| 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 | 32.9 | Very low | 31.4 | Very low | 228 Ų | 228 | 138.4 Ų | 138.4 | 100% | 1.123 | 83% | 0.825 | S | S | * | * | 0 | 106.4 | 0 | -88.7 | 172.2 | 167.6 | 0 | 0 | 107.1 | |||||
| 2 | Q | 32.5 | Very low | 32.4 | Very low | 174 Ų | 174 | 139 Ų | 139 | 81% | 0.813 | 82% | 0.822 | S | S | * | * | cis | -153.2 | 156.8 | 5.3 | -154 | 156.3 | 1.4 | 0 | 0 | 110.4 | ||||
| 3 | D | 28.1 | Very low | 32.7 | Very low | 159 Ų | 159 | 138.5 Ų | 138.5 | 85% | 0.85 | 81% | 0.813 | S | S | * | * | trans | -85.5 | 167.9 | -160.8 | -42.3 | -84.3 | 0 | 0 | 0 | 113.9 | ||||
| 4 | G | 33.9 | Very low | 33.3 | Very low | 77 Ų | 77 | 139.6 Ų | 139.6 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | trans | -176.8 | 67.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 5 | E | 31.6 | Very low | 33.7 | Very low | 182 Ų | 182 | 141.5 Ų | 141.5 | 85% | 0.85 | 81% | 0.812 | S | S | * | * | trans | -70.7 | 165.7 | 169.4 | -119.3 | 79.7 | 106.8 | 0 | 0 | 112.5 | ||||
| 6 | C | 29.9 | Very low | 34.3 | Very low | 114 Ų | 114 | 141.3 Ų | 141.3 | 77% | 0.77 | 80% | 0.801 | S | S | * | * | cis | -135.8 | 152.6 | 7 | -22.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 7 | D | 29.9 | Very low | 34.8 | Very low | 156 Ų | 156 | 137.7 Ų | 137.7 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | 78.1 | 139.3 | 78.2 | -161.5 | 27.2 | 0 | 0 | 0 | 117.1 | |||||
| 8 | G | 30.3 | Very low | 35.3 | Very low | 74 Ų | 74 | 135.3 Ų | 135.3 | 76% | 0.763 | 78% | 0.78 | S | S | * | * | trans | 142.3 | 93.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 9 | T | 29 | Very low | 36 | Very low | 125 Ų | 125 | 139.1 Ų | 139.1 | 77% | 0.767 | 78% | 0.78 | S | S | * | * | trans | -102.1 | 174.1 | -166.3 | 36.6 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 10 | S | 31.7 | Very low | 36.7 | Very low | 108 Ų | 108 | 136.5 Ų | 136.5 | 76% | 0.755 | 77% | 0.768 | S | S | * | * | trans | 72.9 | 119.7 | 176.1 | 71.9 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 11 | V | 36 | Very low | 37.4 | Very low | 125 Ų | 125 | 136.3 Ų | 136.3 | 76% | 0.758 | 76% | 0.762 | S | S | * | * | cis | 68.8 | 134 | 10.6 | -160.2 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 12 | D | 42.7 | Very low | 38.1 | Very low | 146 Ų | 146 | 132.3 Ų | 132.3 | 78% | 0.781 | 74% | 0.743 | S | S | * | * | trans | 71.9 | 79.5 | 174.7 | -61.1 | -40.8 | 0 | 0 | 0 | 118.7 | ||||
| 13 | N | 36.7 | Very low | 38.7 | Very low | 133 Ų | 133 | 130.6 Ų | 130.6 | 71% | 0.711 | 73% | 0.734 | S | S | * | * | trans | -152 | -18.8 | 153.6 | -121.3 | -20.6 | 0 | 0 | 0 | 116.3 | Q15 E16 | N13-Q15 VanDerWaalsContact C-N 3.25Å; N13-Q15 PolarHBondContact O-N 3.29Å; N13-E16 PolarHBondContact O-N 3.02Å | ||
| 14 | D | 40.8 | Very low | 39.4 | Very low | 153 Ų | 153 | 130.1 Ų | 130.1 | 82% | 0.818 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | -13.1 | -177.2 | -70.3 | -49.4 | 0 | 0 | 0 | 114.9 | ||
| 15 | Q | 40.3 | Very low | 39.9 | Very low | 168 Ų | 168 | 133.6 Ų | 133.6 | 79% | 0.785 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -20.2 | -179.5 | -152 | 76.7 | 12 | 0 | 0 | 113.5 | N13 | N13-Q15 VanDerWaalsContact C-N 3.25Å; N13-Q15 PolarHBondContact O-N 3.29Å |
| 16 | E | 43.3 | Very low | 40.6 | Very low | 139 Ų | 139 | 131.3 Ų | 131.3 | 65% | 0.65 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.5 | -32.6 | -173.5 | -164.9 | 148.5 | 132.6 | 0 | 0 | 112.8 | N13 S18 R19 | N13-E16 PolarHBondContact O-N 3.02Å; E16-S18 VanDerWaalsContact C-N 3.29Å; E16-S18 PolarHBondContact O-N 3.4Å; E16-R19 PolarHBondContact O-N 3.42Å; E16-R19 VanDerWaalsContact O-N 3.08Å |
| 17 | S | 41.8 | Very low | 40.8 | Very low | 80 Ų | 80 | 132.7 Ų | 132.7 | 56% | 0.559 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -57 | -36.7 | -178.2 | -169.5 | 0 | 0 | 0 | 0 | 113.6 | R19 V20 | S17-R19 VanDerWaalsContact C-N 3.33Å; S17-R19 PolarHBondContact O-N 3.48Å; S17-V20 PolarHBondContact O-N 3.44Å |
| 18 | S | 44.5 | Very low | 41 | Very low | 95 Ų | 95 | 130.4 Ų | 130.4 | 66% | 0.664 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -72.3 | -19 | 179.9 | -70.3 | 0 | 0 | 0 | 0 | 114.5 | E16 | E16-S18 VanDerWaalsContact C-N 3.29Å; E16-S18 PolarHBondContact O-N 3.4Å |
| 19 | R | 48.3 | Very low | 41.5 | Very low | 206 Ų | 206 | 135.6 Ų | 135.6 | 78% | 0.777 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -83.1 | -27.5 | 177.2 | -71 | -175.6 | 175.7 | 177.8 | 0.5 | 112.7 | E16 S17 | E16-R19 PolarHBondContact O-N 3.42Å; E16-R19 VanDerWaalsContact O-N 3.08Å; S17-R19 VanDerWaalsContact C-N 3.33Å; S17-R19 PolarHBondContact O-N 3.48Å |
| 20 | V | 50.3 | Low | 41.7 | Very low | 87 Ų | 87 | 140.1 Ų | 140.1 | 53% | 0.527 | 72% | 0.72 | S | S | . | * | H | α-helix | trans | -72.6 | -38.2 | -177.9 | -178.3 | 0 | 0 | 0 | 0 | 111.9 | S17 M22 Q23 | S17-V20 PolarHBondContact O-N 3.44Å; V20-M22 PolarHBondContact O-N 3.48Å; V20-Q23 PolarHBondContact O-N 3.43Å |
| 21 | M | 50.2 | Low | 41.6 | Very low | 134 Ų | 134 | 141.4 Ų | 141.4 | 66% | 0.66 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -69.3 | -30.4 | -179.6 | -77.1 | -167.6 | 172 | 0 | 0 | 114.5 | ||
| 22 | M | 47.6 | Very low | 41.5 | Very low | 144 Ų | 144 | 139.9 Ų | 139.9 | 71% | 0.709 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -73.1 | -32.4 | 176.6 | -97.4 | -172.5 | 176.4 | 0 | 0 | 112.8 | V20 Q24 M25 | V20-M22 PolarHBondContact O-N 3.48Å; M22-Q24 VanDerWaalsContact C-N 3.28Å; M22-Q24 PolarHBondContact O-N 3.31Å; M22-M25 PolarHBondContact O-N 3.4Å |
| 23 | Q | 45.2 | Very low | 41.1 | Very low | 137 Ų | 137 | 142.3 Ų | 142.3 | 64% | 0.64 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -69.6 | -26.5 | 179 | -162.9 | 61.4 | 54.3 | 0 | 0 | 112.4 | V20 M25 | V20-Q23 PolarHBondContact O-N 3.43Å; Q23-M25 VanDerWaalsContact C-N 3.33Å; Q23-M25 PolarHBondContact O-N 2.93Å |
| 24 | Q | 43.6 | Very low | 40.9 | Very low | 150 Ų | 150 | 146.9 Ų | 146.9 | 70% | 0.701 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -12.9 | 176.4 | -73.9 | -174.3 | -42 | 0 | 0 | 114.6 | M22 | M22-Q24 VanDerWaalsContact C-N 3.28Å; M22-Q24 PolarHBondContact O-N 3.31Å |
| 25 | M | 43.8 | Very low | 40.3 | Very low | 150 Ų | 150 | 150.7 Ų | 150.7 | 74% | 0.739 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.3 | 0.8 | -178.8 | -75 | -162.5 | -79.5 | 0 | 0 | 115.1 | M22 Q23 | M22-M25 PolarHBondContact O-N 3.4Å; Q23-M25 VanDerWaalsContact C-N 3.33Å; Q23-M25 PolarHBondContact O-N 2.93Å |
| 26 | I | 46.2 | Very low | 39.8 | Very low | 133 Ų | 133 | 148.7 Ų | 148.7 | 68% | 0.682 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -103.1 | -19.2 | -177.6 | -66.1 | -179.9 | 0 | 0 | 0 | 113.5 | ||
| 27 | D | 34.8 | Very low | 39.4 | Very low | 143 Ų | 143 | 148 Ų | 148 | 77% | 0.765 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -93.5 | 5.8 | -178.4 | -113.3 | -23.4 | 0 | 0 | 0 | 114.8 | Q29 | D27-Q29 VanDerWaalsContact C-N 3.28Å; D27-Q29 PolarHBondContact O-N 3.37Å |
| 28 | S | 35 | Very low | 39 | Very low | 108 Ų | 108 | 152.5 Ų | 152.5 | 76% | 0.755 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -81.3 | 5.5 | -175.5 | -150 | 0 | 0 | 0 | 0 | 115.1 | ||
| 29 | Q | 39.5 | Very low | 38.2 | Very low | 184 Ų | 184 | 154.5 Ų | 154.5 | 86% | 0.86 | 76% | 0.762 | S | S | * | * | trans | -136.8 | 72.9 | -179.1 | -75.9 | -169.4 | -36.6 | 0 | 0 | 114.1 | D27 | D27-Q29 VanDerWaalsContact C-N 3.28Å; D27-Q29 PolarHBondContact O-N 3.37Å | ||
| 30 | R | 32.8 | Very low | 37.5 | Very low | 219 Ų | 219 | 151.9 Ų | 151.9 | 83% | 0.826 | 76% | 0.763 | S | S | * | * | trans | -151.5 | 103.1 | 158.1 | -101 | -174.9 | -149.2 | -166.3 | 8.2 | 113.2 | S32 | R30-S32 PolarHBondContact O-N 3.45Š| ||
| 31 | P | 31.3 | Very low | 36.7 | Very low | 136 Ų | 136 | 153.6 Ų | 153.6 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | trans | -76.6 | 88 | 165.6 | 31 | -31.5 | 0 | 0 | 0 | 109.7 | Q33 | P31-Q33 PolarHBondContact O-N 3.08Š| ||
| 32 | S | 32.9 | Very low | 36 | Very low | 93 Ų | 93 | 151.3 Ų | 151.3 | 65% | 0.65 | 78% | 0.776 | S | S | * | * | trans | -86.6 | 107.1 | 176.2 | 68.2 | 0 | 0 | 0 | 0 | 111.6 | R30 R34 | R30-S32 PolarHBondContact O-N 3.45Å; S32-R34 PolarHBondContact O-N 3.21Å | ||
| 33 | Q | 33.3 | Very low | 35.3 | Very low | 197 Ų | 197 | 151.6 Ų | 151.6 | 92% | 0.921 | 78% | 0.78 | S | S | * | * | trans | -73.2 | 83.5 | -175.7 | -166.7 | 179.7 | 38.2 | 0 | 0 | 111.6 | P31 | P31-Q33 PolarHBondContact O-N 3.08Š| ||
| 34 | R | 32.8 | Very low | 34.8 | Very low | 229 Ų | 229 | 156.3 Ų | 156.3 | 86% | 0.864 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -102.4 | 119.4 | 168.8 | -70.6 | -170 | -177.4 | -174.7 | 3.5 | 110.7 | S32 | S32-R34 PolarHBondContact O-N 3.21Š|
| 35 | R | 28.7 | Very low | 34.4 | Very low | 232 Ų | 232 | 152 Ų | 152 | 88% | 0.875 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -62 | 135.9 | 173.4 | -56.2 | 175.5 | -166.8 | 168.7 | 4 | 109.1 | V37 | R35-V37 PolarHBondContact O-N 3.19Š|
| 36 | P | 30.8 | Very low | 34.1 | Very low | 126 Ų | 126 | 152.4 Ų | 152.4 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 119.7 | 168.2 | 27.7 | -31.6 | 0 | 0 | 0 | 108.8 | M38 | P36-M38 PolarHBondContact O-N 3.23Š|
| 37 | V | 34.6 | Very low | 34 | Very low | 124 Ų | 124 | 153.5 Ų | 153.5 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | trans | -66.6 | 114.4 | 167.6 | 172 | 0 | 0 | 0 | 0 | 106.5 | R35 N39 | R35-V37 PolarHBondContact O-N 3.19Å; V37-N39 PolarHBondContact O-N 3.48Å | ||
| 38 | M | 32.3 | Very low | 34.2 | Very low | 175 Ų | 175 | 155.2 Ų | 155.2 | 86% | 0.862 | 80% | 0.795 | S | S | * | * | trans | -72.2 | 94.6 | 179.3 | -161.2 | 174.5 | -152.5 | 0 | 0 | 108.4 | P36 L40 | P36-M38 PolarHBondContact O-N 3.23Å; M38-L40 PolarHBondContact O-N 2.95Å | ||
| 39 | N | 28.8 | Very low | 35 | Very low | 137 Ų | 137 | 155 Ų | 155 | 73% | 0.733 | 79% | 0.79 | S | S | * | * | trans | -65.4 | 89.6 | 169.7 | -82.3 | -11 | 0 | 0 | 0 | 108.4 | V37 T41 | V37-N39 PolarHBondContact O-N 3.48Å; N39-T41 PolarHBondContact O-N 3.23Å | ||
| 40 | L | 33.2 | Very low | 35.4 | Very low | 151 Ų | 151 | 148.8 Ų | 148.8 | 79% | 0.791 | 77% | 0.766 | S | S | * | * | trans | -70.9 | 78.6 | 171 | -169 | 73.7 | 0 | 0 | 0 | 108.3 | M38 A42 | M38-L40 PolarHBondContact O-N 2.95Å; L40-A42 PolarHBondContact O-N 2.83Å | ||
| 41 | T | 34.2 | Very low | 36.6 | Very low | 123 Ų | 123 | 142.4 Ų | 142.4 | 76% | 0.755 | 75% | 0.752 | S | S | * | * | trans | -59.3 | 103.7 | 164.5 | 47.6 | 0 | 0 | 0 | 0 | 107 | N39 D43 | N39-T41 PolarHBondContact O-N 3.23Å; T41-D43 PolarHBondContact O-N 2.83Å | ||
| 42 | A | 34.6 | Very low | 37.8 | Very low | 86 Ų | 86 | 145 Ų | 145 | 71% | 0.711 | 75% | 0.745 | S | S | * | * | trans | -58.7 | 107.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | L40 R44 | L40-A42 PolarHBondContact O-N 2.83Å; A42-R44 PolarHBondContact O-N 2.94Å | ||
| 43 | D | 32.3 | Very low | 39.2 | Very low | 151 Ų | 151 | 145.7 Ų | 145.7 | 81% | 0.807 | 74% | 0.741 | S | S | * | * | trans | -65 | 91.2 | 168.5 | -178.4 | 24 | 0 | 0 | 0 | 107.4 | T41 G45 | T41-D43 PolarHBondContact O-N 2.83Å; D43-G45 PolarHBondContact O-N 2.93Å | ||
| 44 | R | 36.3 | Very low | 40.6 | Very low | 235 Ų | 235 | 138.9 Ų | 138.9 | 89% | 0.887 | 71% | 0.713 | S | S | * | * | trans | -76.3 | 79.9 | 179.3 | -151.3 | -178.8 | -164.9 | -176.1 | 4.1 | 105.9 | A42 Q46 | A42-R44 PolarHBondContact O-N 2.94Å; R44-Q46 PolarHBondContact O-N 3.22Å | ||
| 45 | G | 35 | Very low | 42.3 | Very low | 60 Ų | 60 | 131.8 Ų | 131.8 | 62% | 0.619 | 70% | 0.696 | S | S | * | * | trans | -37.6 | 108.7 | -164.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | D43 L47 | D43-G45 PolarHBondContact O-N 2.93Å; G45-L47 PolarHBondContact O-N 3.09Å | ||
| 46 | Q | 35.8 | Very low | 44 | Very low | 159 Ų | 159 | 124.5 Ų | 124.5 | 74% | 0.743 | 68% | 0.68 | S | S | * | * | trans | -61.8 | 109.7 | 174.7 | -85.7 | -160.8 | -0.7 | 0 | 0 | 108.2 | R44 K48 | R44-Q46 PolarHBondContact O-N 3.22Å; Q46-K48 HydrophobicContact CB-CG 4.5Å; Q46-K48 PolarHBondContact O-N 2.84Å | ||
| 47 | L | 45.7 | Very low | 46 | Very low | 155 Ų | 155 | 123.3 Ų | 123.3 | 81% | 0.812 | 66% | 0.662 | S | S | * | * | trans | -66.4 | 86 | 163.2 | -167.8 | 75.6 | 0 | 0 | 0 | 107.5 | G45 T49 | G45-L47 PolarHBondContact O-N 3.09Å; L47-T49 PolarHBondContact O-N 2.98Å; L47-T49 PolarHBondContact O-OG1 2.8Å | ||
| 48 | K | 37.9 | Very low | 48 | Very low | 180 Ų | 180 | 120.7 Ų | 120.7 | 78% | 0.783 | 64% | 0.643 | S | S | * | * | trans | -62.7 | 81.5 | 174.3 | -75.1 | -173.6 | 178.4 | 179.3 | 0 | 109 | Q46 S50 | Q46-K48 HydrophobicContact CB-CG 4.5Å; Q46-K48 PolarHBondContact O-N 2.84Å; K48-S50 VanDerWaalsContact C-N 3.35Å; K48-S50 PolarHBondContact O-N 3.16Å | ||
| 49 | T | 52 | Low | 50.3 | Low | 104 Ų | 104 | 119 Ų | 119 | 64% | 0.638 | 63% | 0.631 | S | S | * | * | trans | -71.5 | 95.5 | 175.7 | -44.5 | 0 | 0 | 0 | 0 | 106.3 | L47 T51 | L47-T49 PolarHBondContact O-N 2.98Å; L47-T49 PolarHBondContact O-OG1 2.8Å; T49-T51 PolarHBondContact O-N 2.79Å | ||
| 50 | S | 48.8 | Very low | 52.9 | Low | 52 Ų | 52 | 115.9 Ų | 115.9 | 36% | 0.364 | 62% | 0.617 | S | S | . | * | trans | -57 | 127.3 | -167.2 | 171.3 | 0 | 0 | 0 | 0 | 112 | K48 Y52 I53 | K48-S50 VanDerWaalsContact C-N 3.35Å; K48-S50 PolarHBondContact O-N 3.16Å; S50-Y52 PolarHBondContact O-N 3Å; S50-I53 PolarHBondContact O-N 2.98Å | ||
| 51 | T | 57.1 | Low | 55.3 | Low | 85 Ų | 85 | 112 Ų | 112 | 52% | 0.521 | 60% | 0.595 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -54 | -27.9 | -176.1 | -44 | 0 | 0 | 0 | 0 | 113.1 | T49 P55 A148 | T49-T51 PolarHBondContact O-N 2.79Å; T51-P55 WeakPolarHBondContact O-CD 3.34Å; T51-A148 HydrophobicContact CG2-CB 4.32Å |
| 52 | Y | 56.3 | Low | 57.8 | Low | 190 Ų | 190 | 111.7 Ų | 111.7 | 75% | 0.745 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -17.2 | -178.8 | -58.7 | -78.1 | 0 | 0 | 0 | 114.5 | S50 C56 | S50-Y52 PolarHBondContact O-N 3Å; Y52-C56 VanDerWaalsContact O-CB 3.23Å; Y52-C56 WeakPolarHBondContact O-CB 3.46Å; Y52-C56 PolarHBondContact O-N 2.96Å |
| 53 | I | 62.8 | Low | 60.5 | Low | 109 Ų | 109 | 111.6 Ų | 111.6 | 56% | 0.559 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -68.7 | -41.3 | -177.9 | -68.8 | 176.7 | 0 | 0 | 0 | 111.1 | S50 C56 F57 | S50-I53 PolarHBondContact O-N 2.98Å; I53-C56 PolarHBondContact O-N 2.9Å; I53-F57 WeakPolarHBondContact O-CB 3.42Å; I53-F57 PolarHBondContact O-N 2.95Å |
| 54 | V | 62.7 | Low | 63.3 | Low | 54 Ų | 54 | 108.4 Ų | 108.4 | 33% | 0.327 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -68.4 | -47.5 | -176.4 | 179 | 0 | 0 | 0 | 0 | 112.4 | C56 F57 L58 | V54-C56 PolarHBondContact O-N 3.04Å; V54-F57 PolarHBondContact O-N 2.79Å; V54-L58 HydrophobicContact CG1-CD1 4.26Å; V54-L58 WeakPolarHBondContact O-CG 3.46Å; V54-L58 PolarHBondContact O-N 3.07Å; V54-L58 VanDerWaalsContact O-N 3.11Å |
| 55 | P | 67.4 | Low | 66 | Low | 80 Ų | 80 | 99 Ų | 99 | 52% | 0.519 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 174.2 | -23.2 | 34.9 | 0 | 0 | 0 | 112.9 | T51 L58 F59 | T51-P55 WeakPolarHBondContact O-CD 3.34Å; P55-L58 PolarHBondContact O-N 3.28Å; P55-F59 WeakPolarHBondContact O-CB 3.43Å; P55-F59 PolarHBondContact O-N 3.15Å |
| 56 | C | 66.4 | Low | 68.7 | Low | 79 Ų | 79 | 99.1 Ų | 99.1 | 53% | 0.534 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.9 | -44.2 | 177.7 | -173.1 | 0 | 0 | 0 | 0 | 111.9 | Y52 I53 V54 F59 V60 | Y52-C56 VanDerWaalsContact O-CB 3.23Å; Y52-C56 WeakPolarHBondContact O-CB 3.46Å; Y52-C56 PolarHBondContact O-N 2.96Å; I53-C56 PolarHBondContact O-N 2.9Å; V54-C56 PolarHBondContact O-N 3.04Å; C56-F59 PolarHBondContact O-N 3.29Å; C56-V60 WeakPolarHBondContact O-CG2 3.12Å; C56-V60 PolarHBondContact O-N 2.73Å |
| 57 | F | 72.1 | Confident | 71.5 | Confident | 101 Ų | 101 | 93.5 Ų | 93.5 | 44% | 0.443 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.5 | -46.7 | 176.9 | -176.4 | -99 | 0 | 0 | 0 | 111.7 | I53 V54 F59 V60 E61 F315 | I53-F57 WeakPolarHBondContact O-CB 3.42Å; I53-F57 PolarHBondContact O-N 2.95Å; V54-F57 PolarHBondContact O-N 2.79Å; F57-F59 VanDerWaalsContact C-N 3.35Å; F57-F59 PolarHBondContact O-N 3.42Å; F57-V60 PolarHBondContact O-N 3.11Å; F57-E61 HydrophobicContact CD1-CG 4.3Å; F57-E61 HydrophobicContact CE1-CG 3.96Å; F57-E61 WeakPolarHBondContact CE1-OE1 3.46Å; F57-E61 WeakPolarHBondContact CE1-OE2 3.42Å; F57-E61 HydrophobicContact CZ-CG 4.18Å; F57-E61 WeakPolarHBondContact CZ-OE1 3.33Å; F57-E61 WeakPolarHBondContact O-CG 3.23Å; F57-E61 PolarHBondContact O-N 3.07Å; F57-F315 HydrophobicContact CZ-CZ 4.22Å |
| 58 | L | 75.9 | Confident | 73.8 | Confident | 68 Ų | 68 | 87.1 Ų | 87.1 | 36% | 0.356 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.7 | -38.2 | 176.5 | -69.7 | 172.3 | 0 | 0 | 0 | 112.7 | V54 P55 E61 L62 | V54-L58 HydrophobicContact CG1-CD1 4.26Å; V54-L58 WeakPolarHBondContact O-CG 3.46Å; V54-L58 PolarHBondContact O-N 3.07Å; V54-L58 VanDerWaalsContact O-N 3.11Å; P55-L58 PolarHBondContact O-N 3.28Å; L58-E61 PolarHBondContact O-N 3.16Å; L58-L62 WeakPolarHBondContact O-CB 3.39Å; L58-L62 VanDerWaalsContact O-CG 3.26Å; L58-L62 WeakPolarHBondContact O-CG 3.33Å; L58-L62 PolarHBondContact O-N 2.81Å |
| 59 | F | 80.3 | Confident | 76.5 | Confident | 139 Ų | 139 | 81.4 Ų | 81.4 | 61% | 0.61 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -63.9 | -43.9 | 175.8 | -177.2 | -97.9 | 0 | 0 | 0 | 111.7 | P55 C56 F57 L62 V63 | P55-F59 WeakPolarHBondContact O-CB 3.43Å; P55-F59 PolarHBondContact O-N 3.15Å; C56-F59 PolarHBondContact O-N 3.29Å; F57-F59 VanDerWaalsContact C-N 3.35Å; F57-F59 PolarHBondContact O-N 3.42Å; F59-L62 PolarHBondContact O-N 3.1Å; F59-V63 HydrophobicContact CD1-CG2 4.26Å; F59-V63 HydrophobicContact CE1-CG2 3.85Å; F59-V63 HydrophobicContact CE2-CG2 4.48Å; F59-V63 HydrophobicContact CZ-CG2 3.97Å; F59-V63 WeakPolarHBondContact O-CG2 3.08Å; F59-V63 PolarHBondContact O-N 3.04Å |
| 60 | V | 83.6 | Confident | 78.5 | Confident | 73 Ų | 73 | 81.1 Ų | 81.1 | 44% | 0.442 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.4 | -44 | 175.7 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | C56 F57 L62 V63 I64 | C56-V60 WeakPolarHBondContact O-CG2 3.12Å; C56-V60 PolarHBondContact O-N 2.73Å; F57-V60 PolarHBondContact O-N 3.11Å; V60-L62 VanDerWaalsContact C-N 3.34Å; V60-L62 PolarHBondContact O-N 2.69Å; V60-V63 PolarHBondContact O-N 2.94Å; V60-I64 HydrophobicContact CG1-CD1 3.85Å; V60-I64 VanDerWaalsContact O-CG1 3.3Å; V60-I64 WeakPolarHBondContact O-CG1 3.45Å; V60-I64 PolarHBondContact O-N 2.98Å |
| 61 | E | 84.3 | Confident | 80.6 | Confident | 68 Ų | 68 | 82.1 Ų | 82.1 | 32% | 0.318 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.3 | -42.5 | 174 | -73.7 | -172.6 | 139.2 | 0 | 0 | 112 | F57 L58 I64 M65 | F57-E61 HydrophobicContact CD1-CG 4.3Å; F57-E61 HydrophobicContact CE1-CG 3.96Å; F57-E61 WeakPolarHBondContact CE1-OE1 3.46Å; F57-E61 WeakPolarHBondContact CE1-OE2 3.42Å; F57-E61 HydrophobicContact CZ-CG 4.18Å; F57-E61 WeakPolarHBondContact CZ-OE1 3.33Å; F57-E61 WeakPolarHBondContact O-CG 3.23Å; F57-E61 PolarHBondContact O-N 3.07Å; L58-E61 PolarHBondContact O-N 3.16Å; E61-I64 PolarHBondContact O-N 3.31Å; E61-M65 WeakPolarHBondContact O-CB 3.06Å; E61-M65 VanDerWaalsContact O-CG 3.29Å; E61-M65 WeakPolarHBondContact O-CG 3.19Å; E61-M65 PolarHBondContact O-N 2.76Å |
| 62 | L | 86.8 | Confident | 82.4 | Confident | 118 Ų | 118 | 78.3 Ų | 78.3 | 62% | 0.618 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -65.3 | -40.3 | 177.4 | -74.5 | 171.8 | 0 | 0 | 0 | 112.8 | L58 F59 V60 M65 A66 | L58-L62 WeakPolarHBondContact O-CB 3.39Å; L58-L62 VanDerWaalsContact O-CG 3.26Å; L58-L62 WeakPolarHBondContact O-CG 3.33Å; L58-L62 PolarHBondContact O-N 2.81Å; F59-L62 PolarHBondContact O-N 3.1Å; V60-L62 VanDerWaalsContact C-N 3.34Å; V60-L62 PolarHBondContact O-N 2.69Å; L62-M65 PolarHBondContact O-N 3.05Å; L62-A66 WeakPolarHBondContact O-CB 3.21Å; L62-A66 PolarHBondContact O-N 3.23Å |
| 63 | V | 91.2 | Very high | 84.1 | Confident | 83 Ų | 83 | 75.3 Ų | 75.3 | 50% | 0.503 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -65.4 | -42.9 | 175.8 | 171.4 | 0 | 0 | 0 | 0 | 111 | F59 V60 A66 G67 | F59-V63 HydrophobicContact CD1-CG2 4.26Å; F59-V63 HydrophobicContact CE1-CG2 3.85Å; F59-V63 HydrophobicContact CE2-CG2 4.48Å; F59-V63 HydrophobicContact CZ-CG2 3.97Å; F59-V63 WeakPolarHBondContact O-CG2 3.08Å; F59-V63 PolarHBondContact O-N 3.04Å; V60-V63 PolarHBondContact O-N 2.94Å; V63-A66 PolarHBondContact O-N 3.48Å; V63-G67 PolarHBondContact O-N 3.12Å |
| 64 | I | 91.2 | Very high | 85.5 | Confident | 85 Ų | 85 | 75 Ų | 75 | 44% | 0.436 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -60.8 | -47.4 | 174.6 | -68.8 | 166.6 | 0 | 0 | 0 | 110.2 | V60 E61 G67 T68 F169 | V60-I64 HydrophobicContact CG1-CD1 3.85Å; V60-I64 VanDerWaalsContact O-CG1 3.3Å; V60-I64 WeakPolarHBondContact O-CG1 3.45Å; V60-I64 PolarHBondContact O-N 2.98Å; E61-I64 PolarHBondContact O-N 3.31Å; I64-G67 PolarHBondContact O-N 3.14Å; I64-T68 PolarHBondContact O-N 2.93Å; I64-T68 PolarHBondContact O-OG1 3.35Å; I64-F169 HydrophobicContact CG2-CD2 4.2Å; I64-F169 HydrophobicContact CG2-CE2 3.71Å |
| 65 | M | 91.9 | Very high | 86.8 | Confident | 38 Ų | 38 | 73.9 Ų | 73.9 | 19% | 0.187 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -58.1 | -50.4 | 177 | -78.5 | -60 | -56 | 0 | 0 | 111.8 | E61 L62 G67 T68 V69 F169 F172 | E61-M65 WeakPolarHBondContact O-CB 3.06Å; E61-M65 VanDerWaalsContact O-CG 3.29Å; E61-M65 WeakPolarHBondContact O-CG 3.19Å; E61-M65 PolarHBondContact O-N 2.76Å; L62-M65 PolarHBondContact O-N 3.05Å; M65-G67 VanDerWaalsContact C-N 3.31Å; M65-G67 PolarHBondContact O-N 3.37Å; M65-T68 PolarHBondContact O-N 3.41Å; M65-T68 VanDerWaalsContact O-N 3.15Å; M65-T68 PolarHBondContact O-OG1 3.08Å; M65-V69 WeakPolarHBondContact O-CG2 3.29Å; M65-V69 PolarHBondContact O-N 3.32Å; M65-F169 VanDerWaalsContact SD-CA 3.58Å; M65-F169 HydrophobicContact SD-CB 3.55Å; M65-F169 VanDerWaalsContact SD-CB 3.55Å; M65-F169 HydrophobicContact SD-CD2 3.98Å; M65-F169 HydrophobicContact SD-CG 4.28Å; M65-F172 HydrophobicContact CE-CD2 4.06Å; M65-F172 HydrophobicContact CE-CE2 4.35Å |
| 66 | A | 93 | Very high | 87.7 | Confident | 62 Ų | 62 | 72.9 Ų | 72.9 | 51% | 0.512 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -58.4 | -42.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | L62 V63 V69 L70 | L62-A66 WeakPolarHBondContact O-CB 3.21Å; L62-A66 PolarHBondContact O-N 3.23Å; V63-A66 PolarHBondContact O-N 3.48Å; A66-V69 PolarHBondContact O-N 3.45Å; A66-L70 WeakPolarHBondContact O-CB 3.5Å; A66-L70 PolarHBondContact O-N 3.46Å |
| 67 | G | 94.2 | Very high | 88.6 | Confident | 40 Ų | 40 | 76.9 Ų | 76.9 | 41% | 0.412 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | V63 I64 M65 L70 L71 | V63-G67 PolarHBondContact O-N 3.12Å; I64-G67 PolarHBondContact O-N 3.14Å; M65-G67 VanDerWaalsContact C-N 3.31Å; M65-G67 PolarHBondContact O-N 3.37Å; G67-L70 PolarHBondContact O-N 2.94Å; G67-L71 WeakPolarHBondContact O-CB 3.37Å; G67-L71 PolarHBondContact O-N 2.73Å |
| 68 | T | 94.4 | Very high | 89.3 | Confident | 21 Ų | 21 | 73.9 Ų | 73.9 | 13% | 0.129 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -67.4 | -37.9 | 176.7 | 55.8 | 0 | 0 | 0 | 0 | 113.3 | I64 M65 L71 A72 F169 | I64-T68 PolarHBondContact O-N 2.93Å; I64-T68 PolarHBondContact O-OG1 3.35Å; M65-T68 PolarHBondContact O-N 3.41Å; M65-T68 VanDerWaalsContact O-N 3.15Å; M65-T68 PolarHBondContact O-OG1 3.08Å; T68-L71 PolarHBondContact O-N 3.17Å; T68-A72 VanDerWaalsContact O-CB 3.31Å; T68-A72 WeakPolarHBondContact O-CB 2.93Å; T68-A72 PolarHBondContact O-N 2.99Å; T68-F169 HydrophobicContact CG2-CD2 4.14Å; T68-F169 HydrophobicContact CG2-CE2 3.74Å |
| 69 | V | 94.5 | Very high | 89.4 | Confident | 61 Ų | 61 | 77.4 Ų | 77.4 | 37% | 0.37 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.1 | -45.8 | 176 | 171.7 | 0 | 0 | 0 | 0 | 110.3 | M65 A66 A72 Y73 F172 | M65-V69 WeakPolarHBondContact O-CG2 3.29Å; M65-V69 PolarHBondContact O-N 3.32Å; A66-V69 PolarHBondContact O-N 3.45Å; V69-A72 PolarHBondContact O-N 3.04Å; V69-Y73 WeakPolarHBondContact O-CB 3.4Å; V69-Y73 PolarHBondContact O-N 2.67Å; V69-F172 HydrophobicContact CG2-CD1 4.27Å; V69-F172 HydrophobicContact CG2-CD2 3.74Å; V69-F172 HydrophobicContact CG2-CE1 4.07Å; V69-F172 HydrophobicContact CG2-CE2 3.54Å; V69-F172 HydrophobicContact CG2-CG 4.14Å; V69-F172 HydrophobicContact CG2-CZ 3.73Å |
| 70 | L | 94.2 | Very high | 89.4 | Confident | 97 Ų | 97 | 74.5 Ų | 74.5 | 51% | 0.508 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.6 | -44.6 | 178.3 | -176.1 | 62.1 | 0 | 0 | 0 | 111.6 | A66 G67 Y73 Y74 | A66-L70 WeakPolarHBondContact O-CB 3.5Å; A66-L70 PolarHBondContact O-N 3.46Å; G67-L70 PolarHBondContact O-N 2.94Å; L70-Y73 WeakPolarHBondContact O-CB 3.46Å; L70-Y73 PolarHBondContact O-N 2.81Å; L70-Y74 HydrophobicContact CD1-CD2 4.07Å; L70-Y74 HydrophobicContact CD1-CE2 3.58Å; L70-Y74 HydrophobicContact CD2-CE2 4.28Å; L70-Y74 HydrophobicContact CG-CD2 3.99Å; L70-Y74 HydrophobicContact CG-CE2 3.7Å; L70-Y74 WeakPolarHBondContact O-CD2 3.38Å; L70-Y74 PolarHBondContact O-N 3.26Å |
| 71 | L | 93.3 | Very high | 89.4 | Confident | 73 Ų | 73 | 75.3 Ų | 75.3 | 38% | 0.382 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.4 | -41.5 | 177.2 | -176.1 | 58.2 | 0 | 0 | 0 | 112.1 | G67 T68 Y73 Y74 F75 I176 | G67-L71 WeakPolarHBondContact O-CB 3.37Å; G67-L71 PolarHBondContact O-N 2.73Å; T68-L71 PolarHBondContact O-N 3.17Å; L71-Y73 VanDerWaalsContact C-N 3.33Å; L71-Y73 PolarHBondContact O-N 2.99Å; L71-Y74 PolarHBondContact O-N 3.32Å; L71-F75 HydrophobicContact CD1-CD2 3.92Å; L71-F75 HydrophobicContact CD1-CE2 3.68Å; L71-F75 HydrophobicContact CG-CD2 4.02Å; L71-F75 HydrophobicContact CG-CE2 3.98Å; L71-F75 WeakPolarHBondContact O-CD2 3.35Å; L71-F75 PolarHBondContact O-N 3.18Å; L71-F75 VanDerWaalsContact O-N 3.08Å; L71-I176 HydrophobicContact CB-CD1 4.17Å; L71-I176 HydrophobicContact CD2-CD1 4.08Å; L71-I176 HydrophobicContact CD2-CG2 4.27Å; L71-I176 HydrophobicContact CG-CD1 4.13Å; L71-I176 HydrophobicContact CG-CG1 4.31Å |
| 72 | A | 93.1 | Very high | 89.5 | Confident | 5 Ų | 5 | 77.4 Ų | 77.4 | 4% | 0.041 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -62 | -40.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | T68 V69 F75 E76 F172 T175 I176 | T68-A72 VanDerWaalsContact O-CB 3.31Å; T68-A72 WeakPolarHBondContact O-CB 2.93Å; T68-A72 PolarHBondContact O-N 2.99Å; V69-A72 PolarHBondContact O-N 3.04Å; A72-F75 PolarHBondContact O-N 3.22Å; A72-E76 WeakPolarHBondContact O-CB 3.4Å; A72-E76 PolarHBondContact O-N 2.84Å; A72-F172 HydrophobicContact CB-CD1 3.88Å; A72-T175 HydrophobicContact CB-CG2 4.37Å; A72-I176 HydrophobicContact CB-CD1 4.31Å; A72-I176 HydrophobicContact CB-CG1 3.9Å |
| 73 | Y | 92.9 | Very high | 89.7 | Confident | 127 Ų | 127 | 72.9 Ų | 72.9 | 50% | 0.498 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.9 | -46.9 | 175.2 | 174.1 | -92 | 0 | 0 | 0 | 112.2 | V69 L70 L71 F75 E76 Y77 T78 | V69-Y73 WeakPolarHBondContact O-CB 3.4Å; V69-Y73 PolarHBondContact O-N 2.67Å; L70-Y73 WeakPolarHBondContact O-CB 3.46Å; L70-Y73 PolarHBondContact O-N 2.81Å; L71-Y73 VanDerWaalsContact C-N 3.33Å; L71-Y73 PolarHBondContact O-N 2.99Å; Y73-F75 PolarHBondContact O-N 2.93Å; Y73-E76 PolarHBondContact O-N 3.28Å; Y73-Y77 AromaticContact CD2-CD2 3.4Å; Y73-Y77 HydrophobicContact CD2-CD2 3.4Å; Y73-Y77 VanDerWaalsContact CD2-CD2 3.4Å; Y73-Y77 HydrophobicContact CD2-CE2 4.09Å; Y73-Y77 HydrophobicContact CD2-CG 4.18Å; Y73-Y77 AromaticContact CE2-CD2 3.63Å; Y73-Y77 HydrophobicContact CE2-CD2 3.63Å; Y73-Y77 HydrophobicContact CE2-CE2 4.43Å; Y73-Y77 AromaticContact CE2-CG 3.98Å; Y73-Y77 HydrophobicContact CE2-CG 3.98Å; Y73-Y77 HydrophobicContact CG-CD2 4.21Å; Y73-Y77 PolarHBondContact O-N 3.11Å; Y73-T78 HydrophobicContact CE1-CG2 4.21Å |
| 74 | Y | 91.7 | Very high | 89.6 | Confident | 102 Ų | 102 | 74 Ų | 74 | 40% | 0.4 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.2 | -44.9 | 175.7 | -82.1 | -71.1 | 0 | 0 | 0 | 111.8 | L70 L71 E76 T78 | L70-Y74 HydrophobicContact CD1-CD2 4.07Å; L70-Y74 HydrophobicContact CD1-CE2 3.58Å; L70-Y74 HydrophobicContact CD2-CE2 4.28Å; L70-Y74 HydrophobicContact CG-CD2 3.99Å; L70-Y74 HydrophobicContact CG-CE2 3.7Å; L70-Y74 WeakPolarHBondContact O-CD2 3.38Å; L70-Y74 PolarHBondContact O-N 3.26Å; L71-Y74 PolarHBondContact O-N 3.32Å; Y74-E76 VanDerWaalsContact C-N 3.33Å; Y74-E76 PolarHBondContact O-N 3.43Å; Y74-T78 WeakPolarHBondContact CA-OG1 3.12Å; Y74-T78 HydrophobicContact CD1-CG2 3.81Å; Y74-T78 WeakPolarHBondContact CD1-OG1 3.13Å; Y74-T78 HydrophobicContact CE1-CG2 4.33Å; Y74-T78 PolarHBondContact O-N 3.49Å; Y74-T78 PolarHBondContact O-OG1 3.43Å |
| 75 | F | 90 | Very high | 89.6 | Confident | 31 Ų | 31 | 73.7 Ų | 73.7 | 14% | 0.136 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -66.5 | -28.4 | 177.8 | -88.6 | -62.8 | 0 | 0 | 0 | 114.8 | L71 A72 Y73 F81 I176 N179 A180 | L71-F75 HydrophobicContact CD1-CD2 3.92Å; L71-F75 HydrophobicContact CD1-CE2 3.68Å; L71-F75 HydrophobicContact CG-CD2 4.02Å; L71-F75 HydrophobicContact CG-CE2 3.98Å; L71-F75 WeakPolarHBondContact O-CD2 3.35Å; L71-F75 PolarHBondContact O-N 3.18Å; L71-F75 VanDerWaalsContact O-N 3.08Å; A72-F75 PolarHBondContact O-N 3.22Å; Y73-F75 PolarHBondContact O-N 2.93Å; F75-F81 AromaticContact CD1-CD2 3.73Å; F75-F81 HydrophobicContact CD1-CD2 3.73Å; F75-F81 HydrophobicContact CD1-CE2 4.2Å; F75-F81 HydrophobicContact CE1-CB 4.42Å; F75-F81 AromaticContact CE1-CD2 3.47Å; F75-F81 HydrophobicContact CE1-CD2 3.47Å; F75-F81 VanDerWaalsContact CE1-CD2 3.47Å; F75-F81 AromaticContact CE1-CE2 3.84Å; F75-F81 HydrophobicContact CE1-CE2 3.84Å; F75-F81 AromaticContact CE1-CG 3.99Å; F75-F81 HydrophobicContact CE1-CG 3.99Å; F75-F81 HydrophobicContact CE2-CE2 4.26Å; F75-F81 HydrophobicContact CG-CD2 4.42Å; F75-F81 AromaticContact CZ-CD2 4Å; F75-F81 HydrophobicContact CZ-CD2 4Å; F75-F81 AromaticContact CZ-CE2 3.87Å; F75-F81 HydrophobicContact CZ-CE2 3.87Å; F75-F81 HydrophobicContact CZ-CZ 4.38Å; F75-I176 HydrophobicContact CD2-CG2 4.11Å; F75-I176 HydrophobicContact CE2-CG2 3.98Å; F75-N179 HydrophobicContact CB-CB 3.77Å; F75-N179 HydrophobicContact CD1-CB 4.35Å; F75-N179 HydrophobicContact CG-CB 4.25Å; F75-A180 HydrophobicContact CE1-CB 4.1Å; F75-A180 HydrophobicContact CZ-CB 4.03Å |
| 76 | E | 87.4 | Confident | 89.4 | Confident | 59 Ų | 59 | 74.6 Ų | 74.6 | 28% | 0.276 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -88.2 | -45.5 | -177.3 | -169.2 | 73 | -156.7 | 0 | 0 | 112.6 | A72 Y73 Y74 N179 K235 | A72-E76 WeakPolarHBondContact O-CB 3.4Å; A72-E76 PolarHBondContact O-N 2.84Å; Y73-E76 PolarHBondContact O-N 3.28Å; Y74-E76 VanDerWaalsContact C-N 3.33Å; Y74-E76 PolarHBondContact O-N 3.43Å; E76-N179 PolarHBondContact OE2-ND2 3.46Å; E76-N179 PolarHBondContact OE2-OD1 3.27Å; E76-K235 IonicContact OE1-NZ 3.73Å; E76-K235 PolarHBondContact OE1-NZ 3.3Å; E76-K235 IonicContact OE2-NZ 3.93Å; E76-K235 PolarHBondContact OE2-NZ 3.42Å |
| 77 | Y | 85.8 | Confident | 89.3 | Confident | 163 Ų | 163 | 72.1 Ų | 72.1 | 64% | 0.639 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -114.2 | -2.1 | -164.4 | -64.5 | -72.5 | 0 | 0 | 0 | 115.1 | Y73 | Y73-Y77 AromaticContact CD2-CD2 3.4Å; Y73-Y77 HydrophobicContact CD2-CD2 3.4Å; Y73-Y77 VanDerWaalsContact CD2-CD2 3.4Å; Y73-Y77 HydrophobicContact CD2-CE2 4.09Å; Y73-Y77 HydrophobicContact CD2-CG 4.18Å; Y73-Y77 AromaticContact CE2-CD2 3.63Å; Y73-Y77 HydrophobicContact CE2-CD2 3.63Å; Y73-Y77 HydrophobicContact CE2-CE2 4.43Å; Y73-Y77 AromaticContact CE2-CG 3.98Å; Y73-Y77 HydrophobicContact CE2-CG 3.98Å; Y73-Y77 HydrophobicContact CG-CD2 4.21Å; Y73-Y77 PolarHBondContact O-N 3.11Å |
| 78 | T | 85.1 | Confident | 89.2 | Confident | 38 Ų | 38 | 70.4 Ų | 70.4 | 23% | 0.233 | 35% | 0.352 | C | S | . | . | trans | -126.9 | 143.8 | -178.9 | 75.5 | 0 | 0 | 0 | 0 | 111.9 | Y73 Y74 T80 | Y73-T78 HydrophobicContact CE1-CG2 4.21Å; Y74-T78 WeakPolarHBondContact CA-OG1 3.12Å; Y74-T78 HydrophobicContact CD1-CG2 3.81Å; Y74-T78 WeakPolarHBondContact CD1-OG1 3.13Å; Y74-T78 HydrophobicContact CE1-CG2 4.33Å; Y74-T78 PolarHBondContact O-N 3.49Å; Y74-T78 PolarHBondContact O-OG1 3.43Å; T78-T80 PolarHBondContact O-N 3.35Å; T78-T80 VanDerWaalsContact O-N 3.11Å; T78-T80 PolarHBondContact OG1-OG1 3.05Å | ||
| 79 | D | 78.3 | Confident | 89.2 | Confident | 142 Ų | 142 | 73.7 Ų | 73.7 | 76% | 0.759 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | 22.7 | 174.5 | -61.2 | -58.5 | 0 | 0 | 0 | 112.8 | F81 | D79-F81 PolarHBondContact O-N 3.49Š|
| 80 | T | 81.4 | Confident | 89.1 | Confident | 79 Ų | 79 | 70.8 Ų | 70.8 | 49% | 0.485 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -29.4 | -180 | -62.1 | 0 | 0 | 0 | 0 | 112.6 | T78 | T78-T80 PolarHBondContact O-N 3.35Å; T78-T80 VanDerWaalsContact O-N 3.11Å; T78-T80 PolarHBondContact OG1-OG1 3.05Å |
| 81 | F | 83.5 | Confident | 88.9 | Confident | 90 Ų | 90 | 71.2 Ų | 71.2 | 40% | 0.395 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -119.2 | 105.1 | 176 | -54.3 | -74.5 | 0 | 0 | 0 | 110.1 | F75 D79 V183 | F75-F81 AromaticContact CD1-CD2 3.73Å; F75-F81 HydrophobicContact CD1-CD2 3.73Å; F75-F81 HydrophobicContact CD1-CE2 4.2Å; F75-F81 HydrophobicContact CE1-CB 4.42Å; F75-F81 AromaticContact CE1-CD2 3.47Å; F75-F81 HydrophobicContact CE1-CD2 3.47Å; F75-F81 VanDerWaalsContact CE1-CD2 3.47Å; F75-F81 AromaticContact CE1-CE2 3.84Å; F75-F81 HydrophobicContact CE1-CE2 3.84Å; F75-F81 AromaticContact CE1-CG 3.99Å; F75-F81 HydrophobicContact CE1-CG 3.99Å; F75-F81 HydrophobicContact CE2-CE2 4.26Å; F75-F81 HydrophobicContact CG-CD2 4.42Å; F75-F81 AromaticContact CZ-CD2 4Å; F75-F81 HydrophobicContact CZ-CD2 4Å; F75-F81 AromaticContact CZ-CE2 3.87Å; F75-F81 HydrophobicContact CZ-CE2 3.87Å; F75-F81 HydrophobicContact CZ-CZ 4.38Å; D79-F81 PolarHBondContact O-N 3.49Å; F81-V183 HydrophobicContact CB-CG1 3.79Å |
| 82 | P | 85.9 | Confident | 88.9 | Confident | 112 Ų | 112 | 69.6 Ų | 69.6 | 73% | 0.727 | 34% | 0.337 | S | S | * | . | P | Polyproline II helix | trans | -69.7 | 135.6 | -178.2 | 28.1 | -34.3 | 0 | 0 | 0 | 111.1 | H84 V183 | P82-H84 PolarHBondContact O-N 2.94Å; P82-V183 WeakPolarHBondContact O-CG1 3.22Å |
| 83 | V | 89.8 | Confident | 88.8 | Confident | 22 Ų | 22 | 77.6 Ų | 77.6 | 13% | 0.133 | 37% | 0.371 | C | S | . | . | P | Polyproline II helix | trans | -63.4 | 132 | 177.8 | -176.8 | 0 | 0 | 0 | 0 | 110.2 | I85 V183 V226 R229 K230 | V83-I85 PolarHBondContact O-N 2.93Å; V83-V183 HydrophobicContact CG2-CG2 4.39Å; V83-V226 HydrophobicContact CG2-CG1 4.08Å; V83-R229 HydrophobicContact CG1-CB 3.91Å; V83-K230 HydrophobicContact CG2-CD 4.36Å; V83-K230 HydrophobicContact CG2-CG 4.09Å |
| 84 | H | 90.8 | Very high | 88.8 | Confident | 107 Ų | 107 | 73.7 Ų | 73.7 | 50% | 0.495 | 36% | 0.364 | S | S | . | . | P | Polyproline II helix | trans | -58.1 | 130.5 | 175.9 | -176.9 | 68.8 | 0 | 0 | 0 | 111.4 | P82 Q86 V183 V184 G186 | P82-H84 PolarHBondContact O-N 2.94Å; H84-Q86 PolarHBondContact O-N 3.05Å; H84-V183 WeakPolarHBondContact CB-O 3.36Å; H84-V183 PolarHBondContact N-O 3.16Å; H84-V184 WeakPolarHBondContact CB-O 3.24Å; H84-G186 WeakPolarHBondContact O-CA 3.29Å |
| 85 | I | 89.6 | Confident | 88.9 | Confident | 78 Ų | 78 | 70.8 Ų | 70.8 | 40% | 0.4 | 35% | 0.353 | S | S | . | . | trans | -94.4 | 94.8 | -176.8 | -56.7 | 179.2 | 0 | 0 | 0 | 109.3 | V83 N215 | V83-I85 PolarHBondContact O-N 2.93Å; I85-N215 WeakPolarHBondContact CD1-OD1 3.34Å | ||
| 86 | Q | 88.7 | Confident | 89.1 | Confident | 58 Ų | 58 | 72.5 Ų | 72.5 | 27% | 0.271 | 37% | 0.369 | S | S | . | . | trans | -73.5 | 143.7 | 165 | -60.7 | -169.1 | -1.4 | 0 | 0 | 111 | H84 T185 Q188 R229 | H84-Q86 PolarHBondContact O-N 3.05Å; Q86-T185 PolarHBondContact NE2-O 2.89Å; Q86-Q188 PolarHBondContact O-NE2 3.2Å; Q86-R229 PolarHBondContact O-NH1 2.93Å | ||
| 87 | G | 90.6 | Very high | 89.5 | Confident | 9 Ų | 9 | 73.8 Ų | 73.8 | 9% | 0.093 | 37% | 0.373 | C | S | . | . | trans | -75.9 | 175 | 167.6 | 0 | 0 | 0 | 0 | 0 | 113 | Q188 Y211 I212 | G87-Q188 PolarHBondContact O-NE2 3.46Å; G87-Y211 VanDerWaalsContact C-OH 3.23Å; G87-Y211 VanDerWaalsContact CA-CZ 3.49Å; G87-Y211 WeakPolarHBondContact CA-OH 3.41Å; G87-Y211 PolarHBondContact N-OH 3.43Å; G87-Y211 VanDerWaalsContact N-OH 3.1Å; G87-Y211 WeakPolarHBondContact O-CE2 3.48Å; G87-Y211 PolarHBondContact O-OH 3.39Å; G87-Y211 VanDerWaalsContact O-OH 3.1Å; G87-I212 CarbonylContact C-O 3.12Å; G87-I212 WeakPolarHBondContact CA-O 3.26Å | ||
| 88 | F | 93.2 | Very high | 89.9 | Confident | 5 Ų | 5 | 70.3 Ų | 70.3 | 2% | 0.022 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144 | 158.5 | -179.1 | 61.2 | -87.5 | 0 | 0 | 0 | 111.7 | F192 L193 P198 I212 A217 | F88-F192 HydrophobicContact CB-CE1 4.32Å; F88-F192 AromaticContact CD1-CE1 3.74Å; F88-F192 HydrophobicContact CD1-CE1 3.74Å; F88-F192 HydrophobicContact CD1-CZ 4.21Å; F88-F192 HydrophobicContact CE1-CE1 4.21Å; F88-F192 HydrophobicContact CE1-CZ 4.45Å; F88-F192 HydrophobicContact CG-CE1 4.02Å; F88-L193 HydrophobicContact CD2-CD2 3.62Å; F88-L193 HydrophobicContact CE2-CD2 3.82Å; F88-L193 HydrophobicContact CG-CD2 4.23Å; F88-P198 HydrophobicContact CE2-CB 4.18Å; F88-P198 HydrophobicContact CE2-CG 4.26Å; F88-P198 HydrophobicContact CZ-CB 3.98Å; F88-P198 HydrophobicContact CZ-CG 4.45Å; F88-I212 HydrophobicContact CD2-CD1 4.24Å; F88-I212 HydrophobicContact CE1-CB 4.49Å; F88-I212 HydrophobicContact CE1-CG2 4.35Å; F88-I212 HydrophobicContact CE2-CD1 3.59Å; F88-I212 HydrophobicContact CZ-CB 4.36Å; F88-I212 HydrophobicContact CZ-CD1 3.93Å; F88-I212 HydrophobicContact CZ-CG2 4.3Å; F88-I212 PolarHBondContact N-O 3Å; F88-I212 PolarHBondContact O-N 2.96Å; F88-A217 HydrophobicContact CE1-CB 3.85Å; F88-A217 HydrophobicContact CZ-CB 3.85Å |
| 89 | F | 93.6 | Very high | 90.3 | Very high | 90 Ų | 90 | 72.7 Ų | 72.7 | 40% | 0.395 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 143.9 | 175.7 | -67.8 | -82.2 | 0 | 0 | 0 | 112 | F91 D92 Q210 Y211 | F89-F91 PolarHBondContact O-N 3.37Å; F89-D92 HydrophobicContact CB-CB 4.21Å; F89-D92 PolarHBondContact O-N 3.44Å; F89-Q210 WeakPolarHBondContact CA-O 3.27Å; F89-Y211 AromaticContact CD1-CD2 3.95Å; F89-Y211 HydrophobicContact CD1-CD2 3.95Å; F89-Y211 HydrophobicContact CD1-CG 4.48Å; F89-Y211 AromaticContact CD2-CD2 3.91Å; F89-Y211 HydrophobicContact CD2-CD2 3.91Å; F89-Y211 HydrophobicContact CD2-CE2 4.35Å; F89-Y211 AromaticContact CE1-CD2 3.81Å; F89-Y211 HydrophobicContact CE1-CD2 3.81Å; F89-Y211 HydrophobicContact CE1-CG 4.2Å; F89-Y211 AromaticContact CE2-CD2 3.75Å; F89-Y211 HydrophobicContact CE2-CD2 3.75Å; F89-Y211 HydrophobicContact CE2-CE2 4.1Å; F89-Y211 HydrophobicContact CG-CD2 4Å; F89-Y211 AromaticContact CZ-CD2 3.69Å; F89-Y211 HydrophobicContact CZ-CD2 3.69Å; F89-Y211 HydrophobicContact CZ-CE2 4.37Å; F89-Y211 HydrophobicContact CZ-CG 4.35Å |
| 90 | C | 92.6 | Very high | 91 | Very high | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.7 | 130.2 | 173.4 | -65.3 | 0 | 0 | 0 | 0 | 110.7 | D92 C205 S207 P208 Q210 | C90-D92 VanDerWaalsContact C-N 3.26Å; C90-D92 PolarHBondContact O-N 2.85Å; C90-C205 HydrophobicContact CB-CB 3.7Å; C90-C205 WeakPolarHBondContact CB-SG 3.26Å; C90-C205 WeakPolarHBondContact SG-CB 3.36Å; C90-C205 CovalentContact SG-SG 2.04Å; C90-C205 PolarHBondContact SG-SG 2.96Å; C90-S207 WeakPolarHBondContact CB-O 3.3Å; C90-P208 VanDerWaalsContact O-CA 3.29Å; C90-P208 WeakPolarHBondContact O-CA 3.45Å; C90-Q210 PolarHBondContact N-O 2.87Å; C90-Q210 PolarHBondContact SG-O 3.43Å |
| 91 | F | 90.6 | Very high | 91.5 | Very high | 105 Ų | 105 | 65 Ų | 65 | 46% | 0.461 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.8 | 27.3 | 177.7 | -47.9 | -75.9 | 0 | 0 | 0 | 115.9 | F89 K93 Y200 C205 | F89-F91 PolarHBondContact O-N 3.37Å; F91-K93 PolarHBondContact O-N 2.95Å; F91-Y200 HydrophobicContact CD1-CD1 4.36Å; F91-Y200 AromaticContact CD1-CD2 3.98Å; F91-Y200 HydrophobicContact CD1-CD2 3.98Å; F91-Y200 HydrophobicContact CD1-CE1 4.14Å; F91-Y200 AromaticContact CD1-CE2 3.74Å; F91-Y200 HydrophobicContact CD1-CE2 3.74Å; F91-Y200 HydrophobicContact CD1-CG 4.26Å; F91-Y200 AromaticContact CD1-CZ 3.8Å; F91-Y200 HydrophobicContact CE1-CD1 4.03Å; F91-Y200 AromaticContact CE1-CD2 3.33Å; F91-Y200 HydrophobicContact CE1-CD2 3.33Å; F91-Y200 HydrophobicContact CE1-CE1 4.25Å; F91-Y200 AromaticContact CE1-CE2 3.59Å; F91-Y200 HydrophobicContact CE1-CE2 3.59Å; F91-Y200 AromaticContact CE1-CG 3.56Å; F91-Y200 HydrophobicContact CE1-CG 3.56Å; F91-Y200 HydrophobicContact CE2-CD1 4.48Å; F91-Y200 HydrophobicContact CE2-CG 4.46Å; F91-Y200 HydrophobicContact CG-CE1 4.47Å; F91-Y200 HydrophobicContact CZ-CD1 4.09Å; F91-Y200 AromaticContact CZ-CD2 3.93Å; F91-Y200 HydrophobicContact CZ-CD2 3.93Å; F91-Y200 AromaticContact CZ-CG 3.67Å; F91-Y200 HydrophobicContact CZ-CG 3.67Å; F91-C205 HydrophobicContact CE2-CB 3.94Å; F91-C205 HydrophobicContact CZ-CB 4.44Å |
| 92 | D | 92.8 | Very high | 91.9 | Very high | 39 Ų | 39 | 63.5 Ų | 63.5 | 21% | 0.209 | 34% | 0.337 | C | S | . | . | trans | -61.9 | 117.7 | -177.7 | -166.6 | -23.5 | 0 | 0 | 0 | 113.3 | F89 C90 A94 Y95 S96 L193 | F89-D92 HydrophobicContact CB-CB 4.21Å; F89-D92 PolarHBondContact O-N 3.44Å; C90-D92 VanDerWaalsContact C-N 3.26Å; C90-D92 PolarHBondContact O-N 2.85Å; D92-A94 VanDerWaalsContact C-N 3.27Å; D92-A94 PolarHBondContact O-N 2.99Å; D92-A94 VanDerWaalsContact OD1-CB 3.28Å; D92-A94 WeakPolarHBondContact OD1-CB 3.5Å; D92-A94 PolarHBondContact OD1-N 3.47Å; D92-Y95 HydrophobicContact CB-CD2 4.02Å; D92-Y95 PolarHBondContact O-N 3.26Å; D92-Y95 WeakPolarHBondContact OD2-CD2 3.41Å; D92-Y95 WeakPolarHBondContact OD2-CE2 3.21Å; D92-S96 WeakPolarHBondContact O-CB 2.92Å; D92-S96 PolarHBondContact O-N 2.88Å; D92-L193 HydrophobicContact CB-CD1 4.28Å; D92-L193 VanDerWaalsContact O-CD1 3.27Å; D92-L193 WeakPolarHBondContact O-CD1 3.45Å | ||
| 93 | K | 91.3 | Very high | 92 | Very high | 174 Ų | 174 | 61.3 Ų | 61.3 | 76% | 0.757 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.1 | -18.2 | -179.5 | -64.1 | -177.2 | -178.5 | 177.7 | 0 | 113.9 | F91 Y95 | F91-K93 PolarHBondContact O-N 2.95Å; K93-Y95 VanDerWaalsContact C-N 3.33Å |
| 94 | A | 91.8 | Very high | 92 | Very high | 44 Ų | 44 | 65.9 Ų | 65.9 | 36% | 0.364 | 34% | 0.341 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | -32.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | D92 H289 | D92-A94 VanDerWaalsContact C-N 3.27Å; D92-A94 PolarHBondContact O-N 2.99Å; D92-A94 VanDerWaalsContact OD1-CB 3.28Å; D92-A94 WeakPolarHBondContact OD1-CB 3.5Å; D92-A94 PolarHBondContact OD1-N 3.47Å; A94-H289 PolarHBondContact O-CE1 3.33Å |
| 95 | Y | 94.4 | Very high | 91.9 | Very high | 42 Ų | 42 | 70.1 Ų | 70.1 | 17% | 0.165 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -108.1 | 4.4 | -175.3 | -56.6 | -62.8 | 0 | 0 | 0 | 113.8 | D92 K93 Q188 T189 P190 H191 F192 L193 H289 | D92-Y95 HydrophobicContact CB-CD2 4.02Å; D92-Y95 PolarHBondContact O-N 3.26Å; D92-Y95 WeakPolarHBondContact OD2-CD2 3.41Å; D92-Y95 WeakPolarHBondContact OD2-CE2 3.21Å; K93-Y95 VanDerWaalsContact C-N 3.33Å; Y95-Q188 HydrophobicContact CD1-CB 3.81Å; Y95-Q188 HydrophobicContact CE1-CB 3.61Å; Y95-Q188 WeakPolarHBondContact CE1-O 3.38Å; Y95-T189 WeakPolarHBondContact CD1-O 3.12Å; Y95-P190 CarbonylContact C-O 2.99Å; Y95-P190 WeakPolarHBondContact CA-O 3.27Å; Y95-P190 VanDerWaalsContact O-O 3.12Å; Y95-H191 CarbonylContact O-C 3.07Å; Y95-F192 PolarHBondContact O-N 3.01Å; Y95-L193 WeakPolarHBondContact O-CB 3.33Å; Y95-L193 PolarHBondContact O-N 3.34Å; Y95-H289 AromaticContact CD1-CE1 3.81Å; Y95-H289 AromaticContact CD1-NE2 3.46Å; Y95-H289 WeakPolarHBondContact CD1-NE2 3.23Å; Y95-H289 AromaticContact CE1-CE1 3.67Å; Y95-H289 AromaticContact CE1-NE2 2.96Å; Y95-H289 WeakPolarHBondContact CE1-NE2 3.07Å |
| 96 | S | 94.5 | Very high | 92 | Very high | 66 Ų | 66 | 66.8 Ų | 66.8 | 46% | 0.462 | 34% | 0.338 | S | S | . | . | trans | -94.7 | 21.4 | -178 | 82.2 | 0 | 0 | 0 | 0 | 114.5 | D92 | D92-S96 WeakPolarHBondContact O-CB 2.92Å; D92-S96 PolarHBondContact O-N 2.88Å | ||
| 97 | K | 95.6 | Very high | 92.1 | Very high | 87 Ų | 87 | 71.7 Ų | 71.7 | 38% | 0.378 | 36% | 0.358 | S | S | . | . | P | Polyproline II helix | trans | -68.5 | 151.3 | 175.8 | -59.7 | -60.6 | 179.5 | -176.7 | 0 | 110.9 | P190 H191 S194 H286 | K97-P190 HydrophobicContact CB-CB 4.33Å; K97-P190 WeakPolarHBondContact CB-O 3.39Å; K97-P190 HydrophobicContact CG-CB 3.81Å; K97-P190 VanDerWaalsContact CG-O 3.25Å; K97-P190 WeakPolarHBondContact CG-O 3.14Å; K97-P190 PolarHBondContact N-O 3.11Å; K97-H191 HydrophobicContact CB-CB 4.38Å; K97-H191 WeakPolarHBondContact O-CA 3.46Å; K97-S194 WeakPolarHBondContact O-CB 3.37Å; K97-S194 PolarHBondContact O-OG 3.35Å; K97-H286 HydrophobicContact CB-CB 3.97Å; K97-H286 HydrophobicContact CG-CB 4.32Å |
| 98 | P | 94.4 | Very high | 92.2 | Very high | 89 Ų | 89 | 71.5 Ų | 71.5 | 58% | 0.578 | 36% | 0.356 | S | S | * | . | P | Polyproline II helix | trans | -61.4 | 146.4 | 176.8 | 26.6 | -35.4 | 0 | 0 | 0 | 111 | P100 | P98-P100 WeakPolarHBondContact O-CD 3.36Š|
| 99 | Y | 93.8 | Very high | 92.3 | Very high | 89 Ų | 89 | 72.6 Ų | 72.6 | 35% | 0.349 | 36% | 0.364 | S | S | . | . | P | Polyproline II helix | trans | -63.4 | 122.2 | 173.8 | 178.5 | -118.9 | 0 | 0 | 0 | 109.7 | G101 S194 L224 | Y99-G101 VanDerWaalsContact CE1-CA 3.4Å; Y99-G101 PolarHBondContact O-N 3.44Å; Y99-G101 VanDerWaalsContact O-N 3.17Å; Y99-S194 WeakPolarHBondContact CB-OG 3.43Å; Y99-S194 PolarHBondContact N-OG 2.84Å; Y99-L224 HydrophobicContact CE2-CD2 4.47Å; Y99-L224 WeakPolarHBondContact OH-CD2 3.38Å |
| 100 | P | 92.4 | Very high | 92.2 | Very high | 42 Ų | 42 | 69.6 Ų | 69.6 | 27% | 0.273 | 35% | 0.353 | S | S | . | . | trans | -76.5 | 2.4 | -175 | 31.1 | -36.8 | 0 | 0 | 0 | 114.3 | P98 E285 R287 | P98-P100 WeakPolarHBondContact O-CD 3.36Å; P100-E285 HydrophobicContact CB-CB 4.46Å; P100-E285 VanDerWaalsContact CB-O 3.23Å; P100-E285 WeakPolarHBondContact CB-O 3.39Å; P100-E285 WeakPolarHBondContact CG-O 3.21Å; P100-R287 HydrophobicContact CG-CG 3.97Å | ||
| 101 | G | 92.4 | Very high | 92.2 | Very high | 16 Ų | 16 | 74.5 Ų | 74.5 | 17% | 0.165 | 38% | 0.383 | C | S | . | . | trans | 85.3 | 174.1 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y99 | Y99-G101 VanDerWaalsContact CE1-CA 3.4Å; Y99-G101 PolarHBondContact O-N 3.44Å; Y99-G101 VanDerWaalsContact O-N 3.17Å | ||
| 102 | P | 91.6 | Very high | 92.5 | Very high | 59 Ų | 59 | 73.5 Ų | 73.5 | 38% | 0.383 | 38% | 0.382 | S | S | . | . | trans | -52.4 | 154 | 175.2 | -23.9 | 32.1 | 0 | 0 | 0 | 113.5 | D104 Y105 R287 | P102-D104 PolarHBondContact O-N 3.34Å; P102-Y105 HydrophobicContact CB-CD2 3.99Å; P102-Y105 HydrophobicContact CB-CE2 4.44Å; P102-Y105 HydrophobicContact CG-CD2 3.96Å; P102-Y105 HydrophobicContact CG-CE2 4.16Å; P102-Y105 PolarHBondContact O-N 2.94Å; P102-R287 PolarHBondContact O-NH2 3.48Å | ||
| 103 | E | 87.9 | Confident | 92.6 | Very high | 67 Ų | 67 | 71.8 Ų | 71.8 | 31% | 0.313 | 37% | 0.373 | S | S | . | . | G | 310 helix | trans | -58.7 | -31 | 179.2 | -71.2 | -64 | 155 | 0 | 0 | 113.4 | Y105 S106 P110 R282 R287 | E103-Y105 PolarHBondContact O-N 2.88Å; E103-S106 WeakPolarHBondContact O-CB 3.3Å; E103-S106 PolarHBondContact O-N 2.74Å; E103-S106 VanDerWaalsContact O-N 3.08Å; E103-P110 HydrophobicContact CB-CG 4.02Å; E103-R282 IonicContact OE1-NH1 3.68Å; E103-R282 IonicContact OE2-CZ 3.58Å; E103-R282 IonicContact OE2-NH1 3.71Å; E103-R282 PolarHBondContact OE2-NH1 2.89Å; E103-R282 IonicContact OE2-NH2 2.67Å; E103-R282 PolarHBondContact OE2-NH2 3.49Å; E103-R287 WeakPolarHBondContact OE1-CD 3.39Å; E103-R287 IonicContact OE1-CZ 2.68Å; E103-R287 IonicContact OE1-NE 3.5Å; E103-R287 PolarHBondContact OE1-NE 3.25Å; E103-R287 VanDerWaalsContact OE1-NE 3.09Å; E103-R287 IonicContact OE2-CZ 3.61Å; E103-R287 IonicContact OE2-NE 2.68Å; E103-R287 IonicContact OE2-NH1 3.78Å |
| 104 | D | 88.9 | Confident | 92.8 | Very high | 118 Ų | 118 | 67.3 Ų | 67.3 | 63% | 0.631 | 35% | 0.352 | S | S | * | . | G | 310 helix | trans | -67.2 | -23.1 | -179 | -55 | -54 | 0 | 0 | 0 | 113.6 | P102 | P102-D104 PolarHBondContact O-N 3.34Š|
| 105 | Y | 89.1 | Confident | 93 | Very high | 195 Ų | 195 | 68.2 Ų | 68.2 | 77% | 0.765 | 36% | 0.355 | S | S | * | . | G | 310 helix | trans | -94 | 4.6 | 175.4 | -61.1 | -72.8 | 0 | 0 | 0 | 113.1 | P102 E103 | P102-Y105 HydrophobicContact CB-CD2 3.99Å; P102-Y105 HydrophobicContact CB-CE2 4.44Å; P102-Y105 HydrophobicContact CG-CD2 3.96Å; P102-Y105 HydrophobicContact CG-CE2 4.16Å; P102-Y105 PolarHBondContact O-N 2.94Å; E103-Y105 PolarHBondContact O-N 2.88Å |
| 106 | S | 91.3 | Very high | 93.2 | Very high | 9 Ų | 9 | 70 Ų | 70 | 6% | 0.063 | 37% | 0.367 | C | S | . | . | S | Bend | trans | -60.1 | 150.3 | 170.6 | -177.8 | 0 | 0 | 0 | 0 | 111.6 | E103 A108 P109 E285 R287 | E103-S106 WeakPolarHBondContact O-CB 3.3Å; E103-S106 PolarHBondContact O-N 2.74Å; E103-S106 VanDerWaalsContact O-N 3.08Å; S106-A108 PolarHBondContact O-N 3.45Å; S106-A108 VanDerWaalsContact OG-C 3.31Å; S106-A108 PolarHBondContact OG-N 2.74Å; S106-A108 PolarHBondContact OG-O 2.92Å; S106-P109 WeakPolarHBondContact O-CD 3.3Å; S106-E285 WeakPolarHBondContact CA-OE2 3.17Å; S106-E285 WeakPolarHBondContact CB-OE2 2.88Å; S106-E285 PolarHBondContact OG-OE2 3.24Å; S106-R287 VanDerWaalsContact CB-NH1 3.28Å; S106-R287 PolarHBondContact OG-NH1 3.23Å; S106-R287 VanDerWaalsContact OG-NH1 3.07Å |
| 107 | K | 92.4 | Very high | 93.3 | Very high | 160 Ų | 160 | 67.2 Ų | 67.2 | 70% | 0.696 | 35% | 0.348 | S | S | * | . | S | Bend | trans | -64.6 | -19 | 163.4 | -67.5 | 166.2 | -173.1 | 174.4 | 0 | 113.1 | V281 E285 | K107-V281 HydrophobicContact CB-CG1 3.88Å; K107-V281 HydrophobicContact CB-CG2 4.43Å; K107-E285 VanDerWaalsContact CB-OE1 3.29Å; K107-E285 WeakPolarHBondContact CB-OE1 3.38Å; K107-E285 WeakPolarHBondContact CD-OE1 3.37Å; K107-E285 WeakPolarHBondContact CG-OE1 3.27Å; K107-E285 PolarHBondContact N-OE1 3.25Å |
| 108 | A | 91.9 | Very high | 93.3 | Very high | 6 Ų | 6 | 66 Ų | 66 | 5% | 0.05 | 35% | 0.347 | C | S | . | . | S | Bend | trans | -129 | 72.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | S106 V113 V281 R282 | S106-A108 PolarHBondContact O-N 3.45Å; S106-A108 VanDerWaalsContact OG-C 3.31Å; S106-A108 PolarHBondContact OG-N 2.74Å; S106-A108 PolarHBondContact OG-O 2.92Å; A108-V113 HydrophobicContact CB-CG2 4.04Å; A108-V281 HydrophobicContact CB-CB 4.1Å; A108-V281 HydrophobicContact CB-CG1 3.66Å; A108-R282 PolarHBondContact O-NH2 2.93Å |
| 109 | P | 94.3 | Very high | 93.4 | Very high | 28 Ų | 28 | 63.8 Ų | 63.8 | 18% | 0.182 | 34% | 0.337 | C | S | . | . | trans | -69 | 148.6 | -177.9 | 30.2 | -32.4 | 0 | 0 | 0 | 109.8 | S106 V111 L112 V113 | S106-P109 WeakPolarHBondContact O-CD 3.3Å; P109-V111 PolarHBondContact O-N 3.27Å; P109-V111 VanDerWaalsContact O-N 3.11Å; P109-L112 HydrophobicContact CG-CB 3.82Å; P109-L112 WeakPolarHBondContact O-CB 3.49Å; P109-L112 PolarHBondContact O-N 2.87Å; P109-V113 PolarHBondContact O-N 2.95Å; P109-V113 VanDerWaalsContact O-N 3.11Å | ||
| 110 | P | 91.9 | Very high | 93.5 | Very high | 27 Ų | 27 | 61.9 Ų | 61.9 | 18% | 0.175 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -54.2 | -37.3 | -175 | -27.9 | 35.1 | 0 | 0 | 0 | 113.6 | E103 L112 V113 Y114 | E103-P110 HydrophobicContact CB-CG 4.02Å; P110-L112 VanDerWaalsContact C-N 3.33Å; P110-L112 PolarHBondContact O-N 3.4Å; P110-V113 PolarHBondContact O-N 2.92Å; P110-Y114 HydrophobicContact CB-CD2 4.43Å; P110-Y114 HydrophobicContact CB-CE2 4.03Å; P110-Y114 WeakPolarHBondContact O-CB 3.46Å; P110-Y114 PolarHBondContact O-N 3.35Å |
| 111 | V | 93.8 | Very high | 93.7 | Very high | 102 Ų | 102 | 59.9 Ų | 59.9 | 62% | 0.618 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -57.3 | -44.2 | 176 | -178.3 | 0 | 0 | 0 | 0 | 111.6 | P109 S115 | P109-V111 PolarHBondContact O-N 3.27Å; P109-V111 VanDerWaalsContact O-N 3.11Å; V111-S115 WeakPolarHBondContact O-CB 3.34Å; V111-S115 PolarHBondContact O-N 2.92Å; V111-S115 PolarHBondContact O-OG 3.11Å |
| 112 | L | 95.3 | Very high | 93.8 | Very high | 84 Ų | 84 | 61.3 Ų | 61.3 | 44% | 0.44 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -68.4 | -48.4 | 178 | -178.1 | 70.4 | 0 | 0 | 0 | 110.9 | P109 P110 S115 L116 | P109-L112 HydrophobicContact CG-CB 3.82Å; P109-L112 WeakPolarHBondContact O-CB 3.49Å; P109-L112 PolarHBondContact O-N 2.87Å; P110-L112 VanDerWaalsContact C-N 3.33Å; P110-L112 PolarHBondContact O-N 3.4Å; L112-S115 PolarHBondContact O-N 3.47Å; L112-L116 HydrophobicContact CD1-CD1 4.02Å; L112-L116 HydrophobicContact CD1-CG 4.26Å; L112-L116 HydrophobicContact CG-CD1 3.95Å; L112-L116 HydrophobicContact CG-CG 4.47Å; L112-L116 WeakPolarHBondContact O-CB 3.33Å; L112-L116 VanDerWaalsContact O-CG 3.32Å; L112-L116 WeakPolarHBondContact O-CG 3.37Å; L112-L116 PolarHBondContact O-N 3.44Å |
| 113 | V | 95.9 | Very high | 94 | Very high | 4 Ų | 4 | 62.1 Ų | 62.1 | 2% | 0.024 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -59.7 | -51.9 | -178 | 178.6 | 0 | 0 | 0 | 0 | 110.3 | A108 P109 P110 S115 L116 V117 D236 V278 | A108-V113 HydrophobicContact CB-CG2 4.04Å; P109-V113 PolarHBondContact O-N 2.95Å; P109-V113 VanDerWaalsContact O-N 3.11Å; P110-V113 PolarHBondContact O-N 2.92Å; V113-S115 PolarHBondContact O-N 3.39Å; V113-L116 PolarHBondContact O-N 3.32Å; V113-V117 HydrophobicContact CG1-CG2 4.27Å; V113-V117 VanDerWaalsContact O-CB 3.23Å; V113-V117 WeakPolarHBondContact O-CB 3.19Å; V113-V117 VanDerWaalsContact O-CG2 3.24Å; V113-V117 WeakPolarHBondContact O-CG2 3.28Å; V113-V117 PolarHBondContact O-N 3.07Å; V113-D236 HydrophobicContact CG1-CB 4.21Å; V113-V278 HydrophobicContact CG1-CG1 4.29Å; V113-V278 HydrophobicContact CG2-CG1 4.07Å; V113-V278 HydrophobicContact CG2-CG2 4.48Å |
| 114 | Y | 95.6 | Very high | 94.3 | Very high | 79 Ų | 79 | 60.3 Ų | 60.3 | 31% | 0.31 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -67.4 | -35.3 | -178.4 | -58.7 | -13.5 | 0 | 0 | 0 | 112.3 | P110 T118 K235 L239 | P110-Y114 HydrophobicContact CB-CD2 4.43Å; P110-Y114 HydrophobicContact CB-CE2 4.03Å; P110-Y114 WeakPolarHBondContact O-CB 3.46Å; P110-Y114 PolarHBondContact O-N 3.35Å; Y114-T118 WeakPolarHBondContact O-CB 3.44Å; Y114-T118 WeakPolarHBondContact O-CG2 3.39Å; Y114-T118 PolarHBondContact O-N 3.36Å; Y114-T118 PolarHBondContact O-OG1 3.11Å; Y114-K235 WeakPolarHBondContact OH-CE 3.44Å; Y114-L239 HydrophobicContact CD1-CD1 4.24Å; Y114-L239 HydrophobicContact CE1-CD1 3.79Å |
| 115 | S | 96.6 | Very high | 94.4 | Very high | 63 Ų | 63 | 54.8 Ų | 54.8 | 44% | 0.441 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.8 | -45 | 174 | -62.4 | 0 | 0 | 0 | 0 | 111.9 | V111 L112 V113 T118 A119 | V111-S115 WeakPolarHBondContact O-CB 3.34Å; V111-S115 PolarHBondContact O-N 2.92Å; V111-S115 PolarHBondContact O-OG 3.11Å; L112-S115 PolarHBondContact O-N 3.47Å; V113-S115 PolarHBondContact O-N 3.39Å; S115-T118 PolarHBondContact O-N 3.23Å; S115-T118 PolarHBondContact O-OG1 2.97Å; S115-A119 WeakPolarHBondContact O-CB 3.29Å; S115-A119 PolarHBondContact O-N 3.38Å |
| 116 | L | 96.6 | Very high | 94.6 | Very high | 80 Ų | 80 | 49.2 Ų | 49.2 | 42% | 0.419 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -68.6 | -43.3 | 178.1 | -68.5 | 175.6 | 0 | 0 | 0 | 111.8 | L112 V113 T118 A119 I120 | L112-L116 HydrophobicContact CD1-CD1 4.02Å; L112-L116 HydrophobicContact CD1-CG 4.26Å; L112-L116 HydrophobicContact CG-CD1 3.95Å; L112-L116 HydrophobicContact CG-CG 4.47Å; L112-L116 WeakPolarHBondContact O-CB 3.33Å; L112-L116 VanDerWaalsContact O-CG 3.32Å; L112-L116 WeakPolarHBondContact O-CG 3.37Å; L112-L116 PolarHBondContact O-N 3.44Å; V113-L116 PolarHBondContact O-N 3.32Å; L116-T118 PolarHBondContact O-N 3.1Å; L116-A119 PolarHBondContact O-N 3.31Å; L116-I120 HydrophobicContact CB-CD1 4.1Å; L116-I120 HydrophobicContact CD2-CD1 4.24Å; L116-I120 WeakPolarHBondContact O-CB 3.5Å; L116-I120 WeakPolarHBondContact O-CG1 3.49Å; L116-I120 PolarHBondContact O-N 3.2Å |
| 117 | V | 97.4 | Very high | 94.6 | Very high | 8 Ų | 8 | 53.5 Ų | 53.5 | 5% | 0.048 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58.1 | -34.8 | 177.1 | 159.6 | 0 | 0 | 0 | 0 | 111.8 | V113 P121 Y167 L171 S243 | V113-V117 HydrophobicContact CG1-CG2 4.27Å; V113-V117 VanDerWaalsContact O-CB 3.23Å; V113-V117 WeakPolarHBondContact O-CB 3.19Å; V113-V117 VanDerWaalsContact O-CG2 3.24Å; V113-V117 WeakPolarHBondContact O-CG2 3.28Å; V113-V117 PolarHBondContact O-N 3.07Å; V117-P121 WeakPolarHBondContact O-CD 3.23Å; V117-P121 VanDerWaalsContact O-CG 3.22Å; V117-P121 WeakPolarHBondContact O-CG 3.29Å; V117-Y167 PolarHBondContact O-OH 3.38Å; V117-L171 HydrophobicContact CG1-CD1 3.44Å; V117-L171 VanDerWaalsContact CG1-CD1 3.44Å; V117-L171 HydrophobicContact CG1-CD2 4.38Å; V117-S243 PolarHBondContact O-OG 2.76Å |
| 118 | T | 96.1 | Very high | 94.5 | Very high | 60 Ų | 60 | 46.3 Ų | 46.3 | 37% | 0.368 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -88.8 | -42.6 | 177.4 | 52.3 | 0 | 0 | 0 | 0 | 113.2 | Y114 S115 L116 T122 L171 | Y114-T118 WeakPolarHBondContact O-CB 3.44Å; Y114-T118 WeakPolarHBondContact O-CG2 3.39Å; Y114-T118 PolarHBondContact O-N 3.36Å; Y114-T118 PolarHBondContact O-OG1 3.11Å; S115-T118 PolarHBondContact O-N 3.23Å; S115-T118 PolarHBondContact O-OG1 2.97Å; L116-T118 PolarHBondContact O-N 3.1Å; T118-T122 WeakPolarHBondContact O-CB 3.32Å; T118-T122 WeakPolarHBondContact O-CG2 3.32Å; T118-T122 PolarHBondContact O-N 3.08Å; T118-T122 PolarHBondContact O-OG1 3.33Å; T118-L171 HydrophobicContact CG2-CD2 3.95Å |
| 119 | A | 96.8 | Very high | 94.3 | Very high | 44 Ų | 44 | 46 Ų | 46 | 36% | 0.364 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -70.7 | -43 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | S115 L116 T122 V123 | S115-A119 WeakPolarHBondContact O-CB 3.29Å; S115-A119 PolarHBondContact O-N 3.38Å; L116-A119 PolarHBondContact O-N 3.31Å; A119-T122 WeakPolarHBondContact CA-OG1 3.25Å; A119-T122 PolarHBondContact O-N 3.41Å; A119-T122 PolarHBondContact O-OG1 2.97Å; A119-V123 VanDerWaalsContact O-CB 3.31Å; A119-V123 WeakPolarHBondContact O-CB 3.3Å; A119-V123 VanDerWaalsContact O-CG2 3.27Å; A119-V123 WeakPolarHBondContact O-CG2 3.43Å; A119-V123 PolarHBondContact O-N 3.43Å |
| 120 | I | 96.1 | Very high | 94 | Very high | 48 Ų | 48 | 47.8 Ų | 47.8 | 25% | 0.246 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.4 | -49.8 | -175.6 | -66.5 | 170.8 | 0 | 0 | 0 | 111.6 | L116 T124 L271 | L116-I120 HydrophobicContact CB-CD1 4.1Å; L116-I120 HydrophobicContact CD2-CD1 4.24Å; L116-I120 WeakPolarHBondContact O-CB 3.5Å; L116-I120 WeakPolarHBondContact O-CG1 3.49Å; L116-I120 PolarHBondContact O-N 3.2Å; I120-T124 VanDerWaalsContact O-CB 3.26Å; I120-T124 WeakPolarHBondContact O-CB 3.34Å; I120-T124 PolarHBondContact O-N 3.28Å; I120-T124 PolarHBondContact O-OG1 2.92Å; I120-L271 HydrophobicContact CG2-CD2 3.46Å; I120-L271 VanDerWaalsContact CG2-CD2 3.46Å |
| 121 | P | 95.5 | Very high | 93.7 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -69.9 | -40.2 | 179.3 | -18.6 | 33.5 | 0 | 0 | 0 | 112.1 | V117 T124 I125 Y167 S243 T247 | V117-P121 WeakPolarHBondContact O-CD 3.23Å; V117-P121 VanDerWaalsContact O-CG 3.22Å; V117-P121 WeakPolarHBondContact O-CG 3.29Å; P121-T124 PolarHBondContact O-N 3.35Å; P121-I125 WeakPolarHBondContact O-CB 3.34Å; P121-I125 WeakPolarHBondContact O-CD1 3.27Å; P121-I125 WeakPolarHBondContact O-CG1 3.48Å; P121-I125 PolarHBondContact O-N 3.03Å; P121-Y167 HydrophobicContact CB-CD1 4.28Å; P121-Y167 HydrophobicContact CB-CD2 4.31Å; P121-Y167 HydrophobicContact CB-CE1 4.03Å; P121-Y167 HydrophobicContact CB-CE2 4.05Å; P121-Y167 HydrophobicContact CB-CG 4.44Å; P121-Y167 HydrophobicContact CG-CE1 4Å; P121-Y167 HydrophobicContact CG-CE2 3.94Å; P121-S243 WeakPolarHBondContact CG-OG 3.38Å; P121-T247 WeakPolarHBondContact CB-OG1 3.26Å; P121-T247 WeakPolarHBondContact CG-OG1 3.4Å |
| 122 | T | 95.3 | Very high | 93.2 | Very high | 46 Ų | 46 | 46.5 Ų | 46.5 | 28% | 0.282 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.9 | -49.3 | 180 | 51 | 0 | 0 | 0 | 0 | 111.5 | T118 A119 I125 L126 L164 | T118-T122 WeakPolarHBondContact O-CB 3.32Å; T118-T122 WeakPolarHBondContact O-CG2 3.32Å; T118-T122 PolarHBondContact O-N 3.08Å; T118-T122 PolarHBondContact O-OG1 3.33Å; A119-T122 WeakPolarHBondContact CA-OG1 3.25Å; A119-T122 PolarHBondContact O-N 3.41Å; A119-T122 PolarHBondContact O-OG1 2.97Å; T122-I125 PolarHBondContact O-N 2.99Å; T122-L126 WeakPolarHBondContact O-CB 3.42Å; T122-L126 VanDerWaalsContact O-CG 3.26Å; T122-L126 WeakPolarHBondContact O-CG 3.41Å; T122-L126 PolarHBondContact O-N 3.14Å; T122-L164 HydrophobicContact CG2-CD2 3.85Å |
| 123 | V | 95.4 | Very high | 92.6 | Very high | 76 Ų | 76 | 46.7 Ų | 46.7 | 46% | 0.461 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 176.3 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | A119 I125 L126 I127 | A119-V123 VanDerWaalsContact O-CB 3.31Å; A119-V123 WeakPolarHBondContact O-CB 3.3Å; A119-V123 VanDerWaalsContact O-CG2 3.27Å; A119-V123 WeakPolarHBondContact O-CG2 3.43Å; A119-V123 PolarHBondContact O-N 3.43Å; V123-I125 VanDerWaalsContact C-N 3.33Å; V123-I125 PolarHBondContact O-N 2.88Å; V123-L126 PolarHBondContact O-N 2.87Å; V123-I127 HydrophobicContact CG1-CD1 3.61Å; V123-I127 HydrophobicContact CG1-CG1 4.29Å; V123-I127 WeakPolarHBondContact O-CB 3.34Å; V123-I127 VanDerWaalsContact O-CG1 3.3Å; V123-I127 WeakPolarHBondContact O-CG1 3.47Å; V123-I127 PolarHBondContact O-N 3.44Å |
| 124 | T | 93.4 | Very high | 91.9 | Very high | 29 Ų | 29 | 52.7 Ų | 52.7 | 18% | 0.178 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62 | -40.5 | 178.1 | -57.2 | 0 | 0 | 0 | 0 | 111.9 | I120 P121 G128 T247 Y250 V251 | I120-T124 VanDerWaalsContact O-CB 3.26Å; I120-T124 WeakPolarHBondContact O-CB 3.34Å; I120-T124 PolarHBondContact O-N 3.28Å; I120-T124 PolarHBondContact O-OG1 2.92Å; P121-T124 PolarHBondContact O-N 3.35Å; T124-G128 PolarHBondContact O-N 3.29Å; T124-T247 HydrophobicContact CG2-CG2 3.83Å; T124-Y250 HydrophobicContact CG2-CD1 4.09Å; T124-Y250 HydrophobicContact CG2-CE1 4.25Å; T124-Y250 WeakPolarHBondContact O-CE1 3.21Å; T124-V251 HydrophobicContact CG2-CG2 3.74Å |
| 125 | I | 92.8 | Very high | 91.1 | Very high | 2 Ų | 2 | 52.6 Ų | 52.6 | 1% | 0.01 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.6 | -50 | 177.6 | -70.2 | 161.3 | 0 | 0 | 0 | 110.5 | P121 T122 V123 I127 G128 E129 F163 L164 Y246 Y250 | P121-I125 WeakPolarHBondContact O-CB 3.34Å; P121-I125 WeakPolarHBondContact O-CD1 3.27Å; P121-I125 WeakPolarHBondContact O-CG1 3.48Å; P121-I125 PolarHBondContact O-N 3.03Å; T122-I125 PolarHBondContact O-N 2.99Å; V123-I125 VanDerWaalsContact C-N 3.33Å; V123-I125 PolarHBondContact O-N 2.88Å; I125-I127 PolarHBondContact O-N 3.44Å; I125-G128 PolarHBondContact O-N 3.3Å; I125-E129 PolarHBondContact O-N 3.15Å; I125-F163 HydrophobicContact CD1-CB 4.36Å; I125-F163 HydrophobicContact CG2-CB 3.96Å; I125-L164 HydrophobicContact CB-CD2 4.17Å; I125-L164 HydrophobicContact CD1-CD2 3.73Å; I125-L164 HydrophobicContact CG2-CD2 4.09Å; I125-L164 HydrophobicContact CG2-CG 4.28Å; I125-Y246 HydrophobicContact CD1-CE1 4.09Å; I125-Y250 WeakPolarHBondContact CA-OH 3.32Å; I125-Y250 HydrophobicContact CB-CE1 4.36Å; I125-Y250 HydrophobicContact CG1-CD1 4.07Å; I125-Y250 HydrophobicContact CG1-CD2 4.19Å; I125-Y250 HydrophobicContact CG1-CE1 3.98Å; I125-Y250 HydrophobicContact CG1-CE2 4.11Å; I125-Y250 HydrophobicContact CG1-CG 4.17Å; I125-Y250 HydrophobicContact CG2-CE2 4.47Å; I125-Y250 PolarHBondContact O-OH 3.39Å |
| 126 | L | 92.9 | Very high | 89.8 | Confident | 78 Ų | 78 | 55.1 Ų | 55.1 | 41% | 0.408 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -57.1 | -50.4 | 178.2 | -71 | 170.6 | 0 | 0 | 0 | 111.9 | T122 V123 G128 E129 V130 I160 | T122-L126 WeakPolarHBondContact O-CB 3.42Å; T122-L126 VanDerWaalsContact O-CG 3.26Å; T122-L126 WeakPolarHBondContact O-CG 3.41Å; T122-L126 PolarHBondContact O-N 3.14Å; V123-L126 PolarHBondContact O-N 2.87Å; L126-G128 PolarHBondContact O-N 3.37Å; L126-E129 PolarHBondContact O-N 2.77Å; L126-V130 WeakPolarHBondContact O-CB 3.34Å; L126-V130 WeakPolarHBondContact O-CG2 3.15Å; L126-V130 PolarHBondContact O-N 2.72Å; L126-I160 HydrophobicContact CD2-CD1 4.15Å; L126-I160 HydrophobicContact CD2-CG2 3.84Å |
| 127 | I | 91.4 | Very high | 88.1 | Confident | 100 Ų | 100 | 55.2 Ų | 55.2 | 51% | 0.513 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -59.1 | -49.1 | 176.8 | -67.4 | 171.6 | 0 | 0 | 0 | 110.2 | V123 I125 E129 V130 T131 | V123-I127 HydrophobicContact CG1-CD1 3.61Å; V123-I127 HydrophobicContact CG1-CG1 4.29Å; V123-I127 WeakPolarHBondContact O-CB 3.34Å; V123-I127 VanDerWaalsContact O-CG1 3.3Å; V123-I127 WeakPolarHBondContact O-CG1 3.47Å; V123-I127 PolarHBondContact O-N 3.44Å; I125-I127 PolarHBondContact O-N 3.44Å; I127-E129 PolarHBondContact O-N 3.3Å; I127-V130 PolarHBondContact O-N 3.03Å; I127-T131 WeakPolarHBondContact O-CB 3.36Å; I127-T131 PolarHBondContact O-N 2.97Å; I127-T131 PolarHBondContact O-OG1 3.24Å |
| 128 | G | 89 | Confident | 86.2 | Confident | 8 Ų | 8 | 63.1 Ų | 63.1 | 8% | 0.082 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -59.1 | -41.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | T124 I125 L126 S132 M254 | T124-G128 PolarHBondContact O-N 3.29Å; I125-G128 PolarHBondContact O-N 3.3Å; L126-G128 PolarHBondContact O-N 3.37Å; G128-S132 VanDerWaalsContact O-CB 3.29Å; G128-S132 WeakPolarHBondContact O-CB 3.17Å; G128-S132 PolarHBondContact O-N 3.45Å; G128-M254 WeakPolarHBondContact O-CE 3.17Å |
| 129 | E | 89 | Confident | 84.1 | Confident | 1 Ų | 1 | 63.3 Ų | 63.3 | 1% | 0.005 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -74.5 | -38.4 | 178.5 | -66 | -55.6 | 170.7 | 0 | 0 | 113 | I125 L126 I127 S132 F133 R159 I160 F163 Y250 M254 | I125-E129 PolarHBondContact O-N 3.15Å; L126-E129 PolarHBondContact O-N 2.77Å; I127-E129 PolarHBondContact O-N 3.3Å; E129-S132 PolarHBondContact O-N 3.25Å; E129-F133 PolarHBondContact O-N 3.41Å; E129-R159 WeakPolarHBondContact OE1-CD 3.35Å; E129-R159 IonicContact OE1-NH1 3.46Å; E129-R159 WeakPolarHBondContact OE2-CD 3.2Å; E129-R159 IonicContact OE2-CZ 3.64Å; E129-R159 IonicContact OE2-NE 2.74Å; E129-R159 IonicContact OE2-NH1 3.86Å; E129-R159 PolarHBondContact OE2-NH1 3.47Å; E129-I160 HydrophobicContact CB-CD1 4.2Å; E129-I160 HydrophobicContact CB-CG1 3.79Å; E129-I160 HydrophobicContact CG-CG1 3.8Å; E129-F163 VanDerWaalsContact OE1-CD2 3.23Å; E129-F163 WeakPolarHBondContact OE1-CD2 3.18Å; E129-F163 WeakPolarHBondContact OE1-CE2 3.3Å; E129-Y250 PolarHBondContact N-OH 2.9Å; E129-M254 HydrophobicContact CG-CE 4.3Å; E129-M254 WeakPolarHBondContact OE1-CE 3.42Å; E129-M254 WeakPolarHBondContact OE2-CE 3.49Å |
| 130 | V | 88.1 | Confident | 81.5 | Confident | 65 Ų | 65 | 64.7 Ų | 64.7 | 39% | 0.394 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.7 | -45.6 | 175 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | L126 I127 S132 F133 F134 | L126-V130 WeakPolarHBondContact O-CB 3.34Å; L126-V130 WeakPolarHBondContact O-CG2 3.15Å; L126-V130 PolarHBondContact O-N 2.72Å; I127-V130 PolarHBondContact O-N 3.03Å; V130-S132 VanDerWaalsContact C-N 3.35Å; V130-S132 PolarHBondContact O-N 3.48Å; V130-F133 WeakPolarHBondContact O-CB 3.48Å; V130-F133 PolarHBondContact O-N 3.1Å; V130-F134 HydrophobicContact CG1-CD2 3.87Å; V130-F134 HydrophobicContact CG1-CE2 3.5Å; V130-F134 VanDerWaalsContact CG1-CE2 3.5Å; V130-F134 WeakPolarHBondContact O-CD2 3.4Å; V130-F134 PolarHBondContact O-N 3.22Å |
| 131 | T | 85.6 | Confident | 79 | Confident | 73 Ų | 73 | 70.3 Ų | 70.3 | 45% | 0.448 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.7 | -40.4 | 172.6 | -55.8 | 0 | 0 | 0 | 0 | 111.7 | I127 F133 F134 V135 | I127-T131 WeakPolarHBondContact O-CB 3.36Å; I127-T131 PolarHBondContact O-N 2.97Å; I127-T131 PolarHBondContact O-OG1 3.24Å; T131-F133 VanDerWaalsContact C-N 3.26Å; T131-F133 PolarHBondContact O-N 2.77Å; T131-F134 PolarHBondContact O-N 2.87Å; T131-V135 HydrophobicContact CG2-CG2 4.25Å; T131-V135 WeakPolarHBondContact O-CB 3.38Å; T131-V135 WeakPolarHBondContact O-CG2 3.35Å; T131-V135 PolarHBondContact O-N 3.39Å; T131-V135 VanDerWaalsContact O-N 3.11Å |
| 132 | S | 81.9 | Confident | 76.4 | Confident | 28 Ų | 28 | 77.9 Ų | 77.9 | 20% | 0.196 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -64.1 | -30.9 | 176.8 | -169.7 | 0 | 0 | 0 | 0 | 112.7 | G128 E129 V130 K136 | G128-S132 VanDerWaalsContact O-CB 3.29Å; G128-S132 WeakPolarHBondContact O-CB 3.17Å; G128-S132 PolarHBondContact O-N 3.45Å; E129-S132 PolarHBondContact O-N 3.25Å; V130-S132 VanDerWaalsContact C-N 3.35Å; V130-S132 PolarHBondContact O-N 3.48Å; S132-K136 WeakPolarHBondContact O-CB 3.32Å; S132-K136 WeakPolarHBondContact O-CD 3.37Å; S132-K136 WeakPolarHBondContact O-CG 3.21Å; S132-K136 PolarHBondContact O-N 3.17Å |
| 133 | F | 83.1 | Confident | 74 | Confident | 89 Ų | 89 | 83.7 Ų | 83.7 | 39% | 0.39 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66 | -57.2 | 173.9 | -175.7 | -127.9 | 0 | 0 | 0 | 111.7 | E129 V130 T131 V135 K136 T137 L156 | E129-F133 PolarHBondContact O-N 3.41Å; V130-F133 WeakPolarHBondContact O-CB 3.48Å; V130-F133 PolarHBondContact O-N 3.1Å; T131-F133 VanDerWaalsContact C-N 3.26Å; T131-F133 PolarHBondContact O-N 2.77Å; F133-V135 PolarHBondContact O-N 2.84Å; F133-K136 PolarHBondContact O-N 2.94Å; F133-K136 VanDerWaalsContact O-N 3.08Å; F133-T137 PolarHBondContact O-N 3.4Å; F133-T137 PolarHBondContact O-OG1 2.86Å; F133-T137 VanDerWaalsContact O-OG1 3.07Å; F133-L156 HydrophobicContact CB-CD1 3.72Å; F133-L156 HydrophobicContact CB-CD2 3.58Å; F133-L156 HydrophobicContact CB-CG 4.24Å; F133-L156 HydrophobicContact CD1-CD1 3.58Å; F133-L156 HydrophobicContact CD2-CD1 3.63Å; F133-L156 HydrophobicContact CD2-CD2 3.58Å; F133-L156 HydrophobicContact CD2-CG 3.84Å; F133-L156 HydrophobicContact CE1-CD1 3.99Å; F133-L156 HydrophobicContact CE2-CD1 4.02Å; F133-L156 HydrophobicContact CE2-CD2 4.43Å; F133-L156 HydrophobicContact CE2-CG 4.29Å; F133-L156 HydrophobicContact CG-CD1 3.36Å; F133-L156 HydrophobicContact CG-CD2 3.77Å; F133-L156 HydrophobicContact CG-CG 4.01Å; F133-L156 HydrophobicContact CZ-CD1 4.19Å |
| 134 | F | 82.3 | Confident | 71.4 | Confident | 130 Ų | 130 | 86.4 Ų | 86.4 | 57% | 0.57 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -58.7 | -46.6 | -176.3 | -72.1 | -62.3 | 0 | 0 | 0 | 111.9 | V130 T131 K136 T137 | V130-F134 HydrophobicContact CG1-CD2 3.87Å; V130-F134 HydrophobicContact CG1-CE2 3.5Å; V130-F134 VanDerWaalsContact CG1-CE2 3.5Å; V130-F134 WeakPolarHBondContact O-CD2 3.4Å; V130-F134 PolarHBondContact O-N 3.22Å; T131-F134 PolarHBondContact O-N 2.87Å; F134-K136 VanDerWaalsContact C-N 3.26Å; F134-K136 PolarHBondContact O-N 3.48Å; F134-T137 WeakPolarHBondContact O-CB 3.22Å; F134-T137 PolarHBondContact O-N 2.94Å |
| 135 | V | 77.2 | Confident | 69.1 | Low | 77 Ų | 77 | 91.4 Ų | 91.4 | 47% | 0.467 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.3 | -29.1 | 178.3 | 173.8 | 0 | 0 | 0 | 0 | 112.9 | T131 F133 | T131-V135 HydrophobicContact CG2-CG2 4.25Å; T131-V135 WeakPolarHBondContact O-CB 3.38Å; T131-V135 WeakPolarHBondContact O-CG2 3.35Å; T131-V135 PolarHBondContact O-N 3.39Å; T131-V135 VanDerWaalsContact O-N 3.11Å; F133-V135 PolarHBondContact O-N 2.84Å |
| 136 | K | 69.4 | Low | 66.9 | Low | 116 Ų | 116 | 98 Ų | 98 | 50% | 0.504 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -78.9 | -32.8 | 176.2 | -79.2 | 178.3 | 174 | -167.3 | 0 | 113.1 | S132 F133 F134 E138 G139 | S132-K136 WeakPolarHBondContact O-CB 3.32Å; S132-K136 WeakPolarHBondContact O-CD 3.37Å; S132-K136 WeakPolarHBondContact O-CG 3.21Å; S132-K136 PolarHBondContact O-N 3.17Å; F133-K136 PolarHBondContact O-N 2.94Å; F133-K136 VanDerWaalsContact O-N 3.08Å; F134-K136 VanDerWaalsContact C-N 3.26Å; F134-K136 PolarHBondContact O-N 3.48Å; K136-E138 PolarHBondContact O-N 3.45Å; K136-G139 PolarHBondContact O-N 2.89Å |
| 137 | T | 61.4 | Low | 64.6 | Low | 81 Ų | 81 | 98.3 Ų | 98.3 | 50% | 0.497 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.2 | -31.1 | 178.8 | -60.1 | 0 | 0 | 0 | 0 | 112 | F133 F134 | F133-T137 PolarHBondContact O-N 3.4Å; F133-T137 PolarHBondContact O-OG1 2.86Å; F133-T137 VanDerWaalsContact O-OG1 3.07Å; F134-T137 WeakPolarHBondContact O-CB 3.22Å; F134-T137 PolarHBondContact O-N 2.94Å |
| 138 | E | 56.9 | Low | 62.2 | Low | 174 Ų | 174 | 96.4 Ų | 96.4 | 81% | 0.813 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -17.5 | 173.5 | -62.8 | -176.3 | 113 | 0 | 0 | 114.1 | K136 | K136-E138 PolarHBondContact O-N 3.45Š|
| 139 | G | 52.8 | Low | 60.3 | Low | 64 Ų | 64 | 103.5 Ų | 103.5 | 66% | 0.66 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.6 | -32.7 | -164.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | K136 | K136-G139 PolarHBondContact O-N 2.89Š|
| 140 | S | 43.1 | Very low | 58.2 | Low | 73 Ų | 73 | 109.6 Ų | 109.6 | 51% | 0.51 | 61% | 0.608 | S | S | . | * | trans | -168.8 | 124.6 | 172.8 | -173.1 | 0 | 0 | 0 | 0 | 112.1 | E142 | S140-E142 PolarHBondContact O-N 3Å; S140-E142 WeakPolarHBondContact OG-CB 3.4Å; S140-E142 PolarHBondContact OG-N 2.92Å; S140-E142 VanDerWaalsContact OG-N 3.16Å | ||
| 141 | Q | 42.5 | Very low | 56.4 | Low | 166 Ų | 166 | 110.7 Ų | 110.7 | 78% | 0.776 | 62% | 0.618 | S | S | * | * | trans | -77.2 | 48 | 160.6 | -84.8 | -80.6 | -1.9 | 0 | 0 | 110.9 | K143 | Q141-K143 PolarHBondContact O-N 3.47Å; Q141-K143 VanDerWaalsContact O-N 3.1Å | ||
| 142 | E | 40.8 | Very low | 55.1 | Low | 160 Ų | 160 | 115.7 Ų | 115.7 | 75% | 0.748 | 63% | 0.63 | S | S | * | * | trans | -76.6 | 100.8 | 170 | -111.6 | -172.9 | 144.3 | 0 | 0 | 109.5 | S140 T144 | S140-E142 PolarHBondContact O-N 3Å; S140-E142 WeakPolarHBondContact OG-CB 3.4Å; S140-E142 PolarHBondContact OG-N 2.92Å; S140-E142 VanDerWaalsContact OG-N 3.16Å; E142-T144 VanDerWaalsContact C-N 3.3Å; E142-T144 PolarHBondContact O-N 2.98Å | ||
| 143 | K | 44.9 | Very low | 54.1 | Low | 168 Ų | 168 | 119.7 Ų | 119.7 | 73% | 0.73 | 64% | 0.644 | S | S | * | * | trans | -59.9 | 84.2 | 174.8 | -66.8 | 175.7 | 179.8 | 176 | 0 | 111.4 | Q141 I145 | Q141-K143 PolarHBondContact O-N 3.47Å; Q141-K143 VanDerWaalsContact O-N 3.1Å; K143-I145 HydrophobicContact CB-CD1 4.12Å; K143-I145 HydrophobicContact CB-CG1 4.05Å; K143-I145 HydrophobicContact CD-CD1 4.11Å; K143-I145 HydrophobicContact CG-CD1 4.04Å; K143-I145 HydrophobicContact CG-CG1 4.43Å; K143-I145 PolarHBondContact O-N 2.88Å; K143-I145 VanDerWaalsContact O-N 3.07Å | ||
| 144 | T | 40.3 | Very low | 53.8 | Low | 132 Ų | 132 | 119.9 Ų | 119.9 | 81% | 0.81 | 65% | 0.649 | S | S | * | * | trans | -81.2 | 58.8 | 152.7 | 51.6 | 0 | 0 | 0 | 0 | 109.7 | E142 V146 | E142-T144 VanDerWaalsContact C-N 3.3Å; E142-T144 PolarHBondContact O-N 2.98Å; T144-V146 VanDerWaalsContact C-N 3.27Å; T144-V146 PolarHBondContact O-N 3.37Å; T144-V146 VanDerWaalsContact O-N 3.11Å | ||
| 145 | I | 46 | Very low | 53.6 | Low | 134 Ų | 134 | 117.9 Ų | 117.9 | 69% | 0.687 | 65% | 0.649 | S | S | * | * | trans | -78.1 | 85.4 | 165.3 | -56.9 | 172.8 | 0 | 0 | 0 | 106.2 | K143 | K143-I145 HydrophobicContact CB-CD1 4.12Å; K143-I145 HydrophobicContact CB-CG1 4.05Å; K143-I145 HydrophobicContact CD-CD1 4.11Å; K143-I145 HydrophobicContact CG-CD1 4.04Å; K143-I145 HydrophobicContact CG-CG1 4.43Å; K143-I145 PolarHBondContact O-N 2.88Å; K143-I145 VanDerWaalsContact O-N 3.07Å | ||
| 146 | V | 45.9 | Very low | 53.8 | Low | 141 Ų | 141 | 116.1 Ų | 116.1 | 86% | 0.855 | 64% | 0.637 | S | S | * | * | trans | -133.9 | 79.9 | 165.8 | -172.9 | 0 | 0 | 0 | 0 | 106.8 | T144 | T144-V146 VanDerWaalsContact C-N 3.27Å; T144-V146 PolarHBondContact O-N 3.37Å; T144-V146 VanDerWaalsContact O-N 3.11Å | ||
| 147 | T | 45.6 | Very low | 54.4 | Low | 85 Ų | 85 | 114.5 Ų | 114.5 | 52% | 0.521 | 63% | 0.634 | S | S | . | * | trans | -124.3 | 130.8 | 177.6 | -60.1 | 0 | 0 | 0 | 0 | 107.7 | Y152 | T147-Y152 HydrophobicContact CG2-CD2 4.18Š| ||
| 148 | A | 40.3 | Very low | 55.4 | Low | 60 Ų | 60 | 117.2 Ų | 117.2 | 50% | 0.496 | 64% | 0.635 | S | S | . | * | trans | -91.1 | 147.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | T51 C150 | T51-A148 HydrophobicContact CG2-CB 4.32Å; A148-C150 PolarHBondContact O-N 3.46Å | ||
| 149 | D | 49 | Very low | 56.6 | Low | 157 Ų | 157 | 112.9 Ų | 112.9 | 84% | 0.84 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | 114.7 | -175.2 | -61 | -61.6 | 0 | 0 | 0 | 112.7 | ||
| 150 | C | 46.1 | Very low | 58.3 | Low | 128 Ų | 128 | 111.3 Ų | 111.3 | 87% | 0.865 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 173.8 | -18.9 | 142.3 | -104.4 | 0 | 0 | 0 | 0 | 112.4 | A148 | A148-C150 PolarHBondContact O-N 3.46Š|
| 151 | C | 50.2 | Low | 60.4 | Low | 89 Ų | 89 | 111.5 Ų | 111.5 | 60% | 0.601 | 59% | 0.585 | S | S | * | * | trans | -143.6 | 88.9 | 178.6 | -76.1 | 0 | 0 | 0 | 0 | 111.6 | F153 | C151-F153 VanDerWaalsContact C-N 3.34Å; C151-F153 HydrophobicContact CB-CD2 4.16Å; C151-F153 HydrophobicContact CB-CE2 4.14Å; C151-F153 PolarHBondContact O-N 2.94Å | ||
| 152 | Y | 57.2 | Low | 62.4 | Low | 178 Ų | 178 | 108.2 Ų | 108.2 | 70% | 0.698 | 57% | 0.565 | S | S | * | * | trans | -75.3 | 82.5 | 176.3 | -169.2 | -91.2 | 0 | 0 | 0 | 111.2 | T147 | T147-Y152 HydrophobicContact CG2-CD2 4.18Š| ||
| 153 | F | 60.5 | Low | 64.8 | Low | 111 Ų | 111 | 101.9 Ų | 101.9 | 49% | 0.487 | 54% | 0.536 | S | S | . | . | trans | -83.8 | 120.3 | 169 | -79 | -67.8 | 0 | 0 | 0 | 110.9 | C151 L157 | C151-F153 VanDerWaalsContact C-N 3.34Å; C151-F153 HydrophobicContact CB-CD2 4.16Å; C151-F153 HydrophobicContact CB-CE2 4.14Å; C151-F153 PolarHBondContact O-N 2.94Å; F153-L157 HydrophobicContact CD1-CD2 3.83Å; F153-L157 HydrophobicContact CE1-CD2 4.13Å | ||
| 154 | N | 76.8 | Confident | 67 | Low | 93 Ų | 93 | 95.8 Ų | 95.8 | 50% | 0.497 | 51% | 0.51 | S | S | . | . | trans | -48.6 | 133.4 | 170.6 | -81 | -36.9 | 0 | 0 | 0 | 110.4 | L156 L157 R158 | N154-L156 PolarHBondContact O-N 3.23Å; N154-L157 HydrophobicContact CB-CB 4.45Å; N154-L157 PolarHBondContact O-N 3.26Å; N154-R158 PolarHBondContact O-N 2.93Å | ||
| 155 | P | 77.9 | Confident | 69.4 | Low | 88 Ų | 88 | 90.9 Ų | 90.9 | 57% | 0.571 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.7 | -24.1 | -175.2 | 22.7 | -33.3 | 0 | 0 | 0 | 113 | R159 | P155-R159 PolarHBondContact O-N 2.84Å |
| 156 | L | 82 | Confident | 71.6 | Confident | 41 Ų | 41 | 85.1 Ų | 85.1 | 22% | 0.215 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -64.9 | -51 | 170.2 | -55.7 | -178.3 | 0 | 0 | 0 | 112.5 | F133 N154 R158 R159 I160 | F133-L156 HydrophobicContact CB-CD1 3.72Å; F133-L156 HydrophobicContact CB-CD2 3.58Å; F133-L156 HydrophobicContact CB-CG 4.24Å; F133-L156 HydrophobicContact CD1-CD1 3.58Å; F133-L156 HydrophobicContact CD2-CD1 3.63Å; F133-L156 HydrophobicContact CD2-CD2 3.58Å; F133-L156 HydrophobicContact CD2-CG 3.84Å; F133-L156 HydrophobicContact CE1-CD1 3.99Å; F133-L156 HydrophobicContact CE2-CD1 4.02Å; F133-L156 HydrophobicContact CE2-CD2 4.43Å; F133-L156 HydrophobicContact CE2-CG 4.29Å; F133-L156 HydrophobicContact CG-CD1 3.36Å; F133-L156 HydrophobicContact CG-CD2 3.77Å; F133-L156 HydrophobicContact CG-CG 4.01Å; F133-L156 HydrophobicContact CZ-CD1 4.19Å; N154-L156 PolarHBondContact O-N 3.23Å; L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 3.46Å; L156-R159 PolarHBondContact O-N 3.43Å; L156-I160 WeakPolarHBondContact O-CG1 3.44Å; L156-I160 PolarHBondContact O-N 3.41Å |
| 157 | L | 81.6 | Confident | 74 | Confident | 82 Ų | 82 | 78.6 Ų | 78.6 | 43% | 0.429 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.7 | -41.8 | -176.1 | -167.1 | 148.3 | 0 | 0 | 0 | 110.2 | F153 N154 R159 I160 V161 | F153-L157 HydrophobicContact CD1-CD2 3.83Å; F153-L157 HydrophobicContact CE1-CD2 4.13Å; N154-L157 HydrophobicContact CB-CB 4.45Å; N154-L157 PolarHBondContact O-N 3.26Å; L157-R159 PolarHBondContact O-N 3.3Å; L157-I160 PolarHBondContact O-N 2.96Å; L157-V161 HydrophobicContact CD2-CG2 3.73Å; L157-V161 HydrophobicContact CG-CG2 4.41Å; L157-V161 VanDerWaalsContact O-CB 3.32Å; L157-V161 WeakPolarHBondContact O-CB 3.42Å; L157-V161 VanDerWaalsContact O-CG2 3.25Å; L157-V161 WeakPolarHBondContact O-CG2 3.43Å; L157-V161 PolarHBondContact O-N 2.86Å |
| 158 | R | 82.1 | Confident | 76.4 | Confident | 138 Ų | 138 | 76.4 Ų | 76.4 | 52% | 0.521 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -53.1 | -41.8 | 171.5 | -177.1 | -172.7 | -65.4 | -107.4 | 2.2 | 112.4 | N154 L156 R162 | N154-R158 PolarHBondContact O-N 2.93Å; L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 3.46Å; R158-R162 WeakPolarHBondContact O-CB 3.35Å; R158-R162 PolarHBondContact O-N 3.36Å; R158-R162 VanDerWaalsContact O-N 3.16Å |
| 159 | R | 83 | Confident | 79 | Confident | 83 Ų | 83 | 76.5 Ų | 76.5 | 31% | 0.313 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -79.2 | -41.1 | -176.3 | -164.8 | -163.7 | -95.1 | -162.8 | -16.3 | 112.4 | E129 P155 L156 L157 R162 F163 | E129-R159 WeakPolarHBondContact OE1-CD 3.35Å; E129-R159 IonicContact OE1-NH1 3.46Å; E129-R159 WeakPolarHBondContact OE2-CD 3.2Å; E129-R159 IonicContact OE2-CZ 3.64Å; E129-R159 IonicContact OE2-NE 2.74Å; E129-R159 IonicContact OE2-NH1 3.86Å; E129-R159 PolarHBondContact OE2-NH1 3.47Å; P155-R159 PolarHBondContact O-N 2.84Å; L156-R159 PolarHBondContact O-N 3.43Å; L157-R159 PolarHBondContact O-N 3.3Å; R159-R162 PolarHBondContact O-N 3.33Å; R159-F163 HydrophobicContact CG-CD2 3.97Å; R159-F163 HydrophobicContact CG-CE2 3.79Å; R159-F163 WeakPolarHBondContact O-CD2 3.33Å; R159-F163 PolarHBondContact O-N 3.07Å |
| 160 | I | 88.4 | Confident | 81.2 | Confident | 30 Ų | 30 | 69 Ų | 69 | 15% | 0.154 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -58.5 | -51.6 | 172.5 | -69 | 164.6 | 0 | 0 | 0 | 109.7 | L126 E129 L156 L157 R162 F163 L164 | L126-I160 HydrophobicContact CD2-CD1 4.15Å; L126-I160 HydrophobicContact CD2-CG2 3.84Å; E129-I160 HydrophobicContact CB-CD1 4.2Å; E129-I160 HydrophobicContact CB-CG1 3.79Å; E129-I160 HydrophobicContact CG-CG1 3.8Å; L156-I160 WeakPolarHBondContact O-CG1 3.44Å; L156-I160 PolarHBondContact O-N 3.41Å; L157-I160 PolarHBondContact O-N 2.96Å; I160-R162 VanDerWaalsContact C-N 3.26Å; I160-R162 PolarHBondContact O-N 2.98Å; I160-F163 PolarHBondContact O-N 3.36Å; I160-L164 HydrophobicContact CG2-CD1 3.62Å; I160-L164 HydrophobicContact CG2-CG 4.15Å; I160-L164 WeakPolarHBondContact O-CB 3.31Å; I160-L164 WeakPolarHBondContact O-CG 3.3Å; I160-L164 PolarHBondContact O-N 3.42Å |
| 161 | V | 86.6 | Confident | 83.7 | Confident | 77 Ų | 77 | 63.9 Ų | 63.9 | 47% | 0.467 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -55.9 | -41.9 | 176.5 | 168 | 0 | 0 | 0 | 0 | 111.1 | L157 G165 | L157-V161 HydrophobicContact CD2-CG2 3.73Å; L157-V161 HydrophobicContact CG-CG2 4.41Å; L157-V161 VanDerWaalsContact O-CB 3.32Å; L157-V161 WeakPolarHBondContact O-CB 3.42Å; L157-V161 VanDerWaalsContact O-CG2 3.25Å; L157-V161 WeakPolarHBondContact O-CG2 3.43Å; L157-V161 PolarHBondContact O-N 2.86Å; V161-G165 WeakPolarHBondContact O-CA 3.47Å; V161-G165 PolarHBondContact O-N 3.47Å |
| 162 | R | 86.1 | Confident | 85.9 | Confident | 97 Ų | 97 | 62.7 Ų | 62.7 | 37% | 0.366 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.9 | -46.3 | 177.8 | -177.1 | 174.1 | 163.3 | -147.6 | -23.7 | 113.1 | R158 R159 I160 V166 F315 | R158-R162 WeakPolarHBondContact O-CB 3.35Å; R158-R162 PolarHBondContact O-N 3.36Å; R158-R162 VanDerWaalsContact O-N 3.16Å; R159-R162 PolarHBondContact O-N 3.33Å; I160-R162 VanDerWaalsContact C-N 3.26Å; I160-R162 PolarHBondContact O-N 2.98Å; R162-V166 WeakPolarHBondContact O-CG2 3.27Å; R162-V166 PolarHBondContact O-N 3.04Å; R162-V166 VanDerWaalsContact O-N 3.14Å; R162-F315 VanDerWaalsContact NH2-CD2 3.28Å |
| 163 | F | 89.3 | Confident | 87.8 | Confident | 28 Ų | 28 | 54.9 Ų | 54.9 | 12% | 0.123 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -71.1 | -36 | 178.9 | -77.8 | -61.9 | 0 | 0 | 0 | 113 | I125 E129 R159 I160 Y167 Y246 Y250 I312 | I125-F163 HydrophobicContact CD1-CB 4.36Å; I125-F163 HydrophobicContact CG2-CB 3.96Å; E129-F163 VanDerWaalsContact OE1-CD2 3.23Å; E129-F163 WeakPolarHBondContact OE1-CD2 3.18Å; E129-F163 WeakPolarHBondContact OE1-CE2 3.3Å; R159-F163 HydrophobicContact CG-CD2 3.97Å; R159-F163 HydrophobicContact CG-CE2 3.79Å; R159-F163 WeakPolarHBondContact O-CD2 3.33Å; R159-F163 PolarHBondContact O-N 3.07Å; I160-F163 PolarHBondContact O-N 3.36Å; F163-Y167 VanDerWaalsContact O-CB 3.27Å; F163-Y167 WeakPolarHBondContact O-CB 3.25Å; F163-Y167 PolarHBondContact O-N 3.43Å; F163-Y167 VanDerWaalsContact O-N 3.1Å; F163-Y246 PolarHBondContact O-OH 2.98Å; F163-Y250 HydrophobicContact CD1-CD2 4.26Å; F163-Y250 HydrophobicContact CD1-CE2 4.48Å; F163-Y250 HydrophobicContact CD2-CE2 4.05Å; F163-Y250 HydrophobicContact CE1-CD2 4.32Å; F163-Y250 HydrophobicContact CE2-CE2 4.16Å; F163-Y250 HydrophobicContact CG-CD2 4.41Å; F163-Y250 HydrophobicContact CG-CE2 4.23Å; F163-Y250 HydrophobicContact CZ-CE2 4.43Å; F163-I312 HydrophobicContact CD1-CD1 4.01Å; F163-I312 HydrophobicContact CE1-CD1 3.97Å; F163-I312 HydrophobicContact CE1-CG1 4.37Å; F163-I312 HydrophobicContact CE1-CG2 4.01Å |
| 164 | L | 92.3 | Very high | 89.6 | Confident | 39 Ų | 39 | 49.6 Ų | 49.6 | 20% | 0.204 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -73.9 | -34.1 | 175.6 | -66.6 | -176.4 | 0 | 0 | 0 | 112.4 | T122 I125 I160 Y167 S168 | T122-L164 HydrophobicContact CG2-CD2 3.85Å; I125-L164 HydrophobicContact CB-CD2 4.17Å; I125-L164 HydrophobicContact CD1-CD2 3.73Å; I125-L164 HydrophobicContact CG2-CD2 4.09Å; I125-L164 HydrophobicContact CG2-CG 4.28Å; I160-L164 HydrophobicContact CG2-CD1 3.62Å; I160-L164 HydrophobicContact CG2-CG 4.15Å; I160-L164 WeakPolarHBondContact O-CB 3.31Å; I160-L164 WeakPolarHBondContact O-CG 3.3Å; I160-L164 PolarHBondContact O-N 3.42Å; L164-Y167 PolarHBondContact O-N 3.3Å; L164-S168 VanDerWaalsContact O-CB 3.29Å; L164-S168 WeakPolarHBondContact O-CB 3.39Å; L164-S168 PolarHBondContact O-N 3.26Å; L164-S168 PolarHBondContact O-OG 3.09Å |
| 165 | G | 91.3 | Very high | 90.5 | Very high | 29 Ų | 29 | 46 Ų | 46 | 30% | 0.299 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.7 | -52.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | V161 Y167 S168 F169 | V161-G165 WeakPolarHBondContact O-CA 3.47Å; V161-G165 PolarHBondContact O-N 3.47Å; G165-Y167 VanDerWaalsContact C-N 3.28Å; G165-Y167 PolarHBondContact O-N 3.04Å; G165-S168 PolarHBondContact O-N 3.42Å; G165-F169 WeakPolarHBondContact O-CB 3.28Å; G165-F169 PolarHBondContact O-N 3.03Å |
| 166 | V | 92.1 | Very high | 91.4 | Very high | 13 Ų | 13 | 43 Ų | 43 | 8% | 0.079 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.9 | -36.8 | 175.4 | 177.2 | 0 | 0 | 0 | 0 | 111.7 | R162 G170 Y246 L307 V311 I312 | R162-V166 WeakPolarHBondContact O-CG2 3.27Å; R162-V166 PolarHBondContact O-N 3.04Å; R162-V166 VanDerWaalsContact O-N 3.14Å; V166-G170 PolarHBondContact O-N 3.47Å; V166-G170 VanDerWaalsContact O-N 3.15Å; V166-Y246 HydrophobicContact CG1-CE2 4.12Å; V166-L307 HydrophobicContact CG1-CB 4.23Å; V166-V311 HydrophobicContact CG1-CG1 4.47Å; V166-V311 HydrophobicContact CG2-CG1 3.99Å; V166-I312 HydrophobicContact CG1-CD1 4.32Å; V166-I312 HydrophobicContact CG1-CG1 4.42Å |
| 167 | Y | 95.3 | Very high | 92.1 | Very high | 4 Ų | 4 | 47.3 Ų | 47.3 | 2% | 0.016 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.4 | -49.8 | 174.1 | -178.7 | -106.6 | 0 | 0 | 0 | 112.2 | V117 P121 F163 L164 G165 F169 G170 L171 Y242 S243 Y246 | V117-Y167 PolarHBondContact O-OH 3.38Å; P121-Y167 HydrophobicContact CB-CD1 4.28Å; P121-Y167 HydrophobicContact CB-CD2 4.31Å; P121-Y167 HydrophobicContact CB-CE1 4.03Å; P121-Y167 HydrophobicContact CB-CE2 4.05Å; P121-Y167 HydrophobicContact CB-CG 4.44Å; P121-Y167 HydrophobicContact CG-CE1 4Å; P121-Y167 HydrophobicContact CG-CE2 3.94Å; F163-Y167 VanDerWaalsContact O-CB 3.27Å; F163-Y167 WeakPolarHBondContact O-CB 3.25Å; F163-Y167 PolarHBondContact O-N 3.43Å; F163-Y167 VanDerWaalsContact O-N 3.1Å; L164-Y167 PolarHBondContact O-N 3.3Å; G165-Y167 VanDerWaalsContact C-N 3.28Å; G165-Y167 PolarHBondContact O-N 3.04Å; Y167-F169 VanDerWaalsContact C-N 3.35Å; Y167-F169 PolarHBondContact O-N 2.99Å; Y167-G170 PolarHBondContact O-N 2.94Å; Y167-L171 HydrophobicContact CE1-CD2 4.3Å; Y167-L171 WeakPolarHBondContact O-CB 3.38Å; Y167-L171 PolarHBondContact O-N 3.28Å; Y167-Y242 WeakPolarHBondContact CA-OH 3.24Å; Y167-Y242 AromaticContact CD2-CE1 3.77Å; Y167-Y242 HydrophobicContact CD2-CE1 3.77Å; Y167-Y242 AromaticContact CE2-CD1 3.99Å; Y167-Y242 HydrophobicContact CE2-CD1 3.99Å; Y167-Y242 AromaticContact CE2-CE1 3.31Å; Y167-Y242 HydrophobicContact CE2-CE1 3.31Å; Y167-Y242 AromaticContact CZ-CE1 3.93Å; Y167-Y242 PolarHBondContact O-OH 3.02Å; Y167-S243 WeakPolarHBondContact OH-CB 3.23Å; Y167-S243 PolarHBondContact OH-OG 3.25Å; Y167-Y246 AromaticContact CD2-CD1 3.4Å; Y167-Y246 HydrophobicContact CD2-CD1 3.4Å; Y167-Y246 VanDerWaalsContact CD2-CD1 3.4Å; Y167-Y246 HydrophobicContact CD2-CD2 4.31Å; Y167-Y246 AromaticContact CD2-CE1 3.75Å; Y167-Y246 HydrophobicContact CD2-CE1 3.75Å; Y167-Y246 AromaticContact CD2-CG 3.7Å; Y167-Y246 HydrophobicContact CD2-CG 3.7Å; Y167-Y246 HydrophobicContact CE2-CD1 4.19Å; Y167-Y246 HydrophobicContact CE2-CG 4.3Å; Y167-Y246 HydrophobicContact CG-CD1 4.19Å; Y167-Y246 HydrophobicContact CG-CE1 4.1Å; Y167-Y246 PolarHBondContact N-OH 2.85Å |
| 168 | S | 95.8 | Very high | 92.8 | Very high | 39 Ų | 39 | 43.4 Ų | 43.4 | 27% | 0.273 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -62.1 | -43.4 | 179.9 | -56.5 | 0 | 0 | 0 | 0 | 111.2 | L164 G165 G170 L171 F172 | L164-S168 VanDerWaalsContact O-CB 3.29Å; L164-S168 WeakPolarHBondContact O-CB 3.39Å; L164-S168 PolarHBondContact O-N 3.26Å; L164-S168 PolarHBondContact O-OG 3.09Å; G165-S168 PolarHBondContact O-N 3.42Å; S168-G170 PolarHBondContact O-N 3.38Å; S168-L171 WeakPolarHBondContact O-CB 3.35Å; S168-L171 PolarHBondContact O-N 2.97Å; S168-F172 WeakPolarHBondContact O-CD2 3.24Å; S168-F172 PolarHBondContact O-N 2.88Å |
| 169 | F | 95.3 | Very high | 93.5 | Very high | 63 Ų | 63 | 37.1 Ų | 37.1 | 28% | 0.276 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -55 | -51.2 | 175.5 | 178.4 | -102 | 0 | 0 | 0 | 111.6 | I64 M65 T68 G165 Y167 L171 F172 A173 L307 | I64-F169 HydrophobicContact CG2-CD2 4.2Å; I64-F169 HydrophobicContact CG2-CE2 3.71Å; M65-F169 VanDerWaalsContact SD-CA 3.58Å; M65-F169 HydrophobicContact SD-CB 3.55Å; M65-F169 VanDerWaalsContact SD-CB 3.55Å; M65-F169 HydrophobicContact SD-CD2 3.98Å; M65-F169 HydrophobicContact SD-CG 4.28Å; T68-F169 HydrophobicContact CG2-CD2 4.14Å; T68-F169 HydrophobicContact CG2-CE2 3.74Å; G165-F169 WeakPolarHBondContact O-CB 3.28Å; G165-F169 PolarHBondContact O-N 3.03Å; Y167-F169 VanDerWaalsContact C-N 3.35Å; Y167-F169 PolarHBondContact O-N 2.99Å; F169-L171 VanDerWaalsContact C-N 3.31Å; F169-L171 PolarHBondContact O-N 2.95Å; F169-F172 PolarHBondContact O-N 3.4Å; F169-A173 VanDerWaalsContact O-CB 3.32Å; F169-A173 WeakPolarHBondContact O-CB 3.47Å; F169-A173 PolarHBondContact O-N 3.15Å; F169-L307 HydrophobicContact CD1-CD1 4.22Å; F169-L307 HydrophobicContact CD1-CD2 3.88Å; F169-L307 HydrophobicContact CE1-CD2 3.97Å |
| 170 | G | 96.3 | Very high | 94 | Very high | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -68.1 | -29.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | V166 Y167 S168 T174 Y242 | V166-G170 PolarHBondContact O-N 3.47Å; V166-G170 VanDerWaalsContact O-N 3.15Å; Y167-G170 PolarHBondContact O-N 2.94Å; S168-G170 PolarHBondContact O-N 3.38Å; G170-T174 VanDerWaalsContact O-CB 3.32Å; G170-T174 WeakPolarHBondContact O-CB 3.31Å; G170-T174 PolarHBondContact O-N 2.8Å; G170-T174 PolarHBondContact O-OG1 3Å; G170-Y242 VanDerWaalsContact C-CZ 3.45Å; G170-Y242 WeakPolarHBondContact CA-OH 3.21Å |
| 171 | L | 97.3 | Very high | 94.4 | Very high | 20 Ų | 20 | 33.9 Ų | 33.9 | 11% | 0.105 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.7 | -52 | 173.3 | -172.7 | 67.3 | 0 | 0 | 0 | 110.8 | V117 T118 Y167 S168 F169 A173 T174 T175 L239 Y242 | V117-L171 HydrophobicContact CG1-CD1 3.44Å; V117-L171 VanDerWaalsContact CG1-CD1 3.44Å; V117-L171 HydrophobicContact CG1-CD2 4.38Å; T118-L171 HydrophobicContact CG2-CD2 3.95Å; Y167-L171 HydrophobicContact CE1-CD2 4.3Å; Y167-L171 WeakPolarHBondContact O-CB 3.38Å; Y167-L171 PolarHBondContact O-N 3.28Å; S168-L171 WeakPolarHBondContact O-CB 3.35Å; S168-L171 PolarHBondContact O-N 2.97Å; F169-L171 VanDerWaalsContact C-N 3.31Å; F169-L171 PolarHBondContact O-N 2.95Å; L171-A173 PolarHBondContact O-N 2.91Å; L171-T174 PolarHBondContact O-N 3.36Å; L171-T175 PolarHBondContact O-N 3.25Å; L171-T175 PolarHBondContact O-OG1 3.43Å; L171-L239 HydrophobicContact CD1-CD2 3.7Å; L171-Y242 HydrophobicContact CB-CD1 4.48Å; L171-Y242 HydrophobicContact CB-CE1 4Å; L171-Y242 HydrophobicContact CD1-CD1 4.14Å; L171-Y242 HydrophobicContact CD1-CE1 4.42Å |
| 172 | F | 97.3 | Very high | 94.8 | Very high | 63 Ų | 63 | 30.9 Ų | 30.9 | 28% | 0.276 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -64 | -39.4 | 176.4 | -70.8 | -66 | 0 | 0 | 0 | 112.5 | M65 V69 A72 S168 F169 T174 T175 I176 | M65-F172 HydrophobicContact CE-CD2 4.06Å; M65-F172 HydrophobicContact CE-CE2 4.35Å; V69-F172 HydrophobicContact CG2-CD1 4.27Å; V69-F172 HydrophobicContact CG2-CD2 3.74Å; V69-F172 HydrophobicContact CG2-CE1 4.07Å; V69-F172 HydrophobicContact CG2-CE2 3.54Å; V69-F172 HydrophobicContact CG2-CG 4.14Å; V69-F172 HydrophobicContact CG2-CZ 3.73Å; A72-F172 HydrophobicContact CB-CD1 3.88Å; S168-F172 WeakPolarHBondContact O-CD2 3.24Å; S168-F172 PolarHBondContact O-N 2.88Å; F169-F172 PolarHBondContact O-N 3.4Å; F172-T174 VanDerWaalsContact C-N 3.34Å; F172-T174 PolarHBondContact O-N 2.92Å; F172-T175 WeakPolarHBondContact O-CB 3.38Å; F172-T175 PolarHBondContact O-N 3.47Å; F172-I176 WeakPolarHBondContact O-CD1 3.14Å; F172-I176 VanDerWaalsContact O-CG1 3.29Å; F172-I176 WeakPolarHBondContact O-CG1 3.29Å; F172-I176 PolarHBondContact O-N 3.48Å |
| 173 | A | 96.7 | Very high | 95.2 | Very high | 14 Ų | 14 | 27.1 Ų | 27.1 | 12% | 0.116 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -59.4 | -44.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | F169 L171 T175 I176 F177 | F169-A173 VanDerWaalsContact O-CB 3.32Å; F169-A173 WeakPolarHBondContact O-CB 3.47Å; F169-A173 PolarHBondContact O-N 3.15Å; L171-A173 PolarHBondContact O-N 2.91Å; A173-T175 PolarHBondContact O-N 2.9Å; A173-I176 PolarHBondContact O-N 2.85Å; A173-F177 VanDerWaalsContact O-CD2 3.23Å; A173-F177 WeakPolarHBondContact O-CD2 3.29Å; A173-F177 PolarHBondContact O-N 2.91Å |
| 174 | T | 97.6 | Very high | 95.4 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.7 | -41.1 | 176.7 | -56.3 | 0 | 0 | 0 | 0 | 111.5 | G170 L171 F172 F177 A178 A238 L239 I303 | G170-T174 VanDerWaalsContact O-CB 3.32Å; G170-T174 WeakPolarHBondContact O-CB 3.31Å; G170-T174 PolarHBondContact O-N 2.8Å; G170-T174 PolarHBondContact O-OG1 3Å; L171-T174 PolarHBondContact O-N 3.36Å; F172-T174 VanDerWaalsContact C-N 3.34Å; F172-T174 PolarHBondContact O-N 2.92Å; T174-F177 PolarHBondContact O-N 3.48Å; T174-A178 WeakPolarHBondContact O-CB 3.34Å; T174-A178 PolarHBondContact O-N 2.87Å; T174-A238 HydrophobicContact CG2-CB 3.72Å; T174-L239 HydrophobicContact CG2-CD2 3.82Å; T174-L239 HydrophobicContact CG2-CG 4.46Å; T174-I303 HydrophobicContact CG2-CD1 4.37Å; T174-I303 WeakPolarHBondContact OG1-CD1 3.23Å |
| 175 | T | 96.8 | Very high | 95.5 | Very high | 19 Ų | 19 | 31 Ų | 31 | 12% | 0.117 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.7 | -46.9 | 172.5 | -59.8 | 0 | 0 | 0 | 0 | 111.8 | A72 L171 F172 A173 A178 N179 L239 | A72-T175 HydrophobicContact CB-CG2 4.37Å; L171-T175 PolarHBondContact O-N 3.25Å; L171-T175 PolarHBondContact O-OG1 3.43Å; F172-T175 WeakPolarHBondContact O-CB 3.38Å; F172-T175 PolarHBondContact O-N 3.47Å; A173-T175 PolarHBondContact O-N 2.9Å; T175-A178 PolarHBondContact O-N 2.9Å; T175-N179 WeakPolarHBondContact O-CB 3.47Å; T175-N179 PolarHBondContact O-N 3.48Å; T175-L239 WeakPolarHBondContact OG1-CD2 3.3Å |
| 176 | I | 96.6 | Very high | 95.6 | Very high | 24 Ų | 24 | 29.6 Ų | 29.6 | 12% | 0.123 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.3 | -49.1 | 178.5 | -68.1 | 158.8 | 0 | 0 | 0 | 110.7 | L71 A72 F75 F172 A173 A178 N179 A180 | L71-I176 HydrophobicContact CB-CD1 4.17Å; L71-I176 HydrophobicContact CD2-CD1 4.08Å; L71-I176 HydrophobicContact CD2-CG2 4.27Å; L71-I176 HydrophobicContact CG-CD1 4.13Å; L71-I176 HydrophobicContact CG-CG1 4.31Å; A72-I176 HydrophobicContact CB-CD1 4.31Å; A72-I176 HydrophobicContact CB-CG1 3.9Å; F75-I176 HydrophobicContact CD2-CG2 4.11Å; F75-I176 HydrophobicContact CE2-CG2 3.98Å; F172-I176 WeakPolarHBondContact O-CD1 3.14Å; F172-I176 VanDerWaalsContact O-CG1 3.29Å; F172-I176 WeakPolarHBondContact O-CG1 3.29Å; F172-I176 PolarHBondContact O-N 3.48Å; A173-I176 PolarHBondContact O-N 2.85Å; I176-A178 VanDerWaalsContact C-N 3.34Å; I176-A178 PolarHBondContact O-N 3.45Å; I176-N179 PolarHBondContact O-N 3.42Å; I176-A180 WeakPolarHBondContact O-CB 3.29Å; I176-A180 PolarHBondContact O-N 3.24Å |
| 177 | F | 96.7 | Very high | 95.8 | Very high | 131 Ų | 131 | 30.3 Ų | 30.3 | 58% | 0.575 | 17% | 0.169 | S | C | * | . | H | α-helix | trans | -60.6 | -41.7 | 178.5 | -85 | -69.4 | 0 | 0 | 0 | 112.3 | A173 T174 G181 T299 I303 | A173-F177 VanDerWaalsContact O-CD2 3.23Å; A173-F177 WeakPolarHBondContact O-CD2 3.29Å; A173-F177 PolarHBondContact O-N 2.91Å; T174-F177 PolarHBondContact O-N 3.48Å; F177-G181 PolarHBondContact O-N 3.43Å; F177-T299 HydrophobicContact CB-CG2 4.25Å; F177-I303 HydrophobicContact CB-CD1 4.39Å; F177-I303 HydrophobicContact CD2-CD1 3.69Å; F177-I303 HydrophobicContact CE2-CD1 4.38Å; F177-I303 HydrophobicContact CG-CD1 4.31Å |
| 178 | A | 96.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -66.5 | -50.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | T174 T175 I176 A180 G181 Q182 P233 K235 | T174-A178 WeakPolarHBondContact O-CB 3.34Å; T174-A178 PolarHBondContact O-N 2.87Å; T175-A178 PolarHBondContact O-N 2.9Å; I176-A178 VanDerWaalsContact C-N 3.34Å; I176-A178 PolarHBondContact O-N 3.45Å; A178-A180 PolarHBondContact O-N 2.99Å; A178-G181 PolarHBondContact O-N 3.46Å; A178-Q182 WeakPolarHBondContact O-CG 3.4Å; A178-Q182 PolarHBondContact O-N 2.98Å; A178-P233 HydrophobicContact CB-CG 4.44Å; A178-K235 HydrophobicContact CB-CB 3.89Å; A178-K235 HydrophobicContact CB-CG 4.02Å |
| 179 | N | 95.7 | Very high | 95.8 | Very high | 6 Ų | 6 | 28.6 Ų | 28.6 | 3% | 0.032 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -65 | -40.4 | -179.8 | -73.2 | -16.6 | 0 | 0 | 0 | 111.9 | F75 E76 T175 I176 Q182 V183 K235 | F75-N179 HydrophobicContact CB-CB 3.77Å; F75-N179 HydrophobicContact CD1-CB 4.35Å; F75-N179 HydrophobicContact CG-CB 4.25Å; E76-N179 PolarHBondContact OE2-ND2 3.46Å; E76-N179 PolarHBondContact OE2-OD1 3.27Å; T175-N179 WeakPolarHBondContact O-CB 3.47Å; T175-N179 PolarHBondContact O-N 3.48Å; I176-N179 PolarHBondContact O-N 3.42Å; N179-Q182 PolarHBondContact O-N 2.98Å; N179-V183 WeakPolarHBondContact O-CG2 3.12Å; N179-V183 PolarHBondContact O-N 3.23Å; N179-K235 WeakPolarHBondContact OD1-CD 3.46Å; N179-K235 PolarHBondContact OD1-NZ 3.4Å |
| 180 | A | 95.1 | Very high | 95.9 | Very high | 27 Ų | 27 | 26 Ų | 26 | 22% | 0.223 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -61.8 | -43.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | F75 I176 A178 Q182 V183 V184 | F75-A180 HydrophobicContact CE1-CB 4.1Å; F75-A180 HydrophobicContact CZ-CB 4.03Å; I176-A180 WeakPolarHBondContact O-CB 3.29Å; I176-A180 PolarHBondContact O-N 3.24Å; A178-A180 PolarHBondContact O-N 2.99Å; A180-Q182 VanDerWaalsContact C-N 3.33Å; A180-Q182 PolarHBondContact O-N 2.69Å; A180-V183 PolarHBondContact O-N 2.94Å; A180-V184 VanDerWaalsContact O-CB 3.29Å; A180-V184 WeakPolarHBondContact O-CB 3.48Å; A180-V184 VanDerWaalsContact O-CG2 3.24Å; A180-V184 WeakPolarHBondContact O-CG2 3.47Å; A180-V184 PolarHBondContact O-N 2.83Å |
| 181 | G | 95.4 | Very high | 95.8 | Very high | 18 Ų | 18 | 26.7 Ų | 26.7 | 19% | 0.186 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.4 | -41.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113 | F177 A178 T185 F232 | F177-G181 PolarHBondContact O-N 3.43Å; A178-G181 PolarHBondContact O-N 3.46Å; G181-T185 WeakPolarHBondContact O-CB 3.38Å; G181-T185 WeakPolarHBondContact O-CG2 3.32Å; G181-T185 PolarHBondContact O-N 2.69Å; G181-T185 PolarHBondContact O-OG1 3.21Å; G181-F232 CarbonylContact C-O 3.45Å |
| 182 | Q | 95.8 | Very high | 95.8 | Very high | 15 Ų | 15 | 25.8 Ų | 25.8 | 7% | 0.07 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.6 | -43.9 | 177.2 | -72.2 | 175.2 | -0.5 | 0 | 0 | 112.5 | A178 N179 A180 G186 K230 F232 P233 | A178-Q182 WeakPolarHBondContact O-CG 3.4Å; A178-Q182 PolarHBondContact O-N 2.98Å; N179-Q182 PolarHBondContact O-N 2.98Å; A180-Q182 VanDerWaalsContact C-N 3.33Å; A180-Q182 PolarHBondContact O-N 2.69Å; Q182-G186 WeakPolarHBondContact O-CA 3.38Å; Q182-G186 PolarHBondContact O-N 3.18Å; Q182-K230 HydrophobicContact CB-CB 3.92Å; Q182-K230 HydrophobicContact CB-CG 4.16Å; Q182-K230 VanDerWaalsContact CD-O 3.28Å; Q182-K230 HydrophobicContact CG-CB 4.14Å; Q182-K230 WeakPolarHBondContact CG-O 3.34Å; Q182-K230 PolarHBondContact NE2-O 2.89Å; Q182-F232 WeakPolarHBondContact CA-O 3.46Å; Q182-F232 WeakPolarHBondContact CG-O 3.38Å; Q182-F232 PolarHBondContact N-O 3.21Å; Q182-F232 VanDerWaalsContact N-O 3.14Å; Q182-P233 PolarHBondContact NE2-O 3.19Å |
| 183 | V | 94.5 | Very high | 95.7 | Very high | 17 Ų | 17 | 23.3 Ų | 23.3 | 10% | 0.103 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -69.4 | -44.9 | 178.5 | 172.6 | 0 | 0 | 0 | 0 | 111.6 | F81 P82 V83 H84 N179 A180 | F81-V183 HydrophobicContact CB-CG1 3.79Å; P82-V183 WeakPolarHBondContact O-CG1 3.22Å; V83-V183 HydrophobicContact CG2-CG2 4.39Å; H84-V183 WeakPolarHBondContact CB-O 3.36Å; H84-V183 PolarHBondContact N-O 3.16Å; N179-V183 WeakPolarHBondContact O-CG2 3.12Å; N179-V183 PolarHBondContact O-N 3.23Å; A180-V183 PolarHBondContact O-N 2.94Å |
| 184 | V | 94.3 | Very high | 95.6 | Very high | 109 Ų | 109 | 24.4 Ų | 24.4 | 66% | 0.661 | 14% | 0.141 | S | C | * | . | H | α-helix | trans | -69.7 | -42.3 | -177.7 | 170 | 0 | 0 | 0 | 0 | 112 | H84 A180 | H84-V184 WeakPolarHBondContact CB-O 3.24Å; A180-V184 VanDerWaalsContact O-CB 3.29Å; A180-V184 WeakPolarHBondContact O-CB 3.48Å; A180-V184 VanDerWaalsContact O-CG2 3.24Å; A180-V184 WeakPolarHBondContact O-CG2 3.47Å; A180-V184 PolarHBondContact O-N 2.83Å |
| 185 | T | 94 | Very high | 95.5 | Very high | 39 Ų | 39 | 24.7 Ų | 24.7 | 24% | 0.239 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -80.7 | -42 | -179.5 | 62.9 | 0 | 0 | 0 | 0 | 112.4 | Q86 G181 N187 F232 | Q86-T185 PolarHBondContact NE2-O 2.89Å; G181-T185 WeakPolarHBondContact O-CB 3.38Å; G181-T185 WeakPolarHBondContact O-CG2 3.32Å; G181-T185 PolarHBondContact O-N 2.69Å; G181-T185 PolarHBondContact O-OG1 3.21Å; T185-N187 PolarHBondContact O-N 2.98Å; T185-F232 HydrophobicContact CG2-CD1 3.72Å; T185-F232 HydrophobicContact CG2-CE1 4.16Å; T185-F232 PolarHBondContact OG1-O 3.42Å |
| 186 | G | 93.3 | Very high | 95.4 | Very high | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 14% | 0.138 | C | C | . | . | trans | 64.8 | 23.8 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | H84 Q182 R229 | H84-G186 WeakPolarHBondContact O-CA 3.29Å; Q182-G186 WeakPolarHBondContact O-CA 3.38Å; Q182-G186 PolarHBondContact O-N 3.18Å; G186-R229 CarbonylContact C-O 3.47Å; G186-R229 VanDerWaalsContact CA-O 3.26Å; G186-R229 WeakPolarHBondContact CA-O 3.09Å | ||
| 187 | N | 95 | Very high | 95.3 | Very high | 28 Ų | 28 | 30.9 Ų | 30.9 | 15% | 0.15 | 16% | 0.164 | C | C | . | . | P | Polyproline II helix | trans | -65.3 | 136.7 | -174.8 | -170.4 | 30.5 | 0 | 0 | 0 | 111.8 | T185 R229 S231 F232 D292 | T185-N187 PolarHBondContact O-N 2.98Å; N187-R229 PolarHBondContact N-O 3.41Å; N187-R229 CarbonylContact O-C 3.49Å; N187-R229 VanDerWaalsContact O-O 3.07Å; N187-S231 WeakPolarHBondContact O-CB 3.41Å; N187-S231 PolarHBondContact O-N 2.92Å; N187-F232 HydrophobicContact CB-CB 3.61Å; N187-D292 PolarHBondContact ND2-OD1 2.9Å |
| 188 | Q | 95.6 | Very high | 95.2 | Very high | 1 Ų | 1 | 25.3 Ų | 25.3 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | P | Polyproline II helix | trans | -80.8 | 137.5 | -173.3 | -65.9 | 156.8 | 22 | 0 | 0 | 111.7 | Q86 G87 Y95 F192 A228 H289 | Q86-Q188 PolarHBondContact O-NE2 3.2Å; G87-Q188 PolarHBondContact O-NE2 3.46Å; Y95-Q188 HydrophobicContact CD1-CB 3.81Å; Y95-Q188 HydrophobicContact CE1-CB 3.61Å; Y95-Q188 WeakPolarHBondContact CE1-O 3.38Å; Q188-F192 HydrophobicContact CB-CB 3.92Å; Q188-F192 HydrophobicContact CB-CD1 4.18Å; Q188-F192 HydrophobicContact CB-CD2 4.37Å; Q188-F192 HydrophobicContact CB-CG 3.89Å; Q188-F192 HydrophobicContact CG-CD1 3.98Å; Q188-F192 HydrophobicContact CG-CD2 4.12Å; Q188-F192 HydrophobicContact CG-CE1 4.27Å; Q188-F192 HydrophobicContact CG-CE2 4.39Å; Q188-F192 HydrophobicContact CG-CG 3.93Å; Q188-F192 HydrophobicContact CG-CZ 4.47Å; Q188-A228 WeakPolarHBondContact CA-O 3.22Å; Q188-H289 VanDerWaalsContact C-NE2 3.29Å; Q188-H289 PolarHBondContact O-NE2 3.16Å |
| 189 | T | 96.1 | Very high | 95 | Very high | 6 Ų | 6 | 29.1 Ų | 29.1 | 4% | 0.037 | 16% | 0.161 | C | C | . | . | P | Polyproline II helix | trans | -72 | 155.4 | 175.8 | 63.8 | 0 | 0 | 0 | 0 | 111.1 | Y95 H191 F192 A228 R287 | Y95-T189 WeakPolarHBondContact CD1-O 3.12Å; T189-H191 PolarHBondContact O-N 2.89Å; T189-H191 PolarHBondContact OG1-CD2 3.1Å; T189-H191 PolarHBondContact OG1-CE1 3.49Å; T189-H191 PolarHBondContact OG1-ND1 2.98Å; T189-H191 PolarHBondContact OG1-NE2 2.97Å; T189-H191 VanDerWaalsContact OG1-NE2 3.16Å; T189-F192 WeakPolarHBondContact O-CB 3.26Å; T189-F192 PolarHBondContact O-N 3.17Å; T189-F192 PolarHBondContact OG1-N 2.98Å; T189-A228 PolarHBondContact N-O 2.9Å; T189-A228 PolarHBondContact OG1-O 3.45Å; T189-R287 VanDerWaalsContact CG2-O 3.24Å; T189-R287 WeakPolarHBondContact CG2-O 3.42Å |
| 190 | P | 96.8 | Very high | 94.8 | Very high | 10 Ų | 10 | 31.4 Ų | 31.4 | 7% | 0.065 | 17% | 0.169 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.2 | -20.3 | 176.5 | -23.1 | 28.2 | 0 | 0 | 0 | 115.2 | Y95 K97 H286 | Y95-P190 CarbonylContact C-O 2.99Å; Y95-P190 WeakPolarHBondContact CA-O 3.27Å; Y95-P190 VanDerWaalsContact O-O 3.12Å; K97-P190 HydrophobicContact CB-CB 4.33Å; K97-P190 WeakPolarHBondContact CB-O 3.39Å; K97-P190 HydrophobicContact CG-CB 3.81Å; K97-P190 VanDerWaalsContact CG-O 3.25Å; K97-P190 WeakPolarHBondContact CG-O 3.14Å; K97-P190 PolarHBondContact N-O 3.11Å; P190-H286 HydrophobicContact CB-CB 4.19Å; P190-H286 WeakPolarHBondContact CD-O 3.05Å |
| 191 | H | 95.6 | Very high | 94.6 | Very high | 14 Ų | 14 | 36.3 Ų | 36.3 | 7% | 0.065 | 20% | 0.197 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | 7.5 | 177.5 | 65 | -97.2 | 0 | 0 | 0 | 114 | Y95 K97 T189 L193 S194 A195 H286 | Y95-H191 CarbonylContact O-C 3.07Å; K97-H191 HydrophobicContact CB-CB 4.38Å; K97-H191 WeakPolarHBondContact O-CA 3.46Å; T189-H191 PolarHBondContact O-N 2.89Å; T189-H191 PolarHBondContact OG1-CD2 3.1Å; T189-H191 PolarHBondContact OG1-CE1 3.49Å; T189-H191 PolarHBondContact OG1-ND1 2.98Å; T189-H191 PolarHBondContact OG1-NE2 2.97Å; T189-H191 VanDerWaalsContact OG1-NE2 3.16Å; H191-L193 PolarHBondContact O-N 2.84Å; H191-S194 WeakPolarHBondContact O-CB 3.44Å; H191-S194 PolarHBondContact O-N 3.34Å; H191-S194 PolarHBondContact O-OG 2.93Å; H191-A195 PolarHBondContact O-N 3.39Å; H191-H286 PolarHBondContact ND1-O 3.4Å |
| 192 | F | 96.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -52.7 | -43.7 | -171 | 167.2 | -101 | 0 | 0 | 0 | 114.3 | F88 Y95 Q188 T189 S194 A195 C196 V225 A228 R229 | F88-F192 HydrophobicContact CB-CE1 4.32Å; F88-F192 AromaticContact CD1-CE1 3.74Å; F88-F192 HydrophobicContact CD1-CE1 3.74Å; F88-F192 HydrophobicContact CD1-CZ 4.21Å; F88-F192 HydrophobicContact CE1-CE1 4.21Å; F88-F192 HydrophobicContact CE1-CZ 4.45Å; F88-F192 HydrophobicContact CG-CE1 4.02Å; Y95-F192 PolarHBondContact O-N 3.01Å; Q188-F192 HydrophobicContact CB-CB 3.92Å; Q188-F192 HydrophobicContact CB-CD1 4.18Å; Q188-F192 HydrophobicContact CB-CD2 4.37Å; Q188-F192 HydrophobicContact CB-CG 3.89Å; Q188-F192 HydrophobicContact CG-CD1 3.98Å; Q188-F192 HydrophobicContact CG-CD2 4.12Å; Q188-F192 HydrophobicContact CG-CE1 4.27Å; Q188-F192 HydrophobicContact CG-CE2 4.39Å; Q188-F192 HydrophobicContact CG-CG 3.93Å; Q188-F192 HydrophobicContact CG-CZ 4.47Å; T189-F192 WeakPolarHBondContact O-CB 3.26Å; T189-F192 PolarHBondContact O-N 3.17Å; T189-F192 PolarHBondContact OG1-N 2.98Å; F192-S194 VanDerWaalsContact C-N 3.27Å; F192-S194 PolarHBondContact O-N 3.48Å; F192-A195 PolarHBondContact O-N 2.96Å; F192-A195 VanDerWaalsContact O-N 3.17Å; F192-C196 HydrophobicContact CE1-CB 4.12Å; F192-C196 HydrophobicContact CE2-CB 4.15Å; F192-C196 HydrophobicContact CZ-CB 3.87Å; F192-C196 VanDerWaalsContact O-CB 3.28Å; F192-C196 WeakPolarHBondContact O-CB 3.4Å; F192-C196 PolarHBondContact O-N 3.34Å; F192-V225 HydrophobicContact CE2-CG1 4.14Å; F192-A228 HydrophobicContact CB-CB 4.4Å; F192-A228 HydrophobicContact CD2-CB 3.95Å; F192-R229 HydrophobicContact CD2-CG 4.17Å; F192-R229 HydrophobicContact CE2-CG 3.82Å |
| 193 | L | 95.3 | Very high | 94 | Very high | 11 Ų | 11 | 39.4 Ų | 39.4 | 6% | 0.058 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -66.6 | -29.4 | -179.3 | -63.1 | 176.6 | 0 | 0 | 0 | 112.6 | F88 D92 Y95 H191 A195 R197 P198 | F88-L193 HydrophobicContact CD2-CD2 3.62Å; F88-L193 HydrophobicContact CE2-CD2 3.82Å; F88-L193 HydrophobicContact CG-CD2 4.23Å; D92-L193 HydrophobicContact CB-CD1 4.28Å; D92-L193 VanDerWaalsContact O-CD1 3.27Å; D92-L193 WeakPolarHBondContact O-CD1 3.45Å; Y95-L193 WeakPolarHBondContact O-CB 3.33Å; Y95-L193 PolarHBondContact O-N 3.34Å; H191-L193 PolarHBondContact O-N 2.84Å; L193-A195 VanDerWaalsContact C-N 3.34Å; L193-R197 PolarHBondContact O-N 3.33Å; L193-P198 HydrophobicContact CD2-CG 4.31Å |
| 194 | S | 94.8 | Very high | 93.8 | Very high | 37 Ų | 37 | 40.1 Ų | 40.1 | 26% | 0.259 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -69.6 | -31.8 | 175.9 | 78.3 | 0 | 0 | 0 | 0 | 112.7 | K97 Y99 H191 F192 R197 | K97-S194 WeakPolarHBondContact O-CB 3.37Å; K97-S194 PolarHBondContact O-OG 3.35Å; Y99-S194 WeakPolarHBondContact CB-OG 3.43Å; Y99-S194 PolarHBondContact N-OG 2.84Å; H191-S194 WeakPolarHBondContact O-CB 3.44Å; H191-S194 PolarHBondContact O-N 3.34Å; H191-S194 PolarHBondContact O-OG 2.93Å; F192-S194 VanDerWaalsContact C-N 3.27Å; F192-S194 PolarHBondContact O-N 3.48Å; S194-R197 WeakPolarHBondContact O-CG 3.45Å |
| 195 | A | 94.8 | Very high | 93.6 | Very high | 7 Ų | 7 | 35.8 Ų | 35.8 | 6% | 0.058 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -80.5 | -42.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | H191 F192 L193 G220 L224 A228 | H191-A195 PolarHBondContact O-N 3.39Å; F192-A195 PolarHBondContact O-N 2.96Å; F192-A195 VanDerWaalsContact O-N 3.17Å; L193-A195 VanDerWaalsContact C-N 3.34Å; A195-G220 WeakPolarHBondContact O-CA 3.28Å; A195-L224 HydrophobicContact CB-CB 4.32Å; A195-A228 HydrophobicContact CB-CB 4.04Å |
| 196 | C | 94.5 | Very high | 93.3 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.7 | -41 | -180 | 177.8 | 0 | 0 | 0 | 0 | 112.9 | F192 C218 T219 G220 | F192-C196 HydrophobicContact CE1-CB 4.12Å; F192-C196 HydrophobicContact CE2-CB 4.15Å; F192-C196 HydrophobicContact CZ-CB 3.87Å; F192-C196 VanDerWaalsContact O-CB 3.28Å; F192-C196 WeakPolarHBondContact O-CB 3.4Å; F192-C196 PolarHBondContact O-N 3.34Å; C196-C218 HydrophobicContact CB-CB 3.93Å; C196-C218 WeakPolarHBondContact CB-SG 3.49Å; C196-C218 CarbonylContact O-C 3.44Å; C196-C218 VanDerWaalsContact O-CA 3.23Å; C196-C218 WeakPolarHBondContact O-CA 3.37Å; C196-C218 VanDerWaalsContact O-CB 3.25Å; C196-C218 WeakPolarHBondContact O-CB 3.45Å; C196-C218 WeakPolarHBondContact SG-CA 3.45Å; C196-C218 WeakPolarHBondContact SG-CB 3.42Å; C196-C218 CovalentContact SG-SG 2.04Å; C196-C218 PolarHBondContact SG-SG 3.27Å; C196-T219 PolarHBondContact O-N 2.91Å; C196-G220 PolarHBondContact O-N 3.42Å |
| 197 | R | 94.8 | Very high | 93 | Very high | 173 Ų | 173 | 44.7 Ų | 44.7 | 65% | 0.653 | 25% | 0.25 | S | S | * | . | trans | 46.7 | 63.7 | -173.5 | -59.2 | -175.1 | 179.6 | -179.8 | -2 | 112 | L193 S194 T219 | L193-R197 PolarHBondContact O-N 3.33Å; S194-R197 WeakPolarHBondContact O-CG 3.45Å; R197-T219 PolarHBondContact O-N 3.37Å; R197-T219 PolarHBondContact O-OG1 3Å | ||
| 198 | P | 94.2 | Very high | 92.6 | Very high | 14 Ų | 14 | 47.4 Ų | 47.4 | 9% | 0.091 | 27% | 0.269 | C | S | . | . | B | Isolated β-bridge | trans | -69.3 | 141.9 | -178.3 | 30.1 | -36.5 | 0 | 0 | 0 | 112.1 | F88 L193 Y200 L203 A217 | F88-P198 HydrophobicContact CE2-CB 4.18Å; F88-P198 HydrophobicContact CE2-CG 4.26Å; F88-P198 HydrophobicContact CZ-CB 3.98Å; F88-P198 HydrophobicContact CZ-CG 4.45Å; L193-P198 HydrophobicContact CD2-CG 4.31Å; P198-Y200 HydrophobicContact CB-CD1 4.47Å; P198-Y200 HydrophobicContact CB-CE1 4.22Å; P198-Y200 HydrophobicContact CG-CD1 4.22Å; P198-Y200 HydrophobicContact CG-CE1 3.57Å; P198-Y200 HydrophobicContact CG-CE2 4.01Å; P198-Y200 VanDerWaalsContact CG-CZ 3.47Å; P198-Y200 PolarHBondContact O-N 3.29Å; P198-L203 HydrophobicContact CB-CD1 3.87Å; P198-A217 VanDerWaalsContact CA-O 3.22Å; P198-A217 WeakPolarHBondContact CA-O 3.44Å; P198-A217 WeakPolarHBondContact CB-O 3.36Å |
| 199 | N | 93.2 | Very high | 92.2 | Very high | 79 Ų | 79 | 54.4 Ų | 54.4 | 42% | 0.422 | 31% | 0.306 | S | S | . | . | trans | -87 | 86.5 | 172 | -175.7 | -15.5 | 0 | 0 | 0 | 109.4 | T201 A202 L203 T219 | N199-T201 PolarHBondContact O-N 3.37Å; N199-T201 VanDerWaalsContact O-N 3.16Å; N199-T201 PolarHBondContact OD1-N 2.97Å; N199-A202 HydrophobicContact CB-CB 4.02Å; N199-A202 PolarHBondContact O-N 2.9Å; N199-A202 VanDerWaalsContact O-N 3.09Å; N199-A202 PolarHBondContact OD1-N 3.03Å; N199-A202 VanDerWaalsContact OD1-N 3.17Å; N199-L203 WeakPolarHBondContact O-CG 3.39Å; N199-L203 PolarHBondContact O-N 2.73Å; N199-T219 HydrophobicContact CB-CG2 4.36Å | ||
| 200 | Y | 91.1 | Very high | 91.9 | Very high | 54 Ų | 54 | 57.1 Ų | 57.1 | 21% | 0.212 | 32% | 0.318 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | -31.2 | -176.4 | -63.3 | -63 | 0 | 0 | 0 | 114.2 | F91 P198 G204 C205 | F91-Y200 HydrophobicContact CD1-CD1 4.36Å; F91-Y200 AromaticContact CD1-CD2 3.98Å; F91-Y200 HydrophobicContact CD1-CD2 3.98Å; F91-Y200 HydrophobicContact CD1-CE1 4.14Å; F91-Y200 AromaticContact CD1-CE2 3.74Å; F91-Y200 HydrophobicContact CD1-CE2 3.74Å; F91-Y200 HydrophobicContact CD1-CG 4.26Å; F91-Y200 AromaticContact CD1-CZ 3.8Å; F91-Y200 HydrophobicContact CE1-CD1 4.03Å; F91-Y200 AromaticContact CE1-CD2 3.33Å; F91-Y200 HydrophobicContact CE1-CD2 3.33Å; F91-Y200 HydrophobicContact CE1-CE1 4.25Å; F91-Y200 AromaticContact CE1-CE2 3.59Å; F91-Y200 HydrophobicContact CE1-CE2 3.59Å; F91-Y200 AromaticContact CE1-CG 3.56Å; F91-Y200 HydrophobicContact CE1-CG 3.56Å; F91-Y200 HydrophobicContact CE2-CD1 4.48Å; F91-Y200 HydrophobicContact CE2-CG 4.46Å; F91-Y200 HydrophobicContact CG-CE1 4.47Å; F91-Y200 HydrophobicContact CZ-CD1 4.09Å; F91-Y200 AromaticContact CZ-CD2 3.93Å; F91-Y200 HydrophobicContact CZ-CD2 3.93Å; F91-Y200 AromaticContact CZ-CG 3.67Å; F91-Y200 HydrophobicContact CZ-CG 3.67Å; P198-Y200 HydrophobicContact CB-CD1 4.47Å; P198-Y200 HydrophobicContact CB-CE1 4.22Å; P198-Y200 HydrophobicContact CG-CD1 4.22Å; P198-Y200 HydrophobicContact CG-CE1 3.57Å; P198-Y200 HydrophobicContact CG-CE2 4.01Å; P198-Y200 VanDerWaalsContact CG-CZ 3.47Å; P198-Y200 PolarHBondContact O-N 3.29Å; Y200-G204 PolarHBondContact O-N 3.01Å; Y200-C205 HydrophobicContact CD1-CB 4.25Å; Y200-C205 PolarHBondContact O-N 2.93Å |
| 201 | T | 90.3 | Very high | 91.7 | Very high | 131 Ų | 131 | 61.9 Ų | 61.9 | 80% | 0.804 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | -44.6 | 176.5 | -49.1 | 0 | 0 | 0 | 0 | 111.5 | N199 L203 G204 | N199-T201 PolarHBondContact O-N 3.37Å; N199-T201 VanDerWaalsContact O-N 3.16Å; N199-T201 PolarHBondContact OD1-N 2.97Å; T201-L203 VanDerWaalsContact C-N 3.3Å; T201-L203 PolarHBondContact O-N 2.68Å; T201-G204 PolarHBondContact O-N 2.92Å |
| 202 | A | 90.4 | Very high | 91.5 | Very high | 78 Ų | 78 | 61.6 Ų | 61.6 | 65% | 0.645 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -31.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | N199 G204 | N199-A202 HydrophobicContact CB-CB 4.02Å; N199-A202 PolarHBondContact O-N 2.9Å; N199-A202 VanDerWaalsContact O-N 3.09Å; N199-A202 PolarHBondContact OD1-N 3.03Å; N199-A202 VanDerWaalsContact OD1-N 3.17Å; A202-G204 PolarHBondContact O-N 2.95Å |
| 203 | L | 89.4 | Confident | 91.1 | Very high | 19 Ų | 19 | 66.4 Ų | 66.4 | 10% | 0.099 | 36% | 0.364 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.3 | 0.4 | 174.6 | -66.6 | 165.9 | 0 | 0 | 0 | 113.4 | P198 N199 T201 C205 Q210 I212 E214 A217 | P198-L203 HydrophobicContact CB-CD1 3.87Å; N199-L203 WeakPolarHBondContact O-CG 3.39Å; N199-L203 PolarHBondContact O-N 2.73Å; T201-L203 VanDerWaalsContact C-N 3.3Å; T201-L203 PolarHBondContact O-N 2.68Å; L203-C205 VanDerWaalsContact C-N 3.26Å; L203-C205 PolarHBondContact O-N 3.28Å; L203-Q210 PolarHBondContact O-NE2 3.48Å; L203-I212 HydrophobicContact CB-CD1 4.26Å; L203-I212 HydrophobicContact CD1-CD1 3.91Å; L203-I212 HydrophobicContact CD2-CG2 3.98Å; L203-E214 WeakPolarHBondContact CD2-OE2 3.21Å; L203-A217 HydrophobicContact CD1-CB 3.89Å; L203-A217 HydrophobicContact CD2-CB 3.85Å |
| 204 | G | 89.1 | Confident | 90.4 | Very high | 33 Ų | 33 | 71.3 Ų | 71.3 | 34% | 0.34 | 39% | 0.387 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.4 | 32.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y200 T201 A202 Q206 Q210 | Y200-G204 PolarHBondContact O-N 3.01Å; T201-G204 PolarHBondContact O-N 2.92Å; A202-G204 PolarHBondContact O-N 2.95Å; G204-Q206 PolarHBondContact O-N 3.4Å; G204-Q210 PolarHBondContact O-NE2 3.1Å; G204-Q210 PolarHBondContact O-OE1 3.16Å; G204-Q210 VanDerWaalsContact O-OE1 3.12Å |
| 205 | C | 90.4 | Very high | 89.3 | Confident | 17 Ų | 17 | 75.6 Ų | 75.6 | 12% | 0.115 | 41% | 0.407 | C | S | . | . | trans | -67.7 | 95.5 | -179.9 | -78.8 | 0 | 0 | 0 | 0 | 111.6 | C90 F91 Y200 L203 I212 | C90-C205 HydrophobicContact CB-CB 3.7Å; C90-C205 WeakPolarHBondContact CB-SG 3.26Å; C90-C205 WeakPolarHBondContact SG-CB 3.36Å; C90-C205 CovalentContact SG-SG 2.04Å; C90-C205 PolarHBondContact SG-SG 2.96Å; F91-C205 HydrophobicContact CE2-CB 3.94Å; F91-C205 HydrophobicContact CZ-CB 4.44Å; Y200-C205 HydrophobicContact CD1-CB 4.25Å; Y200-C205 PolarHBondContact O-N 2.93Å; L203-C205 VanDerWaalsContact C-N 3.26Å; L203-C205 PolarHBondContact O-N 3.28Å; C205-I212 VanDerWaalsContact SG-CD1 3.58Å | ||
| 206 | Q | 88.4 | Confident | 88.5 | Confident | 178 Ų | 178 | 86.3 Ų | 86.3 | 83% | 0.832 | 45% | 0.446 | S | S | * | . | trans | -90.7 | -22.4 | 176.6 | -63 | -62.4 | -28.6 | 0 | 0 | 112.8 | G204 | G204-Q206 PolarHBondContact O-N 3.4Š| ||
| 207 | S | 87.7 | Confident | 88.2 | Confident | 49 Ų | 49 | 86.5 Ų | 86.5 | 34% | 0.343 | 45% | 0.447 | S | S | . | . | S | Bend | trans | -144.4 | 154.5 | -179.1 | 78.3 | 0 | 0 | 0 | 0 | 111.9 | C90 L209 Q210 | C90-S207 WeakPolarHBondContact CB-O 3.3Å; S207-L209 PolarHBondContact O-N 3.23Å; S207-Q210 WeakPolarHBondContact O-CB 3.36Å; S207-Q210 PolarHBondContact O-N 3.05Å |
| 208 | P | 85.6 | Confident | 88.1 | Confident | 85 Ų | 85 | 79.9 Ų | 79.9 | 55% | 0.552 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.3 | -6.4 | 176.7 | 30.8 | -36.4 | 0 | 0 | 0 | 114 | C90 | C90-P208 VanDerWaalsContact O-CA 3.29Å; C90-P208 WeakPolarHBondContact O-CA 3.45Å |
| 209 | L | 86.8 | Confident | 88.1 | Confident | 148 Ų | 148 | 83.9 Ų | 83.9 | 78% | 0.775 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | -5.3 | 176.9 | -61 | 178.2 | 0 | 0 | 0 | 112.8 | S207 | S207-L209 PolarHBondContact O-N 3.23Š|
| 210 | Q | 91 | Very high | 88.1 | Confident | 62 Ų | 62 | 81 Ų | 81 | 29% | 0.29 | 44% | 0.439 | S | S | . | . | trans | -77.1 | 126.2 | 179.5 | -178.9 | 174.5 | -12 | 0 | 0 | 110.4 | F89 C90 L203 G204 S207 | F89-Q210 WeakPolarHBondContact CA-O 3.27Å; C90-Q210 PolarHBondContact N-O 2.87Å; C90-Q210 PolarHBondContact SG-O 3.43Å; L203-Q210 PolarHBondContact O-NE2 3.48Å; G204-Q210 PolarHBondContact O-NE2 3.1Å; G204-Q210 PolarHBondContact O-OE1 3.16Å; G204-Q210 VanDerWaalsContact O-OE1 3.12Å; S207-Q210 WeakPolarHBondContact O-CB 3.36Å; S207-Q210 PolarHBondContact O-N 3.05Å | ||
| 211 | Y | 92.2 | Very high | 88.2 | Confident | 110 Ų | 110 | 82.4 Ų | 82.4 | 43% | 0.431 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 129.8 | -178.9 | -171 | -110.2 | 0 | 0 | 0 | 110.8 | G87 F89 T213 | G87-Y211 VanDerWaalsContact C-OH 3.23Å; G87-Y211 VanDerWaalsContact CA-CZ 3.49Å; G87-Y211 WeakPolarHBondContact CA-OH 3.41Å; G87-Y211 PolarHBondContact N-OH 3.43Å; G87-Y211 VanDerWaalsContact N-OH 3.1Å; G87-Y211 WeakPolarHBondContact O-CE2 3.48Å; G87-Y211 PolarHBondContact O-OH 3.39Å; G87-Y211 VanDerWaalsContact O-OH 3.1Å; F89-Y211 AromaticContact CD1-CD2 3.95Å; F89-Y211 HydrophobicContact CD1-CD2 3.95Å; F89-Y211 HydrophobicContact CD1-CG 4.48Å; F89-Y211 AromaticContact CD2-CD2 3.91Å; F89-Y211 HydrophobicContact CD2-CD2 3.91Å; F89-Y211 HydrophobicContact CD2-CE2 4.35Å; F89-Y211 AromaticContact CE1-CD2 3.81Å; F89-Y211 HydrophobicContact CE1-CD2 3.81Å; F89-Y211 HydrophobicContact CE1-CG 4.2Å; F89-Y211 AromaticContact CE2-CD2 3.75Å; F89-Y211 HydrophobicContact CE2-CD2 3.75Å; F89-Y211 HydrophobicContact CE2-CE2 4.1Å; F89-Y211 HydrophobicContact CG-CD2 4Å; F89-Y211 AromaticContact CZ-CD2 3.69Å; F89-Y211 HydrophobicContact CZ-CD2 3.69Å; F89-Y211 HydrophobicContact CZ-CE2 4.37Å; F89-Y211 HydrophobicContact CZ-CG 4.35Å; Y211-T213 HydrophobicContact CD1-CG2 3.75Å; Y211-T213 HydrophobicContact CE1-CG2 3.49Å; Y211-T213 VanDerWaalsContact CE1-CG2 3.49Å |
| 212 | I | 91.3 | Very high | 88.3 | Confident | 9 Ų | 9 | 80.4 Ų | 80.4 | 5% | 0.046 | 44% | 0.44 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 122.8 | -177.3 | -61.5 | 155.6 | 0 | 0 | 0 | 109.5 | G87 F88 L203 C205 E214 A217 | G87-I212 CarbonylContact C-O 3.12Å; G87-I212 WeakPolarHBondContact CA-O 3.26Å; F88-I212 HydrophobicContact CD2-CD1 4.24Å; F88-I212 HydrophobicContact CE1-CB 4.49Å; F88-I212 HydrophobicContact CE1-CG2 4.35Å; F88-I212 HydrophobicContact CE2-CD1 3.59Å; F88-I212 HydrophobicContact CZ-CB 4.36Å; F88-I212 HydrophobicContact CZ-CD1 3.93Å; F88-I212 HydrophobicContact CZ-CG2 4.3Å; F88-I212 PolarHBondContact N-O 3Å; F88-I212 PolarHBondContact O-N 2.96Å; L203-I212 HydrophobicContact CB-CD1 4.26Å; L203-I212 HydrophobicContact CD1-CD1 3.91Å; L203-I212 HydrophobicContact CD2-CG2 3.98Å; C205-I212 VanDerWaalsContact SG-CD1 3.58Å; I212-E214 HydrophobicContact CG2-CB 4.2Å; I212-A217 HydrophobicContact CG2-CB 3.72Å |
| 213 | T | 87.7 | Confident | 88.3 | Confident | 101 Ų | 101 | 84.3 Ų | 84.3 | 62% | 0.62 | 44% | 0.443 | S | S | * | . | trans | -108.8 | 3.3 | 175.7 | 50 | 0 | 0 | 0 | 0 | 113.6 | Y211 N215 | Y211-T213 HydrophobicContact CD1-CG2 3.75Å; Y211-T213 HydrophobicContact CE1-CG2 3.49Å; Y211-T213 VanDerWaalsContact CE1-CG2 3.49Å; T213-N215 PolarHBondContact O-N 3.35Å | ||
| 214 | E | 81 | Confident | 88.5 | Confident | 114 Ų | 114 | 86.4 Ų | 86.4 | 53% | 0.533 | 45% | 0.454 | S | S | . | . | trans | -71.9 | 124.8 | -173.3 | -66.7 | -179.5 | -163 | 0 | 0 | 113.4 | L203 I212 R216 A217 | L203-E214 WeakPolarHBondContact CD2-OE2 3.21Å; I212-E214 HydrophobicContact CG2-CB 4.2Å; E214-R216 PolarHBondContact O-N 3.38Å; E214-A217 HydrophobicContact CB-CB 4.37Å; E214-A217 VanDerWaalsContact O-CB 3.26Å; E214-A217 WeakPolarHBondContact O-CB 3.28Å; E214-A217 PolarHBondContact O-N 3.08Å; E214-A217 VanDerWaalsContact O-N 3.07Å | ||
| 215 | N | 70.6 | Confident | 88.7 | Confident | 127 Ų | 127 | 85.5 Ų | 85.5 | 68% | 0.679 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -19.6 | 177.6 | -76.3 | -3.9 | 0 | 0 | 0 | 114.3 | I85 T213 | I85-N215 WeakPolarHBondContact CD1-OD1 3.34Å; T213-N215 PolarHBondContact O-N 3.35Å |
| 216 | R | 79.7 | Confident | 88.8 | Confident | 232 Ų | 232 | 87.6 Ų | 87.6 | 88% | 0.875 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.3 | 17.4 | 178.7 | -69.6 | -172.2 | 176 | 176.2 | -0.2 | 113.8 | E214 C218 | E214-R216 PolarHBondContact O-N 3.38Å; R216-C218 PolarHBondContact O-N 3.49Å |
| 217 | A | 88.2 | Confident | 89 | Confident | 4 Ų | 4 | 82.1 Ų | 82.1 | 3% | 0.033 | 44% | 0.435 | C | S | . | . | trans | -67.4 | -18.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | F88 P198 L203 I212 E214 | F88-A217 HydrophobicContact CE1-CB 3.85Å; F88-A217 HydrophobicContact CZ-CB 3.85Å; P198-A217 VanDerWaalsContact CA-O 3.22Å; P198-A217 WeakPolarHBondContact CA-O 3.44Å; P198-A217 WeakPolarHBondContact CB-O 3.36Å; L203-A217 HydrophobicContact CD1-CB 3.89Å; L203-A217 HydrophobicContact CD2-CB 3.85Å; I212-A217 HydrophobicContact CG2-CB 3.72Å; E214-A217 HydrophobicContact CB-CB 4.37Å; E214-A217 VanDerWaalsContact O-CB 3.26Å; E214-A217 WeakPolarHBondContact O-CB 3.28Å; E214-A217 PolarHBondContact O-N 3.08Å; E214-A217 VanDerWaalsContact O-N 3.07Å | ||
| 218 | C | 92.4 | Very high | 89.3 | Confident | 33 Ų | 33 | 79.9 Ų | 79.9 | 22% | 0.223 | 42% | 0.419 | C | S | . | . | B | Isolated β-bridge | trans | -98.8 | 137.3 | -179.1 | -59.5 | 0 | 0 | 0 | 0 | 112.3 | C196 R216 V225 | C196-C218 HydrophobicContact CB-CB 3.93Å; C196-C218 WeakPolarHBondContact CB-SG 3.49Å; C196-C218 CarbonylContact O-C 3.44Å; C196-C218 VanDerWaalsContact O-CA 3.23Å; C196-C218 WeakPolarHBondContact O-CA 3.37Å; C196-C218 VanDerWaalsContact O-CB 3.25Å; C196-C218 WeakPolarHBondContact O-CB 3.45Å; C196-C218 WeakPolarHBondContact SG-CA 3.45Å; C196-C218 WeakPolarHBondContact SG-CB 3.42Å; C196-C218 CovalentContact SG-SG 2.04Å; C196-C218 PolarHBondContact SG-SG 3.27Å; R216-C218 PolarHBondContact O-N 3.49Å; C218-V225 HydrophobicContact CB-CG1 4.13Å; C218-V225 HydrophobicContact CB-CG2 4.09Å |
| 219 | T | 93.6 | Very high | 89.7 | Confident | 99 Ų | 99 | 76.7 Ų | 76.7 | 61% | 0.607 | 40% | 0.397 | S | S | * | . | trans | -109.6 | -5.3 | 174.1 | 71.7 | 0 | 0 | 0 | 0 | 113.7 | C196 R197 N199 | C196-T219 PolarHBondContact O-N 2.91Å; R197-T219 PolarHBondContact O-N 3.37Å; R197-T219 PolarHBondContact O-OG1 3Å; N199-T219 HydrophobicContact CB-CG2 4.36Å | ||
| 220 | G | 93 | Very high | 90.1 | Very high | 17 Ų | 17 | 72.5 Ų | 72.5 | 18% | 0.175 | 37% | 0.372 | C | S | . | . | S | Bend | trans | -73.3 | -178.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | A195 C196 | A195-G220 WeakPolarHBondContact O-CA 3.28Å; C196-G220 PolarHBondContact O-N 3.42Å |
| 221 | N | 93.6 | Very high | 90.3 | Very high | 85 Ų | 85 | 69.5 Ų | 69.5 | 46% | 0.455 | 36% | 0.358 | S | S | . | . | trans | -62.5 | 122.2 | -179.4 | 177.8 | -26.3 | 0 | 0 | 0 | 110.5 | F223 L224 V225 | N221-F223 VanDerWaalsContact C-N 3.28Å; N221-F223 PolarHBondContact O-N 2.88Å; N221-F223 WeakPolarHBondContact OD1-CD2 3.13Å; N221-F223 PolarHBondContact OD1-N 3.35Å; N221-L224 HydrophobicContact CB-CB 4.35Å; N221-L224 HydrophobicContact CB-CD1 4.14Å; N221-L224 HydrophobicContact CB-CG 4.12Å; N221-L224 PolarHBondContact O-N 2.99Å; N221-V225 WeakPolarHBondContact O-CG2 3.5Å; N221-V225 PolarHBondContact O-N 3.35Å | ||
| 222 | P | 91.9 | Very high | 90.5 | Very high | 88 Ų | 88 | 67.7 Ų | 67.7 | 57% | 0.571 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -58 | -36.2 | -173.7 | 22.8 | -34.2 | 0 | 0 | 0 | 113.4 | L224 V225 V226 | P222-L224 PolarHBondContact O-N 2.75Å; P222-V225 PolarHBondContact O-N 2.91Å; P222-V226 WeakPolarHBondContact O-CG2 3.38Å; P222-V226 PolarHBondContact O-N 2.96Å |
| 223 | F | 90.8 | Very high | 90.8 | Very high | 161 Ų | 161 | 67.6 Ų | 67.6 | 71% | 0.706 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -64.5 | -40 | 177.5 | -64.4 | -76 | 0 | 0 | 0 | 112.2 | N221 S227 | N221-F223 VanDerWaalsContact C-N 3.28Å; N221-F223 PolarHBondContact O-N 2.88Å; N221-F223 WeakPolarHBondContact OD1-CD2 3.13Å; N221-F223 PolarHBondContact OD1-N 3.35Å; F223-S227 WeakPolarHBondContact O-CB 3.36Å; F223-S227 PolarHBondContact O-N 2.97Å |
| 224 | L | 93.1 | Very high | 91.3 | Very high | 62 Ų | 62 | 62.8 Ų | 62.8 | 33% | 0.325 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -69.5 | -36.4 | 175.8 | -62.6 | -176.5 | 0 | 0 | 0 | 111.5 | Y99 A195 N221 P222 S227 A228 | Y99-L224 HydrophobicContact CE2-CD2 4.47Å; Y99-L224 WeakPolarHBondContact OH-CD2 3.38Å; A195-L224 HydrophobicContact CB-CB 4.32Å; N221-L224 HydrophobicContact CB-CB 4.35Å; N221-L224 HydrophobicContact CB-CD1 4.14Å; N221-L224 HydrophobicContact CB-CG 4.12Å; N221-L224 PolarHBondContact O-N 2.99Å; P222-L224 PolarHBondContact O-N 2.75Å; L224-S227 PolarHBondContact O-N 2.74Å; L224-A228 WeakPolarHBondContact O-CB 3.41Å; L224-A228 PolarHBondContact O-N 3.49Å |
| 225 | V | 93.9 | Very high | 92 | Very high | 14 Ų | 14 | 58.4 Ų | 58.4 | 9% | 0.085 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.1 | -42.3 | 176.6 | 178.9 | 0 | 0 | 0 | 0 | 111.6 | F192 C218 N221 P222 A228 R229 | F192-V225 HydrophobicContact CE2-CG1 4.14Å; C218-V225 HydrophobicContact CB-CG1 4.13Å; C218-V225 HydrophobicContact CB-CG2 4.09Å; N221-V225 WeakPolarHBondContact O-CG2 3.5Å; N221-V225 PolarHBondContact O-N 3.35Å; P222-V225 PolarHBondContact O-N 2.91Å; V225-A228 PolarHBondContact O-N 3.43Å; V225-R229 WeakPolarHBondContact O-CG 3.36Å; V225-R229 PolarHBondContact O-N 3.14Å |
| 226 | V | 92.3 | Very high | 93.3 | Very high | 61 Ų | 61 | 53 Ų | 53 | 37% | 0.37 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.1 | -42.5 | 175.7 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | V83 P222 R229 | V83-V226 HydrophobicContact CG2-CG1 4.08Å; P222-V226 WeakPolarHBondContact O-CG2 3.38Å; P222-V226 PolarHBondContact O-N 2.96Å; V226-R229 PolarHBondContact O-N 3.26Å; V226-R229 VanDerWaalsContact O-N 3.17Å |
| 227 | S | 92.3 | Very high | 94.1 | Very high | 64 Ų | 64 | 42 Ų | 42 | 45% | 0.448 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -61.1 | -44 | 174.7 | -170.6 | 0 | 0 | 0 | 0 | 112 | F223 L224 R229 K230 | F223-S227 WeakPolarHBondContact O-CB 3.36Å; F223-S227 PolarHBondContact O-N 2.97Å; L224-S227 PolarHBondContact O-N 2.74Å; S227-R229 PolarHBondContact O-N 3.01Å; S227-K230 PolarHBondContact O-N 2.76Å |
| 228 | A | 94.6 | Very high | 94.6 | Very high | 1 Ų | 1 | 41.8 Ų | 41.8 | 1% | 0.008 | 23% | 0.23 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.8 | 0.6 | 177 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q188 T189 F192 A195 L224 V225 | Q188-A228 WeakPolarHBondContact CA-O 3.22Å; T189-A228 PolarHBondContact N-O 2.9Å; T189-A228 PolarHBondContact OG1-O 3.45Å; F192-A228 HydrophobicContact CB-CB 4.4Å; F192-A228 HydrophobicContact CD2-CB 3.95Å; A195-A228 HydrophobicContact CB-CB 4.04Å; L224-A228 WeakPolarHBondContact O-CB 3.41Å; L224-A228 PolarHBondContact O-N 3.49Å; V225-A228 PolarHBondContact O-N 3.43Å |
| 229 | R | 94.6 | Very high | 94.9 | Very high | 19 Ų | 19 | 40.4 Ų | 40.4 | 7% | 0.072 | 22% | 0.22 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -105.3 | 7.9 | 170.4 | -68.8 | 173 | 175.4 | -78.7 | 6.2 | 113.3 | V83 Q86 G186 N187 F192 V225 V226 S227 | V83-R229 HydrophobicContact CG1-CB 3.91Å; Q86-R229 PolarHBondContact O-NH1 2.93Å; G186-R229 CarbonylContact C-O 3.47Å; G186-R229 VanDerWaalsContact CA-O 3.26Å; G186-R229 WeakPolarHBondContact CA-O 3.09Å; N187-R229 PolarHBondContact N-O 3.41Å; N187-R229 CarbonylContact O-C 3.49Å; N187-R229 VanDerWaalsContact O-O 3.07Å; F192-R229 HydrophobicContact CD2-CG 4.17Å; F192-R229 HydrophobicContact CE2-CG 3.82Å; V225-R229 WeakPolarHBondContact O-CG 3.36Å; V225-R229 PolarHBondContact O-N 3.14Å; V226-R229 PolarHBondContact O-N 3.26Å; V226-R229 VanDerWaalsContact O-N 3.17Å; S227-R229 PolarHBondContact O-N 3.01Å |
| 230 | K | 94.3 | Very high | 95.1 | Very high | 59 Ų | 59 | 36 Ų | 36 | 26% | 0.257 | 19% | 0.194 | S | C | . | . | trans | -107.7 | 41.5 | 179.7 | -66.1 | -174.2 | 179.2 | -176 | 0 | 112.3 | V83 Q182 S227 | V83-K230 HydrophobicContact CG2-CD 4.36Å; V83-K230 HydrophobicContact CG2-CG 4.09Å; Q182-K230 HydrophobicContact CB-CB 3.92Å; Q182-K230 HydrophobicContact CB-CG 4.16Å; Q182-K230 VanDerWaalsContact CD-O 3.28Å; Q182-K230 HydrophobicContact CG-CB 4.14Å; Q182-K230 WeakPolarHBondContact CG-O 3.34Å; Q182-K230 PolarHBondContact NE2-O 2.89Å; S227-K230 PolarHBondContact O-N 2.76Å | ||
| 231 | S | 95.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.195 | C | C | . | . | trans | -77 | -37.6 | -174.6 | -158 | 0 | 0 | 0 | 0 | 114.2 | N187 P233 N288 D292 | N187-S231 WeakPolarHBondContact O-CB 3.41Å; N187-S231 PolarHBondContact O-N 2.92Å; S231-P233 CarbonylContact O-C 3.21Å; S231-N288 PolarHBondContact O-ND2 3.38Å; S231-D292 WeakPolarHBondContact CB-OD2 3.14Å; S231-D292 VanDerWaalsContact O-CB 3.3Å; S231-D292 WeakPolarHBondContact O-CB 3.42Å; S231-D292 PolarHBondContact OG-OD2 3.21Å | ||
| 232 | F | 96.5 | Very high | 95.6 | Very high | 71 Ų | 71 | 33.2 Ų | 33.2 | 31% | 0.311 | 17% | 0.173 | S | C | . | . | S | Bend | trans | -113.6 | 134.3 | -171.4 | -180 | -84.3 | 0 | 0 | 0 | 113 | G181 Q182 T185 N187 D292 A295 | G181-F232 CarbonylContact C-O 3.45Å; Q182-F232 WeakPolarHBondContact CA-O 3.46Å; Q182-F232 WeakPolarHBondContact CG-O 3.38Å; Q182-F232 PolarHBondContact N-O 3.21Å; Q182-F232 VanDerWaalsContact N-O 3.14Å; T185-F232 HydrophobicContact CG2-CD1 3.72Å; T185-F232 HydrophobicContact CG2-CE1 4.16Å; T185-F232 PolarHBondContact OG1-O 3.42Å; N187-F232 HydrophobicContact CB-CB 3.61Å; F232-D292 HydrophobicContact CD2-CB 4.3Å; F232-D292 WeakPolarHBondContact CD2-OD1 3.33Å; F232-A295 HydrophobicContact CD2-CB 4.31Å; F232-A295 HydrophobicContact CE2-CB 3.44Å; F232-A295 VanDerWaalsContact CE2-CB 3.44Å; F232-A295 HydrophobicContact CZ-CB 3.79Å |
| 233 | P | 97.4 | Very high | 95.9 | Very high | 8 Ų | 8 | 29.4 Ų | 29.4 | 5% | 0.052 | 15% | 0.148 | C | C | . | . | S | Bend | cis | -73.5 | 167.1 | -17.6 | 33.7 | -35.9 | 0 | 0 | 0 | 110.8 | A178 Q182 S231 K235 A295 | A178-P233 HydrophobicContact CB-CG 4.44Å; Q182-P233 PolarHBondContact NE2-O 3.19Å; S231-P233 CarbonylContact O-C 3.21Å; P233-K235 PolarHBondContact O-N 2.98Å; P233-A295 HydrophobicContact CB-CB 4.2Å |
| 234 | S | 97.5 | Very high | 96.2 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.117 | C | C | . | . | trans | -73.1 | 112.3 | 174.3 | -176.8 | 0 | 0 | 0 | 0 | 110.5 | A237 A238 N288 D292 | S234-A237 PolarHBondContact O-N 3.21Å; S234-A238 PolarHBondContact O-N 2.93Å; S234-A238 VanDerWaalsContact O-N 3.1Å; S234-N288 PolarHBondContact OG-OD1 3.3Å; S234-D292 PolarHBondContact N-O 3.11Å | ||
| 235 | K | 96.7 | Very high | 96.4 | Very high | 22 Ų | 22 | 20.6 Ų | 20.6 | 10% | 0.096 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.7 | -49.2 | -178.8 | 176.5 | 166.5 | 61.9 | -168.4 | 0 | 112.6 | E76 Y114 A178 N179 P233 A237 A238 L239 | E76-K235 IonicContact OE1-NZ 3.73Å; E76-K235 PolarHBondContact OE1-NZ 3.3Å; E76-K235 IonicContact OE2-NZ 3.93Å; E76-K235 PolarHBondContact OE2-NZ 3.42Å; Y114-K235 WeakPolarHBondContact OH-CE 3.44Å; A178-K235 HydrophobicContact CB-CB 3.89Å; A178-K235 HydrophobicContact CB-CG 4.02Å; N179-K235 WeakPolarHBondContact OD1-CD 3.46Å; N179-K235 PolarHBondContact OD1-NZ 3.4Å; P233-K235 PolarHBondContact O-N 2.98Å; K235-A237 VanDerWaalsContact C-N 3.3Å; K235-A237 PolarHBondContact O-N 3.39Å; K235-A238 WeakPolarHBondContact O-CB 3.39Å; K235-A238 PolarHBondContact O-N 3.46Å; K235-A238 VanDerWaalsContact O-N 3.11Å; K235-L239 HydrophobicContact CD-CD1 4.31Å; K235-L239 HydrophobicContact CG-CD1 3.69Å; K235-L239 HydrophobicContact CG-CG 4.19Å; K235-L239 WeakPolarHBondContact O-CG 3.48Å; K235-L239 PolarHBondContact O-N 3.07Å |
| 236 | D | 96.9 | Very high | 96.5 | Very high | 13 Ų | 13 | 20 Ų | 20 | 7% | 0.07 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -64.4 | -36 | -178.3 | -62.8 | -62.6 | 0 | 0 | 0 | 112.6 | V113 S240 V278 R282 | V113-D236 HydrophobicContact CG1-CB 4.21Å; D236-S240 WeakPolarHBondContact O-CB 3.42Å; D236-S240 PolarHBondContact O-N 3.29Å; D236-S240 PolarHBondContact O-OG 2.58Å; D236-V278 HydrophobicContact CB-CG1 3.84Å; D236-R282 IonicContact OD1-NH2 3.83Å; D236-R282 IonicContact OD2-CZ 3.09Å; D236-R282 IonicContact OD2-NE 3.85Å; D236-R282 PolarHBondContact OD2-NE 2.86Å; D236-R282 IonicContact OD2-NH2 3.39Å; D236-R282 PolarHBondContact OD2-NH2 2.04Å |
| 237 | A | 98.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -61.4 | -46.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | S234 K235 F241 V293 F297 | S234-A237 PolarHBondContact O-N 3.21Å; K235-A237 VanDerWaalsContact C-N 3.3Å; K235-A237 PolarHBondContact O-N 3.39Å; A237-F241 VanDerWaalsContact O-CB 3.28Å; A237-F241 WeakPolarHBondContact O-CB 3.44Å; A237-F241 PolarHBondContact O-N 2.81Å; A237-V293 HydrophobicContact CB-CB 4.39Å; A237-V293 HydrophobicContact CB-CG1 3.95Å; A237-V293 HydrophobicContact CB-CG2 4.49Å; A237-F297 HydrophobicContact CB-CD1 3.75Å; A237-F297 HydrophobicContact CB-CE1 3.63Å; A237-F297 HydrophobicContact CB-CZ 4.46Å; A237-F297 WeakPolarHBondContact O-CD1 3.45Å |
| 238 | A | 98.4 | Very high | 96.7 | Very high | 0 Ų | 0 | 15.2 Ų | 15.2 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -62 | -49.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | T174 S234 K235 F241 Y242 G296 G300 | T174-A238 HydrophobicContact CG2-CB 3.72Å; S234-A238 PolarHBondContact O-N 2.93Å; S234-A238 VanDerWaalsContact O-N 3.1Å; K235-A238 WeakPolarHBondContact O-CB 3.39Å; K235-A238 PolarHBondContact O-N 3.46Å; K235-A238 VanDerWaalsContact O-N 3.11Å; A238-F241 PolarHBondContact O-N 3.37Å; A238-Y242 VanDerWaalsContact O-CB 3.24Å; A238-Y242 WeakPolarHBondContact O-CB 3.41Å; A238-Y242 PolarHBondContact O-N 2.67Å; A238-G296 VanDerWaalsContact CA-O 3.22Å; A238-G296 WeakPolarHBondContact CA-O 3.33Å; A238-G296 WeakPolarHBondContact CB-O 3.41Å; A238-G300 WeakPolarHBondContact O-CA 3.29Å |
| 239 | L | 98.3 | Very high | 96.5 | Very high | 4 Ų | 4 | 17.6 Ų | 17.6 | 2% | 0.021 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -65 | -42.6 | -179.3 | -64.3 | 173.2 | 0 | 0 | 0 | 112.1 | Y114 L171 T174 T175 K235 S243 | Y114-L239 HydrophobicContact CD1-CD1 4.24Å; Y114-L239 HydrophobicContact CE1-CD1 3.79Å; L171-L239 HydrophobicContact CD1-CD2 3.7Å; T174-L239 HydrophobicContact CG2-CD2 3.82Å; T174-L239 HydrophobicContact CG2-CG 4.46Å; T175-L239 WeakPolarHBondContact OG1-CD2 3.3Å; K235-L239 HydrophobicContact CD-CD1 4.31Å; K235-L239 HydrophobicContact CG-CD1 3.69Å; K235-L239 HydrophobicContact CG-CG 4.19Å; K235-L239 WeakPolarHBondContact O-CG 3.48Å; K235-L239 PolarHBondContact O-N 3.07Å; L239-S243 VanDerWaalsContact O-CB 3.29Å; L239-S243 WeakPolarHBondContact O-CB 3.45Å; L239-S243 PolarHBondContact O-N 2.82Å |
| 240 | S | 98.3 | Very high | 96.2 | Very high | 8 Ų | 8 | 17 Ų | 17 | 6% | 0.056 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.6 | -43.8 | 178.6 | -55.5 | 0 | 0 | 0 | 0 | 111.7 | D236 S243 A244 A275 | D236-S240 WeakPolarHBondContact O-CB 3.42Å; D236-S240 PolarHBondContact O-N 3.29Å; D236-S240 PolarHBondContact O-OG 2.58Å; S240-S243 PolarHBondContact O-N 3.46Å; S240-A244 WeakPolarHBondContact O-CB 3.48Å; S240-A244 PolarHBondContact O-N 3.09Å; S240-A275 WeakPolarHBondContact O-CB 3.32Å |
| 241 | F | 98.2 | Very high | 95.9 | Very high | 43 Ų | 43 | 14.2 Ų | 14.2 | 19% | 0.189 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -73.6 | -37.8 | -178.8 | -155.1 | -96.4 | 0 | 0 | 0 | 112.4 | A237 A238 S243 A244 I245 L272 A275 F297 | A237-F241 VanDerWaalsContact O-CB 3.28Å; A237-F241 WeakPolarHBondContact O-CB 3.44Å; A237-F241 PolarHBondContact O-N 2.81Å; A238-F241 PolarHBondContact O-N 3.37Å; F241-S243 VanDerWaalsContact C-N 3.35Å; F241-S243 PolarHBondContact O-N 3.15Å; F241-A244 PolarHBondContact O-N 3.46Å; F241-I245 HydrophobicContact CD1-CD1 4.43Å; F241-I245 HydrophobicContact CD1-CG1 3.73Å; F241-I245 HydrophobicContact CE1-CD1 3.82Å; F241-I245 HydrophobicContact CE1-CG1 3.62Å; F241-I245 HydrophobicContact CG-CG1 4.47Å; F241-I245 HydrophobicContact CZ-CD1 4.11Å; F241-I245 HydrophobicContact CZ-CG1 4.28Å; F241-I245 WeakPolarHBondContact O-CB 3.27Å; F241-I245 WeakPolarHBondContact O-CG1 3.31Å; F241-I245 PolarHBondContact O-N 3.43Å; F241-L272 HydrophobicContact CE2-CD2 4.36Å; F241-A275 HydrophobicContact CD2-CB 4.37Å; F241-F297 HydrophobicContact CB-CB 4.4Å; F241-F297 HydrophobicContact CB-CD1 3.72Å; F241-F297 HydrophobicContact CB-CE1 4.47Å; F241-F297 HydrophobicContact CB-CG 4.42Å; F241-F297 HydrophobicContact CD1-CB 4.24Å; F241-F297 WeakPolarHBondContact CD1-O 3.33Å; F241-F297 HydrophobicContact CD2-CB 4.13Å; F241-F297 AromaticContact CD2-CD1 3.78Å; F241-F297 HydrophobicContact CD2-CD1 3.78Å; F241-F297 HydrophobicContact CD2-CE1 4.31Å; F241-F297 AromaticContact CD2-CG 3.97Å; F241-F297 HydrophobicContact CD2-CG 3.97Å; F241-F297 HydrophobicContact CE2-CB 4.46Å; F241-F297 HydrophobicContact CE2-CG 4.46Å; F241-F297 HydrophobicContact CG-CB 4.01Å; F241-F297 AromaticContact CG-CD1 3.93Å; F241-F297 HydrophobicContact CG-CD1 3.93Å; F241-F297 HydrophobicContact CG-CG 4.2Å |
| 242 | Y | 98.4 | Very high | 95.5 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -54.6 | -50.8 | 168.2 | 170.2 | -100.5 | 0 | 0 | 0 | 111.3 | Y167 G170 L171 A238 I245 Y246 I303 A304 L307 | Y167-Y242 WeakPolarHBondContact CA-OH 3.24Å; Y167-Y242 AromaticContact CD2-CE1 3.77Å; Y167-Y242 HydrophobicContact CD2-CE1 3.77Å; Y167-Y242 AromaticContact CE2-CD1 3.99Å; Y167-Y242 HydrophobicContact CE2-CD1 3.99Å; Y167-Y242 AromaticContact CE2-CE1 3.31Å; Y167-Y242 HydrophobicContact CE2-CE1 3.31Å; Y167-Y242 AromaticContact CZ-CE1 3.93Å; Y167-Y242 PolarHBondContact O-OH 3.02Å; G170-Y242 VanDerWaalsContact C-CZ 3.45Å; G170-Y242 WeakPolarHBondContact CA-OH 3.21Å; L171-Y242 HydrophobicContact CB-CD1 4.48Å; L171-Y242 HydrophobicContact CB-CE1 4Å; L171-Y242 HydrophobicContact CD1-CD1 4.14Å; L171-Y242 HydrophobicContact CD1-CE1 4.42Å; A238-Y242 VanDerWaalsContact O-CB 3.24Å; A238-Y242 WeakPolarHBondContact O-CB 3.41Å; A238-Y242 PolarHBondContact O-N 2.67Å; Y242-I245 PolarHBondContact O-N 2.87Å; Y242-Y246 WeakPolarHBondContact O-CB 3.2Å; Y242-Y246 PolarHBondContact O-N 2.7Å; Y242-I303 HydrophobicContact CD2-CB 4.31Å; Y242-I303 HydrophobicContact CD2-CG2 4Å; Y242-I303 HydrophobicContact CE2-CG2 3.96Å; Y242-A304 HydrophobicContact CD2-CB 3.66Å; Y242-A304 HydrophobicContact CE2-CB 3.95Å; Y242-L307 HydrophobicContact CE2-CD1 4.18Å |
| 243 | S | 98.1 | Very high | 94.7 | Very high | 7 Ų | 7 | 17.3 Ų | 17.3 | 5% | 0.049 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.3 | -47.4 | -179.9 | -171.4 | 0 | 0 | 0 | 0 | 112.5 | V117 P121 Y167 L239 S240 F241 T247 | V117-S243 PolarHBondContact O-OG 2.76Å; P121-S243 WeakPolarHBondContact CG-OG 3.38Å; Y167-S243 WeakPolarHBondContact OH-CB 3.23Å; Y167-S243 PolarHBondContact OH-OG 3.25Å; L239-S243 VanDerWaalsContact O-CB 3.29Å; L239-S243 WeakPolarHBondContact O-CB 3.45Å; L239-S243 PolarHBondContact O-N 2.82Å; S240-S243 PolarHBondContact O-N 3.46Å; F241-S243 VanDerWaalsContact C-N 3.35Å; F241-S243 PolarHBondContact O-N 3.15Å; S243-T247 WeakPolarHBondContact O-CB 3.47Å; S243-T247 PolarHBondContact O-N 3.21Å; S243-T247 PolarHBondContact O-OG1 3.5Å |
| 244 | A | 97.8 | Very high | 93.7 | Very high | 5 Ų | 5 | 19 Ų | 19 | 4% | 0.041 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63 | -50.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | S240 F241 Y246 T247 V248 L271 L272 A275 | S240-A244 WeakPolarHBondContact O-CB 3.48Å; S240-A244 PolarHBondContact O-N 3.09Å; F241-A244 PolarHBondContact O-N 3.46Å; A244-Y246 PolarHBondContact O-N 3.1Å; A244-T247 PolarHBondContact O-N 2.94Å; A244-V248 VanDerWaalsContact O-CB 3.31Å; A244-V248 WeakPolarHBondContact O-CB 3.34Å; A244-V248 WeakPolarHBondContact O-CG2 3.47Å; A244-V248 PolarHBondContact O-N 3.38Å; A244-L271 HydrophobicContact CB-CB 4.4Å; A244-L271 WeakPolarHBondContact CB-O 3.35Å; A244-L272 HydrophobicContact CB-CD2 4.21Å; A244-A275 HydrophobicContact CB-CB 3.72Å |
| 245 | I | 96.8 | Very high | 92.3 | Very high | 34 Ų | 34 | 22 Ų | 22 | 17% | 0.174 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -62.1 | -45.7 | -178.5 | -65.6 | -73.7 | 0 | 0 | 0 | 111.1 | F241 Y242 T247 V248 M249 L272 A304 | F241-I245 HydrophobicContact CD1-CD1 4.43Å; F241-I245 HydrophobicContact CD1-CG1 3.73Å; F241-I245 HydrophobicContact CE1-CD1 3.82Å; F241-I245 HydrophobicContact CE1-CG1 3.62Å; F241-I245 HydrophobicContact CG-CG1 4.47Å; F241-I245 HydrophobicContact CZ-CD1 4.11Å; F241-I245 HydrophobicContact CZ-CG1 4.28Å; F241-I245 WeakPolarHBondContact O-CB 3.27Å; F241-I245 WeakPolarHBondContact O-CG1 3.31Å; F241-I245 PolarHBondContact O-N 3.43Å; Y242-I245 PolarHBondContact O-N 2.87Å; I245-T247 VanDerWaalsContact C-N 3.34Å; I245-T247 PolarHBondContact O-N 3.18Å; I245-V248 PolarHBondContact O-N 3.47Å; I245-M249 HydrophobicContact CG2-CG 4.46Å; I245-M249 HydrophobicContact CG2-SD 4.08Å; I245-M249 VanDerWaalsContact O-CG 3.3Å; I245-M249 WeakPolarHBondContact O-CG 3.47Å; I245-M249 PolarHBondContact O-N 3.3Å; I245-L272 HydrophobicContact CD1-CD2 3.75Å; I245-L272 HydrophobicContact CG1-CD2 4.36Å; I245-A304 HydrophobicContact CB-CB 3.82Å; I245-A304 HydrophobicContact CG2-CB 3.55Å |
| 246 | Y | 95.8 | Very high | 90.7 | Very high | 1 Ų | 1 | 30.6 Ų | 30.6 | 0% | 0.004 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.2 | -45.1 | 177.8 | -170.4 | -87.5 | 0 | 0 | 0 | 111.7 | I125 F163 V166 Y167 Y242 A244 M249 Y250 V308 I312 | I125-Y246 HydrophobicContact CD1-CE1 4.09Å; F163-Y246 PolarHBondContact O-OH 2.98Å; V166-Y246 HydrophobicContact CG1-CE2 4.12Å; Y167-Y246 AromaticContact CD2-CD1 3.4Å; Y167-Y246 HydrophobicContact CD2-CD1 3.4Å; Y167-Y246 VanDerWaalsContact CD2-CD1 3.4Å; Y167-Y246 HydrophobicContact CD2-CD2 4.31Å; Y167-Y246 AromaticContact CD2-CE1 3.75Å; Y167-Y246 HydrophobicContact CD2-CE1 3.75Å; Y167-Y246 AromaticContact CD2-CG 3.7Å; Y167-Y246 HydrophobicContact CD2-CG 3.7Å; Y167-Y246 HydrophobicContact CE2-CD1 4.19Å; Y167-Y246 HydrophobicContact CE2-CG 4.3Å; Y167-Y246 HydrophobicContact CG-CD1 4.19Å; Y167-Y246 HydrophobicContact CG-CE1 4.1Å; Y167-Y246 PolarHBondContact N-OH 2.85Å; Y242-Y246 WeakPolarHBondContact O-CB 3.2Å; Y242-Y246 PolarHBondContact O-N 2.7Å; A244-Y246 PolarHBondContact O-N 3.1Å; Y246-M249 PolarHBondContact O-N 2.87Å; Y246-Y250 PolarHBondContact O-N 2.99Å; Y246-V308 HydrophobicContact CD2-CG2 3.59Å; Y246-V308 HydrophobicContact CE2-CG2 3.85Å; Y246-V308 HydrophobicContact CG-CG2 4.44Å; Y246-I312 HydrophobicContact CE2-CD1 3.91Å |
| 247 | T | 94.8 | Very high | 88.7 | Confident | 2 Ų | 2 | 34.2 Ų | 34.2 | 1% | 0.012 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.8 | -42.8 | 179.1 | -53.4 | 0 | 0 | 0 | 0 | 111.7 | P121 T124 S243 A244 I245 M249 Y250 V251 L271 | P121-T247 WeakPolarHBondContact CB-OG1 3.26Å; P121-T247 WeakPolarHBondContact CG-OG1 3.4Å; T124-T247 HydrophobicContact CG2-CG2 3.83Å; S243-T247 WeakPolarHBondContact O-CB 3.47Å; S243-T247 PolarHBondContact O-N 3.21Å; S243-T247 PolarHBondContact O-OG1 3.5Å; A244-T247 PolarHBondContact O-N 2.94Å; I245-T247 VanDerWaalsContact C-N 3.34Å; I245-T247 PolarHBondContact O-N 3.18Å; T247-M249 VanDerWaalsContact C-N 3.35Å; T247-M249 PolarHBondContact O-N 3.19Å; T247-Y250 PolarHBondContact O-N 2.64Å; T247-V251 HydrophobicContact CG2-CG2 4.47Å; T247-V251 WeakPolarHBondContact O-CB 3.4Å; T247-V251 VanDerWaalsContact O-CG2 3.3Å; T247-V251 WeakPolarHBondContact O-CG2 3.5Å; T247-V251 PolarHBondContact O-N 3.4Å; T247-L271 HydrophobicContact CG2-CD1 3.64Å; T247-L271 HydrophobicContact CG2-CD2 4.39Å |
| 248 | V | 93.5 | Very high | 86.6 | Confident | 22 Ų | 22 | 44.9 Ų | 44.9 | 13% | 0.133 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57.7 | -45.4 | 174.1 | 162.6 | 0 | 0 | 0 | 0 | 111.3 | A244 I245 T252 C268 L271 L272 | A244-V248 VanDerWaalsContact O-CB 3.31Å; A244-V248 WeakPolarHBondContact O-CB 3.34Å; A244-V248 WeakPolarHBondContact O-CG2 3.47Å; A244-V248 PolarHBondContact O-N 3.38Å; I245-V248 PolarHBondContact O-N 3.47Å; V248-T252 VanDerWaalsContact O-CB 3.3Å; V248-T252 WeakPolarHBondContact O-CB 3.32Å; V248-T252 PolarHBondContact O-N 3.24Å; V248-T252 PolarHBondContact O-OG1 2.89Å; V248-C268 HydrophobicContact CG1-CB 4.08Å; V248-C268 HydrophobicContact CG2-CB 3.84Å; V248-L271 HydrophobicContact CG2-CB 4.14Å; V248-L271 HydrophobicContact CG2-CD1 4.1Å; V248-L272 HydrophobicContact CG2-CG 4.27Å |
| 249 | M | 90.1 | Very high | 84.9 | Confident | 52 Ų | 52 | 46.9 Ų | 46.9 | 26% | 0.256 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -67 | -41.1 | 178 | -67.1 | -178.4 | 87 | 0 | 0 | 111.6 | I245 Y246 T247 T252 L253 V308 | I245-M249 HydrophobicContact CG2-CG 4.46Å; I245-M249 HydrophobicContact CG2-SD 4.08Å; I245-M249 VanDerWaalsContact O-CG 3.3Å; I245-M249 WeakPolarHBondContact O-CG 3.47Å; I245-M249 PolarHBondContact O-N 3.3Å; Y246-M249 PolarHBondContact O-N 2.87Å; T247-M249 VanDerWaalsContact C-N 3.35Å; T247-M249 PolarHBondContact O-N 3.19Å; M249-T252 PolarHBondContact O-N 3.11Å; M249-L253 VanDerWaalsContact O-CG 3.29Å; M249-L253 WeakPolarHBondContact O-CG 3.42Å; M249-L253 PolarHBondContact O-N 3.44Å; M249-V308 HydrophobicContact CB-CG1 4.03Å; M249-V308 HydrophobicContact CB-CG2 4.27Å; M249-V308 HydrophobicContact CE-CB 3.67Å; M249-V308 HydrophobicContact CE-CG1 3.48Å; M249-V308 VanDerWaalsContact CE-CG1 3.48Å; M249-V308 HydrophobicContact CE-CG2 4.43Å; M249-V308 HydrophobicContact SD-CB 3.66Å; M249-V308 HydrophobicContact SD-CG1 3.87Å; M249-V308 HydrophobicContact SD-CG2 3.76Å |
| 250 | Y | 89.3 | Confident | 83.3 | Confident | 6 Ų | 6 | 51.3 Ų | 51.3 | 2% | 0.024 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.7 | -49.1 | 174.9 | 175.3 | -96.3 | 0 | 0 | 0 | 112.2 | T124 I125 E129 F163 Y246 T247 T252 L253 M254 | T124-Y250 HydrophobicContact CG2-CD1 4.09Å; T124-Y250 HydrophobicContact CG2-CE1 4.25Å; T124-Y250 WeakPolarHBondContact O-CE1 3.21Å; I125-Y250 WeakPolarHBondContact CA-OH 3.32Å; I125-Y250 HydrophobicContact CB-CE1 4.36Å; I125-Y250 HydrophobicContact CG1-CD1 4.07Å; I125-Y250 HydrophobicContact CG1-CD2 4.19Å; I125-Y250 HydrophobicContact CG1-CE1 3.98Å; I125-Y250 HydrophobicContact CG1-CE2 4.11Å; I125-Y250 HydrophobicContact CG1-CG 4.17Å; I125-Y250 HydrophobicContact CG2-CE2 4.47Å; I125-Y250 PolarHBondContact O-OH 3.39Å; E129-Y250 PolarHBondContact N-OH 2.9Å; F163-Y250 HydrophobicContact CD1-CD2 4.26Å; F163-Y250 HydrophobicContact CD1-CE2 4.48Å; F163-Y250 HydrophobicContact CD2-CE2 4.05Å; F163-Y250 HydrophobicContact CE1-CD2 4.32Å; F163-Y250 HydrophobicContact CE2-CE2 4.16Å; F163-Y250 HydrophobicContact CG-CD2 4.41Å; F163-Y250 HydrophobicContact CG-CE2 4.23Å; F163-Y250 HydrophobicContact CZ-CE2 4.43Å; Y246-Y250 PolarHBondContact O-N 2.99Å; T247-Y250 PolarHBondContact O-N 2.64Å; Y250-T252 VanDerWaalsContact C-N 3.31Å; Y250-T252 PolarHBondContact O-N 2.92Å; Y250-L253 PolarHBondContact O-N 3.23Å; Y250-M254 HydrophobicContact CD1-CG 4.36Å; Y250-M254 HydrophobicContact CD2-CG 4.08Å; Y250-M254 HydrophobicContact CE1-CG 3.94Å; Y250-M254 HydrophobicContact CE2-CE 4.29Å; Y250-M254 HydrophobicContact CE2-CG 3.63Å; Y250-M254 HydrophobicContact CE2-SD 4.33Å; Y250-M254 HydrophobicContact CG-CG 4.43Å; Y250-M254 WeakPolarHBondContact O-CB 3.43Å; Y250-M254 WeakPolarHBondContact O-CG 2.93Å; Y250-M254 PolarHBondContact O-N 3.46Å; Y250-M254 WeakPolarHBondContact OH-CE 3.26Å |
| 251 | V | 88.3 | Confident | 82.1 | Confident | 1 Ų | 1 | 62.4 Ų | 62.4 | 1% | 0.006 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -56.1 | -46.2 | 174.1 | 166 | 0 | 0 | 0 | 0 | 110.7 | T124 T247 L253 M254 F255 L267 | T124-V251 HydrophobicContact CG2-CG2 3.74Å; T247-V251 HydrophobicContact CG2-CG2 4.47Å; T247-V251 WeakPolarHBondContact O-CB 3.4Å; T247-V251 VanDerWaalsContact O-CG2 3.3Å; T247-V251 WeakPolarHBondContact O-CG2 3.5Å; T247-V251 PolarHBondContact O-N 3.4Å; V251-L253 VanDerWaalsContact C-N 3.29Å; V251-L253 PolarHBondContact O-N 3.1Å; V251-M254 PolarHBondContact O-N 2.77Å; V251-F255 HydrophobicContact CB-CD2 4.36Å; V251-F255 HydrophobicContact CG1-CD2 3.79Å; V251-F255 HydrophobicContact CG1-CE2 4.11Å; V251-F255 HydrophobicContact CG2-CE2 4.4Å; V251-F255 WeakPolarHBondContact O-CD2 3.47Å; V251-F255 PolarHBondContact O-N 3.24Å; V251-F255 VanDerWaalsContact O-N 3.11Å; V251-L267 HydrophobicContact CG1-CD2 3.98Å; V251-L267 HydrophobicContact CG2-CD2 3.9Å |
| 252 | T | 86.1 | Confident | 81.3 | Confident | 80 Ų | 80 | 66.5 Ų | 66.5 | 49% | 0.491 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.4 | -37.1 | 179.4 | -60.9 | 0 | 0 | 0 | 0 | 112.5 | V248 M249 Y250 | V248-T252 VanDerWaalsContact O-CB 3.3Å; V248-T252 WeakPolarHBondContact O-CB 3.32Å; V248-T252 PolarHBondContact O-N 3.24Å; V248-T252 PolarHBondContact O-OG1 2.89Å; M249-T252 PolarHBondContact O-N 3.11Å; Y250-T252 VanDerWaalsContact C-N 3.31Å; Y250-T252 PolarHBondContact O-N 2.92Å |
| 253 | L | 79.8 | Confident | 80.4 | Confident | 55 Ų | 55 | 71 Ų | 71 | 29% | 0.288 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -74.6 | -42.1 | 177.4 | -71.3 | 170.1 | 0 | 0 | 0 | 112.9 | M249 Y250 V251 V308 I312 | M249-L253 VanDerWaalsContact O-CG 3.29Å; M249-L253 WeakPolarHBondContact O-CG 3.42Å; M249-L253 PolarHBondContact O-N 3.44Å; Y250-L253 PolarHBondContact O-N 3.23Å; V251-L253 VanDerWaalsContact C-N 3.29Å; V251-L253 PolarHBondContact O-N 3.1Å; L253-V308 HydrophobicContact CD1-CG1 4.48Å; L253-I312 HydrophobicContact CD1-CG2 4.43Å |
| 254 | M | 76.3 | Confident | 79.6 | Confident | 44 Ų | 44 | 74.1 Ų | 74.1 | 22% | 0.217 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -78 | -43.3 | -171.8 | -73.8 | -62.7 | -97.6 | 0 | 0 | 113.6 | G128 E129 Y250 V251 R256 | G128-M254 WeakPolarHBondContact O-CE 3.17Å; E129-M254 HydrophobicContact CG-CE 4.3Å; E129-M254 WeakPolarHBondContact OE1-CE 3.42Å; E129-M254 WeakPolarHBondContact OE2-CE 3.49Å; Y250-M254 HydrophobicContact CD1-CG 4.36Å; Y250-M254 HydrophobicContact CD2-CG 4.08Å; Y250-M254 HydrophobicContact CE1-CG 3.94Å; Y250-M254 HydrophobicContact CE2-CE 4.29Å; Y250-M254 HydrophobicContact CE2-CG 3.63Å; Y250-M254 HydrophobicContact CE2-SD 4.33Å; Y250-M254 HydrophobicContact CG-CG 4.43Å; Y250-M254 WeakPolarHBondContact O-CB 3.43Å; Y250-M254 WeakPolarHBondContact O-CG 2.93Å; Y250-M254 PolarHBondContact O-N 3.46Å; Y250-M254 WeakPolarHBondContact OH-CE 3.26Å; V251-M254 PolarHBondContact O-N 2.77Å; M254-R256 PolarHBondContact O-N 3.36Å |
| 255 | F | 68.9 | Low | 79.2 | Confident | 63 Ų | 63 | 76.9 Ų | 76.9 | 28% | 0.276 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | 35.1 | -176.7 | -70.6 | -85 | 0 | 0 | 0 | 113.4 | V251 T257 M263 K264 | V251-F255 HydrophobicContact CB-CD2 4.36Å; V251-F255 HydrophobicContact CG1-CD2 3.79Å; V251-F255 HydrophobicContact CG1-CE2 4.11Å; V251-F255 HydrophobicContact CG2-CE2 4.4Å; V251-F255 WeakPolarHBondContact O-CD2 3.47Å; V251-F255 PolarHBondContact O-N 3.24Å; V251-F255 VanDerWaalsContact O-N 3.11Å; F255-T257 PolarHBondContact O-N 2.67Å; F255-M263 HydrophobicContact CD1-CE 4.22Å; F255-M263 HydrophobicContact CE1-CE 3.96Å; F255-K264 HydrophobicContact CB-CD 4.26Å; F255-K264 HydrophobicContact CB-CG 4.26Å; F255-K264 WeakPolarHBondContact O-CE 3.35Å; F255-K264 PolarHBondContact O-NZ 3.2Å |
| 256 | R | 62.3 | Low | 78.8 | Confident | 202 Ų | 202 | 79.1 Ų | 79.1 | 76% | 0.762 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.7 | -14 | 175.2 | -99.8 | -174.2 | 155.5 | 145.6 | -2.1 | 114.1 | M254 | M254-R256 PolarHBondContact O-N 3.36Š|
| 257 | T | 54.6 | Low | 78.6 | Confident | 90 Ų | 90 | 82 Ų | 82 | 55% | 0.552 | 41% | 0.41 | S | S | * | . | S | Bend | trans | -69.3 | 164.9 | 171 | 46.6 | 0 | 0 | 0 | 0 | 112.3 | F255 G259 | F255-T257 PolarHBondContact O-N 2.67Å; T257-G259 PolarHBondContact O-N 3.1Å |
| 258 | K | 55.2 | Low | 78.4 | Confident | 223 Ų | 223 | 82.7 Ų | 82.7 | 97% | 0.97 | 42% | 0.415 | S | S | * | . | S | Bend | trans | -73.7 | 52.5 | -170.9 | -61.9 | 176.7 | 179.4 | 174.5 | 0 | 113.9 | ||
| 259 | G | 62.6 | Low | 78.4 | Confident | 43 Ų | 43 | 87.2 Ų | 87.2 | 44% | 0.443 | 44% | 0.438 | S | S | . | . | trans | -71.2 | 175.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | T257 R261 | T257-G259 PolarHBondContact O-N 3.1Å; G259-R261 PolarHBondContact O-N 2.85Å | ||
| 260 | T | 64.7 | Low | 78.7 | Confident | 96 Ų | 96 | 88 Ų | 88 | 59% | 0.589 | 45% | 0.446 | S | S | * | . | trans | -60.2 | 134.6 | 176.1 | 51.7 | 0 | 0 | 0 | 0 | 111.1 | L262 M263 | T260-L262 PolarHBondContact O-N 2.94Å; T260-L262 VanDerWaalsContact O-N 3.08Å; T260-M263 PolarHBondContact O-N 2.73Å; T260-M263 WeakPolarHBondContact OG1-CB 3.33Å | ||
| 261 | R | 72.8 | Confident | 79 | Confident | 241 Ų | 241 | 88.4 Ų | 88.4 | 91% | 0.909 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | -24.5 | -171 | -65.1 | -173.1 | 179.9 | -155.5 | 1.8 | 114 | G259 | G259-R261 PolarHBondContact O-N 2.85Š|
| 262 | L | 80.7 | Confident | 79.4 | Confident | 129 Ų | 129 | 90.7 Ų | 90.7 | 68% | 0.675 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.3 | -20 | -175.4 | -61.9 | 176.5 | 0 | 0 | 0 | 114.8 | T260 K264 P265 T266 | T260-L262 PolarHBondContact O-N 2.94Å; T260-L262 VanDerWaalsContact O-N 3.08Å; L262-K264 VanDerWaalsContact C-N 3.31Å; L262-K264 PolarHBondContact O-N 2.15Å; L262-P265 WeakPolarHBondContact O-CD 3.46Å; L262-P265 VanDerWaalsContact O-CG 3.28Å; L262-P265 WeakPolarHBondContact O-CG 2.96Å; L262-T266 WeakPolarHBondContact O-CB 3.39Å; L262-T266 PolarHBondContact O-N 2.78Å; L262-T266 VanDerWaalsContact O-N 3.09Å; L262-T266 PolarHBondContact O-OG1 3Å |
| 263 | M | 80.7 | Confident | 79.9 | Confident | 96 Ų | 96 | 90.1 Ų | 90.1 | 47% | 0.473 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -64.2 | -35.2 | -173.5 | -177.5 | 174 | 76.5 | 0 | 0 | 112.8 | F255 T260 L267 | F255-M263 HydrophobicContact CD1-CE 4.22Å; F255-M263 HydrophobicContact CE1-CE 3.96Å; T260-M263 PolarHBondContact O-N 2.73Å; T260-M263 WeakPolarHBondContact OG1-CB 3.33Å; M263-L267 VanDerWaalsContact O-CB 3.28Å; M263-L267 WeakPolarHBondContact O-CB 3.46Å; M263-L267 PolarHBondContact O-N 3.31Å |
| 264 | K | 81.7 | Confident | 80.7 | Confident | 72 Ų | 72 | 91.5 Ų | 91.5 | 31% | 0.313 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.7 | -59 | 176.4 | -53 | 177.6 | -168.9 | -179.7 | 0 | 112.8 | F255 L262 T266 L267 C268 | F255-K264 HydrophobicContact CB-CD 4.26Å; F255-K264 HydrophobicContact CB-CG 4.26Å; F255-K264 WeakPolarHBondContact O-CE 3.35Å; F255-K264 PolarHBondContact O-NZ 3.2Å; L262-K264 VanDerWaalsContact C-N 3.31Å; L262-K264 PolarHBondContact O-N 2.15Å; K264-T266 VanDerWaalsContact C-N 3.3Å; K264-T266 PolarHBondContact O-N 2.74Å; K264-L267 PolarHBondContact O-N 3.46Å; K264-C268 PolarHBondContact O-N 3.22Å; K264-C268 PolarHBondContact O-SG 2.83Å |
| 265 | P | 87.8 | Confident | 81.7 | Confident | 62 Ų | 62 | 89.6 Ų | 89.6 | 40% | 0.403 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60.7 | -39.3 | -179.7 | 23 | -33.6 | 0 | 0 | 0 | 111.6 | L262 C268 L269 | L262-P265 WeakPolarHBondContact O-CD 3.46Å; L262-P265 VanDerWaalsContact O-CG 3.28Å; L262-P265 WeakPolarHBondContact O-CG 2.96Å; P265-C268 PolarHBondContact O-N 3.46Å; P265-L269 WeakPolarHBondContact O-CB 3.46Å; P265-L269 VanDerWaalsContact O-CG 3.25Å; P265-L269 WeakPolarHBondContact O-CG 3.36Å; P265-L269 PolarHBondContact O-N 3.19Å |
| 266 | T | 89.8 | Confident | 83.1 | Confident | 81 Ų | 81 | 89.5 Ų | 89.5 | 50% | 0.497 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -60.8 | -48.9 | 176.4 | -57.6 | 0 | 0 | 0 | 0 | 112.1 | L262 K264 C268 L269 V270 | L262-T266 WeakPolarHBondContact O-CB 3.39Å; L262-T266 PolarHBondContact O-N 2.78Å; L262-T266 VanDerWaalsContact O-N 3.09Å; L262-T266 PolarHBondContact O-OG1 3Å; K264-T266 VanDerWaalsContact C-N 3.3Å; K264-T266 PolarHBondContact O-N 2.74Å; T266-C268 VanDerWaalsContact C-N 3.29Å; T266-C268 PolarHBondContact O-N 3.06Å; T266-L269 PolarHBondContact O-N 3.35Å; T266-V270 WeakPolarHBondContact O-CG2 3.43Å; T266-V270 PolarHBondContact O-N 2.87Å |
| 267 | L | 89.8 | Confident | 84.8 | Confident | 62 Ų | 62 | 84.7 Ų | 84.7 | 33% | 0.325 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61 | -40.1 | 177.1 | -179.7 | 58.1 | 0 | 0 | 0 | 111.5 | V251 M263 K264 V270 L271 | V251-L267 HydrophobicContact CG1-CD2 3.98Å; V251-L267 HydrophobicContact CG2-CD2 3.9Å; M263-L267 VanDerWaalsContact O-CB 3.28Å; M263-L267 WeakPolarHBondContact O-CB 3.46Å; M263-L267 PolarHBondContact O-N 3.31Å; K264-L267 PolarHBondContact O-N 3.46Å; L267-V270 PolarHBondContact O-N 3.38Å; L267-L271 HydrophobicContact CD1-CD1 4.29Å; L267-L271 HydrophobicContact CD1-CG 4.34Å; L267-L271 HydrophobicContact CG-CD1 4.16Å; L267-L271 VanDerWaalsContact O-CG 3.27Å; L267-L271 WeakPolarHBondContact O-CG 3.24Å; L267-L271 PolarHBondContact O-N 2.65Å |
| 268 | C | 92 | Very high | 86.9 | Confident | 16 Ų | 16 | 81.5 Ų | 81.5 | 11% | 0.108 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -67.1 | -41.5 | 178.6 | -61.1 | 0 | 0 | 0 | 0 | 112.5 | V248 K264 P265 T266 L271 L272 | V248-C268 HydrophobicContact CG1-CB 4.08Å; V248-C268 HydrophobicContact CG2-CB 3.84Å; K264-C268 PolarHBondContact O-N 3.22Å; K264-C268 PolarHBondContact O-SG 2.83Å; P265-C268 PolarHBondContact O-N 3.46Å; T266-C268 VanDerWaalsContact C-N 3.29Å; T266-C268 PolarHBondContact O-N 3.06Å; C268-L271 PolarHBondContact O-N 3.38Å; C268-L272 WeakPolarHBondContact O-CB 3.28Å; C268-L272 VanDerWaalsContact O-CG 3.3Å; C268-L272 WeakPolarHBondContact O-CG 3.33Å; C268-L272 PolarHBondContact O-N 3.33Å |
| 269 | L | 93.8 | Very high | 88.9 | Confident | 117 Ų | 117 | 70.9 Ų | 70.9 | 61% | 0.613 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -64.7 | -38.8 | 176.2 | -72.6 | 170 | 0 | 0 | 0 | 112 | P265 T266 S273 | P265-L269 WeakPolarHBondContact O-CB 3.46Å; P265-L269 VanDerWaalsContact O-CG 3.25Å; P265-L269 WeakPolarHBondContact O-CG 3.36Å; P265-L269 PolarHBondContact O-N 3.19Å; T266-L269 PolarHBondContact O-N 3.35Å; L269-S273 VanDerWaalsContact O-CB 3.28Å; L269-S273 WeakPolarHBondContact O-CB 3.41Å; L269-S273 PolarHBondContact O-N 2.99Å; L269-S273 PolarHBondContact O-OG 3.25Å |
| 270 | V | 95.4 | Very high | 90.6 | Very high | 70 Ų | 70 | 72.3 Ų | 72.3 | 42% | 0.424 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 175.3 | 170.3 | 0 | 0 | 0 | 0 | 111.5 | T266 L267 L272 S273 L274 | T266-V270 WeakPolarHBondContact O-CG2 3.43Å; T266-V270 PolarHBondContact O-N 2.87Å; L267-V270 PolarHBondContact O-N 3.38Å; V270-L272 PolarHBondContact O-N 3.02Å; V270-S273 PolarHBondContact O-N 3.42Å; V270-S273 PolarHBondContact O-OG 3.19Å; V270-S273 VanDerWaalsContact O-OG 3.1Å; V270-L274 HydrophobicContact CG1-CD1 4.05Å; V270-L274 WeakPolarHBondContact O-CB 3.15Å; V270-L274 VanDerWaalsContact O-CG 3.27Å; V270-L274 WeakPolarHBondContact O-CG 3.08Å; V270-L274 PolarHBondContact O-N 3.1Å |
| 271 | L | 95.9 | Very high | 92.1 | Very high | 13 Ų | 13 | 68.6 Ų | 68.6 | 7% | 0.068 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -62.6 | -42.9 | 177.7 | -69.7 | 168.7 | 0 | 0 | 0 | 111.9 | I120 A244 T247 V248 L267 C268 A275 | I120-L271 HydrophobicContact CG2-CD2 3.46Å; I120-L271 VanDerWaalsContact CG2-CD2 3.46Å; A244-L271 HydrophobicContact CB-CB 4.4Å; A244-L271 WeakPolarHBondContact CB-O 3.35Å; T247-L271 HydrophobicContact CG2-CD1 3.64Å; T247-L271 HydrophobicContact CG2-CD2 4.39Å; V248-L271 HydrophobicContact CG2-CB 4.14Å; V248-L271 HydrophobicContact CG2-CD1 4.1Å; L267-L271 HydrophobicContact CD1-CD1 4.29Å; L267-L271 HydrophobicContact CD1-CG 4.34Å; L267-L271 HydrophobicContact CG-CD1 4.16Å; L267-L271 VanDerWaalsContact O-CG 3.27Å; L267-L271 WeakPolarHBondContact O-CG 3.24Å; L267-L271 PolarHBondContact O-N 2.65Å; C268-L271 PolarHBondContact O-N 3.38Å; L271-A275 PolarHBondContact O-N 3.35Å |
| 272 | L | 96.8 | Very high | 93.2 | Very high | 49 Ų | 49 | 57.3 Ų | 57.3 | 26% | 0.257 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -69.6 | -40.3 | 177.9 | -69.3 | 169.8 | 0 | 0 | 0 | 112.3 | F241 A244 I245 V248 C268 V270 A275 V276 | F241-L272 HydrophobicContact CE2-CD2 4.36Å; A244-L272 HydrophobicContact CB-CD2 4.21Å; I245-L272 HydrophobicContact CD1-CD2 3.75Å; I245-L272 HydrophobicContact CG1-CD2 4.36Å; V248-L272 HydrophobicContact CG2-CG 4.27Å; C268-L272 WeakPolarHBondContact O-CB 3.28Å; C268-L272 VanDerWaalsContact O-CG 3.3Å; C268-L272 WeakPolarHBondContact O-CG 3.33Å; C268-L272 PolarHBondContact O-N 3.33Å; V270-L272 PolarHBondContact O-N 3.02Å; L272-A275 PolarHBondContact O-N 3.11Å; L272-V276 WeakPolarHBondContact O-CG2 3.42Å; L272-V276 PolarHBondContact O-N 2.92Å |
| 273 | S | 97.2 | Very high | 94 | Very high | 69 Ų | 69 | 53.6 Ų | 53.6 | 48% | 0.483 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -67.5 | -36.9 | 179.4 | 69 | 0 | 0 | 0 | 0 | 112.2 | L269 V270 V276 L277 | L269-S273 VanDerWaalsContact O-CB 3.28Å; L269-S273 WeakPolarHBondContact O-CB 3.41Å; L269-S273 PolarHBondContact O-N 2.99Å; L269-S273 PolarHBondContact O-OG 3.25Å; V270-S273 PolarHBondContact O-N 3.42Å; V270-S273 PolarHBondContact O-OG 3.19Å; V270-S273 VanDerWaalsContact O-OG 3.1Å; S273-V276 PolarHBondContact O-N 3.45Å; S273-L277 WeakPolarHBondContact O-CB 3.49Å; S273-L277 PolarHBondContact O-N 3.42Å |
| 274 | L | 96.4 | Very high | 94.7 | Very high | 84 Ų | 84 | 52.9 Ų | 52.9 | 44% | 0.44 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.5 | -44.2 | 171.6 | -72 | 171 | 0 | 0 | 0 | 111.8 | V270 L277 V278 | V270-L274 HydrophobicContact CG1-CD1 4.05Å; V270-L274 WeakPolarHBondContact O-CB 3.15Å; V270-L274 VanDerWaalsContact O-CG 3.27Å; V270-L274 WeakPolarHBondContact O-CG 3.08Å; V270-L274 PolarHBondContact O-N 3.1Å; L274-L277 WeakPolarHBondContact O-CB 3.38Å; L274-L277 PolarHBondContact O-N 3.04Å; L274-V278 PolarHBondContact O-N 3.2Å |
| 275 | A | 97.6 | Very high | 95.4 | Very high | 4 Ų | 4 | 50.7 Ų | 50.7 | 3% | 0.033 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65.6 | -39.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | S240 F241 A244 L271 L272 L277 V278 | S240-A275 WeakPolarHBondContact O-CB 3.32Å; F241-A275 HydrophobicContact CD2-CB 4.37Å; A244-A275 HydrophobicContact CB-CB 3.72Å; L271-A275 PolarHBondContact O-N 3.35Å; L272-A275 PolarHBondContact O-N 3.11Å; A275-L277 VanDerWaalsContact C-N 3.34Å; A275-V278 PolarHBondContact O-N 2.93Å |
| 276 | V | 98.1 | Very high | 95.7 | Very high | 60 Ų | 60 | 50.7 Ų | 50.7 | 36% | 0.364 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.6 | -40 | 174.2 | 171.2 | 0 | 0 | 0 | 0 | 111 | L272 S273 V278 G279 V280 F297 | L272-V276 WeakPolarHBondContact O-CG2 3.42Å; L272-V276 PolarHBondContact O-N 2.92Å; S273-V276 PolarHBondContact O-N 3.45Å; V276-V278 VanDerWaalsContact C-N 3.33Å; V276-V278 PolarHBondContact O-N 3.3Å; V276-G279 PolarHBondContact O-N 2.9Å; V276-G279 VanDerWaalsContact O-N 3.1Å; V276-V280 HydrophobicContact CG1-CG2 4.24Å; V276-V280 WeakPolarHBondContact O-CG2 3.38Å; V276-V280 PolarHBondContact O-N 3.17Å; V276-F297 HydrophobicContact CG2-CE2 4.48Å; V276-F297 HydrophobicContact CG2-CZ 4.47Å |
| 277 | L | 97.8 | Very high | 96 | Very high | 101 Ų | 101 | 47.3 Ų | 47.3 | 53% | 0.529 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -60 | -39.8 | 179 | -177.5 | 62.6 | 0 | 0 | 0 | 112.3 | S273 L274 A275 G279 V280 V281 | S273-L277 WeakPolarHBondContact O-CB 3.49Å; S273-L277 PolarHBondContact O-N 3.42Å; L274-L277 WeakPolarHBondContact O-CB 3.38Å; L274-L277 PolarHBondContact O-N 3.04Å; A275-L277 VanDerWaalsContact C-N 3.34Å; L277-G279 VanDerWaalsContact C-N 3.32Å; L277-G279 PolarHBondContact O-N 3.43Å; L277-V280 PolarHBondContact O-N 2.91Å; L277-V281 WeakPolarHBondContact O-CG2 3.49Å; L277-V281 PolarHBondContact O-N 3.11Å |
| 278 | V | 97.6 | Very high | 96.3 | Very high | 23 Ų | 23 | 45 Ų | 45 | 14% | 0.139 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.2 | -45.4 | 174 | 176.2 | 0 | 0 | 0 | 0 | 111 | V113 D236 L274 A275 V276 V281 R282 | V113-V278 HydrophobicContact CG1-CG1 4.29Å; V113-V278 HydrophobicContact CG2-CG1 4.07Å; V113-V278 HydrophobicContact CG2-CG2 4.48Å; D236-V278 HydrophobicContact CB-CG1 3.84Å; L274-V278 PolarHBondContact O-N 3.2Å; A275-V278 PolarHBondContact O-N 2.93Å; V276-V278 VanDerWaalsContact C-N 3.33Å; V276-V278 PolarHBondContact O-N 3.3Å; V278-V281 PolarHBondContact O-N 3.26Å; V278-R282 WeakPolarHBondContact O-CG 3.43Å; V278-R282 PolarHBondContact O-N 2.95Å; V278-R282 VanDerWaalsContact O-N 3.1Å |
| 279 | G | 97.3 | Very high | 96.5 | Very high | 1 Ų | 1 | 46.3 Ų | 46.3 | 1% | 0.01 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.3 | -40.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | V276 L277 V281 R282 V283 | V276-G279 PolarHBondContact O-N 2.9Å; V276-G279 VanDerWaalsContact O-N 3.1Å; L277-G279 VanDerWaalsContact C-N 3.32Å; L277-G279 PolarHBondContact O-N 3.43Å; G279-V281 PolarHBondContact O-N 3.07Å; G279-R282 PolarHBondContact O-N 3.49Å; G279-V283 PolarHBondContact O-N 3.01Å |
| 280 | V | 98 | Very high | 96.7 | Very high | 73 Ų | 73 | 48.7 Ų | 48.7 | 44% | 0.442 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.1 | -42.9 | 175.3 | 172.8 | 0 | 0 | 0 | 0 | 111.2 | V276 L277 R282 V283 T284 | V276-V280 HydrophobicContact CG1-CG2 4.24Å; V276-V280 WeakPolarHBondContact O-CG2 3.38Å; V276-V280 PolarHBondContact O-N 3.17Å; L277-V280 PolarHBondContact O-N 2.91Å; V280-R282 VanDerWaalsContact C-N 3.32Å; V280-R282 PolarHBondContact O-N 2.83Å; V280-V283 PolarHBondContact O-N 2.89Å; V280-T284 HydrophobicContact CG1-CG2 4.18Å; V280-T284 WeakPolarHBondContact O-CG2 3.26Å; V280-T284 PolarHBondContact O-N 3.03Å; V280-T284 PolarHBondContact O-OG1 3.49Å; V280-T284 VanDerWaalsContact O-OG1 3.11Å |
| 281 | V | 97.2 | Very high | 96.8 | Very high | 18 Ų | 18 | 49.3 Ų | 49.3 | 11% | 0.109 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -57.9 | -46 | 174.9 | 171.1 | 0 | 0 | 0 | 0 | 110.6 | K107 A108 L277 V278 G279 V283 T284 E285 | K107-V281 HydrophobicContact CB-CG1 3.88Å; K107-V281 HydrophobicContact CB-CG2 4.43Å; A108-V281 HydrophobicContact CB-CB 4.1Å; A108-V281 HydrophobicContact CB-CG1 3.66Å; L277-V281 WeakPolarHBondContact O-CG2 3.49Å; L277-V281 PolarHBondContact O-N 3.11Å; V278-V281 PolarHBondContact O-N 3.26Å; G279-V281 PolarHBondContact O-N 3.07Å; V281-V283 VanDerWaalsContact C-N 3.31Å; V281-V283 PolarHBondContact O-N 3.44Å; V281-T284 WeakPolarHBondContact CA-OG1 3.05Å; V281-T284 PolarHBondContact O-N 2.88Å; V281-T284 PolarHBondContact O-OG1 3.34Å; V281-E285 HydrophobicContact CG1-CG 4.22Å; V281-E285 WeakPolarHBondContact O-CB 3.41Å; V281-E285 PolarHBondContact O-N 3.12Å |
| 282 | R | 96.4 | Very high | 96.8 | Very high | 3 Ų | 3 | 48.9 Ų | 48.9 | 1% | 0.011 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.9 | -35.2 | 178.8 | -69.9 | -68.7 | 177.2 | -152.8 | -4.6 | 114.1 | E103 A108 D236 V278 G279 V280 R287 N288 V293 | E103-R282 IonicContact OE1-NH1 3.68Å; E103-R282 IonicContact OE2-CZ 3.58Å; E103-R282 IonicContact OE2-NH1 3.71Å; E103-R282 PolarHBondContact OE2-NH1 2.89Å; E103-R282 IonicContact OE2-NH2 2.67Å; E103-R282 PolarHBondContact OE2-NH2 3.49Å; A108-R282 PolarHBondContact O-NH2 2.93Å; D236-R282 IonicContact OD1-NH2 3.83Å; D236-R282 IonicContact OD2-CZ 3.09Å; D236-R282 IonicContact OD2-NE 3.85Å; D236-R282 PolarHBondContact OD2-NE 2.86Å; D236-R282 IonicContact OD2-NH2 3.39Å; D236-R282 PolarHBondContact OD2-NH2 2.04Å; V278-R282 WeakPolarHBondContact O-CG 3.43Å; V278-R282 PolarHBondContact O-N 2.95Å; V278-R282 VanDerWaalsContact O-N 3.1Å; G279-R282 PolarHBondContact O-N 3.49Å; V280-R282 VanDerWaalsContact C-N 3.32Å; V280-R282 PolarHBondContact O-N 2.83Å; R282-R287 PolarHBondContact O-N 2.91Å; R282-N288 HydrophobicContact CB-CB 4.39Å; R282-N288 WeakPolarHBondContact CB-OD1 3.22Å; R282-N288 PolarHBondContact O-N 2.96Å; R282-V293 HydrophobicContact CB-CG2 4.28Å |
| 283 | V | 96.9 | Very high | 96.9 | Very high | 51 Ų | 51 | 47 Ų | 47 | 31% | 0.309 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -74.5 | -45.4 | 173.7 | -178.8 | 0 | 0 | 0 | 0 | 111.7 | G279 V280 V281 E285 H286 W290 V293 | G279-V283 PolarHBondContact O-N 3.01Å; V280-V283 PolarHBondContact O-N 2.89Å; V281-V283 VanDerWaalsContact C-N 3.31Å; V281-V283 PolarHBondContact O-N 3.44Å; V283-E285 VanDerWaalsContact C-N 3.32Å; V283-E285 PolarHBondContact O-N 3.36Å; V283-H286 PolarHBondContact O-N 3.37Å; V283-H286 PolarHBondContact O-ND1 3.44Å; V283-W290 HydrophobicContact CG2-CB 4.38Å; V283-V293 HydrophobicContact CG2-CB 4.33Å; V283-V293 HydrophobicContact CG2-CG2 3.82Å |
| 284 | T | 96 | Very high | 97 | Very high | 81 Ų | 81 | 47.9 Ų | 47.9 | 50% | 0.497 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -67.1 | -31.6 | -177.5 | 56.5 | 0 | 0 | 0 | 0 | 113 | V280 V281 H286 | V280-T284 HydrophobicContact CG1-CG2 4.18Å; V280-T284 WeakPolarHBondContact O-CG2 3.26Å; V280-T284 PolarHBondContact O-N 3.03Å; V280-T284 PolarHBondContact O-OG1 3.49Å; V280-T284 VanDerWaalsContact O-OG1 3.11Å; V281-T284 WeakPolarHBondContact CA-OG1 3.05Å; V281-T284 PolarHBondContact O-N 2.88Å; V281-T284 PolarHBondContact O-OG1 3.34Å; T284-H286 VanDerWaalsContact C-N 3.25Å; T284-H286 PolarHBondContact O-N 3.35Å |
| 285 | E | 95.3 | Very high | 97.1 | Very high | 26 Ų | 26 | 44.9 Ų | 44.9 | 12% | 0.121 | 24% | 0.236 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | 13.2 | 172.3 | -62 | -172.7 | 163 | 0 | 0 | 113 | P100 S106 K107 V281 V283 R287 | P100-E285 HydrophobicContact CB-CB 4.46Å; P100-E285 VanDerWaalsContact CB-O 3.23Å; P100-E285 WeakPolarHBondContact CB-O 3.39Å; P100-E285 WeakPolarHBondContact CG-O 3.21Å; S106-E285 WeakPolarHBondContact CA-OE2 3.17Å; S106-E285 WeakPolarHBondContact CB-OE2 2.88Å; S106-E285 PolarHBondContact OG-OE2 3.24Å; K107-E285 VanDerWaalsContact CB-OE1 3.29Å; K107-E285 WeakPolarHBondContact CB-OE1 3.38Å; K107-E285 WeakPolarHBondContact CD-OE1 3.37Å; K107-E285 WeakPolarHBondContact CG-OE1 3.27Å; K107-E285 PolarHBondContact N-OE1 3.25Å; V281-E285 HydrophobicContact CG1-CG 4.22Å; V281-E285 WeakPolarHBondContact O-CB 3.41Å; V281-E285 PolarHBondContact O-N 3.12Å; V283-E285 VanDerWaalsContact C-N 3.32Å; V283-E285 PolarHBondContact O-N 3.36Å; E285-R287 HydrophobicContact CB-CG 4.32Å; E285-R287 WeakPolarHBondContact O-CG 3.29Å; E285-R287 PolarHBondContact O-N 3.35Å; E285-R287 IonicContact OE2-CZ 2.73Å; E285-R287 IonicContact OE2-NH1 3.88Å; E285-R287 PolarHBondContact OE2-NH1 2.91Å; E285-R287 IonicContact OE2-NH2 2.74Å |
| 286 | H | 95 | Very high | 97.1 | Very high | 62 Ų | 62 | 44.7 Ų | 44.7 | 29% | 0.287 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.9 | 23.6 | 174.1 | -55.2 | -27.1 | 0 | 0 | 0 | 114.4 | K97 P190 H191 V283 T284 | K97-H286 HydrophobicContact CB-CB 3.97Å; K97-H286 HydrophobicContact CG-CB 4.32Å; P190-H286 HydrophobicContact CB-CB 4.19Å; P190-H286 WeakPolarHBondContact CD-O 3.05Å; H191-H286 PolarHBondContact ND1-O 3.4Å; V283-H286 PolarHBondContact O-N 3.37Å; V283-H286 PolarHBondContact O-ND1 3.44Å; T284-H286 VanDerWaalsContact C-N 3.25Å; T284-H286 PolarHBondContact O-N 3.35Å |
| 287 | R | 95.1 | Very high | 97.1 | Very high | 11 Ų | 11 | 43.4 Ų | 43.4 | 4% | 0.042 | 22% | 0.224 | C | C | . | . | S | Bend | trans | -85 | -28.3 | 179.7 | -63.1 | -133.3 | -173.9 | 69.9 | 6.7 | 112.7 | P100 P102 E103 S106 T189 R282 E285 | P100-R287 HydrophobicContact CG-CG 3.97Å; P102-R287 PolarHBondContact O-NH2 3.48Å; E103-R287 WeakPolarHBondContact OE1-CD 3.39Å; E103-R287 IonicContact OE1-CZ 2.68Å; E103-R287 IonicContact OE1-NE 3.5Å; E103-R287 PolarHBondContact OE1-NE 3.25Å; E103-R287 VanDerWaalsContact OE1-NE 3.09Å; E103-R287 IonicContact OE2-CZ 3.61Å; E103-R287 IonicContact OE2-NE 2.68Å; E103-R287 IonicContact OE2-NH1 3.78Å; S106-R287 VanDerWaalsContact CB-NH1 3.28Å; S106-R287 PolarHBondContact OG-NH1 3.23Å; S106-R287 VanDerWaalsContact OG-NH1 3.07Å; T189-R287 VanDerWaalsContact CG2-O 3.24Å; T189-R287 WeakPolarHBondContact CG2-O 3.42Å; R282-R287 PolarHBondContact O-N 2.91Å; E285-R287 HydrophobicContact CB-CG 4.32Å; E285-R287 WeakPolarHBondContact O-CG 3.29Å; E285-R287 PolarHBondContact O-N 3.35Å; E285-R287 IonicContact OE2-CZ 2.73Å; E285-R287 IonicContact OE2-NH1 3.88Å; E285-R287 PolarHBondContact OE2-NH1 2.91Å; E285-R287 IonicContact OE2-NH2 2.74Å |
| 288 | N | 96.7 | Very high | 97.1 | Very high | 12 Ų | 12 | 43 Ų | 43 | 6% | 0.064 | 23% | 0.226 | C | C | . | . | S | Bend | trans | -136.9 | 154.6 | 175.8 | -63.6 | 112.6 | 0 | 0 | 0 | 110.6 | S231 S234 R282 D292 V293 | S231-N288 PolarHBondContact O-ND2 3.38Å; S234-N288 PolarHBondContact OG-OD1 3.3Å; R282-N288 HydrophobicContact CB-CB 4.39Å; R282-N288 WeakPolarHBondContact CB-OD1 3.22Å; R282-N288 PolarHBondContact O-N 2.96Å; N288-D292 HydrophobicContact CB-CB 4.15Å; N288-V293 HydrophobicContact CB-CG2 3.89Å |
| 289 | H | 96.6 | Very high | 97.1 | Very high | 44 Ų | 44 | 43.9 Ų | 43.9 | 20% | 0.204 | 23% | 0.231 | C | C | . | . | trans | -75.1 | 158.1 | 164.4 | -60.6 | -85.6 | 0 | 0 | 0 | 110.1 | A94 Y95 Q188 N291 D292 V293 | A94-H289 PolarHBondContact O-CE1 3.33Å; Y95-H289 AromaticContact CD1-CE1 3.81Å; Y95-H289 AromaticContact CD1-NE2 3.46Å; Y95-H289 WeakPolarHBondContact CD1-NE2 3.23Å; Y95-H289 AromaticContact CE1-CE1 3.67Å; Y95-H289 AromaticContact CE1-NE2 2.96Å; Y95-H289 WeakPolarHBondContact CE1-NE2 3.07Å; Q188-H289 VanDerWaalsContact C-NE2 3.29Å; Q188-H289 PolarHBondContact O-NE2 3.16Å; H289-N291 PolarHBondContact O-N 2.8Å; H289-D292 WeakPolarHBondContact CB-OD2 3.36Å; H289-D292 IonicContact CD2-OD2 3.03Å; H289-D292 PolarHBondContact CD2-OD2 3.32Å; H289-D292 IonicContact CG-OD2 2.78Å; H289-D292 PolarHBondContact N-OD2 3.27Å; H289-D292 WeakPolarHBondContact O-CB 3.25Å; H289-D292 PolarHBondContact O-N 2.68Å; H289-D292 VanDerWaalsContact O-N 3.09Å; H289-V293 PolarHBondContact O-N 2.95Å | ||
| 290 | W | 97.1 | Very high | 97.2 | Very high | 168 Ų | 168 | 43.9 Ų | 43.9 | 64% | 0.636 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -60.7 | -34.5 | 178.3 | 73.2 | -88.7 | 0 | 0 | 0 | 112.6 | V283 V293 L294 | V283-W290 HydrophobicContact CG2-CB 4.38Å; W290-V293 PolarHBondContact O-N 3.16Å; W290-L294 HydrophobicContact CZ3-CD2 4.09Å; W290-L294 PolarHBondContact O-N 3.37Å |
| 291 | N | 97.3 | Very high | 97.1 | Very high | 82 Ų | 82 | 41 Ų | 41 | 44% | 0.439 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -61.9 | -41.8 | 173.2 | -75.3 | -34.4 | 0 | 0 | 0 | 112.5 | H289 V293 L294 A295 | H289-N291 PolarHBondContact O-N 2.8Å; N291-V293 VanDerWaalsContact C-N 3.29Å; N291-V293 PolarHBondContact O-N 3.41Å; N291-L294 PolarHBondContact O-N 3.09Å; N291-A295 WeakPolarHBondContact O-CB 3.23Å; N291-A295 PolarHBondContact O-N 3.02Å |
| 292 | D | 97.7 | Very high | 97.1 | Very high | 4 Ų | 4 | 42.9 Ų | 42.9 | 2% | 0.021 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.6 | -37.1 | 179.5 | -50 | -25 | 0 | 0 | 0 | 111.2 | N187 S231 F232 S234 N288 H289 G296 | N187-D292 PolarHBondContact ND2-OD1 2.9Å; S231-D292 WeakPolarHBondContact CB-OD2 3.14Å; S231-D292 VanDerWaalsContact O-CB 3.3Å; S231-D292 WeakPolarHBondContact O-CB 3.42Å; S231-D292 PolarHBondContact OG-OD2 3.21Å; F232-D292 HydrophobicContact CD2-CB 4.3Å; F232-D292 WeakPolarHBondContact CD2-OD1 3.33Å; S234-D292 PolarHBondContact N-O 3.11Å; N288-D292 HydrophobicContact CB-CB 4.15Å; H289-D292 WeakPolarHBondContact CB-OD2 3.36Å; H289-D292 IonicContact CD2-OD2 3.03Å; H289-D292 PolarHBondContact CD2-OD2 3.32Å; H289-D292 IonicContact CG-OD2 2.78Å; H289-D292 PolarHBondContact N-OD2 3.27Å; H289-D292 WeakPolarHBondContact O-CB 3.25Å; H289-D292 PolarHBondContact O-N 2.68Å; H289-D292 VanDerWaalsContact O-N 3.09Å; D292-G296 PolarHBondContact O-N 3.45Å |
| 293 | V | 98.3 | Very high | 97.1 | Very high | 9 Ų | 9 | 43.8 Ų | 43.8 | 6% | 0.055 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -70.2 | -43.6 | 176.3 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | A237 R282 V283 N288 H289 W290 N291 G296 F297 | A237-V293 HydrophobicContact CB-CB 4.39Å; A237-V293 HydrophobicContact CB-CG1 3.95Å; A237-V293 HydrophobicContact CB-CG2 4.49Å; R282-V293 HydrophobicContact CB-CG2 4.28Å; V283-V293 HydrophobicContact CG2-CB 4.33Å; V283-V293 HydrophobicContact CG2-CG2 3.82Å; N288-V293 HydrophobicContact CB-CG2 3.89Å; H289-V293 PolarHBondContact O-N 2.95Å; W290-V293 PolarHBondContact O-N 3.16Å; N291-V293 VanDerWaalsContact C-N 3.29Å; N291-V293 PolarHBondContact O-N 3.41Å; V293-G296 WeakPolarHBondContact O-CA 3.49Å; V293-G296 PolarHBondContact O-N 2.68Å; V293-F297 HydrophobicContact CG1-CD2 4.22Å; V293-F297 HydrophobicContact CG1-CE1 4.16Å; V293-F297 HydrophobicContact CG1-CE2 3.66Å; V293-F297 HydrophobicContact CG1-CZ 3.63Å; V293-F297 WeakPolarHBondContact O-CG 3.09Å; V293-F297 PolarHBondContact O-N 2.58Å |
| 294 | L | 98.3 | Very high | 97.1 | Very high | 88 Ų | 88 | 41.3 Ų | 41.3 | 46% | 0.461 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.6 | -45.2 | 174.8 | -179.9 | 60.4 | 0 | 0 | 0 | 111.6 | W290 N291 G296 F297 V298 | W290-L294 HydrophobicContact CZ3-CD2 4.09Å; W290-L294 PolarHBondContact O-N 3.37Å; N291-L294 PolarHBondContact O-N 3.09Å; L294-G296 VanDerWaalsContact C-N 3.28Å; L294-G296 PolarHBondContact O-N 3.07Å; L294-F297 PolarHBondContact O-N 3.47Å; L294-V298 HydrophobicContact CD1-CG2 4.44Å; L294-V298 WeakPolarHBondContact O-CG2 3.43Å; L294-V298 PolarHBondContact O-N 3.27Å |
| 295 | A | 98.3 | Very high | 96.9 | Very high | 22 Ų | 22 | 39.4 Ų | 39.4 | 18% | 0.182 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.8 | -38.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | F232 P233 N291 T299 | F232-A295 HydrophobicContact CD2-CB 4.31Å; F232-A295 HydrophobicContact CE2-CB 3.44Å; F232-A295 VanDerWaalsContact CE2-CB 3.44Å; F232-A295 HydrophobicContact CZ-CB 3.79Å; P233-A295 HydrophobicContact CB-CB 4.2Å; N291-A295 WeakPolarHBondContact O-CB 3.23Å; N291-A295 PolarHBondContact O-N 3.02Å; A295-T299 WeakPolarHBondContact O-CB 3.18Å; A295-T299 PolarHBondContact O-N 3.33Å; A295-T299 PolarHBondContact O-OG1 2.92Å |
| 296 | G | 98.2 | Very high | 96.7 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -58.3 | -54.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A238 D292 V293 L294 V298 T299 G300 | A238-G296 VanDerWaalsContact CA-O 3.22Å; A238-G296 WeakPolarHBondContact CA-O 3.33Å; A238-G296 WeakPolarHBondContact CB-O 3.41Å; D292-G296 PolarHBondContact O-N 3.45Å; V293-G296 WeakPolarHBondContact O-CA 3.49Å; V293-G296 PolarHBondContact O-N 2.68Å; L294-G296 VanDerWaalsContact C-N 3.28Å; L294-G296 PolarHBondContact O-N 3.07Å; G296-V298 PolarHBondContact O-N 2.93Å; G296-T299 PolarHBondContact O-N 3.08Å; G296-T299 VanDerWaalsContact O-N 3.17Å; G296-G300 PolarHBondContact O-N 2.84Å |
| 297 | F | 98.5 | Very high | 96.5 | Very high | 32 Ų | 32 | 41.3 Ų | 41.3 | 14% | 0.14 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57 | -45.6 | 177.7 | -65.5 | -23.8 | 0 | 0 | 0 | 112.7 | A237 F241 V276 V293 L294 T299 G301 | A237-F297 HydrophobicContact CB-CD1 3.75Å; A237-F297 HydrophobicContact CB-CE1 3.63Å; A237-F297 HydrophobicContact CB-CZ 4.46Å; A237-F297 WeakPolarHBondContact O-CD1 3.45Å; F241-F297 HydrophobicContact CB-CB 4.4Å; F241-F297 HydrophobicContact CB-CD1 3.72Å; F241-F297 HydrophobicContact CB-CE1 4.47Å; F241-F297 HydrophobicContact CB-CG 4.42Å; F241-F297 HydrophobicContact CD1-CB 4.24Å; F241-F297 WeakPolarHBondContact CD1-O 3.33Å; F241-F297 HydrophobicContact CD2-CB 4.13Å; F241-F297 AromaticContact CD2-CD1 3.78Å; F241-F297 HydrophobicContact CD2-CD1 3.78Å; F241-F297 HydrophobicContact CD2-CE1 4.31Å; F241-F297 AromaticContact CD2-CG 3.97Å; F241-F297 HydrophobicContact CD2-CG 3.97Å; F241-F297 HydrophobicContact CE2-CB 4.46Å; F241-F297 HydrophobicContact CE2-CG 4.46Å; F241-F297 HydrophobicContact CG-CB 4.01Å; F241-F297 AromaticContact CG-CD1 3.93Å; F241-F297 HydrophobicContact CG-CD1 3.93Å; F241-F297 HydrophobicContact CG-CG 4.2Å; V276-F297 HydrophobicContact CG2-CE2 4.48Å; V276-F297 HydrophobicContact CG2-CZ 4.47Å; V293-F297 HydrophobicContact CG1-CD2 4.22Å; V293-F297 HydrophobicContact CG1-CE1 4.16Å; V293-F297 HydrophobicContact CG1-CE2 3.66Å; V293-F297 HydrophobicContact CG1-CZ 3.63Å; V293-F297 WeakPolarHBondContact O-CG 3.09Å; V293-F297 PolarHBondContact O-N 2.58Å; L294-F297 PolarHBondContact O-N 3.47Å; F297-T299 PolarHBondContact O-N 3.29Å; F297-G301 PolarHBondContact O-N 3.27Å |
| 298 | V | 98.3 | Very high | 96 | Very high | 94 Ų | 94 | 41 Ų | 41 | 57% | 0.57 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -60.8 | -44.4 | 176.6 | 171.7 | 0 | 0 | 0 | 0 | 111 | L294 G296 A302 | L294-V298 HydrophobicContact CD1-CG2 4.44Å; L294-V298 WeakPolarHBondContact O-CG2 3.43Å; L294-V298 PolarHBondContact O-N 3.27Å; G296-V298 PolarHBondContact O-N 2.93Å; V298-A302 WeakPolarHBondContact O-CB 3.07Å; V298-A302 PolarHBondContact O-N 3.26Å |
| 299 | T | 97.9 | Very high | 95.3 | Very high | 41 Ų | 41 | 43 Ų | 43 | 25% | 0.252 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -62.7 | -52.7 | 179.3 | -56.9 | 0 | 0 | 0 | 0 | 111.6 | F177 A295 G296 F297 G301 A302 I303 | F177-T299 HydrophobicContact CB-CG2 4.25Å; A295-T299 WeakPolarHBondContact O-CB 3.18Å; A295-T299 PolarHBondContact O-N 3.33Å; A295-T299 PolarHBondContact O-OG1 2.92Å; G296-T299 PolarHBondContact O-N 3.08Å; G296-T299 VanDerWaalsContact O-N 3.17Å; F297-T299 PolarHBondContact O-N 3.29Å; T299-G301 PolarHBondContact O-N 2.99Å; T299-A302 PolarHBondContact O-N 3.47Å; T299-I303 HydrophobicContact CG2-CD1 3.97Å; T299-I303 WeakPolarHBondContact O-CG1 3.43Å; T299-I303 PolarHBondContact O-N 2.97Å |
| 300 | G | 97.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.4 | -39.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | A238 G296 A304 | A238-G300 WeakPolarHBondContact O-CA 3.29Å; G296-G300 PolarHBondContact O-N 2.84Å; G300-A304 WeakPolarHBondContact O-CB 3.42Å; G300-A304 PolarHBondContact O-N 3.06Å |
| 301 | G | 97.3 | Very high | 93.4 | Very high | 13 Ų | 13 | 37.5 Ų | 37.5 | 13% | 0.134 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.3 | -42.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | F297 T299 A304 A305 | F297-G301 PolarHBondContact O-N 3.27Å; T299-G301 PolarHBondContact O-N 2.99Å; G301-A304 PolarHBondContact O-N 3.19Å; G301-A305 VanDerWaalsContact O-CB 3.27Å; G301-A305 WeakPolarHBondContact O-CB 3.38Å; G301-A305 PolarHBondContact O-N 3.02Å |
| 302 | A | 96.9 | Very high | 92 | Very high | 58 Ų | 58 | 34.3 Ų | 34.3 | 48% | 0.479 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.2 | -43.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | V298 T299 A305 F306 | V298-A302 WeakPolarHBondContact O-CB 3.07Å; V298-A302 PolarHBondContact O-N 3.26Å; T299-A302 PolarHBondContact O-N 3.47Å; A302-A305 PolarHBondContact O-N 3.05Å; A302-F306 VanDerWaalsContact O-CB 3.26Å; A302-F306 WeakPolarHBondContact O-CB 3.25Å; A302-F306 PolarHBondContact O-N 3.03Å |
| 303 | I | 96.4 | Very high | 90.6 | Very high | 21 Ų | 21 | 36.7 Ų | 36.7 | 11% | 0.108 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.8 | -44.3 | 176.7 | -65.9 | 167.3 | 0 | 0 | 0 | 110.8 | T174 F177 Y242 T299 F306 L307 | T174-I303 HydrophobicContact CG2-CD1 4.37Å; T174-I303 WeakPolarHBondContact OG1-CD1 3.23Å; F177-I303 HydrophobicContact CB-CD1 4.39Å; F177-I303 HydrophobicContact CD2-CD1 3.69Å; F177-I303 HydrophobicContact CE2-CD1 4.38Å; F177-I303 HydrophobicContact CG-CD1 4.31Å; Y242-I303 HydrophobicContact CD2-CB 4.31Å; Y242-I303 HydrophobicContact CD2-CG2 4Å; Y242-I303 HydrophobicContact CE2-CG2 3.96Å; T299-I303 HydrophobicContact CG2-CD1 3.97Å; T299-I303 WeakPolarHBondContact O-CG1 3.43Å; T299-I303 PolarHBondContact O-N 2.97Å; I303-F306 PolarHBondContact O-N 2.96Å; I303-L307 HydrophobicContact CG2-CD1 3.93Å; I303-L307 HydrophobicContact CG2-CG 4.49Å; I303-L307 WeakPolarHBondContact O-CB 3.4Å; I303-L307 WeakPolarHBondContact O-CG 3.37Å; I303-L307 PolarHBondContact O-N 2.04Å |
| 304 | A | 95.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.3 | -47.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y242 I245 G300 G301 F306 L307 V308 | Y242-A304 HydrophobicContact CD2-CB 3.66Å; Y242-A304 HydrophobicContact CE2-CB 3.95Å; I245-A304 HydrophobicContact CB-CB 3.82Å; I245-A304 HydrophobicContact CG2-CB 3.55Å; G300-A304 WeakPolarHBondContact O-CB 3.42Å; G300-A304 PolarHBondContact O-N 3.06Å; G301-A304 PolarHBondContact O-N 3.19Å; A304-F306 PolarHBondContact O-N 3.18Å; A304-L307 PolarHBondContact O-N 2.95Å; A304-V308 WeakPolarHBondContact O-CG2 3.22Å; A304-V308 PolarHBondContact O-N 2.95Å |
| 305 | A | 91.9 | Very high | 86.5 | Confident | 41 Ų | 41 | 43 Ų | 43 | 34% | 0.339 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | G301 A302 S309 | G301-A305 VanDerWaalsContact O-CB 3.27Å; G301-A305 WeakPolarHBondContact O-CB 3.38Å; G301-A305 PolarHBondContact O-N 3.02Å; A302-A305 PolarHBondContact O-N 3.05Å; A305-S309 WeakPolarHBondContact O-CB 3.45Å; A305-S309 PolarHBondContact O-N 3.24Å; A305-S309 PolarHBondContact O-OG 2.81Å |
| 306 | F | 92.3 | Very high | 84.1 | Confident | 124 Ų | 124 | 47 Ų | 47 | 54% | 0.544 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.9 | -50.6 | 175.2 | 174.1 | -102.5 | 0 | 0 | 0 | 111.4 | A302 I303 A304 S309 C310 | A302-F306 VanDerWaalsContact O-CB 3.26Å; A302-F306 WeakPolarHBondContact O-CB 3.25Å; A302-F306 PolarHBondContact O-N 3.03Å; I303-F306 PolarHBondContact O-N 2.96Å; A304-F306 PolarHBondContact O-N 3.18Å; F306-S309 PolarHBondContact O-N 3.2Å; F306-C310 HydrophobicContact CD2-CB 4.16Å; F306-C310 VanDerWaalsContact CD2-SG 3.59Å; F306-C310 HydrophobicContact CE2-CB 3.96Å; F306-C310 HydrophobicContact CZ-CB 4.33Å; F306-C310 WeakPolarHBondContact O-CA 3.08Å; F306-C310 WeakPolarHBondContact O-CB 3.28Å; F306-C310 PolarHBondContact O-N 3.17Å |
| 307 | L | 90.8 | Very high | 81.3 | Confident | 4 Ų | 4 | 52.7 Ų | 52.7 | 2% | 0.021 | 30% | 0.302 | C | S | . | . | I | π-helix | trans | -67.2 | -43 | -177.7 | -68.8 | 173.7 | 0 | 0 | 0 | 112.4 | V166 F169 Y242 I303 A304 V311 I312 | V166-L307 HydrophobicContact CG1-CB 4.23Å; F169-L307 HydrophobicContact CD1-CD1 4.22Å; F169-L307 HydrophobicContact CD1-CD2 3.88Å; F169-L307 HydrophobicContact CE1-CD2 3.97Å; Y242-L307 HydrophobicContact CE2-CD1 4.18Å; I303-L307 HydrophobicContact CG2-CD1 3.93Å; I303-L307 HydrophobicContact CG2-CG 4.49Å; I303-L307 WeakPolarHBondContact O-CB 3.4Å; I303-L307 WeakPolarHBondContact O-CG 3.37Å; I303-L307 PolarHBondContact O-N 2.04Å; A304-L307 PolarHBondContact O-N 2.95Å; L307-V311 HydrophobicContact CD2-CG2 3.83Å; L307-V311 WeakPolarHBondContact O-CA 3.47Å; L307-V311 WeakPolarHBondContact O-CB 3.45Å; L307-V311 PolarHBondContact O-N 3.39Å; L307-I312 PolarHBondContact O-N 2.65Å; L307-I312 VanDerWaalsContact O-N 3.14Å |
| 308 | V | 84.5 | Confident | 78.3 | Confident | 3 Ų | 3 | 57.3 Ų | 57.3 | 2% | 0.018 | 33% | 0.333 | C | S | . | . | I | π-helix | trans | -70.6 | -36.2 | 179 | -176.1 | 0 | 0 | 0 | 0 | 111.5 | Y246 M249 L253 A304 I312 N313 | Y246-V308 HydrophobicContact CD2-CG2 3.59Å; Y246-V308 HydrophobicContact CE2-CG2 3.85Å; Y246-V308 HydrophobicContact CG-CG2 4.44Å; M249-V308 HydrophobicContact CB-CG1 4.03Å; M249-V308 HydrophobicContact CB-CG2 4.27Å; M249-V308 HydrophobicContact CE-CB 3.67Å; M249-V308 HydrophobicContact CE-CG1 3.48Å; M249-V308 VanDerWaalsContact CE-CG1 3.48Å; M249-V308 HydrophobicContact CE-CG2 4.43Å; M249-V308 HydrophobicContact SD-CB 3.66Å; M249-V308 HydrophobicContact SD-CG1 3.87Å; M249-V308 HydrophobicContact SD-CG2 3.76Å; L253-V308 HydrophobicContact CD1-CG1 4.48Å; A304-V308 WeakPolarHBondContact O-CG2 3.22Å; A304-V308 PolarHBondContact O-N 2.95Å; V308-I312 HydrophobicContact CB-CD1 4.46Å; V308-I312 HydrophobicContact CG1-CB 4.34Å; V308-I312 HydrophobicContact CG1-CD1 4.33Å; V308-I312 HydrophobicContact CG2-CD1 4.18Å; V308-I312 WeakPolarHBondContact O-CB 3.49Å; V308-I312 PolarHBondContact O-N 3.4Å; V308-N313 PolarHBondContact O-N 3.3Å; V308-N313 VanDerWaalsContact O-N 3.12Å; V308-N313 PolarHBondContact O-ND2 3.02Å |
| 309 | S | 81.5 | Confident | 75.4 | Confident | 54 Ų | 54 | 62.2 Ų | 62.2 | 38% | 0.378 | 35% | 0.346 | S | S | . | . | I | π-helix | trans | -78.8 | -47 | -179.3 | -52.9 | 0 | 0 | 0 | 0 | 112.8 | A305 F306 N313 | A305-S309 WeakPolarHBondContact O-CB 3.45Å; A305-S309 PolarHBondContact O-N 3.24Å; A305-S309 PolarHBondContact O-OG 2.81Å; F306-S309 PolarHBondContact O-N 3.2Å; S309-N313 WeakPolarHBondContact O-CB 3.08Å |
| 310 | C | 78.4 | Confident | 72.6 | Confident | 57 Ų | 57 | 67.8 Ų | 67.8 | 39% | 0.385 | 37% | 0.374 | S | S | . | . | I | π-helix | trans | -87.9 | -33.2 | -174.6 | -57 | 0 | 0 | 0 | 0 | 112.9 | F306 N314 | F306-C310 HydrophobicContact CD2-CB 4.16Å; F306-C310 VanDerWaalsContact CD2-SG 3.59Å; F306-C310 HydrophobicContact CE2-CB 3.96Å; F306-C310 HydrophobicContact CZ-CB 4.33Å; F306-C310 WeakPolarHBondContact O-CA 3.08Å; F306-C310 WeakPolarHBondContact O-CB 3.28Å; F306-C310 PolarHBondContact O-N 3.17Å; C310-N314 WeakPolarHBondContact O-CB 3.42Å; C310-N314 PolarHBondContact O-ND2 3.17Å |
| 311 | V | 74.9 | Confident | 69.8 | Low | 40 Ų | 40 | 72.1 Ų | 72.1 | 24% | 0.242 | 41% | 0.41 | C | S | . | . | I | π-helix | trans | -90.5 | -62 | 176.3 | -168.4 | 0 | 0 | 0 | 0 | 109.8 | V166 L307 N313 F315 | V166-V311 HydrophobicContact CG1-CG1 4.47Å; V166-V311 HydrophobicContact CG2-CG1 3.99Å; L307-V311 HydrophobicContact CD2-CG2 3.83Å; L307-V311 WeakPolarHBondContact O-CA 3.47Å; L307-V311 WeakPolarHBondContact O-CB 3.45Å; L307-V311 PolarHBondContact O-N 3.39Å; V311-N313 PolarHBondContact O-N 3.32Å; V311-F315 HydrophobicContact CG1-CD2 4.32Å; V311-F315 HydrophobicContact CG1-CE2 3.87Å; V311-F315 WeakPolarHBondContact O-CD2 3.49Å |
| 312 | I | 68.8 | Low | 67.1 | Low | 16 Ų | 16 | 77.7 Ų | 77.7 | 8% | 0.082 | 44% | 0.441 | C | S | . | . | I | π-helix | trans | -69.5 | -39.9 | -168.3 | -65.9 | 169.1 | 0 | 0 | 0 | 113.2 | F163 V166 Y246 L253 L307 V308 | F163-I312 HydrophobicContact CD1-CD1 4.01Å; F163-I312 HydrophobicContact CE1-CD1 3.97Å; F163-I312 HydrophobicContact CE1-CG1 4.37Å; F163-I312 HydrophobicContact CE1-CG2 4.01Å; V166-I312 HydrophobicContact CG1-CD1 4.32Å; V166-I312 HydrophobicContact CG1-CG1 4.42Å; Y246-I312 HydrophobicContact CE2-CD1 3.91Å; L253-I312 HydrophobicContact CD1-CG2 4.43Å; L307-I312 PolarHBondContact O-N 2.65Å; L307-I312 VanDerWaalsContact O-N 3.14Å; V308-I312 HydrophobicContact CB-CD1 4.46Å; V308-I312 HydrophobicContact CG1-CB 4.34Å; V308-I312 HydrophobicContact CG1-CD1 4.33Å; V308-I312 HydrophobicContact CG2-CD1 4.18Å; V308-I312 WeakPolarHBondContact O-CB 3.49Å; V308-I312 PolarHBondContact O-N 3.4Å |
| 313 | N | 67.1 | Low | 64.5 | Low | 54 Ų | 54 | 80.4 Ų | 80.4 | 29% | 0.289 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.4 | -33.5 | -178.3 | -72.9 | -45.4 | 0 | 0 | 0 | 114.6 | V308 S309 V311 F315 K316 | V308-N313 PolarHBondContact O-N 3.3Å; V308-N313 VanDerWaalsContact O-N 3.12Å; V308-N313 PolarHBondContact O-ND2 3.02Å; S309-N313 WeakPolarHBondContact O-CB 3.08Å; V311-N313 PolarHBondContact O-N 3.32Å; N313-F315 PolarHBondContact O-N 3.2Å; N313-K316 WeakPolarHBondContact O-CB 3.45Å; N313-K316 PolarHBondContact O-N 3.48Å; N313-K316 PolarHBondContact OD1-NZ 2.97Å |
| 314 | N | 60 | Low | 62.1 | Low | 126 Ų | 126 | 85.6 Ų | 85.6 | 67% | 0.674 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -21.8 | 178.9 | -80.9 | -47.3 | 0 | 0 | 0 | 113.6 | C310 K316 | C310-N314 WeakPolarHBondContact O-CB 3.42Å; C310-N314 PolarHBondContact O-ND2 3.17Å; N314-K316 VanDerWaalsContact C-N 3.26Å; N314-K316 PolarHBondContact O-N 3.24Å |
| 315 | F | 51 | Low | 60 | Low | 103 Ų | 103 | 90.8 Ų | 90.8 | 45% | 0.452 | 52% | 0.52 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | 7.7 | 172.5 | -73.7 | -61.2 | 0 | 0 | 0 | 114.4 | F57 R162 V311 N313 P317 | F57-F315 HydrophobicContact CZ-CZ 4.22Å; R162-F315 VanDerWaalsContact NH2-CD2 3.28Å; V311-F315 HydrophobicContact CG1-CD2 4.32Å; V311-F315 HydrophobicContact CG1-CE2 3.87Å; V311-F315 WeakPolarHBondContact O-CD2 3.49Å; N313-F315 PolarHBondContact O-N 3.2Å; F315-P317 WeakPolarHBondContact O-CD 3.49Å |
| 316 | K | 48.6 | Very low | 58.2 | Low | 107 Ų | 107 | 94.3 Ų | 94.3 | 47% | 0.465 | 54% | 0.54 | S | S | . | . | S | Bend | trans | -75.8 | 117.1 | 160.2 | -70.9 | 167.9 | -179.1 | 160 | 0 | 106 | N313 N314 T318 | N313-K316 WeakPolarHBondContact O-CB 3.45Å; N313-K316 PolarHBondContact O-N 3.48Å; N313-K316 PolarHBondContact OD1-NZ 2.97Å; N314-K316 VanDerWaalsContact C-N 3.26Å; N314-K316 PolarHBondContact O-N 3.24Å; K316-T318 PolarHBondContact O-N 3.44Å |
| 317 | P | 39.6 | Very low | 56.2 | Low | 119 Ų | 119 | 93.9 Ų | 93.9 | 77% | 0.773 | 55% | 0.549 | S | S | * | . | trans | -56.1 | 122.6 | 176.9 | 23.2 | -32.3 | 0 | 0 | 0 | 107.9 | F315 K319 | F315-P317 WeakPolarHBondContact O-CD 3.49Å; P317-K319 PolarHBondContact O-N 3.31Å | ||
| 318 | T | 35.3 | Very low | 54.5 | Low | 128 Ų | 128 | 99 Ų | 99 | 79% | 0.785 | 58% | 0.583 | S | S | * | * | trans | -47.4 | 115.9 | 171.4 | -54.9 | 0 | 0 | 0 | 0 | 106.6 | K316 L320 | K316-T318 PolarHBondContact O-N 3.44Å; T318-L320 PolarHBondContact O-N 2.87Å | ||
| 319 | K | 36 | Very low | 52.6 | Low | 197 Ų | 197 | 104.9 Ų | 104.9 | 86% | 0.857 | 62% | 0.621 | S | S | * | * | trans | -57.2 | 112.4 | 173.2 | -72 | -170.6 | 175.7 | -170.4 | 0 | 105.4 | P317 A321 | P317-K319 PolarHBondContact O-N 3.31Å; K319-A321 PolarHBondContact O-N 3.17Å; K319-A321 VanDerWaalsContact O-N 3.16Å | ||
| 320 | L | 39.8 | Very low | 50.8 | Low | 159 Ų | 159 | 111.9 Ų | 111.9 | 83% | 0.832 | 65% | 0.648 | S | S | * | * | trans | -50.3 | 129.5 | 172.3 | -99.4 | 85.1 | 0 | 0 | 0 | 106.6 | T318 V322 | T318-L320 PolarHBondContact O-N 2.87Å; L320-V322 PolarHBondContact O-N 3.09Å | ||
| 321 | A | 39.8 | Very low | 49 | Very low | 91 Ų | 91 | 120.2 Ų | 120.2 | 75% | 0.752 | 67% | 0.671 | S | S | * | * | trans | -54.3 | 115.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | K319 P323 | K319-A321 PolarHBondContact O-N 3.17Å; K319-A321 VanDerWaalsContact O-N 3.16Å; A321-P323 WeakPolarHBondContact O-CD 3.46Å | ||
| 322 | V | 39.5 | Very low | 47.2 | Very low | 129 Ų | 129 | 124.5 Ų | 124.5 | 78% | 0.782 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 122.4 | 172.1 | 174.2 | 0 | 0 | 0 | 0 | 105.6 | L320 T324 | L320-V322 PolarHBondContact O-N 3.09Å; V322-T324 PolarHBondContact O-N 3.35Å; V322-T324 VanDerWaalsContact O-N 3.09Å |
| 323 | P | 42.5 | Very low | 45.6 | Very low | 116 Ų | 116 | 132.9 Ų | 132.9 | 75% | 0.753 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 121.8 | 175.4 | -23.6 | 34 | 0 | 0 | 0 | 108.3 | A321 | A321-P323 WeakPolarHBondContact O-CD 3.46Š|
| 324 | T | 45.6 | Very low | 43.9 | Very low | 130 Ų | 130 | 134.8 Ų | 134.8 | 80% | 0.798 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 129.6 | 174.4 | -1.2 | 0 | 0 | 0 | 0 | 108.1 | V322 | V322-T324 PolarHBondContact O-N 3.35Å; V322-T324 VanDerWaalsContact O-N 3.09Å |
| 325 | P | 52.3 | Low | 43 | Very low | 108 Ų | 108 | 134.9 Ų | 134.9 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 143.3 | 175.1 | 25.5 | -33.2 | 0 | 0 | 0 | 109.2 | ||
| 326 | P | 53 | Low | 42.6 | Very low | 116 Ų | 116 | 137.5 Ų | 137.5 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 148.3 | -178.4 | 26 | -34.4 | 0 | 0 | 0 | 110.7 | ||
| 327 | P | 51.8 | Low | 41.8 | Very low | 114 Ų | 114 | 138 Ų | 138 | 74% | 0.74 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 143.3 | 179.7 | 26.4 | -34.2 | 0 | 0 | 0 | 110.8 | ||
| 328 | P | 54.3 | Low | 41.6 | Very low | 113 Ų | 113 | 139.7 Ų | 139.7 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 147.7 | 178.8 | 27.1 | -34.2 | 0 | 0 | 0 | 111.1 | Q330 | P328-Q330 PolarHBondContact O-N 3.24Š|
| 329 | P | 45.4 | Very low | 42.1 | Very low | 126 Ų | 126 | 138.6 Ų | 138.6 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 130.7 | -176.8 | 26.1 | -34.1 | 0 | 0 | 0 | 111.5 | R331 | P329-R331 PolarHBondContact O-N 3.16Š|
| 330 | Q | 43.6 | Very low | 42 | Very low | 200 Ų | 200 | 136.8 Ų | 136.8 | 94% | 0.935 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 128.9 | 172.8 | -70.2 | 176.5 | -22.4 | 0 | 0 | 110 | P328 | P328-Q330 PolarHBondContact O-N 3.24Š|
| 331 | R | 39.8 | Very low | 41.7 | Very low | 233 Ų | 233 | 136 Ų | 136 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -103.7 | 137.7 | 172.3 | -168.2 | -175.3 | -85.9 | -167.3 | -4.2 | 108.3 | P329 | P329-R331 PolarHBondContact O-N 3.16Š|
| 332 | P | 38.2 | Very low | 41.4 | Very low | 129 Ų | 129 | 136.1 Ų | 136.1 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 145.7 | -174.3 | -23.5 | 34.4 | 0 | 0 | 0 | 114.2 | ||
| 333 | E | 34.3 | Very low | 41.1 | Very low | 193 Ų | 193 | 137.8 Ų | 137.8 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 150.9 | 175.3 | -65.6 | -168.6 | 132.1 | 0 | 0 | 113.5 | ||
| 334 | A | 31.9 | Very low | 40.9 | Very low | 94 Ų | 94 | 137.6 Ų | 137.6 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | trans | 151.7 | 156.6 | 139.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 335 | P | 40 | Very low | 40.2 | Very low | 128 Ų | 128 | 142.7 Ų | 142.7 | 83% | 0.831 | 80% | 0.796 | S | S | * | * | cis | -128.9 | -171.2 | -33.3 | 35.9 | -18.4 | 0 | 0 | 0 | 112.7 | ||||
| 336 | I | 43.3 | Very low | 39.3 | Very low | 157 Ų | 157 | 143.6 Ų | 143.6 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | trans | -79.1 | 138.5 | -167.5 | -63.3 | 153.7 | 0 | 0 | 0 | 114.5 | L338 | I336-L338 HydrophobicContact CG2-CD1 4.5Š| ||
| 337 | S | 31.2 | Very low | 38.4 | Very low | 118 Ų | 118 | 147.2 Ų | 147.2 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | trans | -156.7 | 135.8 | 148.3 | 59.5 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 338 | L | 35.2 | Very low | 37.5 | Very low | 154 Ų | 154 | 146.9 Ų | 146.9 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | trans | -89.6 | -167.6 | -173.2 | -72.1 | 129.3 | 0 | 0 | 0 | 113 | I336 | I336-L338 HydrophobicContact CG2-CD1 4.5Š| ||
| 339 | P | 47.2 | Very low | 36.6 | Very low | 105 Ų | 105 | 147.6 Ų | 147.6 | 68% | 0.682 | 81% | 0.812 | S | S | * | * | -135.9 | 170.1 | -60.5 | 38.8 | -24.2 | 0 | 0 | 0 | 113.9 | |||||
| 340 | L | 33.1 | Very low | 36.1 | Very low | 160 Ų | 160 | 149.6 Ų | 149.6 | 84% | 0.838 | 82% | 0.815 | S | S | * | * | trans | -159.9 | 111.7 | 151.6 | -141.9 | 72 | 0 | 0 | 0 | 115.1 | ||||
| 341 | I | 34.7 | Very low | 35.9 | Very low | 141 Ų | 141 | 149.2 Ų | 149.2 | 72% | 0.723 | 81% | 0.813 | S | S | * | * | trans | 43.9 | 95.8 | 135.8 | -61.9 | 173.6 | 0 | 0 | 0 | 117 | ||||
| 342 | S | 32.6 | Very low | 35.7 | Very low | 95 Ų | 95 | 148.2 Ų | 148.2 | 66% | 0.664 | 82% | 0.815 | S | S | * | * | 67.6 | 134.7 | 92.2 | 72.7 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 343 | L | 33.1 | Very low | 35.6 | Very low | 164 Ų | 164 | 150.3 Ų | 150.3 | 86% | 0.859 | 82% | 0.818 | S | S | * | * | -149.4 | 178.2 | 60.2 | -113 | 95.9 | 0 | 0 | 0 | 113.5 | |||||
| 344 | P | 38.5 | Very low | 35.7 | Very low | 111 Ų | 111 | 146.9 Ų | 146.9 | 72% | 0.721 | 82% | 0.815 | S | S | * | * | trans | -110 | 170.8 | -150.7 | 42.5 | -37.9 | 0 | 0 | 0 | 116.6 | ||||
| 345 | R | 31.7 | Very low | 35.8 | Very low | 237 Ų | 237 | 145 Ų | 145 | 89% | 0.894 | 81% | 0.805 | S | S | * | * | trans | -156.7 | 103.4 | 152.6 | -152.1 | 171.7 | -179.2 | 107.8 | -2 | 116 | ||||
| 346 | V | 32.2 | Very low | 35.4 | Very low | 128 Ų | 128 | 148.5 Ų | 148.5 | 78% | 0.776 | 81% | 0.808 | S | S | * | * | trans | 49.4 | 108.7 | 144.8 | -170.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 347 | E | 33.9 | Very low | 34.7 | Very low | 192 Ų | 192 | 149.3 Ų | 149.3 | 90% | 0.897 | 81% | 0.808 | S | S | * | * | trans | -102.5 | 139.7 | 153.7 | -77.4 | 160.8 | 142.3 | 0 | 0 | 110.2 | ||||
| 348 | S | 33.7 | Very low | 34.6 | Very low | 106 Ų | 106 | 147.8 Ų | 147.8 | 74% | 0.741 | 80% | 0.803 | S | S | * | * | trans | -99.8 | 128.3 | -178.4 | 54.2 | 0 | 0 | 0 | 0 | 112 | L350 | S348-L350 PolarHBondContact O-N 2.65Š| ||
| 349 | P | 34.9 | Very low | 34.6 | Very low | 129 Ų | 129 | 146.8 Ų | 146.8 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | trans | -86.6 | 93.3 | -173.1 | 33.4 | -34.7 | 0 | 0 | 0 | 112.7 | ||||
| 350 | L | 35.4 | Very low | 33.6 | Very low | 167 Ų | 167 | 145.4 Ų | 145.4 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -139.6 | 22.7 | 171.9 | -147.8 | 92.4 | 0 | 0 | 0 | 115.6 | S348 | S348-L350 PolarHBondContact O-N 2.65Š| ||
| 351 | E | 38.3 | Very low | 33.4 | Very low | 192 Ų | 192 | 146 Ų | 146 | 90% | 0.897 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -111.2 | 8.2 | 175.7 | -70.8 | -167.2 | 120.1 | 0 | 0 | 114.3 | ||
| 352 | K | 36.7 | Very low | 33.7 | Very low | 212 Ų | 212 | 144.2 Ų | 144.2 | 92% | 0.922 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -108.9 | 17.6 | -172.9 | -92.5 | -172.5 | 176 | 179.7 | 0 | 116.4 | ||
| 353 | L | 35.3 | Very low | 33.4 | Very low | 173 Ų | 173 | 150 Ų | 150 | 91% | 0.906 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -133.7 | 20.1 | -169 | -104.9 | 156.2 | 0 | 0 | 0 | 116.2 | ||
| 354 | S | 36.6 | Very low | 33.3 | Very low | 121 Ų | 121 | 147 Ų | 147 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -122.4 | 26.5 | 178.4 | 52.2 | 0 | 0 | 0 | 0 | 114.3 | ||
| 355 | G | 35 | Very low | 32.7 | Very low | 55 Ų | 55 | 149.4 Ų | 149.4 | 57% | 0.567 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -128.1 | 137.2 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 356 | F | 30.6 | Very low | 32.6 | Very low | 201 Ų | 201 | 144.6 Ų | 144.6 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | 68.8 | 137.6 | -168.9 | -55.4 | -92.6 | 0 | 0 | 0 | 112.6 | ||||
| 357 | Q | 28.9 | Very low | 32.6 | Very low | 175 Ų | 175 | 148.2 Ų | 148.2 | 82% | 0.818 | 83% | 0.827 | S | S | * | * | cis | -159.3 | 161.8 | 14.6 | -161.3 | 154.9 | -35 | 0 | 0 | 112 | ||||
| 358 | A | 30 | Very low | 32.6 | Very low | 85 Ų | 85 | 146 Ų | 146 | 70% | 0.702 | 82% | 0.824 | S | S | * | * | trans | -128.6 | 163.8 | 155.3 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 359 | P | 34.2 | Very low | 32.5 | Very low | 133 Ų | 133 | 148.1 Ų | 148.1 | 86% | 0.864 | 83% | 0.828 | S | S | * | * | cis | -135.8 | -174.1 | 12.9 | 42.6 | -25 | 0 | 0 | 0 | 115.1 | ||||
| 360 | G | 27.1 | Very low | 32.4 | Very low | 77 Ų | 77 | 149.2 Ų | 149.2 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | trans | 128.6 | 125.9 | 151.8 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 361 | L | 27.9 | Very low | 32.2 | Very low | 173 Ų | 173 | 148.1 Ų | 148.1 | 91% | 0.906 | 83% | 0.825 | S | S | * | * | trans | -70.2 | -179.8 | 167.9 | -79 | 150.9 | 0 | 0 | 0 | 113.3 | ||||
| 362 | P | 40.3 | Very low | 31.8 | Very low | 103 Ų | 103 | 145.4 Ų | 145.4 | 67% | 0.669 | 82% | 0.821 | S | S | * | * | cis | -136.4 | -169.1 | -22.5 | 25.9 | -1.1 | 0 | 0 | 0 | 114.9 | ||||
| 363 | Y | 28 | Very low | 31.5 | Very low | 215 Ų | 215 | 140.9 Ų | 140.9 | 84% | 0.843 | 81% | 0.814 | S | S | * | * | trans | 98.3 | 138.3 | 150.4 | -104 | -88.1 | 0 | 0 | 0 | 122.9 | ||||
| 364 | S | 29.4 | Very low | 31.2 | Very low | 101 Ų | 101 | 138.6 Ų | 138.6 | 71% | 0.706 | 81% | 0.807 | S | S | * | * | trans | 60.1 | 149.8 | 155.8 | 44.1 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 365 | E | 27 | Very low | 30.8 | Very low | 163 Ų | 163 | 140 Ų | 140 | 76% | 0.762 | 80% | 0.804 | S | S | * | * | cis | -171.6 | 163.4 | -25.1 | -148.8 | -167.2 | 142.6 | 0 | 0 | 107.1 | ||||
| 366 | I | 30.1 | Very low | 30.4 | Very low | 135 Ų | 135 | 147.1 Ų | 147.1 | 69% | 0.692 | 82% | 0.824 | S | S | * | * | trans | 61.6 | 115.8 | 162.6 | -51.9 | 155.9 | 0 | 0 | 0 | 115.3 | ||||
| 367 | T | 31.9 | Very low | 30.4 | Very low | 204 Ų | 204 | 142.2 Ų | 142.2 | 100% | 1.252 | 82% | 0.819 | S | S | * | * | -154.5 | 0 | 59.8 | -41.1 | 0 | 0 | 0 | 0 | 111 |
Retrieved 367 of 367 residues in 725.1 ms
(Link to these results)