-E217 PolarHBondContact OG1-OE1 2.92Å; A213-E217 HydrophobicContact CB-CB 4.43Å; A213-E217 HydrophobicContact CB-CG 3.97Å; A213-E217 WeakPolarHBondContact O-CA 3.45Å; A213-E217 VanDerWaalsContact O-CB 3.24Å; A213-E217 WeakPolarHBondContact O-CB 3.49Å; A213-E217 PolarHBondContact O-N 3.42Å; E217-L220 HydrophobicContact CB-CD2 4.28Å | ||
| 218 | S | 94.9 | Very high | 96.7 | Very high | 121 Ų | 121 | 46.3 Ų | 46.3 | 85% | 0.846 | 25% | 0.253 | S | S | * | . | S | Bend | trans | -78.4 | -28.3 | 173.3 | -63.3 | 0 | 0 | 0 | 0 | 113.2 | ||
| 219 | L | 94.3 | Very high | 96.6 | Very high | 124 Ų | 124 | 47.5 Ų | 47.5 | 65% | 0.649 | 26% | 0.259 | S | S | * | . | S | Bend | trans | -119.5 | 124.6 | -177.3 | -64.5 | 178 | 0 | 0 | 0 | 109.6 | ||
| 220 | L | 96 | Very high | 96.4 | Very high | 81 Ų | 81 | 47.5 Ų | 47.5 | 42% | 0.424 | 26% | 0.259 | S | S | . | . | trans | -113.7 | 139.2 | -177.1 | -62.6 | 171.4 | 0 | 0 | 0 | 110.6 | A213 K214 E217 | A213-L220 VanDerWaalsContact C-CD2 3.43Å; A213-L220 HydrophobicContact CB-CD2 3.75Å; A213-L220 WeakPolarHBondContact O-CD2 3.31Å; K214-L220 HydrophobicContact CB-CD1 4.47Å; K214-L220 HydrophobicContact CG-CD1 3.71Å; K214-L220 HydrophobicContact CG-CD2 4.27Å; E217-L220 HydrophobicContact CB-CD2 4.28Å | ||
| 221 | P | 94.4 | Very high | 96.2 | Very high | 20 Ų | 20 | 52.5 Ų | 52.5 | 13% | 0.13 | 29% | 0.286 | C | S | . | . | trans | -67.3 | 151.4 | 168.5 | 30.2 | -35.4 | 0 | 0 | 0 | 110.3 | L173 F175 L226 | L173-P221 HydrophobicContact CD2-CB 4.24Å; L173-P221 HydrophobicContact CD2-CG 4.16Å; F175-P221 HydrophobicContact CZ-CG 4.14Å; P221-L226 HydrophobicContact CB-CD2 4.14Å; P221-L226 HydrophobicContact CG-CD2 3.52Å; P221-L226 HydrophobicContact CG-CG 4.17Å | ||
| 222 | E | 95.5 | Very high | 96 | Very high | 146 Ų | 146 | 58.2 Ų | 58.2 | 68% | 0.682 | 31% | 0.312 | S | S | * | . | trans | -66.6 | 151.9 | 169.1 | -64.6 | -171.8 | 174.7 | 0 | 0 | 111.1 | S224 G225 L226 | E222-S224 VanDerWaalsContact CB-OG 3.26Å; E222-S224 WeakPolarHBondContact CB-OG 3.47Å; E222-S224 PolarHBondContact O-N 2.92Å; E222-S224 PolarHBondContact OE2-OG 3.37Å; E222-S224 VanDerWaalsContact OE2-OG 3.07Å; E222-G225 WeakPolarHBondContact O-CA 3.5Å; E222-G225 PolarHBondContact O-N 3.43Å; E222-L226 PolarHBondContact O-N 3.35Å; E222-L226 VanDerWaalsContact O-N 3.14Å | ||
| 223 | V | 96.8 | Very high | 95.8 | Very high | 24 Ų | 24 | 62.1 Ų | 62.1 | 15% | 0.145 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.2 | -32.6 | 178.6 | -173.4 | 0 | 0 | 0 | 0 | 111.9 | F210 G225 L226 C227 K236 L239 L240 | F210-V223 HydrophobicContact CE1-CG2 4.24Å; F210-V223 HydrophobicContact CZ-CG2 4.2Å; V223-G225 VanDerWaalsContact C-N 3.35Å; V223-L226 PolarHBondContact O-N 3.19Å; V223-C227 PolarHBondContact O-N 3.47Å; V223-C227 PolarHBondContact O-SG 3.03Å; V223-K236 HydrophobicContact CB-CD 4.49Å; V223-K236 HydrophobicContact CB-CG 4.23Å; V223-K236 HydrophobicContact CG1-CB 4.24Å; V223-K236 HydrophobicContact CG1-CD 4.5Å; V223-K236 HydrophobicContact CG1-CG 3.73Å; V223-L239 HydrophobicContact CG1-CB 4.39Å; V223-L239 HydrophobicContact CG1-CD1 3.97Å; V223-L239 HydrophobicContact CG1-CD2 3.84Å; V223-L239 HydrophobicContact CG1-CG 4.28Å; V223-L240 HydrophobicContact CG2-CD2 4.33Å |
| 224 | S | 95.8 | Very high | 95.7 | Very high | 60 Ų | 60 | 62.6 Ų | 62.6 | 42% | 0.42 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -58.2 | -43.8 | 171 | 44 | 0 | 0 | 0 | 0 | 112.1 | E222 C227 S228 | E222-S224 VanDerWaalsContact CB-OG 3.26Å; E222-S224 WeakPolarHBondContact CB-OG 3.47Å; E222-S224 PolarHBondContact O-N 2.92Å; E222-S224 PolarHBondContact OE2-OG 3.37Å; E222-S224 VanDerWaalsContact OE2-OG 3.07Å; S224-C227 PolarHBondContact O-N 3.28Å; S224-S228 PolarHBondContact O-N 2.91Å; S224-S228 PolarHBondContact O-OG 3.3Å |
| 225 | G | 96 | Very high | 95.7 | Very high | 12 Ų | 12 | 61.9 Ų | 61.9 | 12% | 0.124 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.1 | -43.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | E222 V223 C227 S228 L229 | E222-G225 WeakPolarHBondContact O-CA 3.5Å; E222-G225 PolarHBondContact O-N 3.43Å; V223-G225 VanDerWaalsContact C-N 3.35Å; G225-C227 PolarHBondContact O-N 3.48Å; G225-S228 WeakPolarHBondContact O-CB 3.31Å; G225-S228 PolarHBondContact O-N 2.95Å; G225-S228 VanDerWaalsContact O-N 3.14Å; G225-L229 WeakPolarHBondContact O-CG 3.23Å; G225-L229 PolarHBondContact O-N 3.45Å |
| 226 | L | 96.6 | Very high | 95.8 | Very high | 2 Ų | 2 | 63.1 Ų | 63.1 | 1% | 0.01 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.8 | -40.3 | 176.1 | -58.6 | -177.9 | 0 | 0 | 0 | 112.9 | L173 M206 F210 P221 E222 V223 S228 L229 M230 L239 | L173-L226 HydrophobicContact CD1-CD2 4.42Å; M206-L226 HydrophobicContact CG-CB 4.32Å; M206-L226 HydrophobicContact SD-CB 4.27Å; M206-L226 HydrophobicContact SD-CD2 3.8Å; M206-L226 HydrophobicContact SD-CG 4.46Å; F210-L226 HydrophobicContact CB-CD1 3.91Å; F210-L226 HydrophobicContact CD1-CD1 3.86Å; F210-L226 HydrophobicContact CD2-CD1 3.53Å; F210-L226 HydrophobicContact CE1-CD1 4.15Å; F210-L226 HydrophobicContact CE2-CD1 3.86Å; F210-L226 HydrophobicContact CG-CD1 3.5Å; F210-L226 HydrophobicContact CZ-CD1 4.14Å; P221-L226 HydrophobicContact CB-CD2 4.14Å; P221-L226 HydrophobicContact CG-CD2 3.52Å; P221-L226 HydrophobicContact CG-CG 4.17Å; E222-L226 PolarHBondContact O-N 3.35Å; E222-L226 VanDerWaalsContact O-N 3.14Å; V223-L226 PolarHBondContact O-N 3.19Å; L226-S228 VanDerWaalsContact C-N 3.28Å; L226-S228 PolarHBondContact O-N 3.41Å; L226-L229 HydrophobicContact CD2-CD1 4.32Å; L226-L229 PolarHBondContact O-N 3.16Å; L226-M230 PolarHBondContact O-N 2.98Å; L226-L239 HydrophobicContact CB-CD1 3.84Å; L226-L239 HydrophobicContact CD1-CD1 4.18Å |
| 227 | C | 96.5 | Very high | 95.9 | Very high | 8 Ų | 8 | 65.6 Ų | 65.6 | 5% | 0.054 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -61.1 | -39.3 | 172.9 | -72.4 | 0 | 0 | 0 | 0 | 111.6 | V223 S224 G225 L229 M230 D231 H232 Y234 | V223-C227 PolarHBondContact O-N 3.47Å; V223-C227 PolarHBondContact O-SG 3.03Å; S224-C227 PolarHBondContact O-N 3.28Å; G225-C227 PolarHBondContact O-N 3.48Å; C227-L229 VanDerWaalsContact C-N 3.34Å; C227-L229 PolarHBondContact O-N 3.13Å; C227-M230 CarbonylContact O-C 3.49Å; C227-M230 PolarHBondContact O-N 3.11Å; C227-M230 VanDerWaalsContact O-N 3.16Å; C227-D231 PolarHBondContact O-N 3.05Å; C227-H232 WeakPolarHBondContact O-CA 3.35Å; C227-H232 PolarHBondContact O-N 3.15Å; C227-Y234 PolarHBondContact SG-O 3.38Å |
| 228 | S | 96 | Very high | 95.9 | Very high | 57 Ų | 57 | 67.8 Ų | 67.8 | 40% | 0.399 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -64.9 | -37.4 | 178.4 | -49.4 | 0 | 0 | 0 | 0 | 111.8 | S224 G225 L226 M230 D231 H232 | S224-S228 PolarHBondContact O-N 2.91Å; S224-S228 PolarHBondContact O-OG 3.3Å; G225-S228 WeakPolarHBondContact O-CB 3.31Å; G225-S228 PolarHBondContact O-N 2.95Å; G225-S228 VanDerWaalsContact O-N 3.14Å; L226-S228 VanDerWaalsContact C-N 3.28Å; L226-S228 PolarHBondContact O-N 3.41Å; S228-M230 PolarHBondContact O-N 3.31Å; S228-D231 PolarHBondContact O-N 3.16Å; S228-H232 PolarHBondContact OG-CE1 2.93Å; S228-H232 VanDerWaalsContact OG-CE1 3.23Å |
| 229 | L | 94.9 | Very high | 96.1 | Very high | 26 Ų | 26 | 62 Ų | 62 | 14% | 0.136 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -64.9 | -21.3 | 174.6 | -69.2 | 175.9 | 0 | 0 | 0 | 114.2 | L26 V169 L172 L173 M206 G225 L226 C227 | L26-L229 HydrophobicContact CD1-CD2 4.4Å; V169-L229 HydrophobicContact CG1-CD1 4.07Å; L172-L229 HydrophobicContact CD2-CD2 3.32Å; L172-L229 HydrophobicContact CG-CD2 4.34Å; L173-L229 HydrophobicContact CD1-CD1 4.21Å; L173-L229 HydrophobicContact CD2-CD1 3.96Å; L173-L229 HydrophobicContact CG-CD1 4.22Å; M206-L229 HydrophobicContact CE-CB 3.82Å; M206-L229 HydrophobicContact CE-CD1 4.15Å; G225-L229 WeakPolarHBondContact O-CG 3.23Å; G225-L229 PolarHBondContact O-N 3.45Å; L226-L229 HydrophobicContact CD2-CD1 4.32Å; L226-L229 PolarHBondContact O-N 3.16Å; C227-L229 VanDerWaalsContact C-N 3.34Å; C227-L229 PolarHBondContact O-N 3.13Å |
| 230 | M | 95.6 | Very high | 96.3 | Very high | 2 Ų | 2 | 58.9 Ų | 58.9 | 1% | 0.01 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.9 | 22.9 | 173.2 | -61 | -178.4 | -67.7 | 0 | 0 | 111.8 | W165 Q202 L203 M206 L226 C227 S228 H232 T233 Y234 L239 | W165-M230 HydrophobicContact CH2-CG 3.96Å; W165-M230 HydrophobicContact CH2-SD 4.37Å; W165-M230 HydrophobicContact CZ2-CG 3.94Å; Q202-M230 HydrophobicContact CG-CG 4.27Å; Q202-M230 HydrophobicContact CG-SD 4.33Å; L203-M230 HydrophobicContact CD1-CE 4.05Å; L203-M230 HydrophobicContact CD1-SD 4.42Å; M206-M230 HydrophobicContact CB-CE 4.18Å; M206-M230 HydrophobicContact CB-SD 3.54Å; M206-M230 VanDerWaalsContact CB-SD 3.54Å; M206-M230 HydrophobicContact CE-CG 3.95Å; M206-M230 HydrophobicContact CE-SD 4.43Å; M206-M230 HydrophobicContact CG-CE 3.86Å; M206-M230 HydrophobicContact CG-CG 4.49Å; M206-M230 HydrophobicContact CG-SD 3.78Å; L226-M230 PolarHBondContact O-N 2.98Å; C227-M230 CarbonylContact O-C 3.49Å; C227-M230 PolarHBondContact O-N 3.11Å; C227-M230 VanDerWaalsContact O-N 3.16Å; S228-M230 PolarHBondContact O-N 3.31Å; M230-H232 PolarHBondContact O-N 2.92Å; M230-H232 VanDerWaalsContact O-N 3.13Å; M230-T233 WeakPolarHBondContact O-CB 3.42Å; M230-T233 PolarHBondContact O-N 2.72Å; M230-T233 PolarHBondContact O-OG1 3.07Å; M230-Y234 HydrophobicContact CB-CD2 4.21Å; M230-Y234 HydrophobicContact CE-CD2 3.99Å; M230-Y234 HydrophobicContact SD-CD2 3.69Å; M230-Y234 HydrophobicContact SD-CE2 4.08Å; M230-L239 HydrophobicContact CE-CD1 3.99Å |
| 231 | D | 94.4 | Very high | 96.4 | Very high | 117 Ų | 117 | 63.5 Ų | 63.5 | 63% | 0.626 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.1 | 37.3 | 179.4 | -161.6 | 23.1 | 0 | 0 | 0 | 113.1 | C227 S228 T233 | C227-D231 PolarHBondContact O-N 3.05Å; S228-D231 PolarHBondContact O-N 3.16Å; D231-T233 PolarHBondContact O-N 3.14Å |
| 232 | H | 93.7 | Very high | 96.6 | Very high | 125 Ų | 125 | 63.4 Ų | 63.4 | 58% | 0.579 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | 16.6 | -176.1 | -57 | -68.2 | 0 | 0 | 0 | 115.7 | C227 S228 M230 Y234 | C227-H232 WeakPolarHBondContact O-CA 3.35Å; C227-H232 PolarHBondContact O-N 3.15Å; S228-H232 PolarHBondContact OG-CE1 2.93Å; S228-H232 VanDerWaalsContact OG-CE1 3.23Å; M230-H232 PolarHBondContact O-N 2.92Å; M230-H232 VanDerWaalsContact O-N 3.13Å; H232-Y234 PolarHBondContact O-N 3.33Å |
| 233 | T | 95.6 | Very high | 96.7 | Very high | 82 Ų | 82 | 57.5 Ų | 57.5 | 50% | 0.503 | 29% | 0.294 | S | S | . | . | S | Bend | trans | -54.8 | -29.3 | 175.1 | -54.4 | 0 | 0 | 0 | 0 | 111.7 | M230 D231 | M230-T233 WeakPolarHBondContact O-CB 3.42Å; M230-T233 PolarHBondContact O-N 2.72Å; M230-T233 PolarHBondContact O-OG1 3.07Å; D231-T233 PolarHBondContact O-N 3.14Å |
| 234 | Y | 96.6 | Very high | 96.8 | Very high | 10 Ų | 10 | 64.9 Ų | 64.9 | 4% | 0.039 | 32% | 0.32 | C | S | . | . | S | Bend | trans | -126.4 | 139.9 | 177.2 | -48.2 | -81.5 | 0 | 0 | 0 | 112.1 | A199 Q202 L203 C227 M230 H232 | A199-Y234 PolarHBondContact O-OH 3.02Å; Q202-Y234 HydrophobicContact CB-CE2 4.18Å; L203-Y234 HydrophobicContact CB-CD1 4Å; L203-Y234 HydrophobicContact CB-CD2 3.96Å; L203-Y234 HydrophobicContact CB-CE1 3.83Å; L203-Y234 HydrophobicContact CB-CE2 3.8Å; L203-Y234 HydrophobicContact CB-CG 4.04Å; L203-Y234 HydrophobicContact CD1-CD1 4.36Å; L203-Y234 HydrophobicContact CD1-CD2 4.09Å; L203-Y234 HydrophobicContact CD1-CG 3.85Å; L203-Y234 HydrophobicContact CD2-CD1 3.8Å; L203-Y234 HydrophobicContact CD2-CE1 4.2Å; L203-Y234 HydrophobicContact CD2-CG 4.16Å; L203-Y234 HydrophobicContact CG-CD1 4.27Å; L203-Y234 HydrophobicContact CG-CG 4.23Å; C227-Y234 PolarHBondContact SG-O 3.38Å; M230-Y234 HydrophobicContact CB-CD2 4.21Å; M230-Y234 HydrophobicContact CE-CD2 3.99Å; M230-Y234 HydrophobicContact SD-CD2 3.69Å; M230-Y234 HydrophobicContact SD-CE2 4.08Å; H232-Y234 PolarHBondContact O-N 3.33Å |
| 235 | T | 97.6 | Very high | 96.9 | Very high | 78 Ų | 78 | 66.3 Ų | 66.3 | 48% | 0.479 | 32% | 0.318 | S | S | . | . | trans | -76.4 | 157.8 | 175.6 | 63.4 | 0 | 0 | 0 | 0 | 112.2 | H237 Q238 L239 | T235-H237 PolarHBondContact O-N 3.43Å; T235-Q238 PolarHBondContact O-N 3.04Å; T235-Q238 WeakPolarHBondContact OG1-CG 3.39Å; T235-Q238 PolarHBondContact OG1-N 3.4Å; T235-Q238 PolarHBondContact OG1-OE1 3.43Å; T235-L239 PolarHBondContact O-N 3.37Å | ||
| 236 | K | 97.9 | Very high | 97.1 | Very high | 117 Ų | 117 | 65.8 Ų | 65.8 | 51% | 0.509 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -50.6 | -40.5 | 171.5 | 177 | 174.1 | -179 | -175.9 | 0 | 112 | V223 L239 L240 | V223-K236 HydrophobicContact CB-CD 4.49Å; V223-K236 HydrophobicContact CB-CG 4.23Å; V223-K236 HydrophobicContact CG1-CB 4.24Å; V223-K236 HydrophobicContact CG1-CD 4.5Å; V223-K236 HydrophobicContact CG1-CG 3.73Å; K236-L239 PolarHBondContact O-N 2.85Å; K236-L240 HydrophobicContact CG-CD1 3.92Å; K236-L240 WeakPolarHBondContact O-CG 3.21Å; K236-L240 PolarHBondContact O-N 3.34Å |
| 237 | H | 98.1 | Very high | 97.2 | Very high | 132 Ų | 132 | 67 Ų | 67 | 61% | 0.611 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -65.8 | -42.7 | 179 | 178.6 | -97.2 | 0 | 0 | 0 | 112.5 | T235 L239 R241 | T235-H237 PolarHBondContact O-N 3.43Å; H237-L239 VanDerWaalsContact C-N 3.35Å; H237-R241 VanDerWaalsContact O-CB 3.25Å; H237-R241 WeakPolarHBondContact O-CB 3.44Å; H237-R241 PolarHBondContact O-N 3.23Å |
| 238 | Q | 97.9 | Very high | 97.2 | Very high | 79 Ų | 79 | 70.3 Ų | 70.3 | 37% | 0.369 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.2 | -41.6 | 175.9 | -75.5 | 164 | -50 | 0 | 0 | 111.7 | L203 T235 R241 M242 | L203-Q238 HydrophobicContact CD2-CB 4.18Å; T235-Q238 PolarHBondContact O-N 3.04Å; T235-Q238 WeakPolarHBondContact OG1-CG 3.39Å; T235-Q238 PolarHBondContact OG1-N 3.4Å; T235-Q238 PolarHBondContact OG1-OE1 3.43Å; Q238-R241 PolarHBondContact O-N 3.05Å; Q238-M242 WeakPolarHBondContact O-CB 3.39Å; Q238-M242 PolarHBondContact O-N 3.17Å |
| 239 | L | 98.4 | Very high | 97.3 | Very high | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.6 | -52.3 | 176.4 | -170.3 | 157.6 | 0 | 0 | 0 | 111.6 | L203 M206 V207 F210 V223 L226 M230 T235 K236 H237 R241 M242 E243 | L203-L239 HydrophobicContact CD1-CB 4.05Å; L203-L239 HydrophobicContact CD1-CG 4.31Å; M206-L239 HydrophobicContact CG-CD1 4.46Å; V207-L239 HydrophobicContact CG2-CD2 4.25Å; V207-L239 HydrophobicContact CG2-CG 4.02Å; F210-L239 HydrophobicContact CD1-CD2 4.21Å; F210-L239 HydrophobicContact CE1-CD2 4.43Å; V223-L239 HydrophobicContact CG1-CB 4.39Å; V223-L239 HydrophobicContact CG1-CD1 3.97Å; V223-L239 HydrophobicContact CG1-CD2 3.84Å; V223-L239 HydrophobicContact CG1-CG 4.28Å; L226-L239 HydrophobicContact CB-CD1 3.84Å; L226-L239 HydrophobicContact CD1-CD1 4.18Å; M230-L239 HydrophobicContact CE-CD1 3.99Å; T235-L239 PolarHBondContact O-N 3.37Å; K236-L239 PolarHBondContact O-N 2.85Å; H237-L239 VanDerWaalsContact C-N 3.35Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 3.18Å; L239-M242 PolarHBondContact O-N 3.08Å; L239-E243 PolarHBondContact O-N 3.36Å |
| 240 | L | 98.3 | Very high | 97.4 | Very high | 59 Ų | 59 | 67.7 Ų | 67.7 | 31% | 0.309 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -66 | -30.8 | 179.7 | -64.3 | 170.2 | 0 | 0 | 0 | 112.8 | V223 K236 R244 | V223-L240 HydrophobicContact CG2-CD2 4.33Å; K236-L240 HydrophobicContact CG-CD1 3.92Å; K236-L240 WeakPolarHBondContact O-CG 3.21Å; K236-L240 PolarHBondContact O-N 3.34Å; L240-R244 PolarHBondContact O-N 2.99Å; L240-R244 VanDerWaalsContact O-N 3.13Å |
| 241 | R | 98.4 | Very high | 97.4 | Very high | 178 Ų | 178 | 76.1 Ų | 76.1 | 67% | 0.672 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -68.4 | -43.2 | 173.4 | -177.2 | 175.2 | 179.2 | 158.2 | 0.3 | 111.6 | H237 Q238 L239 R244 K245 | H237-R241 VanDerWaalsContact O-CB 3.25Å; H237-R241 WeakPolarHBondContact O-CB 3.44Å; H237-R241 PolarHBondContact O-N 3.23Å; Q238-R241 PolarHBondContact O-N 3.05Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 3.18Å; R241-R244 PolarHBondContact O-N 2.99Å; R241-K245 PolarHBondContact O-N 3.29Å; R241-K245 VanDerWaalsContact O-N 3.09Å |
| 242 | M | 98.4 | Very high | 97.6 | Very high | 18 Ų | 18 | 77.2 Ų | 77.2 | 9% | 0.089 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -65.8 | -41.1 | 176.1 | -178.1 | 65.8 | 80.1 | 0 | 0 | 110.9 | N200 L203 L204 V207 Q238 L239 R244 K245 V246 | N200-M242 HydrophobicContact CB-CE 4.34Å; L203-M242 HydrophobicContact CD2-CB 4.02Å; L203-M242 HydrophobicContact CD2-CE 4.14Å; L203-M242 HydrophobicContact CD2-CG 4.44Å; L203-M242 HydrophobicContact CG-CB 4.11Å; L203-M242 HydrophobicContact CG-CE 4.47Å; L203-M242 HydrophobicContact CG-CG 4.21Å; L204-M242 HydrophobicContact CD1-SD 4.14Å; V207-M242 HydrophobicContact CB-CG 4.21Å; V207-M242 HydrophobicContact CG1-CG 4.32Å; V207-M242 HydrophobicContact CG2-CB 3.98Å; V207-M242 HydrophobicContact CG2-CG 3.93Å; Q238-M242 WeakPolarHBondContact O-CB 3.39Å; Q238-M242 PolarHBondContact O-N 3.17Å; L239-M242 PolarHBondContact O-N 3.08Å; M242-R244 PolarHBondContact O-N 3.33Å; M242-K245 WeakPolarHBondContact O-CB 3.44Å; M242-K245 PolarHBondContact O-N 3.07Å; M242-K245 VanDerWaalsContact O-N 3.08Å; M242-K245 HydrophobicContact SD-CD 4.33Å; M242-V246 HydrophobicContact CG-CG2 4.46Å; M242-V246 WeakPolarHBondContact O-CG2 3.39Å; M242-V246 PolarHBondContact O-N 3.36Å; M242-V246 HydrophobicContact SD-CG2 4.49Å |
| 243 | E | 98.5 | Very high | 97.7 | Very high | 22 Ų | 22 | 73.2 Ų | 73.2 | 10% | 0.103 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -52.7 | -51.9 | 173.1 | 179.1 | 177.2 | -115.4 | 0 | 0 | 112.2 | V207 F210 L211 K214 L239 K245 V246 L247 | V207-E243 VanDerWaalsContact CG1-CA 3.43Å; V207-E243 HydrophobicContact CG1-CB 4.01Å; F210-E243 WeakPolarHBondContact CD1-OE1 3.4Å; L211-E243 HydrophobicContact CD2-CG 3.8Å; L211-E243 HydrophobicContact CG-CG 4.28Å; K214-E243 IonicContact NZ-OE1 2.63Å; K214-E243 PolarHBondContact NZ-OE1 3.3Å; K214-E243 IonicContact NZ-OE2 3.38Å; K214-E243 PolarHBondContact NZ-OE2 3.47Å; L239-E243 PolarHBondContact O-N 3.36Å; E243-K245 VanDerWaalsContact C-N 3.29Å; E243-K245 PolarHBondContact O-N 3.44Å; E243-V246 PolarHBondContact O-N 3.23Å; E243-L247 HydrophobicContact CG-CD1 4.18Å; E243-L247 PolarHBondContact O-N 3.01Å |
| 244 | R | 98.4 | Very high | 97.7 | Very high | 179 Ų | 179 | 70.8 Ų | 70.8 | 68% | 0.675 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -59.4 | -41.6 | 176.8 | -165.9 | -177.7 | -51.1 | -162.4 | 2.3 | 112 | L240 R241 M242 L247 C248 | L240-R244 PolarHBondContact O-N 2.99Å; L240-R244 VanDerWaalsContact O-N 3.13Å; R241-R244 PolarHBondContact O-N 2.99Å; M242-R244 PolarHBondContact O-N 3.33Å; R244-L247 PolarHBondContact O-N 3.28Å; R244-C248 WeakPolarHBondContact O-CB 3.49Å; R244-C248 PolarHBondContact O-N 3.18Å; R244-C248 PolarHBondContact O-SG 2.9Å |
| 245 | K | 98.3 | Very high | 97.4 | Very high | 90 Ų | 90 | 73.2 Ų | 73.2 | 39% | 0.391 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.6 | -42.1 | 178.8 | -175.8 | 177.6 | 171.3 | -175.4 | 0 | 111.6 | L194 K195 R241 M242 E243 A249 | L194-K245 HydrophobicContact CD1-CG 4.14Å; L194-K245 HydrophobicContact CD2-CD 4.35Å; L194-K245 HydrophobicContact CD2-CG 3.86Å; K195-K245 PolarHBondContact O-NZ 2.93Å; R241-K245 PolarHBondContact O-N 3.29Å; R241-K245 VanDerWaalsContact O-N 3.09Å; M242-K245 WeakPolarHBondContact O-CB 3.44Å; M242-K245 PolarHBondContact O-N 3.07Å; M242-K245 VanDerWaalsContact O-N 3.08Å; M242-K245 HydrophobicContact SD-CD 4.33Å; E243-K245 VanDerWaalsContact C-N 3.29Å; E243-K245 PolarHBondContact O-N 3.44Å; K245-A249 WeakPolarHBondContact O-CB 3.44Å; K245-A249 PolarHBondContact O-N 3.42Å |
| 246 | V | 98.5 | Very high | 97.2 | Very high | 0 Ų | 0 | 71.3 Ų | 71.3 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64.3 | -51.1 | 176.1 | 172.8 | 0 | 0 | 0 | 0 | 110.7 | L194 L204 V207 L211 M242 E243 C248 A249 L250 | L194-V246 HydrophobicContact CD1-CG2 3.94Å; L204-V246 HydrophobicContact CD1-CG2 3.51Å; V207-V246 HydrophobicContact CG1-CB 4.26Å; V207-V246 HydrophobicContact CG1-CG2 3.92Å; L211-V246 HydrophobicContact CD1-CB 4.01Å; L211-V246 HydrophobicContact CD1-CG1 3.53Å; M242-V246 HydrophobicContact CG-CG2 4.46Å; M242-V246 WeakPolarHBondContact O-CG2 3.39Å; M242-V246 PolarHBondContact O-N 3.36Å; M242-V246 HydrophobicContact SD-CG2 4.49Å; E243-V246 PolarHBondContact O-N 3.23Å; V246-C248 VanDerWaalsContact C-N 3.34Å; V246-C248 PolarHBondContact O-N 2.97Å; V246-A249 PolarHBondContact O-N 3.21Å; V246-L250 HydrophobicContact CG1-CD1 3.75Å; V246-L250 HydrophobicContact CG1-CG 4.29Å; V246-L250 WeakPolarHBondContact O-CB 3.32Å; V246-L250 WeakPolarHBondContact O-CG 3.14Å; V246-L250 PolarHBondContact O-N 2.74Å |
| 247 | L | 98.6 | Very high | 96.9 | Very high | 28 Ų | 28 | 66.6 Ų | 66.6 | 15% | 0.147 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.1 | -44.2 | 178.6 | -73.9 | 171.1 | 0 | 0 | 0 | 112.6 | L211 E243 R244 K251 F252 L254 | L211-L247 HydrophobicContact CD1-CD2 4.24Å; L211-L247 HydrophobicContact CD1-CG 4.17Å; L211-L247 HydrophobicContact CD2-CD1 4.02Å; L211-L247 HydrophobicContact CD2-CD2 3.85Å; L211-L247 HydrophobicContact CD2-CG 3.93Å; E243-L247 HydrophobicContact CG-CD1 4.18Å; E243-L247 PolarHBondContact O-N 3.01Å; R244-L247 PolarHBondContact O-N 3.28Å; L247-K251 PolarHBondContact O-N 3.14Å; L247-F252 HydrophobicContact CB-CD1 4.29Å; L247-F252 HydrophobicContact CB-CE1 3.99Å; L247-F252 HydrophobicContact CB-CE2 4.42Å; L247-F252 HydrophobicContact CB-CZ 4.06Å; L247-F252 HydrophobicContact CD1-CE1 4.01Å; L247-F252 HydrophobicContact CD2-CD1 4.01Å; L247-F252 HydrophobicContact CD2-CE1 4.26Å; L247-F252 HydrophobicContact CG-CE1 4.33Å; L247-F252 PolarHBondContact O-N 2.93Å; L247-L254 HydrophobicContact CD2-CD1 4.14Å; L247-L254 HydrophobicContact CD2-CD2 4.23Å |
| 248 | C | 98.1 | Very high | 96.7 | Very high | 77 Ų | 77 | 60.6 Ų | 60.6 | 52% | 0.52 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64.5 | -41.6 | 177.5 | -71.1 | 0 | 0 | 0 | 0 | 112.3 | R244 V246 K251 | R244-C248 WeakPolarHBondContact O-CB 3.49Å; R244-C248 PolarHBondContact O-N 3.18Å; R244-C248 PolarHBondContact O-SG 2.9Å; V246-C248 VanDerWaalsContact C-N 3.34Å; V246-C248 PolarHBondContact O-N 2.97Å; C248-K251 PolarHBondContact O-N 3.03Å |
| 249 | A | 97.4 | Very high | 96.6 | Very high | 25 Ų | 25 | 57.1 Ų | 57.1 | 21% | 0.207 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.8 | -46.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q193 L194 K245 V246 K251 | Q193-A249 HydrophobicContact CB-CB 4.31Å; Q193-A249 PolarHBondContact OE1-O 3.16Å; L194-A249 HydrophobicContact CD1-CB 4.42Å; L194-A249 HydrophobicContact CD2-CB 3.45Å; L194-A249 VanDerWaalsContact CD2-CB 3.45Å; L194-A249 HydrophobicContact CG-CB 3.94Å; K245-A249 WeakPolarHBondContact O-CB 3.44Å; K245-A249 PolarHBondContact O-N 3.42Å; V246-A249 PolarHBondContact O-N 3.21Å; A249-K251 PolarHBondContact O-N 3.29Å |
| 250 | L | 96.4 | Very high | 96.5 | Very high | 3 Ų | 3 | 57.1 Ų | 57.1 | 2% | 0.016 | 27% | 0.272 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.9 | -0.8 | 178.1 | -59.1 | -178.7 | 0 | 0 | 0 | 113.3 | L186 R189 V246 F252 D253 L254 | L186-L250 HydrophobicContact CB-CD1 4.49Å; L186-L250 HydrophobicContact CD2-CD1 3.69Å; R189-L250 HydrophobicContact CB-CD2 3.56Å; V246-L250 HydrophobicContact CG1-CD1 3.75Å; V246-L250 HydrophobicContact CG1-CG 4.29Å; V246-L250 WeakPolarHBondContact O-CB 3.32Å; V246-L250 WeakPolarHBondContact O-CG 3.14Å; V246-L250 PolarHBondContact O-N 2.74Å; L250-F252 PolarHBondContact O-N 3.18Å; L250-D253 WeakPolarHBondContact O-CB 3.49Å; L250-D253 PolarHBondContact O-N 3.14Å; L250-L254 HydrophobicContact CD1-CD2 4.09Å |
| 251 | K | 97 | Very high | 96.4 | Very high | 180 Ų | 180 | 56 Ų | 56 | 78% | 0.783 | 27% | 0.265 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.2 | 37.3 | -176.3 | -54.7 | 178.6 | -178.2 | 177 | 0 | 112.5 | L247 C248 A249 D253 | L247-K251 PolarHBondContact O-N 3.14Å; C248-K251 PolarHBondContact O-N 3.03Å; A249-K251 PolarHBondContact O-N 3.29Å; K251-D253 PolarHBondContact O-N 2.94Å |
| 252 | F | 97.3 | Very high | 96.3 | Very high | 139 Ų | 139 | 47.5 Ų | 47.5 | 61% | 0.61 | 23% | 0.233 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 58.9 | 10.4 | -175.6 | -65.6 | -100.3 | 0 | 0 | 0 | 115.3 | L247 L250 L254 | L247-F252 HydrophobicContact CB-CD1 4.29Å; L247-F252 HydrophobicContact CB-CE1 3.99Å; L247-F252 HydrophobicContact CB-CE2 4.42Å; L247-F252 HydrophobicContact CB-CZ 4.06Å; L247-F252 HydrophobicContact CD1-CE1 4.01Å; L247-F252 HydrophobicContact CD2-CD1 4.01Å; L247-F252 HydrophobicContact CD2-CE1 4.26Å; L247-F252 HydrophobicContact CG-CE1 4.33Å; L247-F252 PolarHBondContact O-N 2.93Å; L250-F252 PolarHBondContact O-N 3.18Å; F252-L254 PolarHBondContact O-N 3.07Å; F252-L254 VanDerWaalsContact O-N 3.15Å |
| 253 | D | 95.3 | Very high | 96.2 | Very high | 41 Ų | 41 | 46.7 Ų | 46.7 | 22% | 0.219 | 23% | 0.229 | C | C | . | . | trans | -81.4 | 97.4 | 172.7 | 171.4 | 37.3 | 0 | 0 | 0 | 109.9 | Y143 R189 L250 K251 S255 | Y143-D253 WeakPolarHBondContact CE1-OD2 3.35Å; Y143-D253 PolarHBondContact OH-OD1 2.88Å; Y143-D253 VanDerWaalsContact OH-OD1 3.13Å; Y143-D253 PolarHBondContact OH-OD2 3.47Å; R189-D253 IonicContact CZ-OD2 3.71Å; R189-D253 PolarHBondContact NH1-O 2.94Å; R189-D253 VanDerWaalsContact NH1-O 3.14Å; R189-D253 IonicContact NH1-OD2 2.78Å; R189-D253 PolarHBondContact NH1-OD2 3.46Å; R189-D253 IonicContact NH2-OD2 2.93Å; R189-D253 PolarHBondContact NH2-OD2 3.21Å; L250-D253 WeakPolarHBondContact O-CB 3.49Å; L250-D253 PolarHBondContact O-N 3.14Å; K251-D253 PolarHBondContact O-N 2.94Å; D253-S255 WeakPolarHBondContact OD1-CB 3.35Å; D253-S255 PolarHBondContact OD1-N 3.42Å; D253-S255 VanDerWaalsContact OD1-N 3.14Å; D253-S255 PolarHBondContact OD1-OG 3.47Å | ||
| 254 | L | 95.5 | Very high | 96.2 | Very high | 31 Ų | 31 | 46.5 Ų | 46.5 | 16% | 0.162 | 23% | 0.228 | C | C | . | . | trans | -103.7 | 15.1 | 174.4 | -51.3 | -178.7 | 0 | 0 | 0 | 111.5 | L182 L186 K215 L247 L250 F252 | L182-L254 WeakPolarHBondContact CD1-O 3.31Å; L186-L254 HydrophobicContact CD1-CD2 4.13Å; L186-L254 HydrophobicContact CD2-CB 4.39Å; L186-L254 HydrophobicContact CD2-CD2 3.56Å; K215-L254 HydrophobicContact CD-CB 4.17Å; K215-L254 PolarHBondContact NZ-O 2.9Å; L247-L254 HydrophobicContact CD2-CD1 4.14Å; L247-L254 HydrophobicContact CD2-CD2 4.23Å; L250-L254 HydrophobicContact CD1-CD2 4.09Å; F252-L254 PolarHBondContact O-N 3.07Å; F252-L254 VanDerWaalsContact O-N 3.15Å | ||
| 255 | S | 91.2 | Very high | 96 | Very high | 62 Ų | 62 | 38 Ų | 38 | 43% | 0.434 | 20% | 0.196 | S | C | . | . | trans | -73.7 | 134.5 | -177 | -29.9 | 0 | 0 | 0 | 0 | 109.4 | Y143 D253 | Y143-S255 VanDerWaalsContact CZ-O 3.3Å; Y143-S255 WeakPolarHBondContact OH-CB 2.94Å; D253-S255 WeakPolarHBondContact OD1-CB 3.35Å; D253-S255 PolarHBondContact OD1-N 3.42Å; D253-S255 VanDerWaalsContact OD1-N 3.14Å; D253-S255 PolarHBondContact OD1-OG 3.47Å | ||
| 256 | F | 93.3 | Very high | 95.8 | Very high | 38 Ų | 38 | 34 Ų | 34 | 17% | 0.167 | 18% | 0.179 | C | C | . | . | trans | -163.8 | 136.4 | -179.7 | -177.8 | -124 | 0 | 0 | 0 | 108.3 | L182 H185 P258 P298 | L182-F256 HydrophobicContact CD1-CB 3.82Å; L182-F256 HydrophobicContact CD1-CD1 4.44Å; H185-F256 HydrophobicContact CB-CD1 3.76Å; H185-F256 HydrophobicContact CB-CD2 4Å; H185-F256 HydrophobicContact CB-CE1 3.77Å; H185-F256 HydrophobicContact CB-CE2 4.03Å; H185-F256 HydrophobicContact CB-CG 3.88Å; H185-F256 HydrophobicContact CB-CZ 3.92Å; H185-F256 AromaticContact CD2-CD2 3.75Å; H185-F256 AromaticContact CD2-CG 3.7Å; H185-F256 AromaticContact CE1-CD2 3.67Å; H185-F256 AromaticContact CG-CD2 3.41Å; H185-F256 VanDerWaalsContact CG-CD2 3.41Å; H185-F256 AromaticContact CG-CE2 3.73Å; H185-F256 AromaticContact CG-CG 3.57Å; H185-F256 AromaticContact ND1-CD2 3.36Å; H185-F256 WeakPolarHBondContact ND1-CD2 3.48Å; H185-F256 AromaticContact ND1-CE2 3.46Å; H185-F256 WeakPolarHBondContact ND1-CE2 3.29Å; H185-F256 AromaticContact NE2-CD2 3.93Å; F256-P258 HydrophobicContact CD1-CG 4.19Å; F256-P258 HydrophobicContact CE1-CB 4.28Å; F256-P258 HydrophobicContact CE1-CG 4.41Å; F256-P258 WeakPolarHBondContact O-CD 3.37Å; F256-P298 HydrophobicContact CE2-CG 4.19Å; F256-P298 HydrophobicContact CZ-CG 4.5Å | ||
| 257 | S | 91.6 | Very high | 95.7 | Very high | 18 Ų | 18 | 34.1 Ų | 34.1 | 13% | 0.126 | 18% | 0.18 | C | C | . | . | trans | -101.3 | 103.2 | 171.7 | -63.4 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 258 | P | 93.6 | Very high | 95.5 | Very high | 6 Ų | 6 | 34.7 Ų | 34.7 | 4% | 0.039 | 19% | 0.186 | C | C | . | . | trans | -59.8 | 143.6 | -175.7 | -24.5 | 34.9 | 0 | 0 | 0 | 112 | Y181 F256 L260 H261 F262 | Y181-P258 HydrophobicContact CG-CB 4.43Å; F256-P258 HydrophobicContact CD1-CG 4.19Å; F256-P258 HydrophobicContact CE1-CB 4.28Å; F256-P258 HydrophobicContact CE1-CG 4.41Å; F256-P258 WeakPolarHBondContact O-CD 3.37Å; P258-L260 HydrophobicContact CB-CB 4.39Å; P258-L260 PolarHBondContact O-N 2.89Å; P258-L260 VanDerWaalsContact O-N 3.13Å; P258-H261 PolarHBondContact O-N 3.43Å; P258-H261 VanDerWaalsContact O-N 3.15Å; P258-F262 WeakPolarHBondContact O-CD2 3.34Å | ||
| 259 | P | 96.1 | Very high | 95.3 | Very high | 6 Ų | 6 | 31.1 Ų | 31.1 | 4% | 0.039 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.5 | -25.7 | 172.7 | 25.4 | -34.4 | 0 | 0 | 0 | 112.3 | Y181 H261 F262 L263 L284 P298 L301 A302 | Y181-P259 HydrophobicContact CD1-CG 3.58Å; Y181-P259 HydrophobicContact CE1-CG 3.71Å; Y181-P259 HydrophobicContact CG-CG 4.31Å; P259-H261 VanDerWaalsContact C-N 3.34Å; P259-H261 PolarHBondContact O-N 3Å; P259-F262 PolarHBondContact O-N 3.02Å; P259-L263 PolarHBondContact O-N 3.34Å; P259-L284 HydrophobicContact CB-CD1 3.84Å; P259-L284 HydrophobicContact CB-CD2 3.92Å; P259-L284 HydrophobicContact CB-CG 4.39Å; P259-L284 HydrophobicContact CG-CD1 4.15Å; P259-L284 HydrophobicContact CG-CD2 4.13Å; P259-L284 HydrophobicContact CG-CG 4.43Å; P259-P298 HydrophobicContact CB-CB 4.03Å; P259-P298 WeakPolarHBondContact CB-O 3.3Å; P259-L301 HydrophobicContact CB-CB 4.41Å; P259-A302 WeakPolarHBondContact O-CB 3.4Å |
| 260 | L | 96.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -57.8 | -42.4 | 176.1 | -177.2 | 62.8 | 0 | 0 | 0 | 112.6 | E177 Y181 P258 F262 L263 L264 R281 | E177-L260 HydrophobicContact CB-CD2 3.43Å; E177-L260 VanDerWaalsContact CB-CD2 3.43Å; E177-L260 HydrophobicContact CG-CD2 4.39Å; Y181-L260 HydrophobicContact CD2-CB 3.98Å; Y181-L260 HydrophobicContact CD2-CD2 4.39Å; Y181-L260 HydrophobicContact CE2-CB 3.83Å; Y181-L260 HydrophobicContact CE2-CD2 4.22Å; Y181-L260 HydrophobicContact CE2-CG 4.46Å; P258-L260 HydrophobicContact CB-CB 4.39Å; P258-L260 PolarHBondContact O-N 2.89Å; P258-L260 VanDerWaalsContact O-N 3.13Å; L260-F262 VanDerWaalsContact C-N 3.35Å; L260-F262 PolarHBondContact O-N 2.89Å; L260-L263 WeakPolarHBondContact O-CB 3.36Å; L260-L263 PolarHBondContact O-N 2.9Å; L260-L263 VanDerWaalsContact O-N 3.16Å; L260-L264 HydrophobicContact CD1-CD1 4.24Å; L260-L264 HydrophobicContact CD1-CD2 4.37Å; L260-L264 HydrophobicContact CD1-CG 4.12Å; L260-L264 HydrophobicContact CG-CD1 4.1Å; L260-L264 HydrophobicContact CG-CG 4.34Å; L260-L264 WeakPolarHBondContact O-CG 3.39Å; L260-L264 PolarHBondContact O-N 3.43Å; L260-R281 HydrophobicContact CD1-CG 4.04Å |
| 261 | H | 95.6 | Very high | 94.9 | Very high | 35 Ų | 35 | 37.2 Ų | 37.2 | 16% | 0.162 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.7 | -43.1 | 179.8 | -65.4 | 174.5 | 0 | 0 | 0 | 111.6 | L122 M136 E178 P258 P259 L263 L264 L265 | L122-H261 HydrophobicContact CD1-CB 4.49Å; M136-H261 HydrophobicContact CE-CB 3.74Å; E178-H261 VanDerWaalsContact CG-NE2 3.33Å; E178-H261 WeakPolarHBondContact CG-NE2 3.36Å; E178-H261 IonicContact OE1-NE2 2.98Å; P258-H261 PolarHBondContact O-N 3.43Å; P258-H261 VanDerWaalsContact O-N 3.15Å; P259-H261 VanDerWaalsContact C-N 3.34Å; P259-H261 PolarHBondContact O-N 3Å; H261-L263 VanDerWaalsContact C-N 3.33Å; H261-L263 PolarHBondContact O-N 3.38Å; H261-L264 PolarHBondContact O-N 3.26Å; H261-L265 VanDerWaalsContact O-CB 3.24Å; H261-L265 WeakPolarHBondContact O-CB 3.22Å; H261-L265 PolarHBondContact O-N 2.88Å |
| 262 | F | 96.2 | Very high | 94.7 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.5 | -41.5 | 174.9 | -63.5 | -77.2 | 0 | 0 | 0 | 111.4 | M136 M137 Q140 P258 P259 L260 L265 F266 P298 V299 A302 | M136-F262 HydrophobicContact CB-CE1 4.17Å; M136-F262 HydrophobicContact CB-CZ 4.01Å; M136-F262 HydrophobicContact CE-CD1 4.46Å; M136-F262 HydrophobicContact CE-CE1 4.14Å; M136-F262 HydrophobicContact CE-CE2 4.46Å; M136-F262 HydrophobicContact CE-CZ 4.16Å; M137-F262 HydrophobicContact CG-CE1 4.41Å; M137-F262 HydrophobicContact SD-CD1 4.2Å; M137-F262 HydrophobicContact SD-CE1 3.64Å; Q140-F262 HydrophobicContact CB-CZ 4.42Å; Q140-F262 HydrophobicContact CG-CZ 4.49Å; P258-F262 WeakPolarHBondContact O-CD2 3.34Å; P259-F262 PolarHBondContact O-N 3.02Å; L260-F262 VanDerWaalsContact C-N 3.35Å; L260-F262 PolarHBondContact O-N 2.89Å; F262-L265 PolarHBondContact O-N 3.05Å; F262-F266 HydrophobicContact CB-CE2 4.13Å; F262-F266 HydrophobicContact CB-CZ 4.25Å; F262-F266 HydrophobicContact CD1-CZ 4.26Å; F262-F266 WeakPolarHBondContact O-CB 3.49Å; F262-F266 WeakPolarHBondContact O-CD1 3.43Å; F262-F266 WeakPolarHBondContact O-CD2 3.33Å; F262-F266 WeakPolarHBondContact O-CG 3.32Å; F262-F266 PolarHBondContact O-N 3Å; F262-P298 HydrophobicContact CD2-CB 3.96Å; F262-P298 HydrophobicContact CE2-CB 3.8Å; F262-V299 HydrophobicContact CD1-CB 4.16Å; F262-V299 HydrophobicContact CD1-CG2 4Å; F262-V299 HydrophobicContact CE1-CB 4.39Å; F262-V299 HydrophobicContact CE1-CG2 4.49Å; F262-V299 HydrophobicContact CG-CB 4.27Å; F262-V299 HydrophobicContact CG-CG2 4.35Å; F262-A302 HydrophobicContact CB-CB 3.63Å |
| 263 | L | 97.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.3 | -48.3 | 178.8 | -177.9 | 156.4 | 0 | 0 | 0 | 111.3 | P259 L260 H261 F266 A267 V277 A280 R281 L284 A302 A305 | P259-L263 PolarHBondContact O-N 3.34Å; L260-L263 WeakPolarHBondContact O-CB 3.36Å; L260-L263 PolarHBondContact O-N 2.9Å; L260-L263 VanDerWaalsContact O-N 3.16Å; H261-L263 VanDerWaalsContact C-N 3.33Å; H261-L263 PolarHBondContact O-N 3.38Å; L263-F266 PolarHBondContact O-N 2.81Å; L263-A267 WeakPolarHBondContact O-CB 3.41Å; L263-A267 PolarHBondContact O-N 3.33Å; L263-V277 HydrophobicContact CD2-CG1 4.21Å; L263-A280 HydrophobicContact CD1-CB 3.78Å; L263-A280 HydrophobicContact CD2-CB 4.18Å; L263-A280 HydrophobicContact CG-CB 4.16Å; L263-R281 HydrophobicContact CD2-CG 4.28Å; L263-L284 HydrophobicContact CB-CD2 4.25Å; L263-L284 HydrophobicContact CD1-CB 3.86Å; L263-L284 HydrophobicContact CD1-CD2 3.61Å; L263-L284 HydrophobicContact CD1-CG 4.31Å; L263-A302 HydrophobicContact CB-CB 3.91Å; L263-A305 HydrophobicContact CD1-CB 4.35Å |
| 264 | L | 96.8 | Very high | 94.5 | Very high | 19 Ų | 19 | 26 Ų | 26 | 10% | 0.099 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -66.7 | -40.8 | -179.9 | -61.9 | -179.9 | 0 | 0 | 0 | 111.7 | L120 L260 H261 A267 S268 V277 R281 | L120-L264 HydrophobicContact CD1-CB 3.89Å; L120-L264 HydrophobicContact CD2-CB 4.13Å; L260-L264 HydrophobicContact CD1-CD1 4.24Å; L260-L264 HydrophobicContact CD1-CD2 4.37Å; L260-L264 HydrophobicContact CD1-CG 4.12Å; L260-L264 HydrophobicContact CG-CD1 4.1Å; L260-L264 HydrophobicContact CG-CG 4.34Å; L260-L264 WeakPolarHBondContact O-CG 3.39Å; L260-L264 PolarHBondContact O-N 3.43Å; H261-L264 PolarHBondContact O-N 3.26Å; L264-A267 PolarHBondContact O-N 2.58Å; L264-S268 VanDerWaalsContact O-CB 3.29Å; L264-S268 WeakPolarHBondContact O-CB 3.34Å; L264-S268 PolarHBondContact O-N 3.05Å; L264-V277 HydrophobicContact CD2-CG1 3.73Å; L264-R281 VanDerWaalsContact CD2-CZ 3.46Å |
| 265 | L | 95.6 | Very high | 94.6 | Very high | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.8 | -50.9 | 174.9 | -179 | 66 | 0 | 0 | 0 | 111 | V113 A116 L117 F133 H261 F262 S268 V269 | V113-L265 HydrophobicContact CG1-CD1 4.25Å; V113-L265 HydrophobicContact CG1-CD2 4.31Å; A116-L265 HydrophobicContact CB-CD1 3.59Å; L117-L265 HydrophobicContact CD2-CD1 4.08Å; L117-L265 HydrophobicContact CG-CD1 3.92Å; F133-L265 HydrophobicContact CD2-CD2 3.52Å; F133-L265 HydrophobicContact CE2-CD2 3.54Å; H261-L265 VanDerWaalsContact O-CB 3.24Å; H261-L265 WeakPolarHBondContact O-CB 3.22Å; H261-L265 PolarHBondContact O-N 2.88Å; F262-L265 PolarHBondContact O-N 3.05Å; L265-S268 WeakPolarHBondContact O-CB 3.22Å; L265-S268 PolarHBondContact O-N 2.95Å; L265-V269 WeakPolarHBondContact O-CG2 3.28Å; L265-V269 PolarHBondContact O-N 3.41Å |
| 266 | F | 94.6 | Very high | 94.8 | Very high | 4 Ų | 4 | 23 Ų | 23 | 2% | 0.018 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.4 | -40.9 | -178.5 | -61.8 | -13.4 | 0 | 0 | 0 | 111.9 | F262 L263 S268 V269 A270 V299 L306 I331 V333 | F262-F266 HydrophobicContact CB-CE2 4.13Å; F262-F266 HydrophobicContact CB-CZ 4.25Å; F262-F266 HydrophobicContact CD1-CZ 4.26Å; F262-F266 WeakPolarHBondContact O-CB 3.49Å; F262-F266 WeakPolarHBondContact O-CD1 3.43Å; F262-F266 WeakPolarHBondContact O-CD2 3.33Å; F262-F266 WeakPolarHBondContact O-CG 3.32Å; F262-F266 PolarHBondContact O-N 3Å; L263-F266 PolarHBondContact O-N 2.81Å; F266-S268 VanDerWaalsContact C-N 3.28Å; F266-S268 PolarHBondContact O-N 3.01Å; F266-V269 PolarHBondContact O-N 3.39Å; F266-A270 WeakPolarHBondContact O-CB 3.36Å; F266-A270 PolarHBondContact O-N 2.98Å; F266-V299 HydrophobicContact CE2-CG2 3.54Å; F266-V299 HydrophobicContact CZ-CG2 3.39Å; F266-L306 HydrophobicContact CB-CD2 3.75Å; F266-I331 HydrophobicContact CD1-CD1 3.64Å; F266-I331 HydrophobicContact CE1-CB 4.35Å; F266-I331 HydrophobicContact CE1-CD1 3.52Å; F266-I331 HydrophobicContact CE1-CG2 3.81Å; F266-I331 HydrophobicContact CZ-CG2 3.85Å; F266-V333 HydrophobicContact CD2-CG2 4.41Å; F266-V333 HydrophobicContact CE2-CG1 4.36Å; F266-V333 HydrophobicContact CE2-CG2 3.78Å; F266-V333 HydrophobicContact CZ-CG2 4.17Å |
| 267 | A | 95.4 | Very high | 95 | Very high | 3 Ų | 3 | 22.2 Ų | 22.2 | 3% | 0.025 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.1 | -37.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L263 L264 R271 C272 V277 L306 | L263-A267 WeakPolarHBondContact O-CB 3.41Å; L263-A267 PolarHBondContact O-N 3.33Å; L264-A267 PolarHBondContact O-N 2.58Å; A267-R271 PolarHBondContact O-N 3.04Å; A267-C272 HydrophobicContact CB-CB 4.13Å; A267-C272 PolarHBondContact O-N 2.79Å; A267-V277 HydrophobicContact CB-CG2 3.76Å; A267-L306 HydrophobicContact CB-CD1 3.98Å; A267-L306 HydrophobicContact CB-CD2 4.38Å |
| 268 | S | 95.2 | Very high | 95.3 | Very high | 41 Ų | 41 | 24.6 Ų | 24.6 | 29% | 0.287 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -68.2 | -50.3 | 176.8 | -176.4 | 0 | 0 | 0 | 0 | 111.5 | A116 L264 L265 F266 A270 R271 | A116-S268 WeakPolarHBondContact CB-OG 3.38Å; L264-S268 VanDerWaalsContact O-CB 3.29Å; L264-S268 WeakPolarHBondContact O-CB 3.34Å; L264-S268 PolarHBondContact O-N 3.05Å; L265-S268 WeakPolarHBondContact O-CB 3.22Å; L265-S268 PolarHBondContact O-N 2.95Å; F266-S268 VanDerWaalsContact C-N 3.28Å; F266-S268 PolarHBondContact O-N 3.01Å; S268-A270 VanDerWaalsContact C-N 3.31Å; S268-A270 PolarHBondContact O-N 2.58Å; S268-R271 PolarHBondContact O-N 3.39Å |
| 269 | V | 93.7 | Very high | 95.5 | Very high | 1 Ų | 1 | 24.3 Ų | 24.3 | 1% | 0.006 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.9 | -41.1 | 176.7 | 175.5 | 0 | 0 | 0 | 0 | 111.1 | E112 V113 A116 L265 F266 R271 L327 A328 | E112-V269 HydrophobicContact CB-CG1 4.21Å; E112-V269 HydrophobicContact CB-CG2 4.44Å; V113-V269 HydrophobicContact CG2-CG2 4.14Å; A116-V269 HydrophobicContact CB-CG2 3.95Å; L265-V269 WeakPolarHBondContact O-CG2 3.28Å; L265-V269 PolarHBondContact O-N 3.41Å; F266-V269 PolarHBondContact O-N 3.39Å; V269-R271 PolarHBondContact O-N 2.82Å; V269-L327 HydrophobicContact CG1-CD2 4.34Å; V269-L327 HydrophobicContact CG1-CG 4.46Å; V269-A328 HydrophobicContact CB-CB 4.31Å; V269-A328 HydrophobicContact CG1-CB 3.94Å |
| 270 | A | 92.2 | Very high | 95.6 | Very high | 4 Ų | 4 | 24 Ų | 24 | 3% | 0.033 | 13% | 0.133 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | -2.7 | 177 | 0 | 0 | 0 | 0 | 0 | 114 | F266 S268 C272 W325 A328 | F266-A270 WeakPolarHBondContact O-CB 3.36Å; F266-A270 PolarHBondContact O-N 2.98Å; S268-A270 VanDerWaalsContact C-N 3.31Å; S268-A270 PolarHBondContact O-N 2.58Å; A270-C272 PolarHBondContact O-N 3.17Å; A270-W325 HydrophobicContact CB-CE3 3.78Å; A270-W325 HydrophobicContact CB-CZ3 4.32Å; A270-A328 HydrophobicContact CB-CB 3.76Å |
| 271 | R | 92.7 | Very high | 95.7 | Very high | 152 Ų | 152 | 26.2 Ų | 26.2 | 57% | 0.574 | 14% | 0.141 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 40.3 | -179.1 | -55.8 | -179.9 | -177.3 | 178.8 | 1.7 | 112.9 | E112 A267 S268 V269 A324 | E112-R271 IonicContact OE1-NH2 3.56Å; E112-R271 PolarHBondContact OE1-NH2 3.14Å; E112-R271 VanDerWaalsContact OE1-NH2 3.14Å; A267-R271 PolarHBondContact O-N 3.04Å; S268-R271 PolarHBondContact O-N 3.39Å; V269-R271 PolarHBondContact O-N 2.82Å; R271-A324 HydrophobicContact CB-CB 4.29Å; R271-A324 HydrophobicContact CG-CB 4.01Å |
| 272 | C | 93.1 | Very high | 95.8 | Very high | 26 Ų | 26 | 24.5 Ų | 24.5 | 18% | 0.176 | 13% | 0.133 | C | C | . | . | trans | -64.8 | 146.6 | -179.4 | -68.6 | 0 | 0 | 0 | 0 | 111.8 | A267 A270 V276 V277 | A267-C272 HydrophobicContact CB-CB 4.13Å; A267-C272 PolarHBondContact O-N 2.79Å; A270-C272 PolarHBondContact O-N 3.17Å; C272-V276 HydrophobicContact CB-CB 4.03Å; C272-V276 HydrophobicContact CB-CG1 3.82Å; C272-V277 HydrophobicContact CB-CG2 4.22Å | ||
| 273 | S | 94.1 | Very high | 95.9 | Very high | 38 Ų | 38 | 24.5 Ų | 24.5 | 27% | 0.266 | 13% | 0.133 | S | C | . | . | trans | -64.8 | 159 | 173 | 89.1 | 0 | 0 | 0 | 0 | 111.3 | A275 V276 V277 E315 | S273-A275 PolarHBondContact O-N 3.41Å; S273-A275 PolarHBondContact OG-N 3.13Å; S273-A275 VanDerWaalsContact OG-N 3.15Å; S273-V276 PolarHBondContact O-N 3.08Å; S273-V276 VanDerWaalsContact O-N 3.12Å; S273-V276 PolarHBondContact OG-N 3.28Å; S273-V277 WeakPolarHBondContact O-CG2 3.32Å; S273-V277 PolarHBondContact O-N 2.96Å; S273-E315 VanDerWaalsContact CB-OE1 3.29Å; S273-E315 WeakPolarHBondContact CB-OE1 3.32Å; S273-E315 WeakPolarHBondContact CB-OE2 3.4Å; S273-E315 VanDerWaalsContact OG-CD 3.24Å; S273-E315 PolarHBondContact OG-OE1 3.13Å; S273-E315 PolarHBondContact OG-OE2 3.18Å | ||
| 274 | A | 95.1 | Very high | 96 | Very high | 62 Ų | 62 | 24.5 Ų | 24.5 | 51% | 0.512 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -56.5 | -32.9 | 173 | 0 | 0 | 0 | 0 | 0 | 112.8 | V277 W278 L371 | A274-V277 PolarHBondContact O-N 3.39Å; A274-W278 WeakPolarHBondContact O-CB 3.03Å; A274-W278 PolarHBondContact O-N 2.86Å; A274-L371 HydrophobicContact CB-CD1 4.37Å |
| 275 | A | 95.9 | Very high | 96 | Very high | 29 Ų | 29 | 23.6 Ų | 23.6 | 24% | 0.24 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -65.2 | -44.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S273 W278 M279 L313 L371 | S273-A275 PolarHBondContact O-N 3.41Å; S273-A275 PolarHBondContact OG-N 3.13Å; S273-A275 VanDerWaalsContact OG-N 3.15Å; A275-W278 PolarHBondContact O-N 3.38Å; A275-M279 VanDerWaalsContact O-CB 3.28Å; A275-M279 WeakPolarHBondContact O-CB 3.36Å; A275-M279 PolarHBondContact O-N 3.43Å; A275-L313 VanDerWaalsContact C-CD1 3.49Å; A275-L313 HydrophobicContact CB-CD1 4.06Å; A275-L371 HydrophobicContact CB-CD1 4.18Å |
| 276 | V | 96.2 | Very high | 96.1 | Very high | 1 Ų | 1 | 23.8 Ų | 23.8 | 1% | 0.006 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.1 | -44.5 | 174.9 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | C272 S273 M279 A280 L306 A309 L313 E315 | C272-V276 HydrophobicContact CB-CB 4.03Å; C272-V276 HydrophobicContact CB-CG1 3.82Å; S273-V276 PolarHBondContact O-N 3.08Å; S273-V276 VanDerWaalsContact O-N 3.12Å; S273-V276 PolarHBondContact OG-N 3.28Å; V276-M279 PolarHBondContact O-N 3.18Å; V276-A280 VanDerWaalsContact O-CB 3.27Å; V276-A280 WeakPolarHBondContact O-CB 3.34Å; V276-A280 PolarHBondContact O-N 2.96Å; V276-L306 HydrophobicContact CG1-CD1 3.77Å; V276-A309 HydrophobicContact CG1-CB 4.25Å; V276-L313 HydrophobicContact CB-CD1 4.26Å; V276-L313 HydrophobicContact CG2-CD1 3.71Å; V276-E315 VanDerWaalsContact CG2-CD 3.44Å; V276-E315 HydrophobicContact CG2-CG 4.18Å; V276-E315 WeakPolarHBondContact CG2-OE2 3.45Å |
| 277 | V | 97.3 | Very high | 96.1 | Very high | 20 Ų | 20 | 23.9 Ų | 23.9 | 12% | 0.121 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -63.6 | -45.2 | 179.5 | -170.5 | 0 | 0 | 0 | 0 | 111.5 | L263 L264 A267 C272 S273 A274 A280 R281 | L263-V277 HydrophobicContact CD2-CG1 4.21Å; L264-V277 HydrophobicContact CD2-CG1 3.73Å; A267-V277 HydrophobicContact CB-CG2 3.76Å; C272-V277 HydrophobicContact CB-CG2 4.22Å; S273-V277 WeakPolarHBondContact O-CG2 3.32Å; S273-V277 PolarHBondContact O-N 2.96Å; A274-V277 PolarHBondContact O-N 3.39Å; V277-A280 PolarHBondContact O-N 3.01Å; V277-R281 VanDerWaalsContact CG1-NH1 3.28Å; V277-R281 WeakPolarHBondContact O-CG 3.49Å; V277-R281 PolarHBondContact O-N 3.1Å |
| 278 | W | 98.1 | Very high | 96.1 | Very high | 69 Ų | 69 | 24.7 Ų | 24.7 | 26% | 0.261 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -64.7 | -40.6 | 177.5 | -81.1 | 116.6 | 0 | 0 | 0 | 112.5 | A274 A275 R281 Y282 Y365 T370 L371 V373 | A274-W278 WeakPolarHBondContact O-CB 3.03Å; A274-W278 PolarHBondContact O-N 2.86Å; A275-W278 PolarHBondContact O-N 3.38Å; W278-R281 PolarHBondContact O-N 3.2Å; W278-Y282 PolarHBondContact O-N 3.01Å; W278-Y365 HydrophobicContact CE3-CD1 4.37Å; W278-Y365 HydrophobicContact CE3-CE1 4.02Å; W278-Y365 HydrophobicContact CZ3-CE1 4.26Å; W278-T370 HydrophobicContact CE3-CG2 4.06Å; W278-T370 HydrophobicContact CH2-CG2 4.39Å; W278-T370 HydrophobicContact CZ3-CG2 3.89Å; W278-L371 HydrophobicContact CG-CD1 4.44Å; W278-V373 HydrophobicContact CB-CG1 3.82Å; W278-V373 HydrophobicContact CB-CG2 4.38Å |
| 279 | M | 98.1 | Very high | 96 | Very high | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63.2 | -43.8 | 175.4 | -179.6 | 64.1 | 73 | 0 | 0 | 111.2 | A275 V276 Y282 L283 A309 V312 L313 V373 H376 L379 | A275-M279 VanDerWaalsContact O-CB 3.28Å; A275-M279 WeakPolarHBondContact O-CB 3.36Å; A275-M279 PolarHBondContact O-N 3.43Å; V276-M279 PolarHBondContact O-N 3.18Å; M279-Y282 WeakPolarHBondContact O-CB 3.43Å; M279-Y282 PolarHBondContact O-N 2.97Å; M279-Y282 HydrophobicContact SD-CD1 4.27Å; M279-L283 HydrophobicContact CG-CD1 4.12Å; M279-L283 WeakPolarHBondContact O-CG 3.26Å; M279-L283 PolarHBondContact O-N 3.23Å; M279-L283 HydrophobicContact SD-CD1 4.5Å; M279-A309 HydrophobicContact CB-CB 3.84Å; M279-A309 HydrophobicContact CG-CB 3.58Å; M279-V312 HydrophobicContact CE-CG1 4.02Å; M279-V312 HydrophobicContact SD-CG1 4.38Å; M279-L313 HydrophobicContact CB-CD1 3.92Å; M279-L313 HydrophobicContact CE-CD2 3.89Å; M279-L313 HydrophobicContact CE-CG 4.3Å; M279-L313 HydrophobicContact CG-CD1 4.34Å; M279-L313 HydrophobicContact CG-CG 4.44Å; M279-V373 HydrophobicContact CB-CB 4.35Å; M279-V373 HydrophobicContact CB-CG1 4.22Å; M279-V373 HydrophobicContact CE-CB 3.84Å; M279-V373 HydrophobicContact CE-CG1 4.29Å; M279-V373 WeakPolarHBondContact CE-O 3.2Å; M279-V373 HydrophobicContact SD-CB 4.19Å; M279-H376 HydrophobicContact CE-CB 3.56Å; M279-L379 HydrophobicContact CE-CD1 4.45Å; M279-L379 HydrophobicContact CE-CG 4.44Å; M279-L379 HydrophobicContact SD-CD1 4.25Å; M279-L379 HydrophobicContact SD-CD2 3.83Å; M279-L379 HydrophobicContact SD-CG 4.27Å |
| 280 | A | 98.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -64.8 | -41.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L263 V276 V277 Y282 L283 L284 L306 A309 | L263-A280 HydrophobicContact CD1-CB 3.78Å; L263-A280 HydrophobicContact CD2-CB 4.18Å; L263-A280 HydrophobicContact CG-CB 4.16Å; V276-A280 VanDerWaalsContact O-CB 3.27Å; V276-A280 WeakPolarHBondContact O-CB 3.34Å; V276-A280 PolarHBondContact O-N 2.96Å; V277-A280 PolarHBondContact O-N 3.01Å; A280-Y282 PolarHBondContact O-N 2.96Å; A280-L283 PolarHBondContact O-N 3.2Å; A280-L284 VanDerWaalsContact O-CB 3.27Å; A280-L284 WeakPolarHBondContact O-CB 3.23Å; A280-L284 PolarHBondContact O-N 3.47Å; A280-L306 HydrophobicContact CB-CB 4.47Å; A280-L306 HydrophobicContact CB-CD1 3.91Å; A280-A309 HydrophobicContact CB-CB 3.77Å |
| 281 | R | 98.4 | Very high | 95.7 | Very high | 45 Ų | 45 | 26 Ų | 26 | 17% | 0.17 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -56.9 | -47.6 | 173 | -78.8 | -179 | 165.6 | 111.2 | -1.6 | 111.7 | E177 L260 L263 L264 V277 W278 L284 E285 Y365 | E177-R281 IonicContact OE2-NE 3.37Å; E177-R281 PolarHBondContact OE2-NE 2.8Å; L260-R281 HydrophobicContact CD1-CG 4.04Å; L263-R281 HydrophobicContact CD2-CG 4.28Å; L264-R281 VanDerWaalsContact CD2-CZ 3.46Å; V277-R281 VanDerWaalsContact CG1-NH1 3.28Å; V277-R281 WeakPolarHBondContact O-CG 3.49Å; V277-R281 PolarHBondContact O-N 3.1Å; W278-R281 PolarHBondContact O-N 3.2Å; R281-L284 PolarHBondContact O-N 3.29Å; R281-E285 PolarHBondContact O-N 3.13Å; R281-Y365 HydrophobicContact CB-CE1 3.84Å |
| 282 | Y | 98.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -57.5 | -51.5 | 176.6 | 168.5 | -118 | 0 | 0 | 0 | 112.1 | W278 M279 A280 L284 E285 L286 A350 A353 T361 Y365 V373 L379 | W278-Y282 PolarHBondContact O-N 3.01Å; M279-Y282 WeakPolarHBondContact O-CB 3.43Å; M279-Y282 PolarHBondContact O-N 2.97Å; M279-Y282 HydrophobicContact SD-CD1 4.27Å; A280-Y282 PolarHBondContact O-N 2.96Å; Y282-L284 VanDerWaalsContact C-N 3.3Å; Y282-L284 PolarHBondContact O-N 2.95Å; Y282-E285 PolarHBondContact O-N 3.06Å; Y282-L286 HydrophobicContact CD1-CD1 4.42Å; Y282-L286 HydrophobicContact CD2-CG 4.38Å; Y282-L286 HydrophobicContact CE1-CD1 3.81Å; Y282-L286 HydrophobicContact CE2-CD1 3.93Å; Y282-L286 HydrophobicContact CE2-CD2 4.11Å; Y282-L286 HydrophobicContact CE2-CG 3.95Å; Y282-L286 WeakPolarHBondContact O-CG 3.39Å; Y282-L286 PolarHBondContact O-N 3.18Å; Y282-A350 HydrophobicContact CE1-CB 4.25Å; Y282-A353 VanDerWaalsContact OH-CB 3.31Å; Y282-A353 WeakPolarHBondContact OH-CB 3.47Å; Y282-T361 HydrophobicContact CD2-CG2 3.89Å; Y282-T361 HydrophobicContact CE2-CG2 3.96Å; Y282-Y365 HydrophobicContact CD2-CD1 4.42Å; Y282-Y365 AromaticContact CD2-CD2 3.78Å; Y282-Y365 HydrophobicContact CD2-CD2 3.78Å; Y282-Y365 AromaticContact CD2-CG 3.69Å; Y282-Y365 HydrophobicContact CD2-CG 3.69Å; Y282-Y365 HydrophobicContact CG-CD1 4.43Å; Y282-Y365 HydrophobicContact CG-CG 4.11Å; Y282-V373 HydrophobicContact CG-CG2 4.38Å; Y282-L379 HydrophobicContact CD1-CD1 4.31Å; Y282-L379 HydrophobicContact CE1-CD1 3.67Å |
| 283 | L | 98.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -61.4 | -39.7 | 178.5 | -69.3 | 169.7 | 0 | 0 | 0 | 111.7 | M279 A280 L286 S287 A305 L308 A309 L346 A350 L379 | M279-L283 HydrophobicContact CG-CD1 4.12Å; M279-L283 WeakPolarHBondContact O-CG 3.26Å; M279-L283 PolarHBondContact O-N 3.23Å; M279-L283 HydrophobicContact SD-CD1 4.5Å; A280-L283 PolarHBondContact O-N 3.2Å; L283-L286 PolarHBondContact O-N 3.27Å; L283-S287 PolarHBondContact O-N 2.79Å; L283-A305 HydrophobicContact CB-CB 4.2Å; L283-L308 HydrophobicContact CD1-CB 4Å; L283-L308 HydrophobicContact CD1-CD2 3.88Å; L283-L308 HydrophobicContact CD1-CG 3.8Å; L283-L308 HydrophobicContact CD2-CD2 3.96Å; L283-L308 HydrophobicContact CG-CD2 4.49Å; L283-A309 HydrophobicContact CD1-CB 4.1Å; L283-L346 HydrophobicContact CB-CD1 4.29Å; L283-L346 HydrophobicContact CD2-CB 4.41Å; L283-L346 WeakPolarHBondContact O-CD2 3.32Å; L283-A350 HydrophobicContact CD2-CB 3.96Å; L283-L379 HydrophobicContact CD2-CD2 4.1Å |
| 284 | L | 98.4 | Very high | 95.5 | Very high | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -67.2 | -40 | 177.4 | -177.3 | 64.8 | 0 | 0 | 0 | 111.8 | Y181 P259 L263 A280 R281 Y282 S287 L301 A305 | Y181-L284 HydrophobicContact CE1-CD2 4.29Å; Y181-L284 HydrophobicContact CE1-CG 4.12Å; Y181-L284 WeakPolarHBondContact OH-CD2 3.33Å; Y181-L284 WeakPolarHBondContact OH-CG 3.29Å; P259-L284 HydrophobicContact CB-CD1 3.84Å; P259-L284 HydrophobicContact CB-CD2 3.92Å; P259-L284 HydrophobicContact CB-CG 4.39Å; P259-L284 HydrophobicContact CG-CD1 4.15Å; P259-L284 HydrophobicContact CG-CD2 4.13Å; P259-L284 HydrophobicContact CG-CG 4.43Å; L263-L284 HydrophobicContact CB-CD2 4.25Å; L263-L284 HydrophobicContact CD1-CB 3.86Å; L263-L284 HydrophobicContact CD1-CD2 3.61Å; L263-L284 HydrophobicContact CD1-CG 4.31Å; A280-L284 VanDerWaalsContact O-CB 3.27Å; A280-L284 WeakPolarHBondContact O-CB 3.23Å; A280-L284 PolarHBondContact O-N 3.47Å; R281-L284 PolarHBondContact O-N 3.29Å; Y282-L284 VanDerWaalsContact C-N 3.3Å; Y282-L284 PolarHBondContact O-N 2.95Å; L284-S287 WeakPolarHBondContact O-CB 3.24Å; L284-S287 PolarHBondContact O-N 2.71Å; L284-S287 PolarHBondContact O-OG 3.2Å; L284-L301 HydrophobicContact CD1-CB 3.7Å; L284-A305 HydrophobicContact CB-CB 4.03Å |
| 285 | E | 98 | Very high | 95.4 | Very high | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -67.9 | -35.5 | 177.2 | -162.6 | -179.3 | 109.5 | 0 | 0 | 111.8 | L180 Y181 R281 Y282 S287 L288 T361 K364 Y365 | L180-E285 HydrophobicContact CD2-CG 4.21Å; Y181-E285 PolarHBondContact OH-N 3.1Å; R281-E285 PolarHBondContact O-N 3.13Å; Y282-E285 PolarHBondContact O-N 3.06Å; E285-S287 PolarHBondContact O-N 3.44Å; E285-L288 HydrophobicContact CG-CD1 3.96Å; E285-L288 VanDerWaalsContact O-CB 3.23Å; E285-L288 WeakPolarHBondContact O-CB 3.34Å; E285-L288 WeakPolarHBondContact O-CG 3.37Å; E285-L288 PolarHBondContact O-N 3.45Å; E285-T361 HydrophobicContact CB-CG2 3.92Å; E285-T361 HydrophobicContact CG-CG2 4.04Å; E285-T361 WeakPolarHBondContact OE1-CG2 3.29Å; E285-T361 PolarHBondContact OE1-OG1 2.96Å; E285-K364 WeakPolarHBondContact OE1-CD 3.48Å; E285-K364 IonicContact OE1-NZ 3.36Å; E285-K364 WeakPolarHBondContact OE2-CE 3.39Å; E285-K364 IonicContact OE2-NZ 2.83Å; E285-K364 PolarHBondContact OE2-NZ 3.02Å; E285-Y365 HydrophobicContact CB-CE2 4.2Å; E285-Y365 WeakPolarHBondContact OE2-CE2 3.05Å; E285-Y365 PolarHBondContact OE2-OH 3.13Å; E285-Y365 VanDerWaalsContact OE2-OH 3.14Å |
| 286 | L | 96.4 | Very high | 95.3 | Very high | 5 Ų | 5 | 19.3 Ų | 19.3 | 3% | 0.026 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -57.9 | -29.3 | 171.5 | -72.5 | 177.1 | 0 | 0 | 0 | 112.7 | Y282 L283 L288 L289 A349 A350 A353 T361 | Y282-L286 HydrophobicContact CD1-CD1 4.42Å; Y282-L286 HydrophobicContact CD2-CG 4.38Å; Y282-L286 HydrophobicContact CE1-CD1 3.81Å; Y282-L286 HydrophobicContact CE2-CD1 3.93Å; Y282-L286 HydrophobicContact CE2-CD2 4.11Å; Y282-L286 HydrophobicContact CE2-CG 3.95Å; Y282-L286 WeakPolarHBondContact O-CG 3.39Å; Y282-L286 PolarHBondContact O-N 3.18Å; L283-L286 PolarHBondContact O-N 3.27Å; L286-L288 PolarHBondContact O-N 2.96Å; L286-L288 VanDerWaalsContact O-N 3.13Å; L286-L289 HydrophobicContact CD2-CD1 4.2Å; L286-L289 WeakPolarHBondContact O-CB 3.27Å; L286-L289 PolarHBondContact O-N 3.42Å; L286-A349 HydrophobicContact CB-CB 4.37Å; L286-A349 HydrophobicContact CD1-CB 4.45Å; L286-A350 HydrophobicContact CD1-CB 3.7Å; L286-A353 HydrophobicContact CD2-CB 4.16Å; L286-T361 HydrophobicContact CD2-CG2 3.81Å; L286-T361 HydrophobicContact CG-CG2 4.08Å |
| 287 | S | 96.1 | Very high | 95.2 | Very high | 5 Ų | 5 | 20.1 Ų | 20.1 | 4% | 0.035 | 10% | 0.099 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.7 | -25.5 | 175.1 | 83.2 | 0 | 0 | 0 | 0 | 112.9 | L283 L284 E285 L289 E290 C293 | L283-S287 PolarHBondContact O-N 2.79Å; L284-S287 WeakPolarHBondContact O-CB 3.24Å; L284-S287 PolarHBondContact O-N 2.71Å; L284-S287 PolarHBondContact O-OG 3.2Å; E285-S287 PolarHBondContact O-N 3.44Å; S287-L289 VanDerWaalsContact C-N 3.27Å; S287-L289 PolarHBondContact O-N 2.8Å; S287-E290 PolarHBondContact O-N 3.24Å; S287-C293 WeakPolarHBondContact O-CB 3.29Å |
| 288 | L | 95.4 | Very high | 95.2 | Very high | 21 Ų | 21 | 19.8 Ų | 19.8 | 11% | 0.11 | 10% | 0.097 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -29.4 | 177.6 | -58.1 | 177.7 | 0 | 0 | 0 | 112 | R159 V163 L180 Y181 M184 E285 L286 | R159-L288 VanDerWaalsContact CZ-O 3.27Å; R159-L288 PolarHBondContact NH1-O 3.12Å; R159-L288 PolarHBondContact NH2-O 3.32Å; V163-L288 HydrophobicContact CG1-CB 4.03Å; L180-L288 HydrophobicContact CD2-CD1 3.94Å; L180-L288 HydrophobicContact CG-CD1 4Å; Y181-L288 HydrophobicContact CD1-CD1 4.34Å; Y181-L288 HydrophobicContact CD1-CD2 3.9Å; Y181-L288 HydrophobicContact CE1-CD1 4.08Å; Y181-L288 HydrophobicContact CE1-CD2 3.92Å; Y181-L288 HydrophobicContact CE1-CG 4.15Å; M184-L288 HydrophobicContact CB-CD2 4.11Å; M184-L288 HydrophobicContact CG-CD1 4.15Å; M184-L288 HydrophobicContact CG-CD2 4.11Å; E285-L288 HydrophobicContact CG-CD1 3.96Å; E285-L288 VanDerWaalsContact O-CB 3.23Å; E285-L288 WeakPolarHBondContact O-CB 3.34Å; E285-L288 WeakPolarHBondContact O-CG 3.37Å; E285-L288 PolarHBondContact O-N 3.45Å; L286-L288 PolarHBondContact O-N 2.96Å; L286-L288 VanDerWaalsContact O-N 3.13Å |
| 289 | L | 92.2 | Very high | 95 | Very high | 17 Ų | 17 | 16.7 Ų | 16.7 | 9% | 0.089 | 9% | 0.086 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.2 | -17.5 | 178.2 | -70.3 | 159.5 | 0 | 0 | 0 | 113 | R159 V163 E164 L286 S287 | R159-L289 PolarHBondContact NH2-O 3.41Å; V163-L289 HydrophobicContact CB-CD2 4.09Å; V163-L289 HydrophobicContact CG1-CD2 3.97Å; V163-L289 HydrophobicContact CG1-CG 4.25Å; E164-L289 HydrophobicContact CB-CD2 4.48Å; L286-L289 HydrophobicContact CD2-CD1 4.2Å; L286-L289 WeakPolarHBondContact O-CB 3.27Å; L286-L289 PolarHBondContact O-N 3.42Å; S287-L289 VanDerWaalsContact C-N 3.27Å; S287-L289 PolarHBondContact O-N 2.8Å |
| 290 | E | 91.9 | Very high | 95 | Very high | 45 Ų | 45 | 18.1 Ų | 18.1 | 21% | 0.21 | 9% | 0.093 | C | C | . | . | trans | -94.6 | 108.9 | 179.1 | -67.5 | -63.5 | 145.2 | 0 | 0 | 111.9 | R159 S287 Q292 C293 I345 A349 | R159-E290 VanDerWaalsContact NH2-N 3.15Å; S287-E290 PolarHBondContact O-N 3.24Å; E290-Q292 VanDerWaalsContact C-N 3.26Å; E290-Q292 HydrophobicContact CB-CG 4.37Å; E290-Q292 PolarHBondContact O-N 3.46Å; E290-Q292 PolarHBondContact OE2-NE2 2.94Å; E290-C293 HydrophobicContact CB-CB 4.32Å; E290-C293 WeakPolarHBondContact O-CB 3.02Å; E290-C293 PolarHBondContact O-N 3.34Å; E290-I345 HydrophobicContact CB-CG2 3.93Å; E290-I345 HydrophobicContact CG-CG2 3.78Å; E290-A349 HydrophobicContact CG-CB 3.96Å | ||
| 291 | A | 87.8 | Confident | 94.9 | Very high | 12 Ų | 12 | 18.8 Ų | 18.8 | 10% | 0.099 | 10% | 0.096 | C | C | . | . | G | 310 helix | trans | -61 | -37.5 | -172.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | D156 C293 V294 | D156-A291 VanDerWaalsContact OD1-CB 3.27Å; D156-A291 WeakPolarHBondContact OD1-CB 3.46Å; A291-C293 PolarHBondContact O-N 3.01Å; A291-V294 WeakPolarHBondContact O-CB 3.37Å; A291-V294 WeakPolarHBondContact O-CG1 3.29Å; A291-V294 PolarHBondContact O-N 3.4Å |
| 292 | Q | 90.3 | Very high | 94.9 | Very high | 75 Ų | 75 | 16.7 Ų | 16.7 | 35% | 0.35 | 9% | 0.088 | S | C | . | . | G | 310 helix | trans | -60.9 | -18.8 | 175.2 | 58.8 | -175.3 | -12.3 | 0 | 0 | 114.3 | E290 V294 V295 I345 | E290-Q292 VanDerWaalsContact C-N 3.26Å; E290-Q292 HydrophobicContact CB-CG 4.37Å; E290-Q292 PolarHBondContact O-N 3.46Å; E290-Q292 PolarHBondContact OE2-NE2 2.94Å; Q292-V294 PolarHBondContact O-N 2.84Å; Q292-V295 WeakPolarHBondContact O-CG2 3.33Å; Q292-I345 HydrophobicContact CG-CD1 3.9Å; Q292-I345 HydrophobicContact CG-CG1 4.45Å; Q292-I345 HydrophobicContact CG-CG2 4.17Å |
| 293 | C | 93.3 | Very high | 94.7 | Very high | 3 Ų | 3 | 16.9 Ų | 16.9 | 2% | 0.02 | 9% | 0.091 | C | C | . | . | G | 310 helix | trans | -73 | -17.3 | 179 | -71.9 | 0 | 0 | 0 | 0 | 113 | S287 E290 A291 V295 F296 L301 | S287-C293 WeakPolarHBondContact O-CB 3.29Å; E290-C293 HydrophobicContact CB-CB 4.32Å; E290-C293 WeakPolarHBondContact O-CB 3.02Å; E290-C293 PolarHBondContact O-N 3.34Å; A291-C293 PolarHBondContact O-N 3.01Å; C293-V295 PolarHBondContact O-N 3.04Å; C293-V295 VanDerWaalsContact O-N 3.17Å; C293-F296 HydrophobicContact CB-CD2 4.5Å; C293-F296 PolarHBondContact O-N 3.24Å; C293-L301 HydrophobicContact CB-CD2 4.11Å |
| 294 | V | 91.3 | Very high | 94.7 | Very high | 27 Ų | 27 | 16.9 Ų | 16.9 | 16% | 0.164 | 9% | 0.091 | C | C | . | . | G | 310 helix | trans | -64.7 | -19.6 | -176.9 | 81 | 0 | 0 | 0 | 0 | 113.6 | F145 A148 N188 A291 Q292 | F145-V294 HydrophobicContact CD2-CG2 3.46Å; F145-V294 VanDerWaalsContact CD2-CG2 3.46Å; F145-V294 WeakPolarHBondContact CD2-O 3.07Å; F145-V294 HydrophobicContact CE2-CG2 3.67Å; F145-V294 HydrophobicContact CG-CG2 4.2Å; A148-V294 HydrophobicContact CB-CG1 4.02Å; N188-V294 HydrophobicContact CB-CG2 4.17Å; A291-V294 WeakPolarHBondContact O-CB 3.37Å; A291-V294 WeakPolarHBondContact O-CG1 3.29Å; A291-V294 PolarHBondContact O-N 3.4Å; Q292-V294 PolarHBondContact O-N 2.84Å |
| 295 | V | 93.1 | Very high | 94.6 | Very high | 41 Ų | 41 | 16.9 Ų | 16.9 | 25% | 0.248 | 9% | 0.091 | C | C | . | . | G | 310 helix | trans | -86.3 | -15.1 | 179.4 | -61.3 | 0 | 0 | 0 | 0 | 113.5 | N147 A148 Q292 C293 | N147-V295 WeakPolarHBondContact O-CG1 3.39Å; A148-V295 HydrophobicContact CB-CG1 4.17Å; Q292-V295 WeakPolarHBondContact O-CG2 3.33Å; C293-V295 PolarHBondContact O-N 3.04Å; C293-V295 VanDerWaalsContact O-N 3.17Å |
| 296 | F | 94.5 | Very high | 94.6 | Very high | 19 Ų | 19 | 17.1 Ų | 17.1 | 8% | 0.083 | 9% | 0.092 | C | C | . | . | S | Bend | trans | -84.6 | 149.3 | -179.2 | -58.4 | -62.6 | 0 | 0 | 0 | 110.8 | C293 L301 T338 R341 I342 I345 | C293-F296 HydrophobicContact CB-CD2 4.5Å; C293-F296 PolarHBondContact O-N 3.24Å; F296-L301 HydrophobicContact CB-CD2 3.94Å; F296-L301 HydrophobicContact CB-CG 4Å; F296-L301 HydrophobicContact CD2-CD2 4.12Å; F296-L301 HydrophobicContact CG-CD2 4.46Å; F296-T338 HydrophobicContact CD1-CG2 4.1Å; F296-T338 HydrophobicContact CE1-CG2 4.26Å; F296-R341 HydrophobicContact CZ-CG 4.22Å; F296-I342 HydrophobicContact CB-CD1 3.91Å; F296-I342 HydrophobicContact CB-CG1 4.39Å; F296-I342 HydrophobicContact CD1-CD1 3.81Å; F296-I342 HydrophobicContact CD1-CG1 3.84Å; F296-I342 HydrophobicContact CD2-CD1 4.06Å; F296-I342 HydrophobicContact CD2-CG1 3.59Å; F296-I342 HydrophobicContact CE1-CD1 4.35Å; F296-I342 HydrophobicContact CE1-CG1 3.94Å; F296-I342 HydrophobicContact CE2-CG1 3.72Å; F296-I342 HydrophobicContact CG-CD1 3.65Å; F296-I342 HydrophobicContact CG-CG1 3.67Å; F296-I342 HydrophobicContact CZ-CG1 3.89Å; F296-I345 HydrophobicContact CE2-CD1 3.81Å; F296-I345 HydrophobicContact CZ-CD1 4.18Å |
| 297 | L | 94.8 | Very high | 94.5 | Very high | 19 Ų | 19 | 18.4 Ų | 18.4 | 10% | 0.099 | 10% | 0.101 | C | C | . | . | trans | -68.6 | 148.6 | 176.8 | -63.3 | 172.2 | 0 | 0 | 0 | 110.7 | M141 V299 Q300 L301 | M141-L297 HydrophobicContact CE-CD1 3.97Å; M141-L297 HydrophobicContact CE-CD2 4.4Å; M141-L297 HydrophobicContact SD-CD1 3.34Å; M141-L297 WeakPolarHBondContact SD-CD1 3.46Å; M141-L297 HydrophobicContact SD-CD2 3.72Å; M141-L297 HydrophobicContact SD-CG 4.18Å; L297-V299 HydrophobicContact CB-CG1 4.12Å; L297-V299 PolarHBondContact O-N 3.35Å; L297-Q300 HydrophobicContact CB-CB 4.34Å; L297-Q300 HydrophobicContact CB-CG 4.01Å; L297-Q300 WeakPolarHBondContact O-CB 3.4Å; L297-Q300 PolarHBondContact O-N 3.48Å; L297-L301 PolarHBondContact O-N 2.89Å | ||
| 298 | P | 95.9 | Very high | 94.4 | Very high | 12 Ų | 12 | 18.1 Ų | 18.1 | 8% | 0.078 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -49.6 | -44.3 | 173.6 | -29.7 | 35.5 | 0 | 0 | 0 | 113.5 | Q140 F256 P259 F262 Q300 L301 A302 | Q140-P298 HydrophobicContact CB-CG 4.11Å; F256-P298 HydrophobicContact CE2-CG 4.19Å; F256-P298 HydrophobicContact CZ-CG 4.5Å; P259-P298 HydrophobicContact CB-CB 4.03Å; P259-P298 WeakPolarHBondContact CB-O 3.3Å; F262-P298 HydrophobicContact CD2-CB 3.96Å; F262-P298 HydrophobicContact CE2-CB 3.8Å; P298-Q300 VanDerWaalsContact C-N 3.34Å; P298-Q300 PolarHBondContact O-N 3.42Å; P298-L301 PolarHBondContact O-N 2.9Å; P298-A302 WeakPolarHBondContact O-CB 3.49Å; P298-A302 PolarHBondContact O-N 2.83Å |
| 299 | V | 95.4 | Very high | 94.5 | Very high | 4 Ų | 4 | 17.1 Ų | 17.1 | 2% | 0.024 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -62 | -39.4 | 177.3 | 72.4 | 0 | 0 | 0 | 0 | 112.8 | M137 F262 F266 L297 A302 G303 V333 | M137-V299 HydrophobicContact CE-CG2 4.29Å; M137-V299 HydrophobicContact SD-CB 4.49Å; M137-V299 HydrophobicContact SD-CG2 4.04Å; F262-V299 HydrophobicContact CD1-CB 4.16Å; F262-V299 HydrophobicContact CD1-CG2 4Å; F262-V299 HydrophobicContact CE1-CB 4.39Å; F262-V299 HydrophobicContact CE1-CG2 4.49Å; F262-V299 HydrophobicContact CG-CB 4.27Å; F262-V299 HydrophobicContact CG-CG2 4.35Å; F266-V299 HydrophobicContact CE2-CG2 3.54Å; F266-V299 HydrophobicContact CZ-CG2 3.39Å; L297-V299 HydrophobicContact CB-CG1 4.12Å; L297-V299 PolarHBondContact O-N 3.35Å; V299-A302 PolarHBondContact O-N 3.02Å; V299-G303 PolarHBondContact O-N 3.04Å; V299-V333 HydrophobicContact CG2-CB 4.49Å; V299-V333 HydrophobicContact CG2-CG1 4.12Å; V299-V333 WeakPolarHBondContact O-CG1 3.46Å |
| 300 | Q | 96.3 | Very high | 94.5 | Very high | 30 Ų | 30 | 18.9 Ų | 18.9 | 14% | 0.14 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -66.5 | -44.4 | 179.4 | -69.9 | 169.6 | -13.9 | 0 | 0 | 111.5 | L297 P298 A302 A304 V333 T338 I342 | L297-Q300 HydrophobicContact CB-CB 4.34Å; L297-Q300 HydrophobicContact CB-CG 4.01Å; L297-Q300 WeakPolarHBondContact O-CB 3.4Å; L297-Q300 PolarHBondContact O-N 3.48Å; P298-Q300 VanDerWaalsContact C-N 3.34Å; P298-Q300 PolarHBondContact O-N 3.42Å; Q300-A302 VanDerWaalsContact C-N 3.33Å; Q300-A304 VanDerWaalsContact O-CB 3.24Å; Q300-A304 WeakPolarHBondContact O-CB 3.27Å; Q300-A304 PolarHBondContact O-N 3.35Å; Q300-V333 WeakPolarHBondContact CG-O 3.29Å; Q300-T338 HydrophobicContact CG-CG2 4.44Å; Q300-I342 HydrophobicContact CB-CD1 3.69Å |
| 301 | L | 97.1 | Very high | 94.5 | Very high | 15 Ų | 15 | 20 Ų | 20 | 8% | 0.079 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -60.7 | -44.9 | 175.9 | -68.2 | 173.5 | 0 | 0 | 0 | 111.1 | P259 L284 C293 F296 L297 P298 A305 I342 | P259-L301 HydrophobicContact CB-CB 4.41Å; L284-L301 HydrophobicContact CD1-CB 3.7Å; C293-L301 HydrophobicContact CB-CD2 4.11Å; F296-L301 HydrophobicContact CB-CD2 3.94Å; F296-L301 HydrophobicContact CB-CG 4Å; F296-L301 HydrophobicContact CD2-CD2 4.12Å; F296-L301 HydrophobicContact CG-CD2 4.46Å; L297-L301 PolarHBondContact O-N 2.89Å; P298-L301 PolarHBondContact O-N 2.9Å; L301-A305 VanDerWaalsContact O-CB 3.26Å; L301-A305 WeakPolarHBondContact O-CB 3.28Å; L301-A305 PolarHBondContact O-N 2.85Å; L301-I342 HydrophobicContact CD2-CD1 4.46Å; L301-I342 HydrophobicContact CD2-CG2 3.91Å |
| 302 | A | 97.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.1 | -51.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | P259 F262 L263 P298 V299 Q300 A305 L306 | P259-A302 WeakPolarHBondContact O-CB 3.4Å; F262-A302 HydrophobicContact CB-CB 3.63Å; L263-A302 HydrophobicContact CB-CB 3.91Å; P298-A302 WeakPolarHBondContact O-CB 3.49Å; P298-A302 PolarHBondContact O-N 2.83Å; V299-A302 PolarHBondContact O-N 3.02Å; Q300-A302 VanDerWaalsContact C-N 3.33Å; A302-A305 PolarHBondContact O-N 2.99Å; A302-L306 WeakPolarHBondContact O-CB 3.1Å; A302-L306 PolarHBondContact O-N 3.41Å |
| 303 | G | 95.9 | Very high | 94.9 | Very high | 5 Ų | 5 | 17.6 Ų | 17.6 | 5% | 0.052 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63.8 | -44.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V299 A305 L306 C307 | V299-G303 PolarHBondContact O-N 3.04Å; G303-A305 PolarHBondContact O-N 3.27Å; G303-L306 PolarHBondContact O-N 3.4Å; G303-C307 WeakPolarHBondContact O-CB 3.4Å; G303-C307 PolarHBondContact O-N 3.14Å; G303-C307 PolarHBondContact O-SG 3.44Å |
| 304 | A | 96.8 | Very high | 94.7 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.6 | -42.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q300 L308 L339 I342 M343 | Q300-A304 VanDerWaalsContact O-CB 3.24Å; Q300-A304 WeakPolarHBondContact O-CB 3.27Å; Q300-A304 PolarHBondContact O-N 3.35Å; A304-L308 WeakPolarHBondContact O-CB 3.36Å; A304-L308 PolarHBondContact O-N 3.32Å; A304-L339 HydrophobicContact CB-CD2 4.18Å; A304-I342 HydrophobicContact CB-CB 3.59Å; A304-I342 HydrophobicContact CB-CD1 4.28Å; A304-I342 HydrophobicContact CB-CG2 3.4Å; A304-M343 HydrophobicContact CB-CG 3.93Å; A304-M343 WeakPolarHBondContact O-CG 3.09Å |
| 305 | A | 97.9 | Very high | 94 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63 | -41.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L263 L283 L284 L301 A302 G303 A309 L346 | L263-A305 HydrophobicContact CD1-CB 4.35Å; L283-A305 HydrophobicContact CB-CB 4.2Å; L284-A305 HydrophobicContact CB-CB 4.03Å; L301-A305 VanDerWaalsContact O-CB 3.26Å; L301-A305 WeakPolarHBondContact O-CB 3.28Å; L301-A305 PolarHBondContact O-N 2.85Å; A302-A305 PolarHBondContact O-N 2.99Å; G303-A305 PolarHBondContact O-N 3.27Å; A305-A309 VanDerWaalsContact O-CB 3.29Å; A305-A309 WeakPolarHBondContact O-CB 3.27Å; A305-A309 PolarHBondContact O-N 3.1Å; A305-L346 HydrophobicContact CB-CD1 3.95Å |
| 306 | L | 96.2 | Very high | 93.2 | Very high | 5 Ų | 5 | 30.1 Ų | 30.1 | 3% | 0.026 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.7 | -44.6 | 178.1 | -169 | 66.4 | 0 | 0 | 0 | 112.2 | F266 A267 V276 A280 A302 G303 L308 A309 R310 W325 | F266-L306 HydrophobicContact CB-CD2 3.75Å; A267-L306 HydrophobicContact CB-CD1 3.98Å; A267-L306 HydrophobicContact CB-CD2 4.38Å; V276-L306 HydrophobicContact CG1-CD1 3.77Å; A280-L306 HydrophobicContact CB-CB 4.47Å; A280-L306 HydrophobicContact CB-CD1 3.91Å; A302-L306 WeakPolarHBondContact O-CB 3.1Å; A302-L306 PolarHBondContact O-N 3.41Å; G303-L306 PolarHBondContact O-N 3.4Å; L306-L308 PolarHBondContact O-N 2.92Å; L306-A309 PolarHBondContact O-N 2.79Å; L306-R310 PolarHBondContact O-N 3.01Å; L306-W325 HydrophobicContact CD2-CH2 4.32Å; L306-W325 HydrophobicContact CD2-CZ3 3.99Å; L306-W325 HydrophobicContact CG-CH2 4.05Å; L306-W325 HydrophobicContact CG-CZ3 3.93Å |
| 307 | C | 94.3 | Very high | 92.4 | Very high | 31 Ų | 31 | 33.1 Ų | 33.1 | 21% | 0.209 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58.4 | -47.9 | 174.6 | -71 | 0 | 0 | 0 | 0 | 111.5 | G303 R310 Q311 W325 M343 | G303-C307 WeakPolarHBondContact O-CB 3.4Å; G303-C307 PolarHBondContact O-N 3.14Å; G303-C307 PolarHBondContact O-SG 3.44Å; C307-R310 PolarHBondContact O-N 3.41Å; C307-Q311 WeakPolarHBondContact O-CG 3.27Å; C307-Q311 PolarHBondContact O-N 3.15Å; C307-Q311 VanDerWaalsContact O-N 3.12Å; C307-W325 HydrophobicContact CB-CZ2 4.49Å; C307-M343 HydrophobicContact CB-CE 3.99Å; C307-M343 HydrophobicContact CB-SD 4.02Å |
| 308 | L | 95.8 | Very high | 92 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.6 | -41.9 | 178.6 | -178.3 | 60.2 | 0 | 0 | 0 | 111.7 | L283 A304 L306 R310 Q311 V312 M343 L346 A347 A382 L386 | L283-L308 HydrophobicContact CD1-CB 4Å; L283-L308 HydrophobicContact CD1-CD2 3.88Å; L283-L308 HydrophobicContact CD1-CG 3.8Å; L283-L308 HydrophobicContact CD2-CD2 3.96Å; L283-L308 HydrophobicContact CG-CD2 4.49Å; A304-L308 WeakPolarHBondContact O-CB 3.36Å; A304-L308 PolarHBondContact O-N 3.32Å; L306-L308 PolarHBondContact O-N 2.92Å; L308-R310 VanDerWaalsContact C-N 3.32Å; L308-R310 PolarHBondContact O-N 3.29Å; L308-Q311 PolarHBondContact O-N 3.15Å; L308-V312 HydrophobicContact CD1-CG2 4.06Å; L308-V312 HydrophobicContact CG-CG2 4.25Å; L308-V312 WeakPolarHBondContact O-CB 3.47Å; L308-V312 VanDerWaalsContact O-CG2 3.3Å; L308-V312 WeakPolarHBondContact O-CG2 3.46Å; L308-V312 PolarHBondContact O-N 2.99Å; L308-M343 HydrophobicContact CB-CB 4.47Å; L308-M343 HydrophobicContact CB-CE 4.04Å; L308-M343 HydrophobicContact CB-CG 4.14Å; L308-M343 HydrophobicContact CD1-CE 4.34Å; L308-L346 HydrophobicContact CD2-CB 3.78Å; L308-A347 HydrophobicContact CD1-CB 4.48Å; L308-A347 HydrophobicContact CD2-CB 4.1Å; L308-A382 HydrophobicContact CD1-CB 4.38Å; L308-L386 HydrophobicContact CD1-CD1 4.4Å; L308-L386 HydrophobicContact CD1-CD2 4.3Å |
| 309 | A | 96.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.4 | -45.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | V276 M279 A280 L283 A305 L306 V312 L313 | V276-A309 HydrophobicContact CG1-CB 4.25Å; M279-A309 HydrophobicContact CB-CB 3.84Å; M279-A309 HydrophobicContact CG-CB 3.58Å; A280-A309 HydrophobicContact CB-CB 3.77Å; L283-A309 HydrophobicContact CD1-CB 4.1Å; A305-A309 VanDerWaalsContact O-CB 3.29Å; A305-A309 WeakPolarHBondContact O-CB 3.27Å; A305-A309 PolarHBondContact O-N 3.1Å; L306-A309 PolarHBondContact O-N 2.79Å; A309-V312 PolarHBondContact O-N 3.45Å; A309-L313 WeakPolarHBondContact O-CB 3.47Å; A309-L313 WeakPolarHBondContact O-CG 3.29Å; A309-L313 PolarHBondContact O-N 3.43Å |
| 310 | R | 92.6 | Very high | 91 | Very high | 53 Ų | 53 | 45.4 Ų | 45.4 | 20% | 0.2 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.1 | -43.1 | 177.3 | -166.8 | 175.8 | -173.9 | -143.9 | -9.3 | 112 | L306 C307 L308 Q314 E322 W325 | L306-R310 PolarHBondContact O-N 3.01Å; C307-R310 PolarHBondContact O-N 3.41Å; L308-R310 VanDerWaalsContact C-N 3.32Å; L308-R310 PolarHBondContact O-N 3.29Å; R310-Q314 PolarHBondContact O-N 2.9Å; R310-E322 IonicContact CZ-OE1 3.54Å; R310-E322 IonicContact CZ-OE2 3.64Å; R310-E322 IonicContact NH1-OE1 2.8Å; R310-E322 IonicContact NH1-OE2 3.84Å; R310-E322 PolarHBondContact NH1-OE2 3.45Å; R310-E322 VanDerWaalsContact NH1-OE2 3.09Å; R310-E322 IonicContact NH2-OE1 2.65Å; R310-E322 PolarHBondContact NH2-OE1 3.47Å; R310-E322 IonicContact NH2-OE2 3.09Å; R310-E322 PolarHBondContact NH2-OE2 3.42Å; R310-W325 HydrophobicContact CB-CH2 4.36Å |
| 311 | Q | 92 | Very high | 90.5 | Very high | 68 Ų | 68 | 44.7 Ų | 44.7 | 32% | 0.318 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -66.4 | -38.2 | 176.9 | -70.4 | -180 | 11.5 | 0 | 0 | 113.1 | C307 L308 Q314 | C307-Q311 WeakPolarHBondContact O-CG 3.27Å; C307-Q311 PolarHBondContact O-N 3.15Å; C307-Q311 VanDerWaalsContact O-N 3.12Å; L308-Q311 PolarHBondContact O-N 3.15Å; Q311-Q314 WeakPolarHBondContact O-CG 3.38Å |
| 312 | V | 94.3 | Very high | 90.1 | Very high | 5 Ų | 5 | 47.2 Ų | 47.2 | 3% | 0.03 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -68.7 | -37.9 | 179.4 | 166.3 | 0 | 0 | 0 | 0 | 111.8 | M279 L308 A309 H376 L379 A382 | M279-V312 HydrophobicContact CE-CG1 4.02Å; M279-V312 HydrophobicContact SD-CG1 4.38Å; L308-V312 HydrophobicContact CD1-CG2 4.06Å; L308-V312 HydrophobicContact CG-CG2 4.25Å; L308-V312 WeakPolarHBondContact O-CB 3.47Å; L308-V312 VanDerWaalsContact O-CG2 3.3Å; L308-V312 WeakPolarHBondContact O-CG2 3.46Å; L308-V312 PolarHBondContact O-N 2.99Å; A309-V312 PolarHBondContact O-N 3.45Å; V312-H376 PolarHBondContact O-CE1 3.16Å; V312-L379 HydrophobicContact CG1-CD2 3.98Å; V312-L379 HydrophobicContact CG1-CG 4.16Å; V312-L379 HydrophobicContact CG2-CD2 4.27Å; V312-A382 HydrophobicContact CG2-CB 3.8Å |
| 313 | L | 92.6 | Very high | 89.6 | Confident | 32 Ų | 32 | 50.2 Ų | 50.2 | 17% | 0.168 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -85.1 | -22.6 | -177.6 | -68.8 | 173.1 | 0 | 0 | 0 | 113.4 | A275 V276 M279 A309 E315 | A275-L313 VanDerWaalsContact C-CD1 3.49Å; A275-L313 HydrophobicContact CB-CD1 4.06Å; V276-L313 HydrophobicContact CB-CD1 4.26Å; V276-L313 HydrophobicContact CG2-CD1 3.71Å; M279-L313 HydrophobicContact CB-CD1 3.92Å; M279-L313 HydrophobicContact CE-CD2 3.89Å; M279-L313 HydrophobicContact CE-CG 4.3Å; M279-L313 HydrophobicContact CG-CD1 4.34Å; M279-L313 HydrophobicContact CG-CG 4.44Å; A309-L313 WeakPolarHBondContact O-CB 3.47Å; A309-L313 WeakPolarHBondContact O-CG 3.29Å; A309-L313 PolarHBondContact O-N 3.43Å; L313-E315 HydrophobicContact CB-CG 4.14Å; L313-E315 PolarHBondContact O-N 3.42Å |
| 314 | Q | 87.1 | Confident | 89.3 | Confident | 143 Ų | 143 | 50.4 Ų | 50.4 | 67% | 0.668 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.9 | 44.7 | 180 | -57.5 | -175.1 | 9.3 | 0 | 0 | 112.8 | R310 Q311 C316 | R310-Q314 PolarHBondContact O-N 2.9Å; Q311-Q314 WeakPolarHBondContact O-CG 3.38Å; Q314-C316 PolarHBondContact O-N 3.3Å |
| 315 | E | 78.6 | Confident | 88.9 | Confident | 75 Ų | 75 | 52.2 Ų | 52.2 | 35% | 0.35 | 29% | 0.293 | S | S | . | . | P | Polyproline II helix | trans | -61.2 | 139.8 | 178.2 | -64.6 | -167.9 | 158.6 | 0 | 0 | 110.8 | S273 V276 L313 | S273-E315 VanDerWaalsContact CB-OE1 3.29Å; S273-E315 WeakPolarHBondContact CB-OE1 3.32Å; S273-E315 WeakPolarHBondContact CB-OE2 3.4Å; S273-E315 VanDerWaalsContact OG-CD 3.24Å; S273-E315 PolarHBondContact OG-OE1 3.13Å; S273-E315 PolarHBondContact OG-OE2 3.18Å; V276-E315 VanDerWaalsContact CG2-CD 3.44Å; V276-E315 HydrophobicContact CG2-CG 4.18Å; V276-E315 WeakPolarHBondContact CG2-OE2 3.45Å; L313-E315 HydrophobicContact CB-CG 4.14Å; L313-E315 PolarHBondContact O-N 3.42Å |
| 316 | C | 75.2 | Confident | 88.4 | Confident | 116 Ų | 116 | 54.6 Ų | 54.6 | 78% | 0.784 | 31% | 0.309 | S | S | * | . | P | Polyproline II helix | trans | -60.9 | 125.4 | -178.3 | -170.3 | 0 | 0 | 0 | 0 | 109.7 | Q314 T318 | Q314-C316 PolarHBondContact O-N 3.3Å; C316-T318 PolarHBondContact O-N 2.85Å |
| 317 | P | 77.1 | Confident | 88 | Confident | 82 Ų | 82 | 55.3 Ų | 55.3 | 53% | 0.532 | 31% | 0.313 | S | S | . | . | P | Polyproline II helix | trans | -68.8 | 122.1 | -177.3 | 29.8 | -36.4 | 0 | 0 | 0 | 109.8 | E322 | P317-E322 HydrophobicContact CB-CG 3.85Å; P317-E322 WeakPolarHBondContact CB-OE1 3.4Å |
| 318 | T | 86.7 | Confident | 87.6 | Confident | 74 Ų | 74 | 54.2 Ų | 54.2 | 45% | 0.454 | 31% | 0.306 | S | S | . | . | P | Polyproline II helix | trans | -93.5 | 146.4 | 166.7 | 55.8 | 0 | 0 | 0 | 0 | 108.7 | C316 E320 G321 E322 | C316-T318 PolarHBondContact O-N 2.85Å; T318-E320 PolarHBondContact O-N 2.76Å; T318-G321 PolarHBondContact O-N 2.88Å; T318-G321 VanDerWaalsContact O-N 3.11Å; T318-G321 WeakPolarHBondContact OG1-CA 3.29Å; T318-G321 PolarHBondContact OG1-N 3.29Å; T318-G321 VanDerWaalsContact OG1-N 3.09Å; T318-E322 PolarHBondContact O-N 2.83Å |
| 319 | P | 86.1 | Confident | 87.1 | Confident | 100 Ų | 100 | 57.4 Ų | 57.4 | 65% | 0.649 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -60.1 | -36.6 | 179.7 | 22.1 | -29.6 | 0 | 0 | 0 | 111.8 | A323 | P319-A323 WeakPolarHBondContact O-CB 3.44Å; P319-A323 PolarHBondContact O-N 3.31Å; P319-A323 VanDerWaalsContact O-N 3.08Å |
| 320 | E | 85.6 | Confident | 86.6 | Confident | 120 Ų | 120 | 60.1 Ų | 60.1 | 56% | 0.561 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -68.3 | -40.2 | 174.7 | -59.2 | 78.3 | -167.7 | 0 | 0 | 112.2 | T318 A323 A324 | T318-E320 PolarHBondContact O-N 2.76Å; E320-A323 PolarHBondContact O-N 3.27Å; E320-A324 WeakPolarHBondContact O-CB 3.33Å; E320-A324 PolarHBondContact O-N 2.86Å |
| 321 | G | 85.6 | Confident | 86.2 | Confident | 15 Ų | 15 | 58 Ų | 58 | 16% | 0.155 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -66.9 | -39.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | T318 A324 W325 | T318-G321 PolarHBondContact O-N 2.88Å; T318-G321 VanDerWaalsContact O-N 3.11Å; T318-G321 WeakPolarHBondContact OG1-CA 3.29Å; T318-G321 PolarHBondContact OG1-N 3.29Å; T318-G321 VanDerWaalsContact OG1-N 3.09Å; G321-A324 PolarHBondContact O-N 2.84Å; G321-W325 WeakPolarHBondContact O-CB 3.37Å; G321-W325 PolarHBondContact O-N 2.93Å |
| 322 | E | 87.6 | Confident | 85.5 | Confident | 67 Ų | 67 | 61.1 Ų | 61.1 | 31% | 0.313 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -67.7 | -41.4 | 174.6 | -69.9 | -57.8 | 165.3 | 0 | 0 | 112.1 | R310 P317 T318 A324 W325 C326 | R310-E322 IonicContact CZ-OE1 3.54Å; R310-E322 IonicContact CZ-OE2 3.64Å; R310-E322 IonicContact NH1-OE1 2.8Å; R310-E322 IonicContact NH1-OE2 3.84Å; R310-E322 PolarHBondContact NH1-OE2 3.45Å; R310-E322 VanDerWaalsContact NH1-OE2 3.09Å; R310-E322 IonicContact NH2-OE1 2.65Å; R310-E322 PolarHBondContact NH2-OE1 3.47Å; R310-E322 IonicContact NH2-OE2 3.09Å; R310-E322 PolarHBondContact NH2-OE2 3.42Å; P317-E322 HydrophobicContact CB-CG 3.85Å; P317-E322 WeakPolarHBondContact CB-OE1 3.4Å; T318-E322 PolarHBondContact O-N 2.83Å; E322-A324 VanDerWaalsContact C-N 3.33Å; E322-A324 PolarHBondContact O-N 2.95Å; E322-W325 PolarHBondContact O-N 3.39Å; E322-C326 WeakPolarHBondContact O-CB 3.44Å; E322-C326 PolarHBondContact O-N 3.32Å; E322-C326 PolarHBondContact O-SG 2.92Å; E322-C326 VanDerWaalsContact O-SG 3.32Å |
| 323 | A | 87.6 | Confident | 84.8 | Confident | 64 Ų | 64 | 61.8 Ų | 61.8 | 53% | 0.529 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | P319 E320 C326 L327 | P319-A323 WeakPolarHBondContact O-CB 3.44Å; P319-A323 PolarHBondContact O-N 3.31Å; P319-A323 VanDerWaalsContact O-N 3.08Å; E320-A323 PolarHBondContact O-N 3.27Å; A323-C326 PolarHBondContact O-N 3.21Å; A323-L327 PolarHBondContact O-N 3.34Å |
| 324 | A | 88.6 | Confident | 84.4 | Confident | 8 Ų | 8 | 61.1 Ų | 61.1 | 7% | 0.066 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | R271 E320 G321 E322 L327 A328 | R271-A324 HydrophobicContact CB-CB 4.29Å; R271-A324 HydrophobicContact CG-CB 4.01Å; E320-A324 WeakPolarHBondContact O-CB 3.33Å; E320-A324 PolarHBondContact O-N 2.86Å; G321-A324 PolarHBondContact O-N 2.84Å; E322-A324 VanDerWaalsContact C-N 3.33Å; E322-A324 PolarHBondContact O-N 2.95Å; A324-L327 WeakPolarHBondContact O-CB 3.46Å; A324-L327 PolarHBondContact O-N 3.33Å; A324-A328 PolarHBondContact O-N 3.19Å |
| 325 | W | 89.4 | Confident | 84.5 | Confident | 39 Ų | 39 | 57 Ų | 57 | 15% | 0.148 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.3 | -43.4 | 175.5 | -176.2 | -93.5 | 0 | 0 | 0 | 112.7 | A270 L306 C307 R310 G321 E322 L327 A328 S329 | A270-W325 HydrophobicContact CB-CE3 3.78Å; A270-W325 HydrophobicContact CB-CZ3 4.32Å; L306-W325 HydrophobicContact CD2-CH2 4.32Å; L306-W325 HydrophobicContact CD2-CZ3 3.99Å; L306-W325 HydrophobicContact CG-CH2 4.05Å; L306-W325 HydrophobicContact CG-CZ3 3.93Å; C307-W325 HydrophobicContact CB-CZ2 4.49Å; R310-W325 HydrophobicContact CB-CH2 4.36Å; G321-W325 WeakPolarHBondContact O-CB 3.37Å; G321-W325 PolarHBondContact O-N 2.93Å; E322-W325 PolarHBondContact O-N 3.39Å; W325-L327 VanDerWaalsContact C-N 3.28Å; W325-L327 PolarHBondContact O-N 3.28Å; W325-A328 PolarHBondContact O-N 3.04Å; W325-S329 PolarHBondContact NE1-OG 3.38Å; W325-S329 VanDerWaalsContact O-CB 3.29Å; W325-S329 WeakPolarHBondContact O-CB 3.39Å; W325-S329 PolarHBondContact O-N 3.29Å; W325-S329 PolarHBondContact O-OG 3.04Å |
| 326 | C | 87 | Confident | 85 | Confident | 50 Ų | 50 | 59.5 Ų | 59.5 | 34% | 0.338 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -59.5 | -40.8 | 174.3 | -75 | 0 | 0 | 0 | 0 | 111.2 | E322 A323 S329 S330 | E322-C326 WeakPolarHBondContact O-CB 3.44Å; E322-C326 PolarHBondContact O-N 3.32Å; E322-C326 PolarHBondContact O-SG 2.92Å; E322-C326 VanDerWaalsContact O-SG 3.32Å; A323-C326 PolarHBondContact O-N 3.21Å; C326-S329 PolarHBondContact O-N 3.19Å; C326-S330 PolarHBondContact O-N 3.16Å |
| 327 | L | 87.7 | Confident | 85.8 | Confident | 19 Ų | 19 | 58.2 Ų | 58.2 | 10% | 0.099 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.7 | -49.7 | 174.7 | -174.4 | 67.2 | 0 | 0 | 0 | 111.5 | V105 L108 L109 E112 V269 A323 A324 W325 S329 S330 | V105-L327 HydrophobicContact CG1-CD1 4.03Å; L108-L327 HydrophobicContact CD2-CD1 4.39Å; L108-L327 HydrophobicContact CD2-CD2 4.22Å; L108-L327 HydrophobicContact CG-CD1 4.4Å; L108-L327 HydrophobicContact CG-CD2 3.98Å; L109-L327 HydrophobicContact CB-CD1 3.86Å; L109-L327 HydrophobicContact CB-CG 4.49Å; L109-L327 HydrophobicContact CD1-CD1 4.24Å; L109-L327 HydrophobicContact CD1-CG 4.07Å; E112-L327 HydrophobicContact CB-CD2 4.09Å; E112-L327 HydrophobicContact CG-CD2 3.72Å; V269-L327 HydrophobicContact CG1-CD2 4.34Å; V269-L327 HydrophobicContact CG1-CG 4.46Å; A323-L327 PolarHBondContact O-N 3.34Å; A324-L327 WeakPolarHBondContact O-CB 3.46Å; A324-L327 PolarHBondContact O-N 3.33Å; W325-L327 VanDerWaalsContact C-N 3.28Å; W325-L327 PolarHBondContact O-N 3.28Å; L327-S329 VanDerWaalsContact C-N 3.26Å; L327-S329 PolarHBondContact O-N 3.01Å; L327-S330 WeakPolarHBondContact O-CB 3.49Å; L327-S330 PolarHBondContact O-N 2.87Å; L327-S330 PolarHBondContact O-OG 3.13Å |
| 328 | A | 87.1 | Confident | 86.6 | Confident | 8 Ų | 8 | 56 Ų | 56 | 7% | 0.066 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.3 | -37.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V269 A270 A324 W325 S330 I331 | V269-A328 HydrophobicContact CB-CB 4.31Å; V269-A328 HydrophobicContact CG1-CB 3.94Å; A270-A328 HydrophobicContact CB-CB 3.76Å; A324-A328 PolarHBondContact O-N 3.19Å; W325-A328 PolarHBondContact O-N 3.04Å; A328-S330 PolarHBondContact O-N 3.26Å; A328-I331 VanDerWaalsContact O-CB 3.29Å; A328-I331 WeakPolarHBondContact O-CB 3.31Å; A328-I331 WeakPolarHBondContact O-CG1 3.32Å; A328-I331 PolarHBondContact O-N 3.13Å; A328-I331 VanDerWaalsContact O-N 3.1Å |
| 329 | S | 85.1 | Confident | 87 | Confident | 68 Ų | 68 | 53.9 Ų | 53.9 | 48% | 0.476 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -68.8 | -16.7 | 177.4 | -58 | 0 | 0 | 0 | 0 | 113.3 | W325 C326 L327 I331 | W325-S329 PolarHBondContact NE1-OG 3.38Å; W325-S329 VanDerWaalsContact O-CB 3.29Å; W325-S329 WeakPolarHBondContact O-CB 3.39Å; W325-S329 PolarHBondContact O-N 3.29Å; W325-S329 PolarHBondContact O-OG 3.04Å; C326-S329 PolarHBondContact O-N 3.19Å; L327-S329 VanDerWaalsContact C-N 3.26Å; L327-S329 PolarHBondContact O-N 3.01Å; S329-I331 PolarHBondContact O-N 3.48Å |
| 330 | S | 84.3 | Confident | 87.3 | Confident | 56 Ų | 56 | 51.2 Ų | 51.2 | 39% | 0.392 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -15.4 | 172.1 | 76.7 | 0 | 0 | 0 | 0 | 113.1 | C326 L327 A328 H332 | C326-S330 PolarHBondContact O-N 3.16Å; L327-S330 WeakPolarHBondContact O-CB 3.49Å; L327-S330 PolarHBondContact O-N 2.87Å; L327-S330 PolarHBondContact O-OG 3.13Å; A328-S330 PolarHBondContact O-N 3.26Å; S330-H332 PolarHBondContact O-N 3.1Å |
| 331 | I | 84.2 | Confident | 87.8 | Confident | 9 Ų | 9 | 52.5 Ų | 52.5 | 5% | 0.046 | 30% | 0.299 | C | S | . | . | S | Bend | trans | -67.5 | 123.9 | 168.1 | -57.1 | 172.7 | 0 | 0 | 0 | 107.1 | L109 V113 F133 F266 A328 S329 V333 | L109-I331 HydrophobicContact CD1-CD1 4.02Å; L109-I331 HydrophobicContact CD1-CG1 3.67Å; L109-I331 HydrophobicContact CD2-CG1 4.1Å; L109-I331 HydrophobicContact CG-CG1 4.4Å; V113-I331 HydrophobicContact CG2-CD1 4.26Å; F133-I331 HydrophobicContact CZ-CG2 4.08Å; F266-I331 HydrophobicContact CD1-CD1 3.64Å; F266-I331 HydrophobicContact CE1-CB 4.35Å; F266-I331 HydrophobicContact CE1-CD1 3.52Å; F266-I331 HydrophobicContact CE1-CG2 3.81Å; F266-I331 HydrophobicContact CZ-CG2 3.85Å; A328-I331 VanDerWaalsContact O-CB 3.29Å; A328-I331 WeakPolarHBondContact O-CB 3.31Å; A328-I331 WeakPolarHBondContact O-CG1 3.32Å; A328-I331 PolarHBondContact O-N 3.13Å; A328-I331 VanDerWaalsContact O-N 3.1Å; S329-I331 PolarHBondContact O-N 3.48Å; I331-V333 VanDerWaalsContact C-N 3.33Å; I331-V333 WeakPolarHBondContact O-CG2 3.39Å; I331-V333 PolarHBondContact O-N 2.93Å |
| 332 | H | 78.5 | Confident | 88.3 | Confident | 134 Ų | 134 | 51.8 Ų | 51.8 | 62% | 0.62 | 29% | 0.291 | S | S | * | . | trans | -69.2 | 90.8 | 178.7 | -173.6 | 74.3 | 0 | 0 | 0 | 110.8 | S330 | S330-H332 PolarHBondContact O-N 3.1Š| ||
| 333 | V | 80.2 | Confident | 88.7 | Confident | 18 Ų | 18 | 48.9 Ų | 48.9 | 11% | 0.109 | 28% | 0.278 | C | S | . | . | trans | -81.9 | -33 | 178.1 | -173.8 | 0 | 0 | 0 | 0 | 110.8 | F266 V299 Q300 I331 L339 | F266-V333 HydrophobicContact CD2-CG2 4.41Å; F266-V333 HydrophobicContact CE2-CG1 4.36Å; F266-V333 HydrophobicContact CE2-CG2 3.78Å; F266-V333 HydrophobicContact CZ-CG2 4.17Å; V299-V333 HydrophobicContact CG2-CB 4.49Å; V299-V333 HydrophobicContact CG2-CG1 4.12Å; V299-V333 WeakPolarHBondContact O-CG1 3.46Å; Q300-V333 WeakPolarHBondContact CG-O 3.29Å; I331-V333 VanDerWaalsContact C-N 3.33Å; I331-V333 WeakPolarHBondContact O-CG2 3.39Å; I331-V333 PolarHBondContact O-N 2.93Å; V333-L339 HydrophobicContact CG1-CD2 3.98Å | ||
| 334 | G | 83.4 | Confident | 89.1 | Confident | 18 Ų | 18 | 49.8 Ų | 49.8 | 19% | 0.186 | 27% | 0.271 | C | S | . | . | trans | 155.5 | -178.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 335 | S | 88.6 | Confident | 89.5 | Confident | 58 Ų | 58 | 50 Ų | 50 | 41% | 0.406 | 27% | 0.271 | S | S | . | . | trans | -73 | 145 | 175.7 | 65.8 | 0 | 0 | 0 | 0 | 111.6 | P337 T338 L339 | S335-P337 VanDerWaalsContact C-CD 3.5Å; S335-T338 WeakPolarHBondContact O-CA 3.29Å; S335-T338 VanDerWaalsContact O-CB 3.29Å; S335-T338 WeakPolarHBondContact O-CB 3.49Å; S335-T338 PolarHBondContact O-N 2.84Å; S335-T338 PolarHBondContact OG-OG1 3.4Å; S335-L339 PolarHBondContact O-N 3.34Å | ||
| 336 | E | 89.5 | Confident | 89.8 | Confident | 126 Ų | 126 | 48.1 Ų | 48.1 | 59% | 0.589 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -47 | -48.5 | 174.2 | -175.7 | 177.3 | -175.6 | 0 | 0 | 114.2 | T338 L339 L340 | E336-T338 PolarHBondContact O-N 3.38Å; E336-L339 PolarHBondContact O-N 3.35Å; E336-L340 HydrophobicContact CG-CD1 4Å; E336-L340 HydrophobicContact CG-CG 4.34Å; E336-L340 WeakPolarHBondContact O-CB 3.42Å; E336-L340 WeakPolarHBondContact O-CG 3.48Å; E336-L340 PolarHBondContact O-N 2.94Å |
| 337 | P | 92.9 | Very high | 90.2 | Very high | 90 Ų | 90 | 45.8 Ų | 45.8 | 58% | 0.584 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -62.2 | -31.8 | 177.7 | 23.2 | -35.5 | 0 | 0 | 0 | 113.2 | S335 R341 | S335-P337 VanDerWaalsContact C-CD 3.5Å; P337-R341 VanDerWaalsContact O-CB 3.32Å; P337-R341 WeakPolarHBondContact O-CB 3.43Å; P337-R341 PolarHBondContact O-N 3.15Å |
| 338 | T | 93.3 | Very high | 90.5 | Very high | 34 Ų | 34 | 47 Ų | 47 | 21% | 0.209 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.6 | -47.6 | 175.8 | -58.7 | 0 | 0 | 0 | 0 | 110.6 | F296 Q300 S335 E336 R341 I342 | F296-T338 HydrophobicContact CD1-CG2 4.1Å; F296-T338 HydrophobicContact CE1-CG2 4.26Å; Q300-T338 HydrophobicContact CG-CG2 4.44Å; S335-T338 WeakPolarHBondContact O-CA 3.29Å; S335-T338 VanDerWaalsContact O-CB 3.29Å; S335-T338 WeakPolarHBondContact O-CB 3.49Å; S335-T338 PolarHBondContact O-N 2.84Å; S335-T338 PolarHBondContact OG-OG1 3.4Å; E336-T338 PolarHBondContact O-N 3.38Å; T338-R341 WeakPolarHBondContact O-CB 3.28Å; T338-R341 PolarHBondContact O-N 3.19Å; T338-I342 HydrophobicContact CG2-CD1 4.13Å; T338-I342 WeakPolarHBondContact O-CG1 3.25Å; T338-I342 PolarHBondContact O-N 3.24Å |
| 339 | L | 94.1 | Very high | 90.9 | Very high | 30 Ų | 30 | 46.9 Ų | 46.9 | 16% | 0.157 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.1 | -46.9 | 178.7 | -62.1 | -178.3 | 0 | 0 | 0 | 111.1 | A304 V333 S335 E336 R341 I342 M343 | A304-L339 HydrophobicContact CB-CD2 4.18Å; V333-L339 HydrophobicContact CG1-CD2 3.98Å; S335-L339 PolarHBondContact O-N 3.34Å; E336-L339 PolarHBondContact O-N 3.35Å; L339-R341 VanDerWaalsContact C-N 3.28Å; L339-R341 PolarHBondContact O-N 3.41Å; L339-I342 PolarHBondContact O-N 3.28Å; L339-I342 VanDerWaalsContact O-N 3.13Å; L339-M343 WeakPolarHBondContact O-CG 3.41Å; L339-M343 PolarHBondContact O-N 2.92Å |
| 340 | L | 93.8 | Very high | 91.3 | Very high | 44 Ų | 44 | 44 Ų | 44 | 23% | 0.23 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57.6 | -42.2 | 175.9 | -74.4 | 174.7 | 0 | 0 | 0 | 111.6 | E336 M343 H344 | E336-L340 HydrophobicContact CG-CD1 4Å; E336-L340 HydrophobicContact CG-CG 4.34Å; E336-L340 WeakPolarHBondContact O-CB 3.42Å; E336-L340 WeakPolarHBondContact O-CG 3.48Å; E336-L340 PolarHBondContact O-N 2.94Å; L340-M343 HydrophobicContact CD2-SD 4.45Å; L340-M343 PolarHBondContact O-N 3.13Å; L340-H344 PolarHBondContact O-N 3.19Å; L340-H344 PolarHBondContact O-ND1 3.12Å |
| 341 | R | 95.6 | Very high | 91.7 | Very high | 148 Ų | 148 | 43.2 Ų | 43.2 | 56% | 0.558 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -60 | -47.2 | 176.1 | -177.4 | 177.4 | -179.6 | -175.7 | 0.1 | 111.5 | F296 P337 T338 L339 H344 I345 | F296-R341 HydrophobicContact CZ-CG 4.22Å; P337-R341 VanDerWaalsContact O-CB 3.32Å; P337-R341 WeakPolarHBondContact O-CB 3.43Å; P337-R341 PolarHBondContact O-N 3.15Å; T338-R341 WeakPolarHBondContact O-CB 3.28Å; T338-R341 PolarHBondContact O-N 3.19Å; L339-R341 VanDerWaalsContact C-N 3.28Å; L339-R341 PolarHBondContact O-N 3.41Å; R341-H344 PolarHBondContact O-N 2.5Å; R341-I345 HydrophobicContact CG-CD1 4.25Å; R341-I345 VanDerWaalsContact O-CG1 3.31Å; R341-I345 WeakPolarHBondContact O-CG1 3.45Å; R341-I345 PolarHBondContact O-N 3.39Å |
| 342 | I | 96.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -61.8 | -47.5 | 177.3 | -62.8 | 164.7 | 0 | 0 | 0 | 110 | F296 Q300 L301 A304 T338 L339 H344 I345 L346 | F296-I342 HydrophobicContact CB-CD1 3.91Å; F296-I342 HydrophobicContact CB-CG1 4.39Å; F296-I342 HydrophobicContact CD1-CD1 3.81Å; F296-I342 HydrophobicContact CD1-CG1 3.84Å; F296-I342 HydrophobicContact CD2-CD1 4.06Å; F296-I342 HydrophobicContact CD2-CG1 3.59Å; F296-I342 HydrophobicContact CE1-CD1 4.35Å; F296-I342 HydrophobicContact CE1-CG1 3.94Å; F296-I342 HydrophobicContact CE2-CG1 3.72Å; F296-I342 HydrophobicContact CG-CD1 3.65Å; F296-I342 HydrophobicContact CG-CG1 3.67Å; F296-I342 HydrophobicContact CZ-CG1 3.89Å; Q300-I342 HydrophobicContact CB-CD1 3.69Å; L301-I342 HydrophobicContact CD2-CD1 4.46Å; L301-I342 HydrophobicContact CD2-CG2 3.91Å; A304-I342 HydrophobicContact CB-CB 3.59Å; A304-I342 HydrophobicContact CB-CD1 4.28Å; A304-I342 HydrophobicContact CB-CG2 3.4Å; T338-I342 HydrophobicContact CG2-CD1 4.13Å; T338-I342 WeakPolarHBondContact O-CG1 3.25Å; T338-I342 PolarHBondContact O-N 3.24Å; L339-I342 PolarHBondContact O-N 3.28Å; L339-I342 VanDerWaalsContact O-N 3.13Å; I342-H344 VanDerWaalsContact C-N 3.29Å; I342-H344 PolarHBondContact O-N 3.24Å; I342-I345 WeakPolarHBondContact O-CB 3.46Å; I342-I345 PolarHBondContact O-N 3.04Å; I342-L346 HydrophobicContact CG2-CD1 4Å; I342-L346 HydrophobicContact CG2-CG 4.1Å; I342-L346 WeakPolarHBondContact O-CG 3.35Å; I342-L346 PolarHBondContact O-N 3.09Å |
| 343 | M | 96.6 | Very high | 92.7 | Very high | 6 Ų | 6 | 41.2 Ų | 41.2 | 3% | 0.03 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -57.2 | -41.2 | 179 | -67.2 | 169.2 | 72.6 | 0 | 0 | 112 | A304 C307 L308 L339 L340 I345 L346 A347 L386 | A304-M343 HydrophobicContact CB-CG 3.93Å; A304-M343 WeakPolarHBondContact O-CG 3.09Å; C307-M343 HydrophobicContact CB-CE 3.99Å; C307-M343 HydrophobicContact CB-SD 4.02Å; L308-M343 HydrophobicContact CB-CB 4.47Å; L308-M343 HydrophobicContact CB-CE 4.04Å; L308-M343 HydrophobicContact CB-CG 4.14Å; L308-M343 HydrophobicContact CD1-CE 4.34Å; L339-M343 WeakPolarHBondContact O-CG 3.41Å; L339-M343 PolarHBondContact O-N 2.92Å; L340-M343 HydrophobicContact CD2-SD 4.45Å; L340-M343 PolarHBondContact O-N 3.13Å; M343-I345 VanDerWaalsContact C-N 3.34Å; M343-I345 PolarHBondContact O-N 3.29Å; M343-L346 PolarHBondContact O-N 3.34Å; M343-A347 VanDerWaalsContact O-CB 3.23Å; M343-A347 WeakPolarHBondContact O-CB 3.44Å; M343-A347 PolarHBondContact O-N 2.79Å; M343-L386 VanDerWaalsContact C-CD1 3.49Å; M343-L386 HydrophobicContact CB-CD1 3.81Å; M343-L386 HydrophobicContact CB-CD2 3.92Å; M343-L386 HydrophobicContact CE-CD2 3.37Å; M343-L386 HydrophobicContact SD-CD2 4.29Å |
| 344 | H | 95.8 | Very high | 93 | Very high | 82 Ų | 82 | 44 Ų | 44 | 38% | 0.38 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -63 | -40.5 | 175.6 | -79.4 | 88.1 | 0 | 0 | 0 | 112.3 | L340 R341 I342 S348 L386 | L340-H344 PolarHBondContact O-N 3.19Å; L340-H344 PolarHBondContact O-ND1 3.12Å; R341-H344 PolarHBondContact O-N 2.5Å; I342-H344 VanDerWaalsContact C-N 3.29Å; I342-H344 PolarHBondContact O-N 3.24Å; H344-S348 WeakPolarHBondContact O-CB 3.32Å; H344-S348 PolarHBondContact O-N 3.04Å; H344-L386 HydrophobicContact CB-CD1 4.34Å; H344-L386 VanDerWaalsContact CE1-CB 3.49Å; H344-L386 WeakPolarHBondContact CE1-CB 3.36Å |
| 345 | I | 95.6 | Very high | 93.1 | Very high | 13 Ų | 13 | 47.9 Ų | 47.9 | 7% | 0.067 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.5 | -50.8 | 176.7 | -64.8 | 164.9 | 0 | 0 | 0 | 109.8 | E290 Q292 F296 R341 I342 M343 A347 S348 A349 | E290-I345 HydrophobicContact CB-CG2 3.93Å; E290-I345 HydrophobicContact CG-CG2 3.78Å; Q292-I345 HydrophobicContact CG-CD1 3.9Å; Q292-I345 HydrophobicContact CG-CG1 4.45Å; Q292-I345 HydrophobicContact CG-CG2 4.17Å; F296-I345 HydrophobicContact CE2-CD1 3.81Å; F296-I345 HydrophobicContact CZ-CD1 4.18Å; R341-I345 HydrophobicContact CG-CD1 4.25Å; R341-I345 VanDerWaalsContact O-CG1 3.31Å; R341-I345 WeakPolarHBondContact O-CG1 3.45Å; R341-I345 PolarHBondContact O-N 3.39Å; I342-I345 WeakPolarHBondContact O-CB 3.46Å; I342-I345 PolarHBondContact O-N 3.04Å; M343-I345 VanDerWaalsContact C-N 3.34Å; M343-I345 PolarHBondContact O-N 3.29Å; I345-A347 PolarHBondContact O-N 2.65Å; I345-S348 PolarHBondContact O-N 3.12Å; I345-A349 WeakPolarHBondContact O-CB 3.45Å; I345-A349 PolarHBondContact O-N 3.48Å |
| 346 | L | 96.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.2 | -40.5 | -179.2 | -58.8 | -173.9 | 0 | 0 | 0 | 112.2 | L283 A305 L308 I342 M343 A349 A350 | L283-L346 HydrophobicContact CB-CD1 4.29Å; L283-L346 HydrophobicContact CD2-CB 4.41Å; L283-L346 WeakPolarHBondContact O-CD2 3.32Å; A305-L346 HydrophobicContact CB-CD1 3.95Å; L308-L346 HydrophobicContact CD2-CB 3.78Å; I342-L346 HydrophobicContact CG2-CD1 4Å; I342-L346 HydrophobicContact CG2-CG 4.1Å; I342-L346 WeakPolarHBondContact O-CG 3.35Å; I342-L346 PolarHBondContact O-N 3.09Å; M343-L346 PolarHBondContact O-N 3.34Å; L346-A349 PolarHBondContact O-N 3.13Å; L346-A350 WeakPolarHBondContact O-CB 3.35Å; L346-A350 PolarHBondContact O-N 3.11Å |
| 347 | A | 96.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.2 | -42.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L308 M343 I345 A350 A351 A382 A383 L386 | L308-A347 HydrophobicContact CD1-CB 4.48Å; L308-A347 HydrophobicContact CD2-CB 4.1Å; M343-A347 VanDerWaalsContact O-CB 3.23Å; M343-A347 WeakPolarHBondContact O-CB 3.44Å; M343-A347 PolarHBondContact O-N 2.79Å; I345-A347 PolarHBondContact O-N 2.65Å; A347-A350 PolarHBondContact O-N 3.37Å; A347-A351 WeakPolarHBondContact O-CB 3.32Å; A347-A351 PolarHBondContact O-N 3.06Å; A347-A382 HydrophobicContact CB-CB 3.84Å; A347-A383 HydrophobicContact CB-CB 4.34Å; A347-L386 HydrophobicContact CB-CD1 4.08Å |
| 348 | S | 93.9 | Very high | 92.1 | Very high | 46 Ų | 46 | 45 Ų | 45 | 32% | 0.322 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.6 | -41.9 | 176.1 | -163.4 | 0 | 0 | 0 | 0 | 112.2 | H344 I345 K352 | H344-S348 WeakPolarHBondContact O-CB 3.32Å; H344-S348 PolarHBondContact O-N 3.04Å; I345-S348 PolarHBondContact O-N 3.12Å; S348-K352 WeakPolarHBondContact O-CD 3.4Å; S348-K352 WeakPolarHBondContact O-CG 3.31Å; S348-K352 PolarHBondContact O-N 3.09Å; S348-K352 PolarHBondContact OG-NZ 2.86Å |
| 349 | A | 94 | Very high | 92.1 | Very high | 5 Ų | 5 | 45 Ų | 45 | 4% | 0.041 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.1 | -48 | 176 | 0 | 0 | 0 | 0 | 0 | 110.7 | L286 E290 I345 L346 A351 K352 A353 | L286-A349 HydrophobicContact CB-CB 4.37Å; L286-A349 HydrophobicContact CD1-CB 4.45Å; E290-A349 HydrophobicContact CG-CB 3.96Å; I345-A349 WeakPolarHBondContact O-CB 3.45Å; I345-A349 PolarHBondContact O-N 3.48Å; L346-A349 PolarHBondContact O-N 3.13Å; A349-A351 PolarHBondContact O-N 2.98Å; A349-K352 PolarHBondContact O-N 3.3Å; A349-K352 VanDerWaalsContact O-N 3.15Å; A349-A353 WeakPolarHBondContact O-CB 3.43Å; A349-A353 PolarHBondContact O-N 3.09Å |
| 350 | A | 95 | Very high | 92 | Very high | 6 Ų | 6 | 44 Ų | 44 | 5% | 0.05 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.8 | -40.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113 | Y282 L283 L286 L346 A347 K352 A353 L379 | Y282-A350 HydrophobicContact CE1-CB 4.25Å; L283-A350 HydrophobicContact CD2-CB 3.96Å; L286-A350 HydrophobicContact CD1-CB 3.7Å; L346-A350 WeakPolarHBondContact O-CB 3.35Å; L346-A350 PolarHBondContact O-N 3.11Å; A347-A350 PolarHBondContact O-N 3.37Å; A350-K352 PolarHBondContact O-N 3.08Å; A350-A353 WeakPolarHBondContact O-CB 3.3Å; A350-A353 PolarHBondContact O-N 3.4Å; A350-L379 HydrophobicContact CB-CD2 3.94Å |
| 351 | A | 92.6 | Very high | 92.1 | Very high | 40 Ų | 40 | 42 Ų | 42 | 33% | 0.331 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.5 | -25.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A347 A349 | A347-A351 WeakPolarHBondContact O-CB 3.32Å; A347-A351 PolarHBondContact O-N 3.06Å; A349-A351 PolarHBondContact O-N 2.98Å |
| 352 | K | 91.1 | Very high | 92.1 | Very high | 99 Ų | 99 | 36.8 Ų | 36.8 | 43% | 0.43 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -98.4 | -12.3 | 179 | -63.4 | 167.8 | -175.9 | 159.4 | 0 | 113 | S348 A349 A350 S354 S355 Q356 | S348-K352 WeakPolarHBondContact O-CD 3.4Å; S348-K352 WeakPolarHBondContact O-CG 3.31Å; S348-K352 PolarHBondContact O-N 3.09Å; S348-K352 PolarHBondContact OG-NZ 2.86Å; A349-K352 PolarHBondContact O-N 3.3Å; A349-K352 VanDerWaalsContact O-N 3.15Å; A350-K352 PolarHBondContact O-N 3.08Å; K352-S354 PolarHBondContact O-N 3.12Å; K352-S354 VanDerWaalsContact O-N 3.13Å; K352-S355 PolarHBondContact O-N 3.32Å; K352-S355 PolarHBondContact O-OG 3.39Å; K352-S355 VanDerWaalsContact O-OG 3.11Å; K352-Q356 HydrophobicContact CB-CG 4.07Å; K352-Q356 VanDerWaalsContact CB-NE2 3.33Å; K352-Q356 WeakPolarHBondContact O-CG 3.43Å; K352-Q356 PolarHBondContact O-N 3.06Å |
| 353 | A | 90.7 | Very high | 92.1 | Very high | 3 Ų | 3 | 41.6 Ų | 41.6 | 3% | 0.025 | 23% | 0.234 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -29.6 | -168.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y282 L286 A349 A350 F362 | Y282-A353 VanDerWaalsContact OH-CB 3.31Å; Y282-A353 WeakPolarHBondContact OH-CB 3.47Å; L286-A353 HydrophobicContact CD2-CB 4.16Å; A349-A353 WeakPolarHBondContact O-CB 3.43Å; A349-A353 PolarHBondContact O-N 3.09Å; A350-A353 WeakPolarHBondContact O-CB 3.3Å; A350-A353 PolarHBondContact O-N 3.4Å; A353-F362 HydrophobicContact CB-CB 4.16Å; A353-F362 HydrophobicContact CB-CD2 4.25Å |
| 354 | S | 88.3 | Confident | 92 | Very high | 76 Ų | 76 | 42.6 Ų | 42.6 | 53% | 0.531 | 24% | 0.239 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | -20.8 | 178.1 | 65.8 | 0 | 0 | 0 | 0 | 114.2 | K352 | K352-S354 PolarHBondContact O-N 3.12Å; K352-S354 VanDerWaalsContact O-N 3.13Å |
| 355 | S | 84.4 | Confident | 92.1 | Very high | 99 Ų | 99 | 38.7 Ų | 38.7 | 69% | 0.692 | 22% | 0.22 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -106.7 | -13.2 | -175.3 | 58.6 | 0 | 0 | 0 | 0 | 113.5 | K352 | K352-S355 PolarHBondContact O-N 3.32Å; K352-S355 PolarHBondContact O-OG 3.39Å; K352-S355 VanDerWaalsContact O-OG 3.11Å |
| 356 | Q | 82.5 | Confident | 92.1 | Very high | 64 Ų | 64 | 38.9 Ų | 38.9 | 30% | 0.299 | 22% | 0.223 | S | C | . | . | S | Bend | trans | -74.4 | 154.3 | 174.8 | -76.1 | 179.5 | 4.9 | 0 | 0 | 112.1 | K352 T358 | K352-Q356 HydrophobicContact CB-CG 4.07Å; K352-Q356 VanDerWaalsContact CB-NE2 3.33Å; K352-Q356 WeakPolarHBondContact O-CG 3.43Å; K352-Q356 PolarHBondContact O-N 3.06Å; Q356-T358 VanDerWaalsContact C-N 3.25Å; Q356-T358 PolarHBondContact O-N 3.34Å |
| 357 | E | 82.4 | Confident | 92 | Very high | 134 Ų | 134 | 40.6 Ų | 40.6 | 63% | 0.626 | 24% | 0.235 | S | C | * | . | S | Bend | trans | -66.6 | -29 | 173.4 | -71.6 | -166.8 | -158.7 | 0 | 0 | 113.3 | R27 | R27-E357 IonicContact NH1-OE2 3.85Å; R27-E357 PolarHBondContact NH1-OE2 3.35Å; R27-E357 PolarHBondContact NH2-O 3.49Å; R27-E357 VanDerWaalsContact NH2-O 3.15Å |
| 358 | T | 85.7 | Confident | 91.8 | Very high | 16 Ų | 16 | 45.3 Ų | 45.3 | 10% | 0.098 | 27% | 0.266 | C | S | . | . | trans | -92.8 | 90.8 | 176.2 | 50.4 | 0 | 0 | 0 | 0 | 109.2 | A160 I161 E164 Q356 | A160-T358 HydrophobicContact CB-CG2 4.25Å; I161-T358 HydrophobicContact CG1-CG2 4.49Å; E164-T358 HydrophobicContact CB-CG2 3.7Å; E164-T358 VanDerWaalsContact CD-CA 3.49Å; E164-T358 HydrophobicContact CG-CG2 3.97Å; E164-T358 WeakPolarHBondContact OE2-CA 3.33Å; Q356-T358 VanDerWaalsContact C-N 3.25Å; Q356-T358 PolarHBondContact O-N 3.34Å | ||
| 359 | C | 92.3 | Very high | 91.8 | Very high | 34 Ų | 34 | 52 Ų | 52 | 23% | 0.23 | 29% | 0.289 | C | S | . | . | trans | -124.5 | 13.1 | -170.7 | 65 | 0 | 0 | 0 | 0 | 113.8 | E164 T361 F362 I363 | E164-C359 PolarHBondContact OE1-N 3.07Å; E164-C359 VanDerWaalsContact OE1-N 3.15Å; E164-C359 PolarHBondContact OE2-N 3.14Å; E164-C359 VanDerWaalsContact OE2-N 3.14Å; C359-T361 PolarHBondContact O-N 2.87Å; C359-F362 HydrophobicContact CB-CB 4.39Å; C359-F362 WeakPolarHBondContact O-CB 3.32Å; C359-F362 PolarHBondContact O-N 3.15Å; C359-F362 VanDerWaalsContact O-N 3.1Å; C359-I363 WeakPolarHBondContact O-CG1 3.2Å; C359-I363 PolarHBondContact O-N 2.95Å | ||
| 360 | A | 93.1 | Very high | 91.8 | Very high | 9 Ų | 9 | 52.2 Ų | 52.2 | 7% | 0.074 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -58.4 | -46.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | E164 I167 Q168 F362 I363 K364 | E164-A360 HydrophobicContact CG-CB 4.45Å; E164-A360 WeakPolarHBondContact OE1-CA 3.47Å; E164-A360 WeakPolarHBondContact OE1-CB 3.48Å; E164-A360 PolarHBondContact OE1-N 3.36Å; E164-A360 VanDerWaalsContact OE2-CB 3.28Å; E164-A360 WeakPolarHBondContact OE2-CB 3.45Å; E164-A360 PolarHBondContact OE2-N 2.9Å; I167-A360 HydrophobicContact CB-CB 4.37Å; I167-A360 HydrophobicContact CG2-CB 3.94Å; Q168-A360 HydrophobicContact CG-CB 3.65Å; A360-F362 VanDerWaalsContact C-N 3.34Å; A360-F362 PolarHBondContact O-N 3.23Å; A360-I363 PolarHBondContact O-N 3.48Å; A360-K364 VanDerWaalsContact O-CB 3.27Å; A360-K364 WeakPolarHBondContact O-CB 3.23Å; A360-K364 PolarHBondContact O-N 3.27Å |
| 361 | T | 95.4 | Very high | 91.8 | Very high | 1 Ų | 1 | 56.3 Ų | 56.3 | 1% | 0.006 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.6 | -42.4 | 175.6 | -59.7 | 0 | 0 | 0 | 0 | 111.1 | I167 Y282 E285 L286 C359 I363 K364 Y365 | I167-T361 WeakPolarHBondContact CD1-OG1 3.32Å; Y282-T361 HydrophobicContact CD2-CG2 3.89Å; Y282-T361 HydrophobicContact CE2-CG2 3.96Å; E285-T361 HydrophobicContact CB-CG2 3.92Å; E285-T361 HydrophobicContact CG-CG2 4.04Å; E285-T361 WeakPolarHBondContact OE1-CG2 3.29Å; E285-T361 PolarHBondContact OE1-OG1 2.96Å; L286-T361 HydrophobicContact CD2-CG2 3.81Å; L286-T361 HydrophobicContact CG-CG2 4.08Å; C359-T361 PolarHBondContact O-N 2.87Å; T361-I363 PolarHBondContact O-N 3.42Å; T361-K364 PolarHBondContact O-N 3.11Å; T361-Y365 HydrophobicContact CG2-CD2 4.04Å; T361-Y365 HydrophobicContact CG2-CE2 4.15Å; T361-Y365 VanDerWaalsContact O-CD2 3.3Å; T361-Y365 WeakPolarHBondContact O-CD2 3.42Å; T361-Y365 PolarHBondContact O-N 2.85Å; T361-Y365 VanDerWaalsContact O-N 3.12Å |
| 362 | F | 96.2 | Very high | 92 | Very high | 39 Ų | 39 | 58.6 Ų | 58.6 | 17% | 0.171 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59 | -46.3 | 175.1 | 175.1 | -93.5 | 0 | 0 | 0 | 111.9 | A353 C359 A360 S366 S374 R375 | A353-F362 HydrophobicContact CB-CB 4.16Å; A353-F362 HydrophobicContact CB-CD2 4.25Å; C359-F362 HydrophobicContact CB-CB 4.39Å; C359-F362 WeakPolarHBondContact O-CB 3.32Å; C359-F362 PolarHBondContact O-N 3.15Å; C359-F362 VanDerWaalsContact O-N 3.1Å; A360-F362 VanDerWaalsContact C-N 3.34Å; A360-F362 PolarHBondContact O-N 3.23Å; F362-S366 WeakPolarHBondContact O-CB 3.49Å; F362-S366 PolarHBondContact O-N 3.47Å; F362-S366 VanDerWaalsContact O-N 3.12Å; F362-S374 VanDerWaalsContact CE2-O 3.27Å; F362-S374 WeakPolarHBondContact CE2-O 3.36Å; F362-S374 WeakPolarHBondContact O-CB 3.34Å; F362-S374 PolarHBondContact O-OG 3.13Å; F362-R375 HydrophobicContact CZ-CG 4.13Å |
| 363 | I | 95.1 | Very high | 92.2 | Very high | 101 Ų | 101 | 54.2 Ų | 54.2 | 52% | 0.518 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -65.3 | -47.4 | 179.8 | -67.9 | 169.1 | 0 | 0 | 0 | 110.7 | C359 A360 T361 Y365 S366 | C359-I363 WeakPolarHBondContact O-CG1 3.2Å; C359-I363 PolarHBondContact O-N 2.95Å; A360-I363 PolarHBondContact O-N 3.48Å; T361-I363 PolarHBondContact O-N 3.42Å; I363-Y365 VanDerWaalsContact C-N 3.29Å; I363-Y365 PolarHBondContact O-N 3.46Å; I363-S366 WeakPolarHBondContact O-CB 3.44Å; I363-S366 PolarHBondContact O-N 2.91Å; I363-S366 PolarHBondContact O-OG 3.24Å |
| 364 | K | 95.1 | Very high | 92.5 | Very high | 27 Ų | 27 | 54.3 Ų | 54.3 | 12% | 0.117 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -51.3 | -48.9 | 177.7 | 174.8 | -179.9 | 174.2 | 171.8 | 0 | 111.4 | E171 E285 A360 T361 S366 | E171-K364 VanDerWaalsContact CD-CD 3.47Å; E171-K364 HydrophobicContact CG-CD 4.02Å; E171-K364 HydrophobicContact CG-CG 4.46Å; E171-K364 VanDerWaalsContact OE1-CD 3.31Å; E171-K364 WeakPolarHBondContact OE1-CD 3.21Å; E171-K364 WeakPolarHBondContact OE1-CE 3.43Å; E171-K364 IonicContact OE1-NZ 3.06Å; E171-K364 PolarHBondContact OE1-NZ 2.91Å; E285-K364 WeakPolarHBondContact OE1-CD 3.48Å; E285-K364 IonicContact OE1-NZ 3.36Å; E285-K364 WeakPolarHBondContact OE2-CE 3.39Å; E285-K364 IonicContact OE2-NZ 2.83Å; E285-K364 PolarHBondContact OE2-NZ 3.02Å; A360-K364 VanDerWaalsContact O-CB 3.27Å; A360-K364 WeakPolarHBondContact O-CB 3.23Å; A360-K364 PolarHBondContact O-N 3.27Å; T361-K364 PolarHBondContact O-N 3.11Å; K364-S366 VanDerWaalsContact C-N 3.32Å; K364-S366 PolarHBondContact O-N 3.02Å |
| 365 | Y | 97.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 30% | 0.298 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | 2.7 | -178 | -72.2 | -95.3 | 0 | 0 | 0 | 114.5 | E177 W278 R281 Y282 E285 T361 I363 S367 T370 Q372 V373 S374 | E177-Y365 PolarHBondContact OE1-OH 2.94Å; W278-Y365 HydrophobicContact CE3-CD1 4.37Å; W278-Y365 HydrophobicContact CE3-CE1 4.02Å; W278-Y365 HydrophobicContact CZ3-CE1 4.26Å; R281-Y365 HydrophobicContact CB-CE1 3.84Å; Y282-Y365 HydrophobicContact CD2-CD1 4.42Å; Y282-Y365 AromaticContact CD2-CD2 3.78Å; Y282-Y365 HydrophobicContact CD2-CD2 3.78Å; Y282-Y365 AromaticContact CD2-CG 3.69Å; Y282-Y365 HydrophobicContact CD2-CG 3.69Å; Y282-Y365 HydrophobicContact CG-CD1 4.43Å; Y282-Y365 HydrophobicContact CG-CG 4.11Å; E285-Y365 HydrophobicContact CB-CE2 4.2Å; E285-Y365 WeakPolarHBondContact OE2-CE2 3.05Å; E285-Y365 PolarHBondContact OE2-OH 3.13Å; E285-Y365 VanDerWaalsContact OE2-OH 3.14Å; T361-Y365 HydrophobicContact CG2-CD2 4.04Å; T361-Y365 HydrophobicContact CG2-CE2 4.15Å; T361-Y365 VanDerWaalsContact O-CD2 3.3Å; T361-Y365 WeakPolarHBondContact O-CD2 3.42Å; T361-Y365 PolarHBondContact O-N 2.85Å; T361-Y365 VanDerWaalsContact O-N 3.12Å; I363-Y365 VanDerWaalsContact C-N 3.29Å; I363-Y365 PolarHBondContact O-N 3.46Å; Y365-S367 VanDerWaalsContact C-N 3.3Å; Y365-T370 VanDerWaalsContact CA-OG1 3.29Å; Y365-T370 WeakPolarHBondContact CA-OG1 3.5Å; Y365-T370 HydrophobicContact CD1-CG2 4.14Å; Y365-T370 PolarHBondContact O-OG1 3.01Å; Y365-Q372 CarbonylContact O-C 3.51Å; Y365-Q372 WeakPolarHBondContact O-CA 3.39Å; Y365-V373 HydrophobicContact CD1-CG2 3.97Å; Y365-V373 HydrophobicContact CG-CG2 4.47Å; Y365-V373 PolarHBondContact O-N 3.17Å; Y365-S374 PolarHBondContact O-OG 3.38Å |
| 366 | S | 95.8 | Very high | 93.3 | Very high | 18 Ų | 18 | 56.2 Ų | 56.2 | 13% | 0.126 | 28% | 0.28 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.4 | -4 | 176.9 | 75.5 | 0 | 0 | 0 | 0 | 114 | F362 I363 K364 S374 | F362-S366 WeakPolarHBondContact O-CB 3.49Å; F362-S366 PolarHBondContact O-N 3.47Å; F362-S366 VanDerWaalsContact O-N 3.12Å; I363-S366 WeakPolarHBondContact O-CB 3.44Å; I363-S366 PolarHBondContact O-N 2.91Å; I363-S366 PolarHBondContact O-OG 3.24Å; K364-S366 VanDerWaalsContact C-N 3.32Å; K364-S366 PolarHBondContact O-N 3.02Å; S366-S374 VanDerWaalsContact CA-OG 3.25Å; S366-S374 WeakPolarHBondContact CA-OG 3.43Å; S366-S374 WeakPolarHBondContact CB-OG 3.28Å; S366-S374 PolarHBondContact N-OG 2.65Å; S366-S374 VanDerWaalsContact N-OG 3.13Å |
| 367 | S | 94.4 | Very high | 93.7 | Very high | 36 Ų | 36 | 57.5 Ų | 57.5 | 25% | 0.252 | 29% | 0.293 | S | S | . | . | S | Bend | trans | -78.5 | 157.8 | -176.3 | 83 | 0 | 0 | 0 | 0 | 112.6 | Y365 K369 T370 L371 Q372 | Y365-S367 VanDerWaalsContact C-N 3.3Å; S367-K369 PolarHBondContact O-N 2.8Å; S367-K369 PolarHBondContact OG-N 3.37Å; S367-T370 PolarHBondContact N-OG1 3.41Å; S367-T370 PolarHBondContact O-N 3.19Å; S367-T370 PolarHBondContact O-OG1 3Å; S367-T370 PolarHBondContact OG-N 2.75Å; S367-T370 PolarHBondContact OG-OG1 2.93Å; S367-T370 VanDerWaalsContact OG-OG1 3.1Å; S367-L371 PolarHBondContact O-N 3.19Å; S367-Q372 WeakPolarHBondContact O-CG 3.48Å; S367-Q372 PolarHBondContact O-N 2.97Å |
| 368 | P | 93.5 | Very high | 94.1 | Very high | 99 Ų | 99 | 52 Ų | 52 | 64% | 0.643 | 27% | 0.272 | S | S | * | . | G | 310 helix | trans | -60.4 | -28.8 | 171.6 | -22.8 | 33.2 | 0 | 0 | 0 | 113.6 | T370 L371 | P368-T370 VanDerWaalsContact C-N 3.26Å; P368-T370 PolarHBondContact O-N 2.94Å; P368-L371 PolarHBondContact O-N 2.86Å; P368-L371 VanDerWaalsContact O-N 3.13Å |
| 369 | K | 92.9 | Very high | 94.4 | Very high | 185 Ų | 185 | 51.4 Ų | 51.4 | 80% | 0.804 | 27% | 0.268 | S | S | * | . | G | 310 helix | trans | -65.3 | -32.6 | 179.1 | -65.1 | -176.3 | 178.1 | -177.2 | 0 | 112.2 | S367 L371 | S367-K369 PolarHBondContact O-N 2.8Å; S367-K369 PolarHBondContact OG-N 3.37Å; K369-L371 VanDerWaalsContact C-N 3.3Å |
| 370 | T | 94.3 | Very high | 94.1 | Very high | 11 Ų | 11 | 55 Ų | 55 | 7% | 0.067 | 29% | 0.286 | C | S | . | . | G | 310 helix | trans | -96.4 | 19.9 | 177.6 | 55.6 | 0 | 0 | 0 | 0 | 111.5 | W278 Y365 S367 P368 Q372 V373 | W278-T370 HydrophobicContact CE3-CG2 4.06Å; W278-T370 HydrophobicContact CH2-CG2 4.39Å; W278-T370 HydrophobicContact CZ3-CG2 3.89Å; Y365-T370 VanDerWaalsContact CA-OG1 3.29Å; Y365-T370 WeakPolarHBondContact CA-OG1 3.5Å; Y365-T370 HydrophobicContact CD1-CG2 4.14Å; Y365-T370 PolarHBondContact O-OG1 3.01Å; S367-T370 PolarHBondContact N-OG1 3.41Å; S367-T370 PolarHBondContact O-N 3.19Å; S367-T370 PolarHBondContact O-OG1 3Å; S367-T370 PolarHBondContact OG-N 2.75Å; S367-T370 PolarHBondContact OG-OG1 2.93Å; S367-T370 VanDerWaalsContact OG-OG1 3.1Å; P368-T370 VanDerWaalsContact C-N 3.26Å; P368-T370 PolarHBondContact O-N 2.94Å; T370-Q372 PolarHBondContact O-N 3.26Å; T370-V373 WeakPolarHBondContact O-CG1 3.44Å; T370-V373 WeakPolarHBondContact O-CG2 3.37Å; T370-V373 PolarHBondContact O-N 3.16Å |
| 371 | L | 95.9 | Very high | 93.5 | Very high | 91 Ų | 91 | 60.2 Ų | 60.2 | 48% | 0.476 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.6 | 21.5 | -177.5 | -55.8 | 178 | 0 | 0 | 0 | 114.6 | A274 A275 W278 S367 P368 K369 V373 | A274-L371 HydrophobicContact CB-CD1 4.37Å; A275-L371 HydrophobicContact CB-CD1 4.18Å; W278-L371 HydrophobicContact CG-CD1 4.44Å; S367-L371 PolarHBondContact O-N 3.19Å; P368-L371 PolarHBondContact O-N 2.86Å; P368-L371 VanDerWaalsContact O-N 3.13Å; K369-L371 VanDerWaalsContact C-N 3.3Å; L371-V373 HydrophobicContact CB-CG1 4.13Å; L371-V373 PolarHBondContact O-N 3.12Å; L371-V373 VanDerWaalsContact O-N 3.09Å |
| 372 | Q | 95.8 | Very high | 92.6 | Very high | 88 Ų | 88 | 60.1 Ų | 60.1 | 41% | 0.411 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.7 | 29.3 | -178.5 | -48.8 | -177.9 | -2.5 | 0 | 0 | 113.5 | Y365 S367 T370 S374 R375 | Y365-Q372 CarbonylContact O-C 3.51Å; Y365-Q372 WeakPolarHBondContact O-CA 3.39Å; S367-Q372 WeakPolarHBondContact O-CG 3.48Å; S367-Q372 PolarHBondContact O-N 2.97Å; T370-Q372 PolarHBondContact O-N 3.26Å; Q372-S374 PolarHBondContact O-N 3.11Å; Q372-S374 VanDerWaalsContact O-N 3.13Å; Q372-R375 PolarHBondContact O-N 3.24Å |
| 373 | V | 96.4 | Very high | 91.7 | Very high | 7 Ų | 7 | 60.5 Ų | 60.5 | 4% | 0.042 | 32% | 0.322 | C | S | . | . | G | 310 helix | trans | -57.6 | -31.6 | -172.9 | -68.9 | 0 | 0 | 0 | 0 | 113.2 | W278 M279 Y282 Y365 T370 L371 R375 H376 L379 | W278-V373 HydrophobicContact CB-CG1 3.82Å; W278-V373 HydrophobicContact CB-CG2 4.38Å; M279-V373 HydrophobicContact CB-CB 4.35Å; M279-V373 HydrophobicContact CB-CG1 4.22Å; M279-V373 HydrophobicContact CE-CB 3.84Å; M279-V373 HydrophobicContact CE-CG1 4.29Å; M279-V373 WeakPolarHBondContact CE-O 3.2Å; M279-V373 HydrophobicContact SD-CB 4.19Å; Y282-V373 HydrophobicContact CG-CG2 4.38Å; Y365-V373 HydrophobicContact CD1-CG2 3.97Å; Y365-V373 HydrophobicContact CG-CG2 4.47Å; Y365-V373 PolarHBondContact O-N 3.17Å; T370-V373 WeakPolarHBondContact O-CG1 3.44Å; T370-V373 WeakPolarHBondContact O-CG2 3.37Å; T370-V373 PolarHBondContact O-N 3.16Å; L371-V373 HydrophobicContact CB-CG1 4.13Å; L371-V373 PolarHBondContact O-N 3.12Å; L371-V373 VanDerWaalsContact O-N 3.09Å; V373-R375 PolarHBondContact O-N 3.03Å; V373-H376 VanDerWaalsContact O-CB 3.28Å; V373-H376 WeakPolarHBondContact O-CB 3.27Å; V373-H376 PolarHBondContact O-N 3.43Å; V373-H376 VanDerWaalsContact O-N 3.11Å; V373-L379 WeakPolarHBondContact O-CD1 3.44Å |
| 374 | S | 96.3 | Very high | 90.5 | Very high | 6 Ų | 6 | 57.6 Ų | 57.6 | 4% | 0.042 | 32% | 0.317 | C | S | . | . | G | 310 helix | trans | -65.5 | -20.1 | 177.6 | 66.5 | 0 | 0 | 0 | 0 | 113.6 | F362 Y365 S366 Q372 | F362-S374 VanDerWaalsContact CE2-O 3.27Å; F362-S374 WeakPolarHBondContact CE2-O 3.36Å; F362-S374 WeakPolarHBondContact O-CB 3.34Å; F362-S374 PolarHBondContact O-OG 3.13Å; Y365-S374 PolarHBondContact O-OG 3.38Å; S366-S374 VanDerWaalsContact CA-OG 3.25Å; S366-S374 WeakPolarHBondContact CA-OG 3.43Å; S366-S374 WeakPolarHBondContact CB-OG 3.28Å; S366-S374 PolarHBondContact N-OG 2.65Å; S366-S374 VanDerWaalsContact N-OG 3.13Å; Q372-S374 PolarHBondContact O-N 3.11Å; Q372-S374 VanDerWaalsContact O-N 3.13Å |
| 375 | R | 94.8 | Very high | 89.4 | Confident | 151 Ų | 151 | 58.8 Ų | 58.8 | 57% | 0.57 | 32% | 0.324 | S | S | * | . | G | 310 helix | trans | -95.3 | 3.2 | 177.7 | -62.3 | -176.5 | 174.8 | 174.5 | 3.5 | 113.4 | F362 Q372 V373 | F362-R375 HydrophobicContact CZ-CG 4.13Å; Q372-R375 PolarHBondContact O-N 3.24Å; V373-R375 PolarHBondContact O-N 3.03Å |
| 376 | H | 94.9 | Very high | 88.3 | Confident | 64 Ų | 64 | 59.1 Ų | 59.1 | 30% | 0.296 | 33% | 0.326 | S | S | . | . | trans | -64.5 | 128.1 | -176.5 | -169.7 | -93.5 | 0 | 0 | 0 | 111.1 | M279 V312 V373 G378 L379 | M279-H376 HydrophobicContact CE-CB 3.56Å; V312-H376 PolarHBondContact O-CE1 3.16Å; V373-H376 VanDerWaalsContact O-CB 3.28Å; V373-H376 WeakPolarHBondContact O-CB 3.27Å; V373-H376 PolarHBondContact O-N 3.43Å; V373-H376 VanDerWaalsContact O-N 3.11Å; H376-G378 PolarHBondContact ND1-N 3.37Å; H376-G378 VanDerWaalsContact ND1-N 3.17Å; H376-G378 PolarHBondContact O-N 3.21Å; H376-G378 VanDerWaalsContact O-N 3.16Å; H376-L379 HydrophobicContact CB-CD1 4.42Å; H376-L379 WeakPolarHBondContact O-CB 3.02Å; H376-L379 PolarHBondContact O-N 3.34Å; H376-L379 VanDerWaalsContact O-N 3.12Å | ||
| 377 | P | 91.1 | Very high | 86.5 | Confident | 91 Ų | 91 | 61.7 Ų | 61.7 | 59% | 0.591 | 34% | 0.344 | S | S | * | . | G | 310 helix | trans | -64 | -25.9 | -173.7 | 25.1 | -34.7 | 0 | 0 | 0 | 113.4 | L379 N380 | P377-L379 PolarHBondContact O-N 3.04Å; P377-L379 VanDerWaalsContact O-N 3.16Å; P377-N380 PolarHBondContact O-N 3.22Å |
| 378 | G | 90.1 | Very high | 84.5 | Confident | 17 Ų | 17 | 65.7 Ų | 65.7 | 18% | 0.175 | 37% | 0.366 | C | S | . | . | G | 310 helix | trans | -60.4 | -21.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114 | H376 N380 N381 A382 | H376-G378 PolarHBondContact ND1-N 3.37Å; H376-G378 VanDerWaalsContact ND1-N 3.17Å; H376-G378 PolarHBondContact O-N 3.21Å; H376-G378 VanDerWaalsContact O-N 3.16Å; G378-N380 VanDerWaalsContact C-N 3.31Å; G378-N380 PolarHBondContact O-N 3.37Å; G378-N381 PolarHBondContact O-N 3.37Å; G378-A382 PolarHBondContact O-N 3.18Å |
| 379 | L | 91.9 | Very high | 81.9 | Confident | 4 Ų | 4 | 64.7 Ų | 64.7 | 2% | 0.021 | 36% | 0.361 | C | S | . | . | G | 310 helix | trans | -67.2 | -30.6 | 178 | -69.3 | 171 | 0 | 0 | 0 | 112.9 | M279 Y282 L283 V312 A350 V373 H376 P377 N381 A382 | M279-L379 HydrophobicContact CE-CD1 4.45Å; M279-L379 HydrophobicContact CE-CG 4.44Å; M279-L379 HydrophobicContact SD-CD1 4.25Å; M279-L379 HydrophobicContact SD-CD2 3.83Å; M279-L379 HydrophobicContact SD-CG 4.27Å; Y282-L379 HydrophobicContact CD1-CD1 4.31Å; Y282-L379 HydrophobicContact CE1-CD1 3.67Å; L283-L379 HydrophobicContact CD2-CD2 4.1Å; V312-L379 HydrophobicContact CG1-CD2 3.98Å; V312-L379 HydrophobicContact CG1-CG 4.16Å; V312-L379 HydrophobicContact CG2-CD2 4.27Å; A350-L379 HydrophobicContact CB-CD2 3.94Å; V373-L379 WeakPolarHBondContact O-CD1 3.44Å; H376-L379 HydrophobicContact CB-CD1 4.42Å; H376-L379 WeakPolarHBondContact O-CB 3.02Å; H376-L379 PolarHBondContact O-N 3.34Å; H376-L379 VanDerWaalsContact O-N 3.12Å; P377-L379 PolarHBondContact O-N 3.04Å; P377-L379 VanDerWaalsContact O-N 3.16Å; L379-N381 PolarHBondContact O-N 3.29Å; L379-A382 WeakPolarHBondContact O-CB 3.21Å; L379-A382 PolarHBondContact O-N 3.37Å |
| 380 | N | 85.8 | Confident | 79 | Confident | 111 Ų | 111 | 70.1 Ų | 70.1 | 59% | 0.594 | 38% | 0.376 | S | S | * | . | G | 310 helix | trans | -66.7 | -29.5 | 179.7 | -66.1 | -24.7 | 0 | 0 | 0 | 112.4 | P377 G378 | P377-N380 PolarHBondContact O-N 3.22Å; G378-N380 VanDerWaalsContact C-N 3.31Å; G378-N380 PolarHBondContact O-N 3.37Å |
| 381 | N | 80.6 | Confident | 78.3 | Confident | 117 Ų | 117 | 73.1 Ų | 73.1 | 63% | 0.626 | 39% | 0.392 | S | S | * | . | G | 310 helix | trans | -105.3 | 1.9 | -178 | -64.9 | -22.9 | 0 | 0 | 0 | 112.8 | G378 L379 A383 G384 L385 | G378-N381 PolarHBondContact O-N 3.37Å; L379-N381 PolarHBondContact O-N 3.29Å; N381-A383 VanDerWaalsContact C-N 3.28Å; N381-A383 PolarHBondContact O-N 3.35Å; N381-G384 WeakPolarHBondContact O-CA 3.45Å; N381-G384 PolarHBondContact O-N 3.22Å; N381-L385 PolarHBondContact O-N 3.48Å; N381-L385 VanDerWaalsContact O-N 3.16Å |
| 382 | A | 77.6 | Confident | 77.4 | Confident | 0 Ų | 0 | 72.2 Ų | 72.2 | 0% | 0 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -57.7 | -38.6 | -172.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L308 V312 A347 G378 L379 G384 L385 L386 | L308-A382 HydrophobicContact CD1-CB 4.38Å; V312-A382 HydrophobicContact CG2-CB 3.8Å; A347-A382 HydrophobicContact CB-CB 3.84Å; G378-A382 PolarHBondContact O-N 3.18Å; L379-A382 WeakPolarHBondContact O-CB 3.21Å; L379-A382 PolarHBondContact O-N 3.37Å; A382-G384 VanDerWaalsContact C-N 3.27Å; A382-G384 PolarHBondContact O-N 3.45Å; A382-L385 WeakPolarHBondContact O-CB 3.4Å; A382-L385 PolarHBondContact O-N 3.13Å; A382-L386 PolarHBondContact O-N 3.28Å |
| 383 | A | 75.6 | Confident | 76.3 | Confident | 46 Ų | 46 | 71.3 Ų | 71.3 | 38% | 0.38 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -65.2 | -30.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | A347 N381 | A347-A383 HydrophobicContact CB-CB 4.34Å; N381-A383 VanDerWaalsContact C-N 3.28Å; N381-A383 PolarHBondContact O-N 3.35Å |
| 384 | G | 71.1 | Confident | 75.2 | Confident | 40 Ų | 40 | 75.1 Ų | 75.1 | 41% | 0.412 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -70.6 | -36.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N381 A382 L386 S387 | N381-G384 WeakPolarHBondContact O-CA 3.45Å; N381-G384 PolarHBondContact O-N 3.22Å; A382-G384 VanDerWaalsContact C-N 3.27Å; A382-G384 PolarHBondContact O-N 3.45Å; G384-L386 PolarHBondContact O-N 3.48Å; G384-S387 PolarHBondContact O-N 3.47Å; G384-S387 VanDerWaalsContact O-N 3.13Å; G384-S387 PolarHBondContact O-OG 3.16Å |
| 385 | L | 71.3 | Confident | 73.8 | Confident | 53 Ų | 53 | 79.4 Ų | 79.4 | 28% | 0.277 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -59.4 | -35.4 | 177.5 | -62.1 | 175.6 | 0 | 0 | 0 | 112.1 | N381 A382 S387 | N381-L385 PolarHBondContact O-N 3.48Å; N381-L385 VanDerWaalsContact O-N 3.16Å; A382-L385 WeakPolarHBondContact O-CB 3.4Å; A382-L385 PolarHBondContact O-N 3.13Å; L385-S387 VanDerWaalsContact C-N 3.31Å; L385-S387 PolarHBondContact O-N 2.9Å |
| 386 | L | 73.6 | Confident | 72.4 | Confident | 7 Ų | 7 | 74.6 Ų | 74.6 | 4% | 0.037 | 42% | 0.42 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | -18.4 | -179.3 | -58.8 | 172.5 | 0 | 0 | 0 | 113.8 | L308 M343 H344 A347 A382 G384 V388 | L308-L386 HydrophobicContact CD1-CD1 4.4Å; L308-L386 HydrophobicContact CD1-CD2 4.3Å; M343-L386 VanDerWaalsContact C-CD1 3.49Å; M343-L386 HydrophobicContact CB-CD1 3.81Å; M343-L386 HydrophobicContact CB-CD2 3.92Å; M343-L386 HydrophobicContact CE-CD2 3.37Å; M343-L386 HydrophobicContact SD-CD2 4.29Å; H344-L386 HydrophobicContact CB-CD1 4.34Å; H344-L386 VanDerWaalsContact CE1-CB 3.49Å; H344-L386 WeakPolarHBondContact CE1-CB 3.36Å; A347-L386 HydrophobicContact CB-CD1 4.08Å; A382-L386 PolarHBondContact O-N 3.28Å; G384-L386 PolarHBondContact O-N 3.48Å; L386-V388 VanDerWaalsContact C-N 3.34Å |
| 387 | S | 58.8 | Low | 70.8 | Confident | 72 Ų | 72 | 75.4 Ų | 75.4 | 50% | 0.503 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.4 | -14.2 | -179.8 | 70.3 | 0 | 0 | 0 | 0 | 114 | G384 L385 | G384-S387 PolarHBondContact O-N 3.47Å; G384-S387 VanDerWaalsContact O-N 3.13Å; G384-S387 PolarHBondContact O-OG 3.16Å; L385-S387 VanDerWaalsContact C-N 3.31Å; L385-S387 PolarHBondContact O-N 2.9Å |
| 388 | V | 51.2 | Low | 69.3 | Low | 119 Ų | 119 | 74.2 Ų | 74.2 | 72% | 0.721 | 42% | 0.416 | S | S | * | . | S | Bend | trans | -85.2 | -13.8 | -176.4 | -177 | 0 | 0 | 0 | 0 | 112.3 | L386 R390 | L386-V388 VanDerWaalsContact C-N 3.34Å; V388-R390 VanDerWaalsContact C-N 3.35Å; V388-R390 PolarHBondContact O-N 2.68Å |
| 389 | C | 40.4 | Very low | 67.5 | Low | 78 Ų | 78 | 78.9 Ų | 78.9 | 53% | 0.527 | 44% | 0.436 | S | S | . | . | trans | -92.4 | 35 | -179.3 | -61.8 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 390 | R | 32.5 | Very low | 65.3 | Low | 300 Ų | 300 | 85.7 Ų | 85.7 | 100% | 1.132 | 47% | 0.474 | S | S | * | . | trans | -99.3 | 0 | 177.7 | -88.4 | -168.9 | 179.5 | -174.2 | 1.3 | 113.6 | V388 | V388-R390 VanDerWaalsContact C-N 3.35Å; V388-R390 PolarHBondContact O-N 2.68Å |
Retrieved 390 of 390 residues in 935.3 ms
(Link to these results)