| 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 | 33.6 | Very low | 36 | Very low | 243 Ų | 243 | 169 Ų | 169 | 100% | 1.197 | 89% | 0.894 | S | S | * | * | 0 | 77.6 | 0 | -56.5 | -167.4 | -158.8 | 0 | 0 | 107.2 | |||||
| 2 | Q | 30.9 | Very low | 36.1 | Very low | 197 Ų | 197 | 163.5 Ų | 163.5 | 92% | 0.921 | 89% | 0.891 | S | S | * | * | 70.1 | 102.8 | 79 | -142.6 | 165.1 | 13.9 | 0 | 0 | 112.8 | |||||
| 3 | A | 33.6 | Very low | 36.4 | Very low | 109 Ų | 109 | 162.4 Ų | 162.4 | 90% | 0.901 | 88% | 0.883 | S | S | * | * | trans | -138.2 | 111.6 | 165.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 4 | K | 33.8 | Very low | 36.4 | Very low | 202 Ų | 202 | 162.8 Ų | 162.8 | 88% | 0.878 | 88% | 0.876 | S | S | * | * | trans | -98.6 | 135.7 | 161.7 | -85.8 | 179.9 | 170.8 | -179.5 | 0 | 107.9 | ||||
| 5 | K | 41.1 | Very low | 36.4 | Very low | 203 Ų | 203 | 167.6 Ų | 167.6 | 88% | 0.883 | 88% | 0.877 | S | S | * | * | trans | 165.3 | 130.3 | 147.2 | -106 | 177.8 | 169.9 | -179.6 | 0 | 106.5 | ||||
| 6 | I | 44.8 | Very low | 36.5 | Very low | 172 Ų | 172 | 164.1 Ų | 164.1 | 88% | 0.882 | 87% | 0.868 | S | S | * | * | -162.4 | 146.4 | 87.7 | -79.9 | 151.5 | 0 | 0 | 0 | 108.9 | |||||
| 7 | C | 32.8 | Very low | 36.5 | Very low | 110 Ų | 110 | 165.4 Ų | 165.4 | 74% | 0.743 | 87% | 0.871 | S | S | * | * | trans | -118 | 156.3 | -170.5 | -119.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 8 | K | 34.5 | Very low | 36.4 | Very low | 191 Ų | 191 | 162.6 Ų | 162.6 | 83% | 0.83 | 87% | 0.867 | S | S | * | * | trans | 52 | 127.9 | 144.9 | -79.8 | -179.4 | 170.2 | -178 | 0 | 121.6 | ||||
| 9 | E | 37 | Very low | 36.4 | Very low | 182 Ų | 182 | 158.8 Ų | 158.8 | 85% | 0.85 | 86% | 0.86 | S | S | * | * | trans | 168.5 | 117.8 | 130.1 | -94.8 | 166.1 | 177.1 | 0 | 0 | 107.9 | ||||
| 10 | T | 39.5 | Very low | 36.4 | Very low | 148 Ų | 148 | 157.9 Ų | 157.9 | 91% | 0.908 | 86% | 0.86 | S | S | * | * | 179.7 | 141.6 | 92.7 | 28.6 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 11 | A | 34.7 | Very low | 36.2 | Very low | 102 Ų | 102 | 155.2 Ų | 155.2 | 84% | 0.843 | 85% | 0.854 | S | S | * | * | trans | -131.3 | 160.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 12 | A | 37 | Very low | 36.3 | Very low | 103 Ų | 103 | 153.8 Ų | 153.8 | 85% | 0.851 | 84% | 0.841 | S | S | * | * | trans | 97.1 | 110.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 13 | D | 40.5 | Very low | 36.2 | Very low | 149 Ų | 149 | 152.2 Ų | 152.2 | 80% | 0.797 | 83% | 0.834 | S | S | * | * | -169.2 | 158.7 | 101.9 | -147.6 | -3.6 | 0 | 0 | 0 | 112.9 | |||||
| 14 | Q | 36.1 | Very low | 36.2 | Very low | 168 Ų | 168 | 152.5 Ų | 152.5 | 79% | 0.785 | 83% | 0.826 | S | S | * | * | trans | -76.2 | 151.6 | -162.4 | -58.2 | 157.4 | 19.8 | 0 | 0 | 113.9 | ||||
| 15 | R | 36.5 | Very low | 36.1 | Very low | 235 Ų | 235 | 152.1 Ų | 152.1 | 89% | 0.887 | 83% | 0.825 | S | S | * | * | 174.6 | 149 | 80.8 | -128.4 | 177.4 | -165.1 | 179.9 | 4 | 110.1 | |||||
| 16 | P | 37.1 | Very low | 35.7 | Very low | 112 Ų | 112 | 147 Ų | 147 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | trans | -107.4 | 156.2 | -177.1 | 38.4 | -29.6 | 0 | 0 | 0 | 114.8 | ||||
| 17 | M | 37.2 | Very low | 35.1 | Very low | 186 Ų | 186 | 146.1 Ų | 146.1 | 92% | 0.916 | 82% | 0.817 | S | S | * | * | trans | -144.1 | 137.2 | 161.5 | -84.8 | -76.2 | 109.8 | 0 | 0 | 109.3 | ||||
| 18 | S | 33.8 | Very low | 35.1 | Very low | 115 Ų | 115 | 143.5 Ų | 143.5 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | -72.6 | 141.6 | -164.9 | 49.6 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 19 | A | 36.8 | Very low | 34.9 | Very low | 90 Ų | 90 | 140.2 Ų | 140.2 | 74% | 0.744 | 81% | 0.81 | S | S | * | * | trans | -156 | 108.7 | 148.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 20 | T | 37.3 | Very low | 35.1 | Very low | 140 Ų | 140 | 136.3 Ų | 136.3 | 86% | 0.859 | 80% | 0.798 | S | S | * | * | trans | 48.4 | 107 | 145.1 | 58.6 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 21 | S | 32.2 | Very low | 35.3 | Very low | 103 Ų | 103 | 134.1 Ų | 134.1 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | trans | -30.6 | 128.3 | 164 | 53.2 | 0 | 0 | 0 | 0 | 119 | ||||
| 22 | F | 34.9 | Very low | 35.7 | Very low | 213 Ų | 213 | 134 Ų | 134 | 93% | 0.934 | 78% | 0.775 | S | S | * | * | trans | -130 | 114.5 | 136.7 | -118.9 | -95.2 | 0 | 0 | 0 | 106.8 | ||||
| 23 | E | 29.9 | Very low | 35.7 | Very low | 164 Ų | 164 | 135.2 Ų | 135.2 | 77% | 0.766 | 77% | 0.767 | S | S | * | * | trans | -66.9 | 132.3 | -175.8 | -72.3 | -101.4 | 124.2 | 0 | 0 | 111.7 | ||||
| 24 | P | 33.7 | Very low | 35.7 | Very low | 114 Ų | 114 | 134.9 Ų | 134.9 | 74% | 0.74 | 76% | 0.76 | S | S | * | * | trans | -83.8 | 115.5 | 165.2 | 30.8 | -25.1 | 0 | 0 | 0 | 109.1 | A26 | P24-A26 PolarHBondContact O-N 3.5Š| ||
| 25 | F | 30.7 | Very low | 36.2 | Very low | 194 Ų | 194 | 132 Ų | 132 | 85% | 0.851 | 75% | 0.747 | S | S | * | * | trans | -61.7 | 105.8 | 170.7 | -102.1 | -90.3 | 0 | 0 | 0 | 110.3 | L27 | F25-L27 HydrophobicContact CD1-CD1 4.38Å; F25-L27 PolarHBondContact O-N 2.99Å | ||
| 26 | A | 32 | Very low | 36.4 | Very low | 97 Ų | 97 | 125.6 Ų | 125.6 | 80% | 0.802 | 73% | 0.725 | S | S | * | * | trans | -79 | 108.1 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | P24 | P24-A26 PolarHBondContact O-N 3.5Š| ||
| 27 | L | 33.6 | Very low | 36.8 | Very low | 153 Ų | 153 | 123.8 Ų | 123.8 | 80% | 0.801 | 71% | 0.712 | S | S | * | * | trans | -126 | 109.7 | 157.2 | -79.8 | 160 | 0 | 0 | 0 | 104.1 | F25 | F25-L27 HydrophobicContact CD1-CD1 4.38Å; F25-L27 PolarHBondContact O-N 2.99Å | ||
| 28 | G | 32.8 | Very low | 37 | Very low | 55 Ų | 55 | 119.8 Ų | 119.8 | 57% | 0.567 | 69% | 0.691 | S | S | * | * | 96.6 | 83.4 | 61.8 | 0 | 0 | 0 | 0 | 0 | 108 | |||||
| 29 | S | 29.7 | Very low | 37.3 | Very low | 122 Ų | 122 | 118.2 Ų | 118.2 | 85% | 0.853 | 67% | 0.674 | S | S | * | * | trans | 50.4 | 82.4 | 149.1 | -38.3 | 0 | 0 | 0 | 0 | 118 | ||||
| 30 | V | 40.2 | Very low | 37.3 | Very low | 100 Ų | 100 | 117 Ų | 117 | 61% | 0.606 | 65% | 0.654 | S | S | * | * | trans | -122.6 | 100 | 167.5 | -158.2 | 0 | 0 | 0 | 0 | 110.9 | V32 L33 | V30-V32 HydrophobicContact CG1-CB 3.6Å; V30-V32 HydrophobicContact CG1-CG2 3.56Å; V30-V32 PolarHBondContact O-N 3.48Å; V30-L33 PolarHBondContact O-N 3.15Å | ||
| 31 | P | 45.5 | Very low | 37.3 | Very low | 102 Ų | 102 | 114.1 Ų | 114.1 | 66% | 0.662 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -58.3 | -12.6 | 173.1 | -19.1 | 30.1 | 0 | 0 | 0 | 113.6 | L33 Q34 Q35 | P31-L33 PolarHBondContact O-N 2.99Å; P31-Q34 PolarHBondContact O-N 2.97Å; P31-Q35 PolarHBondContact O-N 3.31Å |
| 32 | V | 41.9 | Very low | 37.8 | Very low | 98 Ų | 98 | 115.5 Ų | 115.5 | 59% | 0.594 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -64.9 | -36.6 | -177.8 | -177.9 | 0 | 0 | 0 | 0 | 112.2 | V30 Q34 Q35 F36 | V30-V32 HydrophobicContact CG1-CB 3.6Å; V30-V32 HydrophobicContact CG1-CG2 3.56Å; V30-V32 PolarHBondContact O-N 3.48Å; V32-Q34 VanDerWaalsContact C-N 3.34Å; V32-Q34 PolarHBondContact O-N 3.45Å; V32-Q35 PolarHBondContact O-N 3.43Å; V32-F36 WeakPolarHBondContact O-CB 3.38Å; V32-F36 PolarHBondContact O-N 3.04Å |
| 33 | L | 36.7 | Very low | 37.7 | Very low | 130 Ų | 130 | 109.3 Ų | 109.3 | 68% | 0.681 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -68.2 | -37.3 | 178.3 | -154.1 | 87.9 | 0 | 0 | 0 | 111.1 | V30 P31 F36 V37 | V30-L33 PolarHBondContact O-N 3.15Å; P31-L33 PolarHBondContact O-N 2.99Å; L33-F36 PolarHBondContact O-N 2.81Å; L33-V37 WeakPolarHBondContact O-CB 3.49Å; L33-V37 WeakPolarHBondContact O-CG2 3.15Å; L33-V37 PolarHBondContact O-N 3.42Å |
| 34 | Q | 42 | Very low | 38.2 | Very low | 142 Ų | 142 | 108.1 Ų | 108.1 | 66% | 0.664 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -73.3 | -36.8 | 178.2 | -167.8 | 156.6 | -9.2 | 0 | 0 | 111.9 | P31 V32 Q38 | P31-Q34 PolarHBondContact O-N 2.97Å; V32-Q34 VanDerWaalsContact C-N 3.34Å; V32-Q34 PolarHBondContact O-N 3.45Å; Q34-Q38 WeakPolarHBondContact O-CB 3.21Å; Q34-Q38 WeakPolarHBondContact O-CG 3.41Å; Q34-Q38 PolarHBondContact O-N 3.48Å |
| 35 | Q | 46.2 | Very low | 38.3 | Very low | 107 Ų | 107 | 111.2 Ų | 111.2 | 50% | 0.5 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -67.1 | -37.1 | 171.7 | -157.3 | 70.7 | 29.3 | 0 | 0 | 111.7 | P31 V32 Q38 N39 | P31-Q35 PolarHBondContact O-N 3.31Å; V32-Q35 PolarHBondContact O-N 3.43Å; Q35-Q38 PolarHBondContact O-N 3.29Å; Q35-N39 PolarHBondContact O-N 3.05Å |
| 36 | F | 41.1 | Very low | 38.4 | Very low | 101 Ų | 101 | 107.5 Ų | 107.5 | 44% | 0.443 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -67.1 | -42.7 | 175.6 | -173.4 | -105.6 | 0 | 0 | 0 | 111.8 | V32 L33 Q38 N39 L40 | V32-F36 WeakPolarHBondContact O-CB 3.38Å; V32-F36 PolarHBondContact O-N 3.04Å; L33-F36 PolarHBondContact O-N 2.81Å; F36-Q38 VanDerWaalsContact C-N 3.33Å; F36-Q38 PolarHBondContact O-N 2.97Å; F36-N39 PolarHBondContact O-N 3.03Å; F36-L40 HydrophobicContact CD1-CD1 3.62Å; F36-L40 HydrophobicContact CD1-CG 4.39Å; F36-L40 HydrophobicContact CE1-CD1 3.5Å; F36-L40 HydrophobicContact CE1-CG 4.23Å; F36-L40 HydrophobicContact CG-CD1 4.47Å; F36-L40 HydrophobicContact CZ-CD1 4.28Å; F36-L40 WeakPolarHBondContact O-CB 3.45Å; F36-L40 WeakPolarHBondContact O-CG 3.36Å; F36-L40 PolarHBondContact O-N 3.4Å |
| 37 | V | 44.7 | Very low | 38.4 | Very low | 73 Ų | 73 | 106.8 Ų | 106.8 | 44% | 0.442 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64.4 | -35.5 | 173 | 172 | 0 | 0 | 0 | 0 | 111.6 | L33 L40 N41 | L33-V37 WeakPolarHBondContact O-CB 3.49Å; L33-V37 WeakPolarHBondContact O-CG2 3.15Å; L33-V37 PolarHBondContact O-N 3.42Å; V37-L40 PolarHBondContact O-N 3.29Å; V37-N41 PolarHBondContact O-N 3.44Å; V37-N41 PolarHBondContact O-ND2 3Å |
| 38 | Q | 41.5 | Very low | 38.4 | Very low | 102 Ų | 102 | 104.7 Ų | 104.7 | 48% | 0.477 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -68.4 | -38.7 | 173.3 | -78.1 | 178 | -7.9 | 0 | 0 | 112.8 | Q34 Q35 F36 N41 Q42 | Q34-Q38 WeakPolarHBondContact O-CB 3.21Å; Q34-Q38 WeakPolarHBondContact O-CG 3.41Å; Q34-Q38 PolarHBondContact O-N 3.48Å; Q35-Q38 PolarHBondContact O-N 3.29Å; F36-Q38 VanDerWaalsContact C-N 3.33Å; F36-Q38 PolarHBondContact O-N 2.97Å; Q38-N41 WeakPolarHBondContact O-CB 3.46Å; Q38-N41 PolarHBondContact O-N 3.47Å; Q38-Q42 PolarHBondContact O-N 2.91Å |
| 39 | N | 40.9 | Very low | 38.9 | Very low | 83 Ų | 83 | 106.6 Ų | 106.6 | 44% | 0.444 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -69.2 | -35 | 174.1 | -71.2 | -16.4 | 0 | 0 | 0 | 112 | Q35 F36 N41 Q42 C43 | Q35-N39 PolarHBondContact O-N 3.05Å; F36-N39 PolarHBondContact O-N 3.03Å; N39-N41 VanDerWaalsContact C-N 3.32Å; N39-N41 PolarHBondContact O-N 3.38Å; N39-Q42 WeakPolarHBondContact O-CB 3.45Å; N39-Q42 PolarHBondContact O-N 3.39Å; N39-Q42 VanDerWaalsContact O-N 3.13Å; N39-C43 PolarHBondContact O-N 3.32Å |
| 40 | L | 36.2 | Very low | 39.3 | Very low | 64 Ų | 64 | 104.1 Ų | 104.1 | 34% | 0.335 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63 | -35.9 | 170.6 | -78.7 | 164.8 | 0 | 0 | 0 | 112.3 | F36 V37 Q42 C43 Q44 | F36-L40 HydrophobicContact CD1-CD1 3.62Å; F36-L40 HydrophobicContact CD1-CG 4.39Å; F36-L40 HydrophobicContact CE1-CD1 3.5Å; F36-L40 HydrophobicContact CE1-CG 4.23Å; F36-L40 HydrophobicContact CG-CD1 4.47Å; F36-L40 HydrophobicContact CZ-CD1 4.28Å; F36-L40 WeakPolarHBondContact O-CB 3.45Å; F36-L40 WeakPolarHBondContact O-CG 3.36Å; F36-L40 PolarHBondContact O-N 3.4Å; V37-L40 PolarHBondContact O-N 3.29Å; L40-Q42 VanDerWaalsContact C-N 3.27Å; L40-Q42 PolarHBondContact O-N 3.39Å; L40-C43 WeakPolarHBondContact O-CB 3.44Å; L40-C43 PolarHBondContact O-N 3.34Å; L40-C43 VanDerWaalsContact O-N 3.15Å; L40-Q44 PolarHBondContact O-N 2.92Å |
| 41 | N | 37.6 | Very low | 39.2 | Very low | 79 Ų | 79 | 102.6 Ų | 102.6 | 42% | 0.422 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67 | -25.4 | 173.7 | -79.8 | -48.7 | 0 | 0 | 0 | 112.9 | V37 Q38 N39 Q44 | V37-N41 PolarHBondContact O-N 3.44Å; V37-N41 PolarHBondContact O-ND2 3Å; Q38-N41 WeakPolarHBondContact O-CB 3.46Å; Q38-N41 PolarHBondContact O-N 3.47Å; N39-N41 VanDerWaalsContact C-N 3.32Å; N39-N41 PolarHBondContact O-N 3.38Å; N41-Q44 PolarHBondContact O-N 3.38Å; N41-Q44 PolarHBondContact OD1-OE1 2.96Å; N41-Q44 VanDerWaalsContact OD1-OE1 3.11Å |
| 42 | Q | 41.2 | Very low | 39.4 | Very low | 132 Ų | 132 | 104.2 Ų | 104.2 | 62% | 0.617 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -73.9 | -34.8 | 169.8 | -106 | 169.5 | 0.8 | 0 | 0 | 111.9 | Q38 N39 L40 Q44 K45 | Q38-Q42 PolarHBondContact O-N 2.91Å; N39-Q42 WeakPolarHBondContact O-CB 3.45Å; N39-Q42 PolarHBondContact O-N 3.39Å; N39-Q42 VanDerWaalsContact O-N 3.13Å; L40-Q42 VanDerWaalsContact C-N 3.27Å; L40-Q42 PolarHBondContact O-N 3.39Å; Q42-Q44 VanDerWaalsContact C-N 3.3Å; Q42-Q44 PolarHBondContact O-N 3.12Å; Q42-K45 PolarHBondContact O-N 3.3Å |
| 43 | C | 33.9 | Very low | 39.6 | Very low | 83 Ų | 83 | 100.4 Ų | 100.4 | 56% | 0.561 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -67.6 | -26.4 | 170.1 | -70.6 | 0 | 0 | 0 | 0 | 113.4 | N39 L40 K45 L46 | N39-C43 PolarHBondContact O-N 3.32Å; L40-C43 WeakPolarHBondContact O-CB 3.44Å; L40-C43 PolarHBondContact O-N 3.34Å; L40-C43 VanDerWaalsContact O-N 3.15Å; C43-K45 PolarHBondContact O-N 3.26Å; C43-L46 PolarHBondContact O-N 2.86Å |
| 44 | Q | 39.2 | Very low | 40 | Very low | 139 Ų | 139 | 96.5 Ų | 96.5 | 65% | 0.65 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -12.4 | 174.2 | -75.8 | -177.6 | -2.1 | 0 | 0 | 114.2 | L40 N41 Q42 L46 | L40-Q44 PolarHBondContact O-N 2.92Å; N41-Q44 PolarHBondContact O-N 3.38Å; N41-Q44 PolarHBondContact OD1-OE1 2.96Å; N41-Q44 VanDerWaalsContact OD1-OE1 3.11Å; Q42-Q44 VanDerWaalsContact C-N 3.3Å; Q42-Q44 PolarHBondContact O-N 3.12Å; Q44-L46 PolarHBondContact O-N 3.27Å |
| 45 | K | 37.4 | Very low | 40.2 | Very low | 180 Ų | 180 | 91.8 Ų | 91.8 | 78% | 0.783 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.7 | -3.5 | 173.7 | -75.8 | -175.8 | 177.8 | 178.8 | 0 | 114 | Q42 C43 S47 | Q42-K45 PolarHBondContact O-N 3.3Å; C43-K45 PolarHBondContact O-N 3.26Å; K45-S47 PolarHBondContact O-N 3.48Å |
| 46 | L | 32.7 | Very low | 40.2 | Very low | 116 Ų | 116 | 88.9 Ų | 88.9 | 61% | 0.607 | 47% | 0.471 | S | S | * | . | S | Bend | trans | -91.1 | 78.1 | 158.2 | -76.4 | 98.1 | 0 | 0 | 0 | 109.4 | C43 Q44 C48 | C43-L46 PolarHBondContact O-N 2.86Å; Q44-L46 PolarHBondContact O-N 3.27Å; L46-C48 PolarHBondContact O-N 3.04Å |
| 47 | S | 31.6 | Very low | 40.4 | Very low | 82 Ų | 82 | 84.4 Ų | 84.4 | 57% | 0.573 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.7 | 122.2 | 167.9 | 55.5 | 0 | 0 | 0 | 0 | 110 | K45 | K45-S47 PolarHBondContact O-N 3.48Š|
| 48 | C | 33.7 | Very low | 40.3 | Very low | 108 Ų | 108 | 91.4 Ų | 91.4 | 73% | 0.73 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 116.6 | -0.2 | 159.1 | -61.1 | 0 | 0 | 0 | 0 | 120.4 | L46 | L46-C48 PolarHBondContact O-N 3.04Š|
| 49 | Q | 43.8 | Very low | 40.4 | Very low | 95 Ų | 95 | 92.4 Ų | 92.4 | 44% | 0.444 | 48% | 0.475 | S | S | . | . | S | Bend | trans | -100.6 | -26.7 | -178.6 | -66.4 | -165.4 | -16.1 | 0 | 0 | 118.4 | A51 | Q49-A51 PolarHBondContact O-N 3.11Š|
| 50 | P | 37.2 | Very low | 40.7 | Very low | 71 Ų | 71 | 89.6 Ų | 89.6 | 46% | 0.461 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.2 | -20.1 | -179.3 | -17.9 | 30.9 | 0 | 0 | 0 | 115.5 | R52 Y389 | P50-R52 VanDerWaalsContact C-N 3.28Å; P50-R52 PolarHBondContact O-N 2.84Å; P50-Y389 PolarHBondContact O-OH 2.92Å |
| 51 | A | 38.4 | Very low | 41.4 | Very low | 67 Ų | 67 | 89.6 Ų | 89.6 | 55% | 0.554 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -69.6 | -21.5 | -170.5 | 0 | 0 | 0 | 0 | 0 | 114 | Q49 S55 | Q49-A51 PolarHBondContact O-N 3.11Å; A51-S55 VanDerWaalsContact O-CB 3.27Å; A51-S55 WeakPolarHBondContact O-CB 3.3Å; A51-S55 PolarHBondContact O-N 3.46Å; A51-S55 PolarHBondContact O-OG 3.48Å |
| 52 | R | 49 | Very low | 42.1 | Very low | 137 Ų | 137 | 89.9 Ų | 89.9 | 52% | 0.517 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -83.2 | -39 | -175.5 | -74.8 | -171.8 | 169.5 | 174.3 | -3.5 | 114.4 | P50 L54 S55 H56 | P50-R52 VanDerWaalsContact C-N 3.28Å; P50-R52 PolarHBondContact O-N 2.84Å; R52-L54 VanDerWaalsContact C-N 3.26Å; R52-L54 PolarHBondContact O-N 3.45Å; R52-S55 WeakPolarHBondContact CA-OG 3.45Å; R52-S55 PolarHBondContact O-N 2.99Å; R52-S55 PolarHBondContact O-OG 3.31Å; R52-H56 PolarHBondContact O-N 3.2Å |
| 53 | F | 46.4 | Very low | 43.6 | Very low | 17 Ų | 17 | 89.1 Ų | 89.1 | 8% | 0.075 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -63.2 | -39.9 | 172.3 | -175.3 | -94.9 | 0 | 0 | 0 | 110.4 | L57 M322 Y389 | F53-L57 HydrophobicContact CD1-CD1 3.59Å; F53-L57 HydrophobicContact CE1-CD1 3.29Å; F53-L57 HydrophobicContact CG-CD1 4.44Å; F53-L57 HydrophobicContact CZ-CD1 3.87Å; F53-L57 PolarHBondContact O-N 3.24Å; F53-M322 HydrophobicContact CB-CE 4.13Å; F53-M322 HydrophobicContact CD2-CE 3.32Å; F53-M322 HydrophobicContact CE2-CE 4Å; F53-M322 HydrophobicContact CG-CE 4.04Å; F53-Y389 AromaticContact CD1-CD1 3.91Å; F53-Y389 HydrophobicContact CD1-CD1 3.91Å; F53-Y389 AromaticContact CD1-CE1 3.31Å; F53-Y389 HydrophobicContact CD1-CE1 3.31Å; F53-Y389 AromaticContact CE1-CD1 3.72Å; F53-Y389 HydrophobicContact CE1-CD1 3.72Å; F53-Y389 AromaticContact CE1-CE1 3.6Å; F53-Y389 HydrophobicContact CE1-CE1 3.6Å; F53-Y389 HydrophobicContact CG-CE1 4.13Å; F53-Y389 HydrophobicContact CZ-CD1 4.49Å |
| 54 | L | 46.3 | Very low | 46.2 | Very low | 49 Ų | 49 | 89 Ų | 89 | 26% | 0.257 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -73.6 | -34.3 | 176.5 | -69 | 176.7 | 0 | 0 | 0 | 113.4 | R52 H56 L57 R58 C393 A398 | R52-L54 VanDerWaalsContact C-N 3.26Å; R52-L54 PolarHBondContact O-N 3.45Å; L54-H56 VanDerWaalsContact C-N 3.33Å; L54-H56 PolarHBondContact O-N 3.49Å; L54-L57 PolarHBondContact O-N 2.93Å; L54-R58 WeakPolarHBondContact O-CB 3.43Å; L54-R58 PolarHBondContact O-N 3.18Å; L54-C393 HydrophobicContact CD2-CB 4.11Å; L54-A398 HydrophobicContact CD2-CB 4.17Å |
| 55 | S | 44.3 | Very low | 48.8 | Very low | 42 Ų | 42 | 82.5 Ų | 82.5 | 29% | 0.294 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -66 | -37.9 | 177.2 | 62.1 | 0 | 0 | 0 | 0 | 111.3 | A51 R52 R58 E59 | A51-S55 VanDerWaalsContact O-CB 3.27Å; A51-S55 WeakPolarHBondContact O-CB 3.3Å; A51-S55 PolarHBondContact O-N 3.46Å; A51-S55 PolarHBondContact O-OG 3.48Å; R52-S55 WeakPolarHBondContact CA-OG 3.45Å; R52-S55 PolarHBondContact O-N 2.99Å; R52-S55 PolarHBondContact O-OG 3.31Å; S55-R58 CarbonylContact O-C 3.56Å; S55-R58 PolarHBondContact O-N 2.92Å; S55-E59 WeakPolarHBondContact O-CA 3.46Å; S55-E59 WeakPolarHBondContact O-CB 3.42Å; S55-E59 WeakPolarHBondContact O-CG 3.08Å; S55-E59 PolarHBondContact O-N 3.41Å |
| 56 | H | 47.3 | Very low | 51.4 | Low | 46 Ų | 46 | 76.3 Ų | 76.3 | 21% | 0.213 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -73.1 | -34.2 | 177.1 | -89.2 | -72.1 | 0 | 0 | 0 | 113.8 | R52 L54 R58 E59 S60 S497 | R52-H56 PolarHBondContact O-N 3.2Å; L54-H56 VanDerWaalsContact C-N 3.33Å; L54-H56 PolarHBondContact O-N 3.49Å; H56-R58 VanDerWaalsContact C-N 3.33Å; H56-E59 CarbonylContact O-C 3.43Å; H56-S60 PolarHBondContact O-N 3.04Å; H56-S60 VanDerWaalsContact O-N 3.13Å; H56-S497 PolarHBondContact CD2-O 3.37Å |
| 57 | L | 45.5 | Very low | 54.4 | Low | 8 Ų | 8 | 70.8 Ų | 70.8 | 4% | 0.042 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -72.9 | -26 | 171 | -71.6 | 166.2 | 0 | 0 | 0 | 112.8 | F53 L54 S60 L399 Q403 V407 | F53-L57 HydrophobicContact CD1-CD1 3.59Å; F53-L57 HydrophobicContact CE1-CD1 3.29Å; F53-L57 HydrophobicContact CG-CD1 4.44Å; F53-L57 HydrophobicContact CZ-CD1 3.87Å; F53-L57 PolarHBondContact O-N 3.24Å; L54-L57 PolarHBondContact O-N 2.93Å; L57-S60 PolarHBondContact O-OG 3Å; L57-L399 HydrophobicContact CB-CD2 3.71Å; L57-L399 HydrophobicContact CD1-CD2 3.86Å; L57-L399 HydrophobicContact CD2-CD2 4.5Å; L57-L399 HydrophobicContact CG-CD2 4.24Å; L57-Q403 PolarHBondContact O-NE2 2.82Å; L57-V407 HydrophobicContact CD2-CG2 4.41Å |
| 58 | R | 42.9 | Very low | 57.5 | Low | 219 Ų | 219 | 67.2 Ų | 67.2 | 83% | 0.826 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -86 | -23.9 | 175.5 | -166.4 | 177.4 | -175.1 | -166.3 | 2.1 | 112.8 | L54 S55 H56 | L54-R58 WeakPolarHBondContact O-CB 3.43Å; L54-R58 PolarHBondContact O-N 3.18Å; S55-R58 CarbonylContact O-C 3.56Å; S55-R58 PolarHBondContact O-N 2.92Å; H56-R58 VanDerWaalsContact C-N 3.33Å |
| 59 | E | 43.8 | Very low | 60.2 | Low | 124 Ų | 124 | 64.2 Ų | 64.2 | 58% | 0.579 | 34% | 0.338 | S | S | * | . | S | Bend | trans | -100.7 | 24.7 | 171.7 | -71.2 | 173.8 | 151.8 | 0 | 0 | 111.6 | S55 H56 N61 | S55-E59 WeakPolarHBondContact O-CA 3.46Å; S55-E59 WeakPolarHBondContact O-CB 3.42Å; S55-E59 WeakPolarHBondContact O-CG 3.08Å; S55-E59 PolarHBondContact O-N 3.41Å; H56-E59 CarbonylContact O-C 3.43Å; E59-N61 PolarHBondContact O-N 3Å |
| 60 | S | 46.1 | Very low | 62.6 | Low | 23 Ų | 23 | 60.9 Ų | 60.9 | 16% | 0.161 | 32% | 0.323 | C | S | . | . | trans | -41.6 | 128.3 | 164.6 | -65.6 | 0 | 0 | 0 | 0 | 107.3 | H56 L57 N62 D63 Q403 | H56-S60 PolarHBondContact O-N 3.04Å; H56-S60 VanDerWaalsContact O-N 3.13Å; L57-S60 PolarHBondContact O-OG 3Å; S60-N62 PolarHBondContact O-N 2.88Å; S60-D63 PolarHBondContact O-N 3.49Å; S60-Q403 PolarHBondContact OG-NE2 3.21Å | ||
| 61 | N | 50.5 | Low | 65.2 | Low | 64 Ų | 64 | 65 Ų | 65 | 34% | 0.342 | 33% | 0.334 | S | S | . | . | G | 310 helix | trans | -49.7 | 4 | 169 | -87.9 | -62.7 | 0 | 0 | 0 | 113.3 | E59 D63 L64 T80 | E59-N61 PolarHBondContact O-N 3Å; N61-D63 PolarHBondContact O-N 3Å; N61-L64 CarbonylContact O-C 3.47Å; N61-L64 PolarHBondContact O-N 2.9Å; N61-T80 WeakPolarHBondContact O-CG2 3.48Å |
| 62 | N | 54 | Low | 67.8 | Low | 85 Ų | 85 | 62.4 Ų | 62.4 | 46% | 0.455 | 31% | 0.312 | S | S | . | . | G | 310 helix | trans | -52.2 | -23.7 | 166.5 | -74.2 | -11.2 | 0 | 0 | 0 | 114.7 | S60 A72 T80 | S60-N62 PolarHBondContact O-N 2.88Å; N62-A72 WeakPolarHBondContact O-CB 3.2Å; N62-T80 WeakPolarHBondContact O-CG2 3.41Å; N62-T80 PolarHBondContact OD1-OG1 3.47Å |
| 63 | D | 72.2 | Confident | 69.8 | Low | 117 Ų | 117 | 58.7 Ų | 58.7 | 63% | 0.626 | 31% | 0.307 | S | S | * | . | G | 310 helix | trans | -90.3 | -12.7 | 172.9 | -81.3 | -10.4 | 0 | 0 | 0 | 114.4 | S60 N61 K71 A72 | S60-D63 PolarHBondContact O-N 3.49Å; N61-D63 PolarHBondContact O-N 3Å; D63-K71 CarbonylContact O-C 3.55Å; D63-K71 WeakPolarHBondContact O-CA 3.4Å; D63-A72 PolarHBondContact O-N 3.21Å |
| 64 | L | 87.8 | Confident | 71.9 | Confident | 80 Ų | 80 | 59.2 Ų | 59.2 | 42% | 0.419 | 32% | 0.318 | S | S | . | . | B | Isolated β-bridge | trans | -124.5 | 141 | -177.8 | -63.2 | 179.4 | 0 | 0 | 0 | 112.3 | N61 V66 D70 | N61-L64 CarbonylContact O-C 3.47Å; N61-L64 PolarHBondContact O-N 2.9Å; L64-V66 PolarHBondContact O-N 3.26Å; L64-V66 VanDerWaalsContact O-N 3.14Å; L64-D70 CarbonylContact C-O 3.57Å; L64-D70 WeakPolarHBondContact CA-O 3.35Å |
| 65 | C | 94.6 | Very high | 74 | Confident | 2 Ų | 2 | 65 Ų | 65 | 1% | 0.014 | 34% | 0.336 | C | S | . | . | trans | -69.9 | 113.1 | 179.9 | 176.4 | 0 | 0 | 0 | 0 | 109.9 | V67 C68 G69 D70 C82 | C65-V67 PolarHBondContact O-N 3.37Å; C65-C68 PolarHBondContact O-N 2.81Å; C65-C68 VanDerWaalsContact SG-SG 3.6Å; C65-G69 WeakPolarHBondContact O-CA 3.33Å; C65-G69 PolarHBondContact O-N 2.99Å; C65-D70 WeakPolarHBondContact CB-O 3.38Å; C65-D70 PolarHBondContact N-O 3.3Å; C65-C82 HydrophobicContact CB-CB 3.77Å; C65-C82 VanDerWaalsContact CB-N 3.35Å; C65-C82 PolarHBondContact SG-N 3Å | ||
| 66 | V | 91.4 | Very high | 76.3 | Confident | 50 Ų | 50 | 64.3 Ų | 64.3 | 30% | 0.303 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.7 | -22 | 180 | -58.1 | 0 | 0 | 0 | 0 | 113.3 | L64 A79 T80 M128 | L64-V66 PolarHBondContact O-N 3.26Å; L64-V66 VanDerWaalsContact O-N 3.14Å; V66-A79 HydrophobicContact CG2-CB 4.24Å; V66-T80 WeakPolarHBondContact CG2-O 3.32Å; V66-T80 PolarHBondContact N-O 3.13Å; V66-M128 HydrophobicContact CB-CB 4.42Å; V66-M128 HydrophobicContact CG2-CB 3.62Å; V66-M128 HydrophobicContact CG2-CG 4.16Å |
| 67 | V | 95.4 | Very high | 78.6 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | -46.1 | 178.3 | -177.5 | 0 | 0 | 0 | 0 | 112.4 | C65 C85 V109 K124 M128 M130 | C65-V67 PolarHBondContact O-N 3.37Å; V67-C85 HydrophobicContact CB-CB 4.31Å; V67-C85 HydrophobicContact CG2-CB 4.46Å; V67-V109 HydrophobicContact CG1-CG1 4.11Å; V67-K124 HydrophobicContact CG1-CB 4.4Å; V67-K124 HydrophobicContact CG1-CD 4.44Å; V67-K124 HydrophobicContact CG1-CG 4.35Å; V67-K124 VanDerWaalsContact O-CD 3.23Å; V67-K124 WeakPolarHBondContact O-CD 3.26Å; V67-K124 WeakPolarHBondContact O-CE 3.38Å; V67-K124 PolarHBondContact O-NZ 3.45Å; V67-M128 HydrophobicContact CG2-CB 4.44Å; V67-M130 HydrophobicContact CG2-CE 4.21Å |
| 68 | C | 96.4 | Very high | 80.6 | Confident | 7 Ų | 7 | 65.1 Ų | 65.1 | 5% | 0.047 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -129.2 | -5.7 | -168.7 | 70.7 | 0 | 0 | 0 | 0 | 115.6 | C65 D70 C82 V109 T110 K111 R114 | C65-C68 PolarHBondContact O-N 2.81Å; C65-C68 VanDerWaalsContact SG-SG 3.6Å; C68-D70 VanDerWaalsContact C-N 3.28Å; C68-D70 PolarHBondContact O-N 3.49Å; C68-D70 VanDerWaalsContact SG-CB 3.56Å; C68-C82 VanDerWaalsContact SG-SG 3.61Å; C68-V109 HydrophobicContact CB-CG1 4.12Å; C68-T110 CarbonylContact O-C 3.54Å; C68-T110 VanDerWaalsContact O-C 3.28Å; C68-T110 WeakPolarHBondContact O-CA 3.42Å; C68-K111 PolarHBondContact O-N 3.18Å; C68-R114 HydrophobicContact CB-CB 4.27Å; C68-R114 PolarHBondContact SG-NH1 3.25Å |
| 69 | G | 91.4 | Very high | 82.8 | Confident | 45 Ų | 45 | 55 Ų | 55 | 46% | 0.464 | 30% | 0.303 | S | S | . | . | S | Bend | trans | 73.2 | 11.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | C65 | C65-G69 WeakPolarHBondContact O-CA 3.33Å; C65-G69 PolarHBondContact O-N 2.99Å |
| 70 | D | 94.2 | Very high | 85 | Confident | 25 Ų | 25 | 50 Ų | 50 | 13% | 0.134 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -81 | 164 | 172.4 | -164.8 | 15.1 | 0 | 0 | 0 | 111.2 | L64 C65 C68 A72 C82 K111 R114 | L64-D70 CarbonylContact C-O 3.57Å; L64-D70 WeakPolarHBondContact CA-O 3.35Å; C65-D70 WeakPolarHBondContact CB-O 3.38Å; C65-D70 PolarHBondContact N-O 3.3Å; C68-D70 VanDerWaalsContact C-N 3.28Å; C68-D70 PolarHBondContact O-N 3.49Å; C68-D70 VanDerWaalsContact SG-CB 3.56Å; D70-A72 PolarHBondContact O-N 3.42Å; D70-C82 HydrophobicContact CB-CB 4.22Å; D70-K111 HydrophobicContact CB-CB 4.2Å; D70-K111 HydrophobicContact CB-CD 4.18Å; D70-K111 HydrophobicContact CB-CG 3.99Å; D70-K111 WeakPolarHBondContact OD1-CD 3.45Å; D70-K111 WeakPolarHBondContact OD1-CE 3.45Å; D70-K111 IonicContact OD1-NZ 2.81Å; D70-K111 PolarHBondContact OD1-NZ 2.62Å; D70-R114 IonicContact OD2-CZ 2.67Å; D70-R114 IonicContact OD2-NH1 3.71Å; D70-R114 PolarHBondContact OD2-NH1 2.87Å; D70-R114 IonicContact OD2-NH2 2.84Å; D70-R114 PolarHBondContact OD2-NH2 2.87Å |
| 71 | K | 91.9 | Very high | 87.3 | Confident | 158 Ų | 158 | 48.9 Ų | 48.9 | 69% | 0.687 | 27% | 0.272 | S | S | * | . | B | Isolated β-bridge | trans | -56.7 | 122.6 | 179.9 | -167.9 | -178.1 | -179.6 | -168.8 | 0 | 111.1 | D63 C82 | D63-K71 CarbonylContact O-C 3.55Å; D63-K71 WeakPolarHBondContact O-CA 3.4Å; K71-C82 WeakPolarHBondContact O-CB 3.49Å |
| 72 | A | 92.1 | Very high | 89.5 | Confident | 12 Ų | 12 | 45.9 Ų | 45.9 | 10% | 0.099 | 26% | 0.257 | C | S | . | . | P | Polyproline II helix | trans | -71.6 | 149.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111 | N62 D63 D70 T80 | N62-A72 WeakPolarHBondContact O-CB 3.2Å; D63-A72 PolarHBondContact O-N 3.21Å; D70-A72 PolarHBondContact O-N 3.42Å; A72-T80 HydrophobicContact CB-CG2 3.5Å |
| 73 | S | 92.3 | Very high | 91.5 | Very high | 59 Ų | 59 | 46.7 Ų | 46.7 | 41% | 0.413 | 26% | 0.258 | S | S | . | . | trans | -106.8 | 5.5 | 171.5 | 53.9 | 0 | 0 | 0 | 0 | 112.3 | H76 S81 E83 | S73-H76 PolarHBondContact OG-NE2 3.29Å; S73-S81 PolarHBondContact N-O 3.46Å; S73-S81 PolarHBondContact OG-O 3.41Å; S73-E83 WeakPolarHBondContact CB-OE1 3.36Å; S73-E83 PolarHBondContact OG-OE1 3.46Å | ||
| 74 | G | 89.1 | Confident | 92.7 | Very high | 29 Ų | 29 | 42.4 Ų | 42.4 | 30% | 0.299 | 24% | 0.241 | S | C | . | . | S | Bend | trans | 123.7 | -166.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113 | H76 T80 S81 | G74-H76 PolarHBondContact O-CD2 2.84Å; G74-H76 VanDerWaalsContact O-CD2 3.31Å; G74-T80 WeakPolarHBondContact O-CA 3.34Å; G74-S81 PolarHBondContact O-N 2.78Å |
| 75 | R | 90.1 | Very high | 93.2 | Very high | 169 Ų | 169 | 38.6 Ų | 38.6 | 64% | 0.638 | 22% | 0.221 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 122.7 | -179.2 | -156.1 | 169.8 | -173.6 | 162.9 | 0.7 | 110.4 | G78 | R75-G78 PolarHBondContact NE-O 3.2Å; R75-G78 PolarHBondContact NH2-O 3.47Å |
| 76 | H | 94.4 | Very high | 93.4 | Very high | 29 Ų | 29 | 41 Ų | 41 | 13% | 0.134 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 125.8 | 177.9 | -54.9 | -74.3 | 0 | 0 | 0 | 109.9 | S73 G74 G78 A79 S81 E83 K86 | S73-H76 PolarHBondContact OG-NE2 3.29Å; G74-H76 PolarHBondContact O-CD2 2.84Å; G74-H76 VanDerWaalsContact O-CD2 3.31Å; H76-G78 PolarHBondContact O-N 3.15Å; H76-A79 PolarHBondContact N-O 3.41Å; H76-A79 PolarHBondContact O-N 3.46Å; H76-A79 VanDerWaalsContact O-O 3.13Å; H76-S81 WeakPolarHBondContact CB-OG 3.32Å; H76-S81 PolarHBondContact CD2-O 3.01Å; H76-S81 PolarHBondContact CD2-OG 2.84Å; H76-E83 IonicContact CE1-OE1 3.56Å; H76-E83 IonicContact NE2-OE1 3.48Å; H76-K86 HydrophobicContact CB-CB 4.01Å; H76-K86 HydrophobicContact CB-CD 4.4Å; H76-K86 HydrophobicContact CB-CG 3.86Å; H76-K86 WeakPolarHBondContact ND1-CD 3.26Å; H76-K86 VanDerWaalsContact ND1-CE 3.26Å; H76-K86 WeakPolarHBondContact ND1-CE 3.48Å |
| 77 | Y | 94.8 | Very high | 93.6 | Very high | 38 Ų | 38 | 39.2 Ų | 39.2 | 15% | 0.149 | 22% | 0.223 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 55.6 | 33.7 | -179.8 | -46.6 | -65.3 | 0 | 0 | 0 | 113.6 | K86 F89 K90 M130 R131 V135 | Y77-K86 HydrophobicContact CE2-CG 3.94Å; Y77-F89 HydrophobicContact CD2-CB 4.46Å; Y77-F89 AromaticContact CD2-CD1 3.56Å; Y77-F89 HydrophobicContact CD2-CD1 3.56Å; Y77-F89 HydrophobicContact CD2-CE1 4.26Å; Y77-F89 HydrophobicContact CD2-CG 4.37Å; Y77-F89 HydrophobicContact CE2-CD1 4.16Å; Y77-F89 AromaticContact CG-CD1 3.81Å; Y77-F89 HydrophobicContact CG-CD1 3.81Å; Y77-F89 HydrophobicContact CG-CE1 4.04Å; Y77-K90 HydrophobicContact CE2-CB 4.16Å; Y77-K90 WeakPolarHBondContact OH-CB 3.04Å; Y77-K90 WeakPolarHBondContact OH-CD 3.44Å; Y77-K90 VanDerWaalsContact OH-CG 3.29Å; Y77-K90 WeakPolarHBondContact OH-CG 3.4Å; Y77-M130 CarbonylContact O-C 3.51Å; Y77-M130 VanDerWaalsContact O-CA 3.29Å; Y77-M130 WeakPolarHBondContact O-CA 3.31Å; Y77-R131 PolarHBondContact O-N 3.25Å; Y77-V135 HydrophobicContact CD1-CG2 3.7Å; Y77-V135 HydrophobicContact CE1-CB 4.38Å; Y77-V135 HydrophobicContact CE1-CG2 3.72Å; Y77-V135 HydrophobicContact CG-CG2 4.27Å |
| 78 | G | 87.9 | Confident | 93.8 | Very high | 32 Ų | 32 | 39.5 Ų | 39.5 | 33% | 0.33 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 100.3 | -15.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | R75 H76 | R75-G78 PolarHBondContact NE-O 3.2Å; R75-G78 PolarHBondContact NH2-O 3.47Å; H76-G78 PolarHBondContact O-N 3.15Å |
| 79 | A | 88.9 | Confident | 93.8 | Very high | 8 Ų | 8 | 39.2 Ų | 39.2 | 7% | 0.066 | 22% | 0.222 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 146.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | V66 H76 S81 M128 M130 | V66-A79 HydrophobicContact CG2-CB 4.24Å; H76-A79 PolarHBondContact N-O 3.41Å; H76-A79 PolarHBondContact O-N 3.46Å; H76-A79 VanDerWaalsContact O-O 3.13Å; A79-S81 PolarHBondContact O-N 3.5Å; A79-M128 VanDerWaalsContact CB-O 3.29Å; A79-M128 WeakPolarHBondContact CB-O 3.3Å; A79-M130 HydrophobicContact CB-CG 3.98Å |
| 80 | T | 89.2 | Confident | 94.1 | Very high | 17 Ų | 17 | 40.6 Ų | 40.6 | 10% | 0.104 | 22% | 0.216 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -64.1 | 116.5 | 174.2 | -59.1 | 0 | 0 | 0 | 0 | 110.6 | N61 N62 V66 A72 G74 | N61-T80 WeakPolarHBondContact O-CG2 3.48Å; N62-T80 WeakPolarHBondContact O-CG2 3.41Å; N62-T80 PolarHBondContact OD1-OG1 3.47Å; V66-T80 WeakPolarHBondContact CG2-O 3.32Å; V66-T80 PolarHBondContact N-O 3.13Å; A72-T80 HydrophobicContact CB-CG2 3.5Å; G74-T80 WeakPolarHBondContact O-CA 3.34Å |
| 81 | S | 93.7 | Very high | 94.2 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 23% | 0.233 | C | C | . | . | trans | -146.9 | 161.7 | -175.2 | 61.6 | 0 | 0 | 0 | 0 | 114 | S73 G74 H76 A79 M130 | S73-S81 PolarHBondContact N-O 3.46Å; S73-S81 PolarHBondContact OG-O 3.41Å; G74-S81 PolarHBondContact O-N 2.78Å; H76-S81 WeakPolarHBondContact CB-OG 3.32Å; H76-S81 PolarHBondContact CD2-O 3.01Å; H76-S81 PolarHBondContact CD2-OG 2.84Å; A79-S81 PolarHBondContact O-N 3.5Å; S81-M130 WeakPolarHBondContact OG-CE 3.43Å | ||
| 82 | C | 97.3 | Very high | 94.4 | Very high | 2 Ų | 2 | 38.2 Ų | 38.2 | 1% | 0.014 | 20% | 0.201 | C | C | . | . | trans | -82.3 | 160.8 | 172.4 | 68.1 | 0 | 0 | 0 | 0 | 110.8 | C65 C68 D70 K71 G84 C85 K86 R114 | C65-C82 HydrophobicContact CB-CB 3.77Å; C65-C82 VanDerWaalsContact CB-N 3.35Å; C65-C82 PolarHBondContact SG-N 3Å; C68-C82 VanDerWaalsContact SG-SG 3.61Å; D70-C82 HydrophobicContact CB-CB 4.22Å; K71-C82 WeakPolarHBondContact O-CB 3.49Å; C82-G84 PolarHBondContact O-N 3.5Å; C82-G84 VanDerWaalsContact O-N 3.07Å; C82-C85 PolarHBondContact O-N 3.44Å; C82-C85 PolarHBondContact SG-N 2.94Å; C82-K86 PolarHBondContact O-N 3.43Å; C82-R114 PolarHBondContact SG-NH1 3.23Å | ||
| 83 | E | 97 | Very high | 94.6 | Very high | 102 Ų | 102 | 39.7 Ų | 39.7 | 48% | 0.477 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -53.6 | -33 | 175.7 | -71.6 | -56.5 | 119 | 0 | 0 | 113 | S73 H76 K86 G87 | S73-E83 WeakPolarHBondContact CB-OE1 3.36Å; S73-E83 PolarHBondContact OG-OE1 3.46Å; H76-E83 IonicContact CE1-OE1 3.56Å; H76-E83 IonicContact NE2-OE1 3.48Å; E83-K86 VanDerWaalsContact CD-NZ 3.28Å; E83-K86 WeakPolarHBondContact OE1-CD 3.39Å; E83-K86 IonicContact OE1-NZ 3.05Å; E83-K86 PolarHBondContact OE1-NZ 3.32Å; E83-K86 WeakPolarHBondContact OE2-CD 3.49Å; E83-K86 IonicContact OE2-NZ 3.74Å; E83-K86 PolarHBondContact OE2-NZ 2.86Å; E83-G87 PolarHBondContact O-N 3.3Å |
| 84 | G | 97.4 | Very high | 94.6 | Very high | 26 Ų | 26 | 41.8 Ų | 41.8 | 27% | 0.268 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -63.2 | -44.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | C82 F88 R121 | C82-G84 PolarHBondContact O-N 3.5Å; C82-G84 VanDerWaalsContact O-N 3.07Å; G84-F88 VanDerWaalsContact O-CB 3.25Å; G84-F88 WeakPolarHBondContact O-CB 3.11Å; G84-F88 PolarHBondContact O-N 3.5Å; G84-F88 VanDerWaalsContact O-N 3.15Å; G84-R121 VanDerWaalsContact C-NH2 3.26Å; G84-R121 PolarHBondContact O-NH2 2.78Å |
| 85 | C | 98.2 | Very high | 94.7 | Very high | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -79.7 | -38.2 | -179.9 | -70.6 | 0 | 0 | 0 | 0 | 112 | V67 C82 G87 F88 F89 M130 | V67-C85 HydrophobicContact CB-CB 4.31Å; V67-C85 HydrophobicContact CG2-CB 4.46Å; C82-C85 PolarHBondContact O-N 3.44Å; C82-C85 PolarHBondContact SG-N 2.94Å; C85-G87 PolarHBondContact O-N 2.83Å; C85-F88 PolarHBondContact O-N 2.86Å; C85-F89 WeakPolarHBondContact O-CB 3.29Å; C85-F89 PolarHBondContact O-N 3.15Å; C85-M130 HydrophobicContact CB-CE 4.37Å |
| 86 | K | 97.4 | Very high | 94.7 | Very high | 52 Ų | 52 | 48.8 Ų | 48.8 | 23% | 0.226 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -52.1 | -55 | 168.9 | 172.6 | -161.9 | -171.3 | -179.5 | 0 | 111.8 | H76 Y77 C82 E83 F88 F89 K90 | H76-K86 HydrophobicContact CB-CB 4.01Å; H76-K86 HydrophobicContact CB-CD 4.4Å; H76-K86 HydrophobicContact CB-CG 3.86Å; H76-K86 WeakPolarHBondContact ND1-CD 3.26Å; H76-K86 VanDerWaalsContact ND1-CE 3.26Å; H76-K86 WeakPolarHBondContact ND1-CE 3.48Å; Y77-K86 HydrophobicContact CE2-CG 3.94Å; C82-K86 PolarHBondContact O-N 3.43Å; E83-K86 VanDerWaalsContact CD-NZ 3.28Å; E83-K86 WeakPolarHBondContact OE1-CD 3.39Å; E83-K86 IonicContact OE1-NZ 3.05Å; E83-K86 PolarHBondContact OE1-NZ 3.32Å; E83-K86 WeakPolarHBondContact OE2-CD 3.49Å; E83-K86 IonicContact OE2-NZ 3.74Å; E83-K86 PolarHBondContact OE2-NZ 2.86Å; K86-F88 VanDerWaalsContact C-N 3.34Å; K86-F88 PolarHBondContact O-N 3.37Å; K86-F89 PolarHBondContact O-N 3.47Å; K86-K90 WeakPolarHBondContact O-CB 3.08Å; K86-K90 PolarHBondContact O-N 3.32Å |
| 87 | G | 97.1 | Very high | 94.5 | Very high | 13 Ų | 13 | 50.3 Ų | 50.3 | 13% | 0.134 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.5 | -37.4 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | E83 C85 R91 | E83-G87 PolarHBondContact O-N 3.3Å; C85-G87 PolarHBondContact O-N 2.83Å; G87-R91 WeakPolarHBondContact O-CG 3.47Å; G87-R91 VanDerWaalsContact O-CZ 3.29Å; G87-R91 PolarHBondContact O-N 3.43Å; G87-R91 VanDerWaalsContact O-N 3.17Å; G87-R91 PolarHBondContact O-NH1 3.48Å |
| 88 | F | 98.3 | Very high | 94.4 | Very high | 7 Ų | 7 | 52 Ų | 52 | 3% | 0.031 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.3 | -54.9 | 174.3 | 171.9 | -100.4 | 0 | 0 | 0 | 111.2 | G84 C85 K86 K90 R91 S92 Y99 Q118 R121 L122 | G84-F88 VanDerWaalsContact O-CB 3.25Å; G84-F88 WeakPolarHBondContact O-CB 3.11Å; G84-F88 PolarHBondContact O-N 3.5Å; G84-F88 VanDerWaalsContact O-N 3.15Å; C85-F88 PolarHBondContact O-N 2.86Å; K86-F88 VanDerWaalsContact C-N 3.34Å; K86-F88 PolarHBondContact O-N 3.37Å; F88-K90 PolarHBondContact O-N 3.37Å; F88-R91 PolarHBondContact O-N 3.42Å; F88-R91 VanDerWaalsContact O-N 3.16Å; F88-S92 PolarHBondContact O-N 3.35Å; F88-S92 PolarHBondContact O-OG 3.14Å; F88-Y99 AromaticContact CE2-CE2 3.9Å; F88-Y99 HydrophobicContact CE2-CE2 3.9Å; F88-Y99 AromaticContact CE2-CZ 3.98Å; F88-Y99 HydrophobicContact CZ-CD2 4.37Å; F88-Y99 AromaticContact CZ-CE2 3.69Å; F88-Y99 HydrophobicContact CZ-CE2 3.69Å; F88-Q118 HydrophobicContact CE2-CB 4.11Å; F88-Q118 HydrophobicContact CE2-CG 4.18Å; F88-Q118 HydrophobicContact CZ-CB 4.27Å; F88-Q118 WeakPolarHBondContact CZ-O 3.42Å; F88-R121 HydrophobicContact CD1-CG 3.85Å; F88-R121 HydrophobicContact CE1-CB 3.86Å; F88-R121 HydrophobicContact CE1-CG 3.62Å; F88-R121 HydrophobicContact CZ-CB 3.97Å; F88-R121 HydrophobicContact CZ-CG 4.11Å; F88-L122 HydrophobicContact CE1-CB 3.8Å; F88-L122 HydrophobicContact CE1-CD1 4.25Å; F88-L122 HydrophobicContact CZ-CB 3.92Å |
| 89 | F | 97.9 | Very high | 94.8 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -56.1 | -50 | 179.9 | -171.1 | -98.7 | 0 | 0 | 0 | 111.7 | Y77 C85 K86 R91 S92 I93 L122 C125 L126 M130 R131 V135 | Y77-F89 HydrophobicContact CD2-CB 4.46Å; Y77-F89 AromaticContact CD2-CD1 3.56Å; Y77-F89 HydrophobicContact CD2-CD1 3.56Å; Y77-F89 HydrophobicContact CD2-CE1 4.26Å; Y77-F89 HydrophobicContact CD2-CG 4.37Å; Y77-F89 HydrophobicContact CE2-CD1 4.16Å; Y77-F89 AromaticContact CG-CD1 3.81Å; Y77-F89 HydrophobicContact CG-CD1 3.81Å; Y77-F89 HydrophobicContact CG-CE1 4.04Å; C85-F89 WeakPolarHBondContact O-CB 3.29Å; C85-F89 PolarHBondContact O-N 3.15Å; K86-F89 PolarHBondContact O-N 3.47Å; F89-R91 VanDerWaalsContact C-N 3.32Å; F89-R91 PolarHBondContact O-N 3.22Å; F89-S92 PolarHBondContact O-N 2.76Å; F89-S92 VanDerWaalsContact O-N 3.15Å; F89-I93 HydrophobicContact CD1-CG1 4.02Å; F89-I93 HydrophobicContact CD2-CG1 4.39Å; F89-I93 HydrophobicContact CE1-CG1 3.72Å; F89-I93 HydrophobicContact CE2-CD1 4.2Å; F89-I93 HydrophobicContact CE2-CG1 4.12Å; F89-I93 HydrophobicContact CG-CG1 4.36Å; F89-I93 HydrophobicContact CZ-CD1 4.08Å; F89-I93 HydrophobicContact CZ-CG1 3.77Å; F89-I93 WeakPolarHBondContact O-CG1 3.29Å; F89-I93 PolarHBondContact O-N 2.92Å; F89-L122 HydrophobicContact CD2-CD1 3.95Å; F89-L122 HydrophobicContact CE2-CD1 4.27Å; F89-C125 HydrophobicContact CD2-CB 3.61Å; F89-C125 HydrophobicContact CE2-CB 4.12Å; F89-L126 HydrophobicContact CE2-CD2 3.76Å; F89-L126 HydrophobicContact CE2-CG 4.26Å; F89-L126 HydrophobicContact CZ-CD2 4.11Å; F89-M130 HydrophobicContact CB-SD 3.79Å; F89-M130 HydrophobicContact CD1-CB 4.27Å; F89-M130 HydrophobicContact CD1-SD 4.32Å; F89-M130 HydrophobicContact CD2-CB 3.78Å; F89-M130 HydrophobicContact CD2-CG 4.42Å; F89-M130 HydrophobicContact CD2-SD 3.76Å; F89-M130 HydrophobicContact CE1-CB 3.98Å; F89-M130 HydrophobicContact CE2-CB 3.45Å; F89-M130 VanDerWaalsContact CE2-CB 3.45Å; F89-M130 HydrophobicContact CE2-SD 4.42Å; F89-M130 HydrophobicContact CG-CB 4.18Å; F89-M130 HydrophobicContact CG-SD 3.7Å; F89-M130 HydrophobicContact CZ-CB 3.56Å; F89-M130 WeakPolarHBondContact CZ-O 3.49Å; F89-R131 WeakPolarHBondContact CE1-O 3.47Å; F89-V135 HydrophobicContact CD1-CG2 3.94Å; F89-V135 HydrophobicContact CE1-CG2 3.73Å |
| 90 | K | 96.4 | Very high | 95.2 | Very high | 75 Ų | 75 | 58 Ų | 58 | 33% | 0.326 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -52.5 | -46.2 | 176.5 | -169.5 | 177.9 | 85.6 | 178.3 | 0 | 113 | Y77 K86 F88 R94 V135 | Y77-K90 HydrophobicContact CE2-CB 4.16Å; Y77-K90 WeakPolarHBondContact OH-CB 3.04Å; Y77-K90 WeakPolarHBondContact OH-CD 3.44Å; Y77-K90 VanDerWaalsContact OH-CG 3.29Å; Y77-K90 WeakPolarHBondContact OH-CG 3.4Å; K86-K90 WeakPolarHBondContact O-CB 3.08Å; K86-K90 PolarHBondContact O-N 3.32Å; F88-K90 PolarHBondContact O-N 3.37Å; K90-R94 VanDerWaalsContact CG-NH1 3.26Å; K90-R94 WeakPolarHBondContact O-CB 3.43Å; K90-R94 WeakPolarHBondContact O-CG 3.36Å; K90-R94 PolarHBondContact O-N 3.36Å; K90-V135 HydrophobicContact CG-CG1 4.26Å |
| 91 | R | 96.5 | Very high | 95.6 | Very high | 131 Ų | 131 | 58 Ų | 58 | 49% | 0.494 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -68.7 | -42.6 | 179.3 | -74.1 | -173.5 | -60.3 | -92.3 | 0.8 | 111.8 | G87 F88 F89 K95 | G87-R91 WeakPolarHBondContact O-CG 3.47Å; G87-R91 VanDerWaalsContact O-CZ 3.29Å; G87-R91 PolarHBondContact O-N 3.43Å; G87-R91 VanDerWaalsContact O-N 3.17Å; G87-R91 PolarHBondContact O-NH1 3.48Å; F88-R91 PolarHBondContact O-N 3.42Å; F88-R91 VanDerWaalsContact O-N 3.16Å; F89-R91 VanDerWaalsContact C-N 3.32Å; F89-R91 PolarHBondContact O-N 3.22Å; R91-K95 WeakPolarHBondContact O-CB 3.33Å; R91-K95 PolarHBondContact O-N 2.86Å |
| 92 | S | 96.9 | Very high | 95.6 | Very high | 2 Ų | 2 | 70.2 Ų | 70.2 | 1% | 0.014 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -63.4 | -43.6 | -179.5 | -55.2 | 0 | 0 | 0 | 0 | 111.8 | F88 F89 K96 I97 Y99 | F88-S92 PolarHBondContact O-N 3.35Å; F88-S92 PolarHBondContact O-OG 3.14Å; F89-S92 PolarHBondContact O-N 2.76Å; F89-S92 VanDerWaalsContact O-N 3.15Å; S92-K96 WeakPolarHBondContact O-CA 3.41Å; S92-K96 PolarHBondContact O-N 3.49Å; S92-I97 PolarHBondContact O-N 3.01Å; S92-Y99 VanDerWaalsContact OG-CE2 3.27Å; S92-Y99 WeakPolarHBondContact OG-CE2 3.15Å; S92-Y99 PolarHBondContact OG-OH 2.95Å |
| 93 | I | 95.6 | Very high | 95.4 | Very high | 43 Ų | 43 | 72.4 Ų | 72.4 | 22% | 0.221 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -72.1 | -49.8 | 179.5 | -59.6 | -52.4 | 0 | 0 | 0 | 111.7 | F89 K95 K96 V135 | F89-I93 HydrophobicContact CD1-CG1 4.02Å; F89-I93 HydrophobicContact CD2-CG1 4.39Å; F89-I93 HydrophobicContact CE1-CG1 3.72Å; F89-I93 HydrophobicContact CE2-CD1 4.2Å; F89-I93 HydrophobicContact CE2-CG1 4.12Å; F89-I93 HydrophobicContact CG-CG1 4.36Å; F89-I93 HydrophobicContact CZ-CD1 4.08Å; F89-I93 HydrophobicContact CZ-CG1 3.77Å; F89-I93 WeakPolarHBondContact O-CG1 3.29Å; F89-I93 PolarHBondContact O-N 2.92Å; I93-K95 VanDerWaalsContact C-N 3.34Å; I93-K95 PolarHBondContact O-N 2.99Å; I93-K96 PolarHBondContact O-N 2.96Å; I93-V135 HydrophobicContact CB-CB 4.29Å; I93-V135 HydrophobicContact CB-CG1 4.33Å; I93-V135 HydrophobicContact CB-CG2 4.02Å; I93-V135 HydrophobicContact CG1-CG2 4.21Å; I93-V135 HydrophobicContact CG2-CB 3.87Å; I93-V135 HydrophobicContact CG2-CG1 4.22Å; I93-V135 HydrophobicContact CG2-CG2 3.97Å |
| 94 | R | 92.6 | Very high | 95.3 | Very high | 102 Ų | 102 | 71.9 Ų | 71.9 | 39% | 0.385 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60 | -42.4 | -177.8 | -76.7 | -173.1 | 176.5 | 141 | 7.5 | 113.7 | K90 K96 V135 Q136 | K90-R94 VanDerWaalsContact CG-NH1 3.26Å; K90-R94 WeakPolarHBondContact O-CB 3.43Å; K90-R94 WeakPolarHBondContact O-CG 3.36Å; K90-R94 PolarHBondContact O-N 3.36Å; R94-K96 VanDerWaalsContact C-N 3.27Å; R94-V135 HydrophobicContact CG-CG1 3.61Å; R94-Q136 PolarHBondContact NE-O 3.27Å; R94-Q136 PolarHBondContact NH2-O 3.26Å |
| 95 | K | 91.9 | Very high | 95 | Very high | 156 Ų | 156 | 78 Ų | 78 | 68% | 0.678 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | 2.4 | -179.8 | -64.5 | -175.8 | 175.5 | -166.2 | 0 | 112.7 | R91 I93 I97 | R91-K95 WeakPolarHBondContact O-CB 3.33Å; R91-K95 PolarHBondContact O-N 2.86Å; I93-K95 VanDerWaalsContact C-N 3.34Å; I93-K95 PolarHBondContact O-N 2.99Å; K95-I97 VanDerWaalsContact C-N 3.25Å; K95-I97 HydrophobicContact CB-CD1 3.86Å; K95-I97 HydrophobicContact CB-CG1 3.51Å; K95-I97 HydrophobicContact CD-CD1 4.16Å; K95-I97 PolarHBondContact O-N 2.91Å |
| 96 | K | 89.4 | Confident | 94.7 | Very high | 190 Ų | 190 | 83.3 Ų | 83.3 | 83% | 0.826 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 44.9 | 49.7 | -176 | -61.7 | -176.8 | 178.5 | -178.2 | 0 | 112.2 | S92 I93 R94 G98 | S92-K96 WeakPolarHBondContact O-CA 3.41Å; S92-K96 PolarHBondContact O-N 3.49Å; I93-K96 PolarHBondContact O-N 2.96Å; R94-K96 VanDerWaalsContact C-N 3.27Å; K96-G98 PolarHBondContact O-N 3.44Å |
| 97 | I | 90.6 | Very high | 94.6 | Very high | 61 Ų | 61 | 82.4 Ų | 82.4 | 31% | 0.313 | 42% | 0.415 | S | S | . | . | trans | -78.2 | 117.2 | -171.5 | -51.7 | 178.1 | 0 | 0 | 0 | 110.2 | S92 K95 Y99 | S92-I97 PolarHBondContact O-N 3.01Å; K95-I97 VanDerWaalsContact C-N 3.25Å; K95-I97 HydrophobicContact CB-CD1 3.86Å; K95-I97 HydrophobicContact CB-CG1 3.51Å; K95-I97 HydrophobicContact CD-CD1 4.16Å; K95-I97 PolarHBondContact O-N 2.91Å; I97-Y99 HydrophobicContact CB-CE1 4.17Å; I97-Y99 HydrophobicContact CB-CE2 4.44Å; I97-Y99 HydrophobicContact CG2-CD1 3.75Å; I97-Y99 HydrophobicContact CG2-CE1 3.37Å; I97-Y99 HydrophobicContact CG2-CE2 4.4Å; I97-Y99 HydrophobicContact CG2-CG 4.39Å; I97-Y99 PolarHBondContact O-N 3.48Å | ||
| 98 | G | 92.1 | Very high | 94.4 | Very high | 72 Ų | 72 | 87 Ų | 87 | 74% | 0.742 | 44% | 0.442 | S | S | * | . | trans | -81.2 | 99.1 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | K96 | K96-G98 PolarHBondContact O-N 3.44Š| ||
| 99 | Y | 96.8 | Very high | 94.2 | Very high | 40 Ų | 40 | 87.2 Ų | 87.2 | 16% | 0.157 | 44% | 0.444 | C | S | . | . | trans | -79.9 | 150.5 | 172.7 | -60.2 | -59.3 | 0 | 0 | 0 | 111.6 | F88 S92 I97 Q118 Y119 L122 | F88-Y99 AromaticContact CE2-CE2 3.9Å; F88-Y99 HydrophobicContact CE2-CE2 3.9Å; F88-Y99 AromaticContact CE2-CZ 3.98Å; F88-Y99 HydrophobicContact CZ-CD2 4.37Å; F88-Y99 AromaticContact CZ-CE2 3.69Å; F88-Y99 HydrophobicContact CZ-CE2 3.69Å; S92-Y99 VanDerWaalsContact OG-CE2 3.27Å; S92-Y99 WeakPolarHBondContact OG-CE2 3.15Å; S92-Y99 PolarHBondContact OG-OH 2.95Å; I97-Y99 HydrophobicContact CB-CE1 4.17Å; I97-Y99 HydrophobicContact CB-CE2 4.44Å; I97-Y99 HydrophobicContact CG2-CD1 3.75Å; I97-Y99 HydrophobicContact CG2-CE1 3.37Å; I97-Y99 HydrophobicContact CG2-CE2 4.4Å; I97-Y99 HydrophobicContact CG2-CG 4.39Å; I97-Y99 PolarHBondContact O-N 3.48Å; Y99-Q118 HydrophobicContact CD1-CB 3.56Å; Y99-Q118 HydrophobicContact CD1-CG 4.39Å; Y99-Q118 VanDerWaalsContact CD1-OE1 3.28Å; Y99-Q118 HydrophobicContact CD2-CB 3.95Å; Y99-Q118 HydrophobicContact CE1-CB 3.76Å; Y99-Q118 HydrophobicContact CE1-CG 4.23Å; Y99-Q118 HydrophobicContact CE2-CB 4.11Å; Y99-Q118 HydrophobicContact CG-CB 3.68Å; Y99-Y119 VanDerWaalsContact O-CD2 3.32Å; Y99-Y119 WeakPolarHBondContact O-CD2 3.25Å; Y99-L122 HydrophobicContact CD2-CB 4.13Å; Y99-L122 HydrophobicContact CD2-CD2 3.85Å; Y99-L122 HydrophobicContact CE2-CB 4.33Å; Y99-L122 HydrophobicContact CE2-CD2 4Å | ||
| 100 | V | 96.3 | Very high | 94 | Very high | 128 Ų | 128 | 89.7 Ų | 89.7 | 78% | 0.776 | 46% | 0.459 | S | S | * | . | trans | -118.6 | 131 | 172.2 | -177.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 101 | C | 97.4 | Very high | 93.9 | Very high | 16 Ų | 16 | 90.9 Ų | 90.9 | 11% | 0.108 | 46% | 0.464 | C | S | . | . | trans | -77.5 | 136.3 | 172.5 | -168.4 | 0 | 0 | 0 | 0 | 110.2 | G103 R105 Y119 | C101-G103 PolarHBondContact SG-N 2.76Å; C101-G103 VanDerWaalsContact SG-N 3.36Å; C101-R105 HydrophobicContact CB-CG 3.84Å; C101-Y119 HydrophobicContact CB-CD1 3.56Å; C101-Y119 HydrophobicContact CB-CE1 4.26Å; C101-Y119 HydrophobicContact CB-CG 3.83Å | ||
| 102 | R | 95.3 | Very high | 93.9 | Very high | 257 Ų | 257 | 92.6 Ų | 92.6 | 97% | 0.97 | 48% | 0.475 | S | S | * | . | S | Bend | trans | -90.2 | 0.7 | 173.8 | -63.2 | -175.5 | 178.2 | -175.2 | -1.7 | 113.9 | ||
| 103 | G | 92.7 | Very high | 93.7 | Very high | 47 Ų | 47 | 98.2 Ų | 98.2 | 49% | 0.485 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -129 | -150.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | C101 R105 | C101-G103 PolarHBondContact SG-N 2.76Å; C101-G103 VanDerWaalsContact SG-N 3.36Å; G103-R105 VanDerWaalsContact C-N 3.25Å; G103-R105 PolarHBondContact O-N 3.15Å; G103-R105 VanDerWaalsContact O-N 3.12Å |
| 104 | S | 93.9 | Very high | 93.7 | Very high | 92 Ų | 92 | 98.3 Ų | 98.3 | 64% | 0.643 | 50% | 0.499 | S | S | * | . | S | Bend | trans | -79.1 | 18.6 | -174 | 35 | 0 | 0 | 0 | 0 | 115.9 | D106 | S104-D106 VanDerWaalsContact CB-OD1 3.27Å; S104-D106 WeakPolarHBondContact CB-OD1 3.32Å; S104-D106 PolarHBondContact O-N 2.77Å; S104-D106 VanDerWaalsContact OG-CG 3.25Å; S104-D106 PolarHBondContact OG-OD1 3.18Å; S104-D106 PolarHBondContact OG-OD2 3.41Å |
| 105 | R | 92.7 | Very high | 93.9 | Very high | 155 Ų | 155 | 99.1 Ų | 99.1 | 59% | 0.585 | 51% | 0.511 | S | S | * | . | S | Bend | trans | 59.7 | 25.2 | 178.3 | -60.2 | -179.8 | -174.7 | -167 | 3.2 | 115.1 | C101 G103 Y119 K123 | C101-R105 HydrophobicContact CB-CG 3.84Å; G103-R105 VanDerWaalsContact C-N 3.25Å; G103-R105 PolarHBondContact O-N 3.15Å; G103-R105 VanDerWaalsContact O-N 3.12Å; R105-Y119 HydrophobicContact CB-CD1 4.42Å; R105-Y119 HydrophobicContact CB-CE1 3.71Å; R105-Y119 HydrophobicContact CG-CD1 4.36Å; R105-Y119 HydrophobicContact CG-CE1 3.73Å; R105-K123 PolarHBondContact O-NZ 3.01Å |
| 106 | D | 91.8 | Very high | 94.1 | Very high | 110 Ų | 110 | 102.3 Ų | 102.3 | 59% | 0.588 | 52% | 0.519 | S | S | * | . | trans | -135.6 | 10.3 | -175.1 | 64.4 | -18.6 | 0 | 0 | 0 | 113.1 | S104 | S104-D106 VanDerWaalsContact CB-OD1 3.27Å; S104-D106 WeakPolarHBondContact CB-OD1 3.32Å; S104-D106 PolarHBondContact O-N 2.77Å; S104-D106 VanDerWaalsContact OG-CG 3.25Å; S104-D106 PolarHBondContact OG-OD1 3.18Å; S104-D106 PolarHBondContact OG-OD2 3.41Å | ||
| 107 | C | 94.4 | Very high | 94.5 | Very high | 34 Ų | 34 | 94 Ų | 94 | 23% | 0.23 | 48% | 0.484 | C | S | . | . | trans | -50.5 | 131.2 | -178.1 | -51.8 | 0 | 0 | 0 | 0 | 113.1 | V109 C117 C120 | C107-V109 PolarHBondContact O-N 3.48Å; C107-C117 HydrophobicContact CB-CB 3.8Å; C107-C120 HydrophobicContact CB-CB 3.93Å; C107-C120 PolarHBondContact N-SG 3.07Å | ||
| 108 | P | 92.2 | Very high | 94.9 | Very high | 108 Ų | 108 | 96.1 Ų | 96.1 | 70% | 0.701 | 49% | 0.493 | S | S | * | . | trans | -66.4 | 132.8 | -177.9 | 26.1 | -34.3 | 0 | 0 | 0 | 111.8 | ||||
| 109 | V | 95.1 | Very high | 95.2 | Very high | 13 Ų | 13 | 95.7 Ų | 95.7 | 8% | 0.079 | 47% | 0.469 | C | S | . | . | trans | -107.3 | 105.5 | 179.4 | -177 | 0 | 0 | 0 | 0 | 109 | V67 C68 C107 R114 C120 R121 K124 | V67-V109 HydrophobicContact CG1-CG1 4.11Å; C68-V109 HydrophobicContact CB-CG1 4.12Å; C107-V109 PolarHBondContact O-N 3.48Å; V109-R114 HydrophobicContact CG1-CB 3.96Å; V109-C120 HydrophobicContact CG2-CB 4.43Å; V109-R121 HydrophobicContact CG1-CG 4.14Å; V109-R121 HydrophobicContact CG2-CB 4.42Å; V109-K124 HydrophobicContact CB-CD 3.74Å; V109-K124 HydrophobicContact CG1-CD 4.33Å; V109-K124 HydrophobicContact CG2-CB 4.35Å; V109-K124 HydrophobicContact CG2-CD 4.03Å; V109-K124 PolarHBondContact O-NZ 3.3Å | ||
| 110 | T | 93.6 | Very high | 95.2 | Very high | 52 Ų | 52 | 94.1 Ų | 94.1 | 32% | 0.319 | 46% | 0.464 | S | S | . | . | trans | -125.8 | 166.5 | -179.3 | 59.7 | 0 | 0 | 0 | 0 | 110.4 | C68 F112 H113 R114 | C68-T110 CarbonylContact O-C 3.54Å; C68-T110 VanDerWaalsContact O-C 3.28Å; C68-T110 WeakPolarHBondContact O-CA 3.42Å; T110-F112 PolarHBondContact O-N 3.29Å; T110-H113 PolarHBondContact O-N 2.94Å; T110-H113 PolarHBondContact OG1-N 3.31Å; T110-H113 PolarHBondContact OG1-ND1 3Å; T110-H113 VanDerWaalsContact OG1-ND1 3.17Å; T110-R114 WeakPolarHBondContact O-CA 3.36Å; T110-R114 WeakPolarHBondContact O-CB 3.46Å; T110-R114 PolarHBondContact O-N 3.06Å | ||
| 111 | K | 94.6 | Very high | 95.3 | Very high | 100 Ų | 100 | 88.4 Ų | 88.4 | 44% | 0.435 | 43% | 0.429 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -48.5 | -46 | 177.5 | 175.4 | 175.6 | 178.7 | 157.8 | 0 | 112.6 | C68 D70 | C68-K111 PolarHBondContact O-N 3.18Å; D70-K111 HydrophobicContact CB-CB 4.2Å; D70-K111 HydrophobicContact CB-CD 4.18Å; D70-K111 HydrophobicContact CB-CG 3.99Å; D70-K111 WeakPolarHBondContact OD1-CD 3.45Å; D70-K111 WeakPolarHBondContact OD1-CE 3.45Å; D70-K111 IonicContact OD1-NZ 2.81Å; D70-K111 PolarHBondContact OD1-NZ 2.62Å |
| 112 | F | 95.2 | Very high | 95.3 | Very high | 166 Ų | 166 | 88.9 Ų | 88.9 | 73% | 0.728 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -37.5 | -176 | -54.9 | -74.9 | 0 | 0 | 0 | 112.9 | T110 | T110-F112 PolarHBondContact O-N 3.29Š|
| 113 | H | 93.3 | Very high | 95.4 | Very high | 121 Ų | 121 | 81.8 Ų | 81.8 | 56% | 0.56 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.9 | 9.5 | -169.9 | -48.3 | 102.4 | 0 | 0 | 0 | 114.1 | T110 N115 R116 | T110-H113 PolarHBondContact O-N 2.94Å; T110-H113 PolarHBondContact OG1-N 3.31Å; T110-H113 PolarHBondContact OG1-ND1 3Å; T110-H113 VanDerWaalsContact OG1-ND1 3.17Å; H113-N115 PolarHBondContact O-N 2.87Å; H113-R116 VanDerWaalsContact O-CB 3.3Å; H113-R116 WeakPolarHBondContact O-CB 3.38Å; H113-R116 PolarHBondContact O-N 3Å |
| 114 | R | 96.3 | Very high | 95.6 | Very high | 44 Ų | 44 | 82.9 Ų | 82.9 | 17% | 0.166 | 40% | 0.397 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58 | -20.3 | 179.5 | 60.6 | -170.4 | -173.1 | -162.2 | -5.7 | 114.4 | C68 D70 C82 V109 T110 R121 | C68-R114 HydrophobicContact CB-CB 4.27Å; C68-R114 PolarHBondContact SG-NH1 3.25Å; D70-R114 IonicContact OD2-CZ 2.67Å; D70-R114 IonicContact OD2-NH1 3.71Å; D70-R114 PolarHBondContact OD2-NH1 2.87Å; D70-R114 IonicContact OD2-NH2 2.84Å; D70-R114 PolarHBondContact OD2-NH2 2.87Å; C82-R114 PolarHBondContact SG-NH1 3.23Å; V109-R114 HydrophobicContact CG1-CB 3.96Å; T110-R114 WeakPolarHBondContact O-CA 3.36Å; T110-R114 WeakPolarHBondContact O-CB 3.46Å; T110-R114 PolarHBondContact O-N 3.06Å; R114-R121 WeakPolarHBondContact O-CD 3.38Å |
| 115 | N | 97 | Very high | 95.7 | Very high | 120 Ų | 120 | 78.5 Ų | 78.5 | 64% | 0.642 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -5.3 | 179.1 | -64.6 | -23.7 | 0 | 0 | 0 | 113.6 | H113 R121 | H113-N115 PolarHBondContact O-N 2.87Å; N115-R121 PolarHBondContact OD1-NH1 2.89Å |
| 116 | R | 96.2 | Very high | 95.8 | Very high | 222 Ų | 222 | 75.2 Ų | 75.2 | 84% | 0.838 | 36% | 0.36 | S | S | * | . | S | Bend | trans | -68.2 | -38.7 | -177 | -178 | 61.9 | 172 | -171.2 | -1.1 | 113.1 | H113 | H113-R116 VanDerWaalsContact O-CB 3.3Å; H113-R116 WeakPolarHBondContact O-CB 3.38Å; H113-R116 PolarHBondContact O-N 3Å |
| 117 | C | 97.9 | Very high | 95.9 | Very high | 16 Ų | 16 | 73.3 Ų | 73.3 | 11% | 0.108 | 36% | 0.36 | C | S | . | . | trans | -138.8 | 107.5 | 179.9 | -176.6 | 0 | 0 | 0 | 0 | 110.7 | C107 C120 R121 | C107-C117 HydrophobicContact CB-CB 3.8Å; C117-C120 HydrophobicContact CB-CB 4.23Å; C117-C120 PolarHBondContact SG-N 3.03Å; C117-R121 WeakPolarHBondContact O-CB 3.47Å; C117-R121 PolarHBondContact O-N 3.33Å; C117-R121 VanDerWaalsContact O-N 3.11Å | ||
| 118 | Q | 97.8 | Very high | 95.7 | Very high | 105 Ų | 105 | 74.5 Ų | 74.5 | 49% | 0.491 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -68.6 | -35.9 | 180 | -65.9 | 175.5 | -36.2 | 0 | 0 | 112 | F88 Y99 R121 L122 | F88-Q118 HydrophobicContact CE2-CB 4.11Å; F88-Q118 HydrophobicContact CE2-CG 4.18Å; F88-Q118 HydrophobicContact CZ-CB 4.27Å; F88-Q118 WeakPolarHBondContact CZ-O 3.42Å; Y99-Q118 HydrophobicContact CD1-CB 3.56Å; Y99-Q118 HydrophobicContact CD1-CG 4.39Å; Y99-Q118 VanDerWaalsContact CD1-OE1 3.28Å; Y99-Q118 HydrophobicContact CD2-CB 3.95Å; Y99-Q118 HydrophobicContact CE1-CB 3.76Å; Y99-Q118 HydrophobicContact CE1-CG 4.23Å; Y99-Q118 HydrophobicContact CE2-CB 4.11Å; Y99-Q118 HydrophobicContact CG-CB 3.68Å; Q118-R121 PolarHBondContact O-N 3.33Å; Q118-L122 PolarHBondContact O-N 3.5Å |
| 119 | Y | 98.2 | Very high | 95.6 | Very high | 63 Ų | 63 | 71.1 Ų | 71.1 | 25% | 0.247 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.6 | -55.4 | 175.2 | 174.5 | -88.6 | 0 | 0 | 0 | 111.5 | Y99 C101 R105 R121 L122 K123 | Y99-Y119 VanDerWaalsContact O-CD2 3.32Å; Y99-Y119 WeakPolarHBondContact O-CD2 3.25Å; C101-Y119 HydrophobicContact CB-CD1 3.56Å; C101-Y119 HydrophobicContact CB-CE1 4.26Å; C101-Y119 HydrophobicContact CB-CG 3.83Å; R105-Y119 HydrophobicContact CB-CD1 4.42Å; R105-Y119 HydrophobicContact CB-CE1 3.71Å; R105-Y119 HydrophobicContact CG-CD1 4.36Å; R105-Y119 HydrophobicContact CG-CE1 3.73Å; Y119-R121 VanDerWaalsContact C-N 3.28Å; Y119-R121 PolarHBondContact O-N 3.43Å; Y119-L122 PolarHBondContact O-N 2.93Å; Y119-K123 HydrophobicContact CE1-CD 4.01Å; Y119-K123 WeakPolarHBondContact O-CB 3.27Å; Y119-K123 PolarHBondContact O-N 3.44Å |
| 120 | C | 97.5 | Very high | 95.6 | Very high | 7 Ų | 7 | 70.8 Ų | 70.8 | 5% | 0.047 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -65.8 | -33 | -178.9 | -64.7 | 0 | 0 | 0 | 0 | 112 | C107 V109 C117 K124 | C107-C120 HydrophobicContact CB-CB 3.93Å; C107-C120 PolarHBondContact N-SG 3.07Å; V109-C120 HydrophobicContact CG2-CB 4.43Å; C117-C120 HydrophobicContact CB-CB 4.23Å; C117-C120 PolarHBondContact SG-N 3.03Å; C120-K124 VanDerWaalsContact O-CB 3.32Å; C120-K124 WeakPolarHBondContact O-CB 3.4Å; C120-K124 PolarHBondContact O-N 3.3Å |
| 121 | R | 98.3 | Very high | 95.5 | Very high | 9 Ų | 9 | 75.1 Ų | 75.1 | 3% | 0.034 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.4 | -46.7 | 173.6 | -169.4 | -173.1 | -172 | 165.9 | -3.7 | 112.2 | G84 F88 V109 R114 N115 C117 Q118 Y119 K124 C125 | G84-R121 VanDerWaalsContact C-NH2 3.26Å; G84-R121 PolarHBondContact O-NH2 2.78Å; F88-R121 HydrophobicContact CD1-CG 3.85Å; F88-R121 HydrophobicContact CE1-CB 3.86Å; F88-R121 HydrophobicContact CE1-CG 3.62Å; F88-R121 HydrophobicContact CZ-CB 3.97Å; F88-R121 HydrophobicContact CZ-CG 4.11Å; V109-R121 HydrophobicContact CG1-CG 4.14Å; V109-R121 HydrophobicContact CG2-CB 4.42Å; R114-R121 WeakPolarHBondContact O-CD 3.38Å; N115-R121 PolarHBondContact OD1-NH1 2.89Å; C117-R121 WeakPolarHBondContact O-CB 3.47Å; C117-R121 PolarHBondContact O-N 3.33Å; C117-R121 VanDerWaalsContact O-N 3.11Å; Q118-R121 PolarHBondContact O-N 3.33Å; Y119-R121 VanDerWaalsContact C-N 3.28Å; Y119-R121 PolarHBondContact O-N 3.43Å; R121-K124 PolarHBondContact O-N 3.4Å; R121-C125 PolarHBondContact O-N 3.35Å; R121-C125 PolarHBondContact O-SG 3.28Å |
| 122 | L | 98 | Very high | 95.4 | Very high | 25 Ų | 25 | 73 Ų | 73 | 13% | 0.131 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -67.3 | -44.2 | 178.8 | -176.9 | 62.3 | 0 | 0 | 0 | 111.3 | F88 F89 Y99 Q118 Y119 K124 C125 L126 | F88-L122 HydrophobicContact CE1-CB 3.8Å; F88-L122 HydrophobicContact CE1-CD1 4.25Å; F88-L122 HydrophobicContact CZ-CB 3.92Å; F89-L122 HydrophobicContact CD2-CD1 3.95Å; F89-L122 HydrophobicContact CE2-CD1 4.27Å; Y99-L122 HydrophobicContact CD2-CB 4.13Å; Y99-L122 HydrophobicContact CD2-CD2 3.85Å; Y99-L122 HydrophobicContact CE2-CB 4.33Å; Y99-L122 HydrophobicContact CE2-CD2 4Å; Q118-L122 PolarHBondContact O-N 3.5Å; Y119-L122 PolarHBondContact O-N 2.93Å; L122-K124 VanDerWaalsContact C-N 3.27Å; L122-K124 PolarHBondContact O-N 3.45Å; L122-C125 WeakPolarHBondContact O-CB 3.18Å; L122-C125 PolarHBondContact O-N 3.17Å; L122-L126 HydrophobicContact CG-CD1 4.47Å; L122-L126 PolarHBondContact O-N 3.16Å |
| 123 | K | 96.6 | Very high | 95.3 | Very high | 108 Ų | 108 | 71 Ų | 71 | 47% | 0.47 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -53.2 | -45.8 | 172.7 | -179 | 179.8 | 171.2 | -174.8 | 0 | 111.1 | R105 Y119 L126 A127 | R105-K123 PolarHBondContact O-NZ 3.01Å; Y119-K123 HydrophobicContact CE1-CD 4.01Å; Y119-K123 WeakPolarHBondContact O-CB 3.27Å; Y119-K123 PolarHBondContact O-N 3.44Å; K123-L126 PolarHBondContact O-N 3.4Å; K123-A127 WeakPolarHBondContact O-CB 3.5Å; K123-A127 PolarHBondContact O-N 3.33Å |
| 124 | K | 95.9 | Very high | 95 | Very high | 70 Ų | 70 | 67.9 Ų | 67.9 | 30% | 0.304 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -68.1 | -36 | 176.6 | -165.6 | 174.7 | -177.7 | -171.4 | 0 | 112.9 | V67 V109 C120 R121 L122 A127 M128 | V67-K124 HydrophobicContact CG1-CB 4.4Å; V67-K124 HydrophobicContact CG1-CD 4.44Å; V67-K124 HydrophobicContact CG1-CG 4.35Å; V67-K124 VanDerWaalsContact O-CD 3.23Å; V67-K124 WeakPolarHBondContact O-CD 3.26Å; V67-K124 WeakPolarHBondContact O-CE 3.38Å; V67-K124 PolarHBondContact O-NZ 3.45Å; V109-K124 HydrophobicContact CB-CD 3.74Å; V109-K124 HydrophobicContact CG1-CD 4.33Å; V109-K124 HydrophobicContact CG2-CB 4.35Å; V109-K124 HydrophobicContact CG2-CD 4.03Å; V109-K124 PolarHBondContact O-NZ 3.3Å; C120-K124 VanDerWaalsContact O-CB 3.32Å; C120-K124 WeakPolarHBondContact O-CB 3.4Å; C120-K124 PolarHBondContact O-N 3.3Å; R121-K124 PolarHBondContact O-N 3.4Å; L122-K124 VanDerWaalsContact C-N 3.27Å; L122-K124 PolarHBondContact O-N 3.45Å; K124-A127 PolarHBondContact O-N 3.12Å; K124-M128 HydrophobicContact CG-CG 4.04Å; K124-M128 WeakPolarHBondContact O-CB 3.38Å; K124-M128 WeakPolarHBondContact O-CG 3.39Å; K124-M128 PolarHBondContact O-N 3.07Å |
| 125 | C | 96.8 | Very high | 94.7 | Very high | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.2 | -49.7 | 174.3 | -65.5 | 0 | 0 | 0 | 0 | 111.4 | F89 R121 L122 M128 G129 M130 | F89-C125 HydrophobicContact CD2-CB 3.61Å; F89-C125 HydrophobicContact CE2-CB 4.12Å; R121-C125 PolarHBondContact O-N 3.35Å; R121-C125 PolarHBondContact O-SG 3.28Å; L122-C125 WeakPolarHBondContact O-CB 3.18Å; L122-C125 PolarHBondContact O-N 3.17Å; C125-M128 PolarHBondContact O-N 3.27Å; C125-G129 PolarHBondContact O-N 3.2Å; C125-M130 HydrophobicContact CB-CB 4.31Å; C125-M130 HydrophobicContact CB-CG 4.28Å; C125-M130 HydrophobicContact CB-SD 3.65Å; C125-M130 VanDerWaalsContact O-CB 3.3Å; C125-M130 WeakPolarHBondContact O-CB 3.4Å; C125-M130 PolarHBondContact O-N 3.34Å |
| 126 | L | 95.7 | Very high | 94.1 | Very high | 86 Ų | 86 | 67.2 Ų | 67.2 | 45% | 0.45 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.3 | -45.2 | 177.9 | -65.9 | 167.7 | 0 | 0 | 0 | 111.3 | F89 L122 K123 M128 G129 | F89-L126 HydrophobicContact CE2-CD2 3.76Å; F89-L126 HydrophobicContact CE2-CG 4.26Å; F89-L126 HydrophobicContact CZ-CD2 4.11Å; L122-L126 HydrophobicContact CG-CD1 4.47Å; L122-L126 PolarHBondContact O-N 3.16Å; K123-L126 PolarHBondContact O-N 3.4Å; L126-M128 PolarHBondContact O-N 3.4Å; L126-G129 PolarHBondContact O-N 3.43Å |
| 127 | A | 92.9 | Very high | 93.2 | Very high | 71 Ų | 71 | 60.9 Ų | 60.9 | 59% | 0.587 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -62 | -31 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | K123 K124 G129 | K123-A127 WeakPolarHBondContact O-CB 3.5Å; K123-A127 PolarHBondContact O-N 3.33Å; K124-A127 PolarHBondContact O-N 3.12Å; A127-G129 VanDerWaalsContact C-N 3.26Å; A127-G129 PolarHBondContact O-N 3.08Å |
| 128 | M | 91.4 | Very high | 92.1 | Very high | 58 Ų | 58 | 68.4 Ų | 68.4 | 29% | 0.286 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 16.5 | 176.3 | -57.5 | -67.6 | 94 | 0 | 0 | 113 | V66 V67 A79 K124 C125 L126 | V66-M128 HydrophobicContact CB-CB 4.42Å; V66-M128 HydrophobicContact CG2-CB 3.62Å; V66-M128 HydrophobicContact CG2-CG 4.16Å; V67-M128 HydrophobicContact CG2-CB 4.44Å; A79-M128 VanDerWaalsContact CB-O 3.29Å; A79-M128 WeakPolarHBondContact CB-O 3.3Å; K124-M128 HydrophobicContact CG-CG 4.04Å; K124-M128 WeakPolarHBondContact O-CB 3.38Å; K124-M128 WeakPolarHBondContact O-CG 3.39Å; K124-M128 PolarHBondContact O-N 3.07Å; C125-M128 PolarHBondContact O-N 3.27Å; L126-M128 PolarHBondContact O-N 3.4Å |
| 129 | G | 89.5 | Confident | 91 | Very high | 38 Ų | 38 | 73.5 Ų | 73.5 | 39% | 0.392 | 38% | 0.378 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 88.4 | 16 | 170.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | C125 L126 A127 R131 | C125-G129 PolarHBondContact O-N 3.2Å; L126-G129 PolarHBondContact O-N 3.43Å; A127-G129 VanDerWaalsContact C-N 3.26Å; A127-G129 PolarHBondContact O-N 3.08Å; G129-R131 PolarHBondContact O-N 2.83Å |
| 130 | M | 94.3 | Very high | 89.7 | Confident | 5 Ų | 5 | 79.9 Ų | 79.9 | 3% | 0.025 | 41% | 0.407 | C | S | . | . | trans | -73.1 | 123.2 | 170 | -67.6 | -170.6 | 163.9 | 0 | 0 | 111.4 | V67 Y77 A79 S81 C85 F89 C125 | V67-M130 HydrophobicContact CG2-CE 4.21Å; Y77-M130 CarbonylContact O-C 3.51Å; Y77-M130 VanDerWaalsContact O-CA 3.29Å; Y77-M130 WeakPolarHBondContact O-CA 3.31Å; A79-M130 HydrophobicContact CB-CG 3.98Å; S81-M130 WeakPolarHBondContact OG-CE 3.43Å; C85-M130 HydrophobicContact CB-CE 4.37Å; F89-M130 HydrophobicContact CB-SD 3.79Å; F89-M130 HydrophobicContact CD1-CB 4.27Å; F89-M130 HydrophobicContact CD1-SD 4.32Å; F89-M130 HydrophobicContact CD2-CB 3.78Å; F89-M130 HydrophobicContact CD2-CG 4.42Å; F89-M130 HydrophobicContact CD2-SD 3.76Å; F89-M130 HydrophobicContact CE1-CB 3.98Å; F89-M130 HydrophobicContact CE2-CB 3.45Å; F89-M130 VanDerWaalsContact CE2-CB 3.45Å; F89-M130 HydrophobicContact CE2-SD 4.42Å; F89-M130 HydrophobicContact CG-CB 4.18Å; F89-M130 HydrophobicContact CG-SD 3.7Å; F89-M130 HydrophobicContact CZ-CB 3.56Å; F89-M130 WeakPolarHBondContact CZ-O 3.49Å; C125-M130 HydrophobicContact CB-CB 4.31Å; C125-M130 HydrophobicContact CB-CG 4.28Å; C125-M130 HydrophobicContact CB-SD 3.65Å; C125-M130 VanDerWaalsContact O-CB 3.3Å; C125-M130 WeakPolarHBondContact O-CB 3.4Å; C125-M130 PolarHBondContact O-N 3.34Å | ||
| 131 | R | 92.9 | Very high | 88.3 | Confident | 143 Ų | 143 | 85.3 Ų | 85.3 | 54% | 0.54 | 44% | 0.443 | S | S | . | . | trans | -94 | 120.9 | -173.9 | -73.3 | -179.3 | -176.8 | -83.5 | 2.1 | 111.8 | Y77 F89 G129 E133 S134 | Y77-R131 PolarHBondContact O-N 3.25Å; F89-R131 WeakPolarHBondContact CE1-O 3.47Å; G129-R131 PolarHBondContact O-N 2.83Å; R131-E133 VanDerWaalsContact C-N 3.31Å; R131-E133 VanDerWaalsContact CB-CD 3.45Å; R131-E133 HydrophobicContact CB-CG 4.23Å; R131-E133 WeakPolarHBondContact CB-OE1 3.38Å; R131-E133 WeakPolarHBondContact CB-OE2 3.31Å; R131-E133 VanDerWaalsContact CD-OE1 3.28Å; R131-E133 WeakPolarHBondContact CD-OE1 3.43Å; R131-E133 VanDerWaalsContact CG-OE1 3.24Å; R131-E133 WeakPolarHBondContact CG-OE1 3.35Å; R131-E133 IonicContact NH1-OE1 3.62Å; R131-E133 PolarHBondContact NH1-OE1 3.31Å; R131-E133 VanDerWaalsContact NH1-OE1 3.11Å; R131-S134 WeakPolarHBondContact CB-OG 3.46Å; R131-S134 PolarHBondContact O-N 3.27Å | ||
| 132 | S | 92.5 | Very high | 86.4 | Confident | 55 Ų | 55 | 92.5 Ų | 92.5 | 39% | 0.385 | 48% | 0.48 | S | S | . | . | G | 310 helix | trans | -70.4 | -32.1 | -178.4 | 58.9 | 0 | 0 | 0 | 0 | 111.6 | S134 V135 | S132-S134 PolarHBondContact O-N 2.94Å; S132-V135 WeakPolarHBondContact O-CB 3.19Å; S132-V135 PolarHBondContact O-N 3.45Å; S132-V135 VanDerWaalsContact O-N 3.12Å |
| 133 | E | 91.5 | Very high | 84.4 | Confident | 124 Ų | 124 | 95.7 Ų | 95.7 | 58% | 0.579 | 51% | 0.51 | S | S | * | . | G | 310 helix | trans | -61.7 | -26.3 | 175.4 | 65.4 | -85.3 | -161.8 | 0 | 0 | 113.1 | R131 V135 | R131-E133 VanDerWaalsContact C-N 3.31Å; R131-E133 VanDerWaalsContact CB-CD 3.45Å; R131-E133 HydrophobicContact CB-CG 4.23Å; R131-E133 WeakPolarHBondContact CB-OE1 3.38Å; R131-E133 WeakPolarHBondContact CB-OE2 3.31Å; R131-E133 VanDerWaalsContact CD-OE1 3.28Å; R131-E133 WeakPolarHBondContact CD-OE1 3.43Å; R131-E133 VanDerWaalsContact CG-OE1 3.24Å; R131-E133 WeakPolarHBondContact CG-OE1 3.35Å; R131-E133 IonicContact NH1-OE1 3.62Å; R131-E133 PolarHBondContact NH1-OE1 3.31Å; R131-E133 VanDerWaalsContact NH1-OE1 3.11Å; E133-V135 PolarHBondContact O-N 3.4Å |
| 134 | S | 88.8 | Confident | 81.8 | Confident | 56 Ų | 56 | 98.3 Ų | 98.3 | 39% | 0.392 | 53% | 0.529 | S | S | . | . | G | 310 helix | trans | -76.6 | -4.3 | 177 | -53.3 | 0 | 0 | 0 | 0 | 113.5 | R131 S132 Q136 | R131-S134 WeakPolarHBondContact CB-OG 3.46Å; R131-S134 PolarHBondContact O-N 3.27Å; S132-S134 PolarHBondContact O-N 2.94Å; S134-Q136 PolarHBondContact O-N 3.47Å |
| 135 | V | 89.5 | Confident | 79.3 | Confident | 18 Ų | 18 | 98.4 Ų | 98.4 | 11% | 0.109 | 55% | 0.55 | C | S | . | * | S | Bend | trans | -91.1 | 99.5 | -179.4 | -175.3 | 0 | 0 | 0 | 0 | 110 | Y77 F89 K90 I93 R94 S132 E133 | Y77-V135 HydrophobicContact CD1-CG2 3.7Å; Y77-V135 HydrophobicContact CE1-CB 4.38Å; Y77-V135 HydrophobicContact CE1-CG2 3.72Å; Y77-V135 HydrophobicContact CG-CG2 4.27Å; F89-V135 HydrophobicContact CD1-CG2 3.94Å; F89-V135 HydrophobicContact CE1-CG2 3.73Å; K90-V135 HydrophobicContact CG-CG1 4.26Å; I93-V135 HydrophobicContact CB-CB 4.29Å; I93-V135 HydrophobicContact CB-CG1 4.33Å; I93-V135 HydrophobicContact CB-CG2 4.02Å; I93-V135 HydrophobicContact CG1-CG2 4.21Å; I93-V135 HydrophobicContact CG2-CB 3.87Å; I93-V135 HydrophobicContact CG2-CG1 4.22Å; I93-V135 HydrophobicContact CG2-CG2 3.97Å; R94-V135 HydrophobicContact CG-CG1 3.61Å; S132-V135 WeakPolarHBondContact O-CB 3.19Å; S132-V135 PolarHBondContact O-N 3.45Å; S132-V135 VanDerWaalsContact O-N 3.12Å; E133-V135 PolarHBondContact O-N 3.4Å |
| 136 | Q | 84.8 | Confident | 76.5 | Confident | 133 Ų | 133 | 106.9 Ų | 106.9 | 62% | 0.621 | 60% | 0.595 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 143.6 | 176.5 | -66.1 | 176.5 | -12.9 | 0 | 0 | 112.4 | R94 S134 | R94-Q136 PolarHBondContact NE-O 3.27Å; R94-Q136 PolarHBondContact NH2-O 3.26Å; S134-Q136 PolarHBondContact O-N 3.47Å |
| 137 | A | 77 | Confident | 73.8 | Confident | 89 Ų | 89 | 105.9 Ų | 105.9 | 74% | 0.736 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -61 | 160.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | R139 | A137-R139 PolarHBondContact O-N 3Š|
| 138 | E | 73.4 | Confident | 71.3 | Confident | 174 Ų | 174 | 107.7 Ų | 107.7 | 81% | 0.813 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 131.6 | -177.2 | -168.1 | 155.8 | -142.9 | 0 | 0 | 111.3 | K140 | E138-K140 PolarHBondContact O-N 2.87Š|
| 139 | R | 76.2 | Confident | 68.8 | Low | 212 Ų | 212 | 111 Ų | 111 | 80% | 0.8 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 121 | 169.3 | -68 | -174.6 | -172.2 | -169.1 | 1.4 | 107.2 | A137 | A137-R139 PolarHBondContact O-N 3Š|
| 140 | K | 71.4 | Confident | 66.5 | Low | 196 Ų | 196 | 117 Ų | 117 | 85% | 0.852 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 131.5 | 170.3 | -71.3 | 177.2 | 178.8 | 177.7 | 0 | 108.5 | E138 I142 | E138-K140 PolarHBondContact O-N 2.87Å; K140-I142 PolarHBondContact O-N 2.82Å |
| 141 | P | 67.3 | Low | 63.9 | Low | 122 Ų | 122 | 123 Ų | 123 | 79% | 0.792 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 133.4 | 173.1 | -19.4 | 30.5 | 0 | 0 | 0 | 109.9 | A143 | P141-A143 PolarHBondContact O-N 2.88Š|
| 142 | I | 58.6 | Low | 61.3 | Low | 159 Ų | 159 | 122.4 Ų | 122.4 | 82% | 0.815 | 71% | 0.71 | S | S | * | * | trans | -68.3 | 103.9 | 170.1 | -61.9 | 166 | 0 | 0 | 0 | 106.2 | K140 N144 | K140-I142 PolarHBondContact O-N 2.82Å; I142-N144 PolarHBondContact O-N 3.06Å | ||
| 143 | A | 56 | Low | 58.8 | Low | 92 Ų | 92 | 125.5 Ų | 125.5 | 76% | 0.76 | 73% | 0.727 | S | S | * | * | trans | -73.6 | 110.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | P141 G145 | P141-A143 PolarHBondContact O-N 2.88Å; A143-G145 PolarHBondContact O-N 3.25Å; A143-G145 VanDerWaalsContact O-N 3.15Å | ||
| 144 | N | 41 | Very low | 56.4 | Low | 163 Ų | 163 | 125.1 Ų | 125.1 | 87% | 0.872 | 74% | 0.735 | S | S | * | * | trans | -64.4 | 106.2 | 162.9 | -79.4 | 2.2 | 0 | 0 | 0 | 108.1 | I142 | I142-N144 PolarHBondContact O-N 3.06Š| ||
| 145 | G | 43.3 | Very low | 54 | Low | 73 Ų | 73 | 126.9 Ų | 126.9 | 75% | 0.753 | 75% | 0.747 | S | S | * | * | trans | -157.8 | 108.2 | 176 | 0 | 0 | 0 | 0 | 0 | 110.9 | A143 | A143-G145 PolarHBondContact O-N 3.25Å; A143-G145 VanDerWaalsContact O-N 3.15Å | ||
| 146 | N | 39.8 | Very low | 51.3 | Low | 177 Ų | 177 | 131.5 Ų | 131.5 | 95% | 0.947 | 78% | 0.781 | S | S | * | * | trans | -51.2 | 147.2 | 172.8 | -84.5 | -10.4 | 0 | 0 | 0 | 113.3 | ||||
| 147 | G | 37.9 | Very low | 49.1 | Very low | 65 Ų | 65 | 132.9 Ų | 132.9 | 67% | 0.67 | 79% | 0.791 | S | S | * | * | trans | 116.9 | 94 | 144.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 148 | S | 41.3 | Very low | 47.1 | Very low | 110 Ų | 110 | 135.7 Ų | 135.7 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | 52.6 | 127.3 | 131.3 | 43.6 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 149 | T | 37.8 | Very low | 45.2 | Very low | 126 Ų | 126 | 135.4 Ų | 135.4 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | 68.9 | 95.8 | 153.3 | 62.3 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 150 | D | 41.6 | Very low | 43.3 | Very low | 165 Ų | 165 | 131.8 Ų | 131.8 | 88% | 0.882 | 79% | 0.79 | S | S | * | * | -171.4 | 139.9 | 96.4 | -108.9 | -27.6 | 0 | 0 | 0 | 113 | |||||
| 151 | V | 39.3 | Very low | 41.3 | Very low | 132 Ų | 132 | 128.3 Ų | 128.3 | 80% | 0.8 | 79% | 0.787 | S | S | * | * | trans | -76.7 | 114.8 | 178.6 | 172.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 152 | T | 39 | Very low | 39.7 | Very low | 130 Ų | 130 | 127.4 Ų | 127.4 | 80% | 0.798 | 79% | 0.79 | S | S | * | * | trans | -164.4 | 111 | 148.9 | -61.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 153 | T | 39.2 | Very low | 38.6 | Very low | 120 Ų | 120 | 124.5 Ų | 124.5 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | trans | -57.3 | 145.3 | 163.2 | -0.5 | 0 | 0 | 0 | 0 | 111 | ||||
| 154 | P | 40.8 | Very low | 37.6 | Very low | 115 Ų | 115 | 125.8 Ų | 125.8 | 75% | 0.747 | 79% | 0.794 | S | S | * | * | -139.2 | 116 | 117 | 25.7 | -7.5 | 0 | 0 | 0 | 110.9 | |||||
| 155 | S | 39 | Very low | 37.6 | Very low | 93 Ų | 93 | 124.9 Ų | 124.9 | 65% | 0.65 | 79% | 0.794 | S | S | * | * | 79.3 | 100.3 | 86.5 | -63.3 | 0 | 0 | 0 | 0 | 112.2 | I157 | S155-I157 PolarHBondContact O-N 3.22Š| |||
| 156 | S | 33.1 | Very low | 37.2 | Very low | 116 Ų | 116 | 125 Ų | 125 | 81% | 0.811 | 80% | 0.795 | S | S | * | * | trans | -20.1 | 114 | 148.7 | -40.2 | 0 | 0 | 0 | 0 | 113.1 | M158 | S156-M158 VanDerWaalsContact C-N 3.3Å; S156-M158 PolarHBondContact O-N 3.39Å; S156-M158 VanDerWaalsContact O-N 3.12Å | ||
| 157 | I | 38 | Very low | 37 | Very low | 161 Ų | 161 | 120 Ų | 120 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | trans | -81.7 | 89.2 | 162.4 | -57.9 | 177.8 | 0 | 0 | 0 | 106.4 | S155 | S155-I157 PolarHBondContact O-N 3.22Š| ||
| 158 | M | 34.3 | Very low | 37.1 | Very low | 148 Ų | 148 | 122.8 Ų | 122.8 | 73% | 0.729 | 80% | 0.795 | S | S | * | * | trans | -69.8 | 127.7 | 153 | -70.1 | -165.1 | 86.2 | 0 | 0 | 108 | S156 N160 | S156-M158 VanDerWaalsContact C-N 3.3Å; S156-M158 PolarHBondContact O-N 3.39Å; S156-M158 VanDerWaalsContact O-N 3.12Å; M158-N160 PolarHBondContact O-N 2.74Å | ||
| 159 | L | 35.4 | Very low | 36.5 | Very low | 169 Ų | 169 | 126.9 Ų | 126.9 | 89% | 0.885 | 80% | 0.799 | S | S | * | * | trans | -89.9 | 91.1 | 159.8 | -82.4 | 156.2 | 0 | 0 | 0 | 107 | ||||
| 160 | N | 34.4 | Very low | 36.4 | Very low | 135 Ų | 135 | 126.4 Ų | 126.4 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | trans | -101.7 | 133.1 | 163.8 | -113.1 | 19.3 | 0 | 0 | 0 | 108.4 | M158 | M158-N160 PolarHBondContact O-N 2.74Š| ||
| 161 | P | 30.9 | Very low | 35.9 | Very low | 123 Ų | 123 | 125.4 Ų | 125.4 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | trans | -92.1 | 111.1 | 175.1 | 32.9 | -25.7 | 0 | 0 | 0 | 109.9 | ||||
| 162 | A | 33.3 | Very low | 35.6 | Very low | 103 Ų | 103 | 126 Ų | 126 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | trans | -176.5 | 109.1 | 154.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 163 | A | 36.2 | Very low | 35.5 | Very low | 99 Ų | 99 | 123.7 Ų | 123.7 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -125 | 101.7 | 159.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 164 | S | 34.3 | Very low | 35.3 | Very low | 119 Ų | 119 | 125.3 Ų | 125.3 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -68.9 | 125.2 | 163.8 | 51.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 165 | V | 41.5 | Very low | 34.8 | Very low | 143 Ų | 143 | 127.8 Ų | 127.8 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | trans | -114.5 | 117.4 | 159.1 | 177.3 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 166 | G | 34.7 | Very low | 34.6 | Very low | 76 Ų | 76 | 131 Ų | 131 | 78% | 0.784 | 79% | 0.791 | S | S | * | * | trans | -82.5 | 156.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 167 | G | 35 | Very low | 34.6 | Very low | 71 Ų | 71 | 131.4 Ų | 131.4 | 73% | 0.732 | 79% | 0.788 | S | S | * | * | trans | 175.2 | 84.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 168 | S | 39.2 | Very low | 34.2 | Very low | 125 Ų | 125 | 129 Ų | 129 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | 52 | 117.6 | 144.7 | -50.8 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 169 | F | 28.9 | Very low | 34.1 | Very low | 195 Ų | 195 | 127 Ų | 127 | 86% | 0.855 | 78% | 0.784 | S | S | * | * | trans | -62 | 174.1 | 160.6 | -71.3 | -78.3 | 0 | 0 | 0 | 113.9 | ||||
| 170 | P | 37.4 | Very low | 34 | Very low | 117 Ų | 117 | 126.9 Ų | 126.9 | 76% | 0.76 | 78% | 0.779 | S | S | * | * | cis | -145.6 | 164.8 | 24.8 | 38.7 | -16.3 | 0 | 0 | 0 | 120.6 | ||||
| 171 | N | 29.9 | Very low | 34 | Very low | 144 Ų | 144 | 127.1 Ų | 127.1 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | 24.8 | 129.3 | 149.3 | -74.4 | -0.4 | 0 | 0 | 0 | 121.2 | ||||
| 172 | N | 34.1 | Very low | 33.9 | Very low | 145 Ų | 145 | 129 Ų | 129 | 78% | 0.775 | 79% | 0.789 | S | S | * | * | -174.2 | 145.3 | 86.7 | -130 | 7 | 0 | 0 | 0 | 113.7 | |||||
| 173 | S | 36.2 | Very low | 33.7 | Very low | 81 Ų | 81 | 135.8 Ų | 135.8 | 57% | 0.566 | 79% | 0.792 | S | S | * | * | trans | 66.9 | 120 | 148.1 | 39.4 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 174 | D | 34.2 | Very low | 33.4 | Very low | 153 Ų | 153 | 135.9 Ų | 135.9 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | 72.6 | 133.5 | 140.9 | -44.5 | -26.2 | 0 | 0 | 0 | 116.9 | ||||
| 175 | E | 31.4 | Very low | 33.2 | Very low | 168 Ų | 168 | 138.9 Ų | 138.9 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | cis | -171 | 153.5 | 18.1 | -176.3 | 161.7 | 108.9 | 0 | 0 | 108 | ||||
| 176 | E | 33.5 | Very low | 32.6 | Very low | 159 Ų | 159 | 137.5 Ų | 137.5 | 74% | 0.743 | 80% | 0.795 | S | S | * | * | trans | 76.1 | 105.7 | 159 | -83.1 | -170.5 | 161.9 | 0 | 0 | 125.5 | ||||
| 177 | T | 32.9 | Very low | 32.3 | Very low | 125 Ų | 125 | 141.6 Ų | 141.6 | 77% | 0.767 | 80% | 0.798 | S | S | * | * | trans | 79.2 | 123.3 | 132.2 | 49.5 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 178 | P | 31.4 | Very low | 32 | Very low | 110 Ų | 110 | 143.4 Ų | 143.4 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | trans | -114.9 | 161.6 | -176.7 | 41.9 | -31.5 | 0 | 0 | 0 | 114.9 | ||||
| 179 | S | 32 | Very low | 31.7 | Very low | 108 Ų | 108 | 143.1 Ų | 143.1 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | trans | 169.8 | 114.3 | 134.4 | 45 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 180 | H | 32.1 | Very low | 31.8 | Very low | 165 Ų | 165 | 142 Ų | 142 | 76% | 0.764 | 80% | 0.802 | S | S | * | * | 60.7 | 105 | 92.3 | -65.8 | -74.1 | 0 | 0 | 0 | 114.6 | |||||
| 181 | T | 34.2 | Very low | 31.5 | Very low | 141 Ų | 141 | 141 Ų | 141 | 87% | 0.865 | 80% | 0.803 | S | S | * | * | 174.3 | 102.7 | 108.9 | 34.7 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 182 | N | 30.1 | Very low | 31.6 | Very low | 162 Ų | 162 | 142.3 Ų | 142.3 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | trans | -85.2 | 144.1 | 144.3 | -84.3 | -58.1 | 0 | 0 | 0 | 107.2 | ||||
| 183 | R | 28.8 | Very low | 31.3 | Very low | 246 Ų | 246 | 142.2 Ų | 142.2 | 93% | 0.928 | 81% | 0.814 | S | S | * | * | trans | 97.6 | 80.9 | 174.6 | -61.3 | 177.3 | 165.4 | 153.3 | -3.3 | 116.6 | ||||
| 184 | A | 28.8 | Very low | 30.9 | Very low | 100 Ų | 100 | 142.9 Ų | 142.9 | 83% | 0.826 | 83% | 0.825 | S | S | * | * | trans | -161.5 | 70.2 | 151.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 185 | L | 30.6 | Very low | 30.6 | Very low | 183 Ų | 183 | 141 Ų | 141 | 96% | 0.958 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -141.9 | 25 | 175.4 | -102.5 | 167.9 | 0 | 0 | 0 | 113.5 | ||
| 186 | S | 29.2 | Very low | 30.5 | Very low | 113 Ų | 113 | 139 Ų | 139 | 79% | 0.79 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -133.5 | 20.8 | -174.8 | -163.5 | 0 | 0 | 0 | 0 | 116 | ||
| 187 | L | 29.3 | Very low | 30.1 | Very low | 162 Ų | 162 | 137.8 Ų | 137.8 | 85% | 0.848 | 83% | 0.834 | S | S | * | * | trans | -133.9 | 13.4 | -177 | -73.5 | 172.9 | 0 | 0 | 0 | 116.3 | S189 | L187-S189 PolarHBondContact O-N 2.89Š| ||
| 188 | A | 28.5 | Very low | 29.9 | Very low | 110 Ų | 110 | 136.2 Ų | 136.2 | 91% | 0.909 | 83% | 0.834 | S | S | * | * | trans | -93.4 | 16.3 | -177 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 189 | S | 32.8 | Very low | 29.9 | Very low | 118 Ų | 118 | 136.2 Ų | 136.2 | 83% | 0.825 | 84% | 0.837 | S | S | * | * | S | Bend | trans | -107.1 | 2.3 | -171.6 | -168.8 | 0 | 0 | 0 | 0 | 115.9 | L187 | L187-S189 PolarHBondContact O-N 2.89Š|
| 190 | E | 31.4 | Very low | 29.7 | Very low | 172 Ų | 172 | 136.8 Ų | 136.8 | 80% | 0.804 | 84% | 0.841 | S | S | * | * | S | Bend | trans | -125.3 | 6 | -168.6 | -71.2 | -177.9 | 155.1 | 0 | 0 | 116.2 | ||
| 191 | A | 30.1 | Very low | 29.6 | Very low | 96 Ų | 96 | 133.6 Ų | 133.6 | 79% | 0.793 | 84% | 0.837 | S | S | * | * | S | Bend | trans | -106.8 | -0.9 | -168.4 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 192 | L | 31.3 | Very low | 29.3 | Very low | 172 Ų | 172 | 136 Ų | 136 | 90% | 0.901 | 84% | 0.836 | S | S | * | * | S | Bend | trans | -102.8 | 5.1 | -169.6 | -81 | 161.5 | 0 | 0 | 0 | 116.3 | ||
| 193 | T | 28.5 | Very low | 29.4 | Very low | 142 Ų | 142 | 137 Ų | 137 | 87% | 0.871 | 84% | 0.84 | S | S | * | * | S | Bend | trans | -96.2 | 16 | -175.5 | 23.3 | 0 | 0 | 0 | 0 | 116 | ||
| 194 | A | 28 | Very low | 29.2 | Very low | 96 Ų | 96 | 133.1 Ų | 133.1 | 79% | 0.793 | 84% | 0.837 | S | S | * | * | S | Bend | trans | -130 | -1.9 | -169.3 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||
| 195 | S | 27.9 | Very low | 29.3 | Very low | 112 Ų | 112 | 132.2 Ų | 132.2 | 78% | 0.783 | 84% | 0.838 | S | S | * | * | trans | -113.6 | -1.9 | -157.3 | -158.1 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 196 | C | 28.4 | Very low | 29.1 | Very low | 127 Ų | 127 | 129.1 Ų | 129.1 | 86% | 0.858 | 83% | 0.832 | S | S | * | * | trans | -131 | 61.8 | -171.7 | -60.3 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 197 | C | 25.3 | Very low | 29.2 | Very low | 133 Ų | 133 | 128.5 Ų | 128.5 | 90% | 0.899 | 83% | 0.833 | S | S | * | * | trans | -117.2 | 95.1 | 156.8 | -72.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 198 | A | 28.7 | Very low | 29.1 | Very low | 92 Ų | 92 | 127.9 Ų | 127.9 | 76% | 0.76 | 83% | 0.831 | S | S | * | * | trans | -174 | 134.5 | 157.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 199 | S | 31.7 | Very low | 29.1 | Very low | 110 Ų | 110 | 127.2 Ų | 127.2 | 77% | 0.769 | 82% | 0.82 | S | S | * | * | trans | 92.4 | 94 | 160.2 | -38.4 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 200 | S | 28.8 | Very low | 29.1 | Very low | 121 Ų | 121 | 128.6 Ų | 128.6 | 85% | 0.846 | 82% | 0.823 | S | S | * | * | 58.5 | 134.4 | 78 | -66.1 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 201 | S | 28.9 | Very low | 29 | Very low | 98 Ų | 98 | 129.1 Ų | 129.1 | 69% | 0.685 | 83% | 0.825 | S | S | * | * | cis | 177.6 | 148.9 | -0.2 | 45.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 202 | K | 27.7 | Very low | 28.9 | Very low | 192 Ų | 192 | 128 Ų | 128 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | trans | 69.8 | 124.7 | 155.5 | -68.4 | 176.1 | 177.6 | 178.4 | 0 | 120.3 | ||||
| 203 | L | 31.9 | Very low | 28.8 | Very low | 181 Ų | 181 | 125.6 Ų | 125.6 | 95% | 0.948 | 82% | 0.821 | S | S | * | * | -166.3 | 130.1 | 119.8 | -94 | 168.1 | 0 | 0 | 0 | 110.2 | |||||
| 204 | D | 25.7 | Very low | 29 | Very low | 165 Ų | 165 | 126.2 Ų | 126.2 | 88% | 0.882 | 82% | 0.818 | S | S | * | * | trans | -82.5 | 159 | -177.2 | -68.2 | -56 | 0 | 0 | 0 | 113.4 | ||||
| 205 | G | 29.7 | Very low | 29.1 | Very low | 82 Ų | 82 | 128.5 Ų | 128.5 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | 168.1 | 96 | 164.7 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 206 | S | 26.9 | Very low | 29.3 | Very low | 117 Ų | 117 | 128.2 Ų | 128.2 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -71.3 | 142.6 | -179.8 | 152.5 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 207 | A | 31.5 | Very low | 29.5 | Very low | 100 Ų | 100 | 124.9 Ų | 124.9 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | trans | -174.2 | 138.4 | 131 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 208 | N | 28 | Very low | 29.9 | Very low | 149 Ų | 149 | 124.8 Ų | 124.8 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | trans | -93 | 154.9 | -169.5 | -73.5 | -49.3 | 0 | 0 | 0 | 114.7 | ||||
| 209 | S | 28.4 | Very low | 30.2 | Very low | 96 Ų | 96 | 127.5 Ų | 127.5 | 67% | 0.671 | 80% | 0.796 | S | S | * | * | trans | 61.1 | 111.8 | 130.1 | -180 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 210 | V | 31.7 | Very low | 30.3 | Very low | 147 Ų | 147 | 126.3 Ų | 126.3 | 89% | 0.891 | 79% | 0.792 | S | S | * | * | -145 | 117.7 | 126.6 | -174.7 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 211 | Q | 29.1 | Very low | 30.6 | Very low | 183 Ų | 183 | 127.3 Ų | 127.3 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | trans | -65.7 | 151.7 | 167.5 | -75 | 162.9 | -87.4 | 0 | 0 | 111.9 | ||||
| 212 | G | 27.7 | Very low | 30.7 | Very low | 74 Ų | 74 | 128.4 Ų | 128.4 | 76% | 0.763 | 79% | 0.786 | S | S | * | * | trans | 144.5 | 112.6 | 141.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 213 | S | 30 | Very low | 31 | Very low | 121 Ų | 121 | 129.6 Ų | 129.6 | 85% | 0.846 | 79% | 0.785 | S | S | * | * | trans | 80.8 | 75.4 | 145.5 | -164.4 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 214 | L | 31.9 | Very low | 31 | Very low | 155 Ų | 155 | 130.1 Ų | 130.1 | 81% | 0.812 | 78% | 0.78 | S | S | * | * | trans | -158.9 | 34.9 | 147.2 | -152.6 | 65.6 | 0 | 0 | 0 | 114.6 | ||||
| 215 | M | 31.2 | Very low | 31.3 | Very low | 144 Ų | 144 | 126 Ų | 126 | 71% | 0.709 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -111.6 | 7.6 | -177.1 | -88.4 | -68.1 | -131.8 | 0 | 0 | 115 | ||
| 216 | A | 32.7 | Very low | 31.6 | Very low | 106 Ų | 106 | 127.7 Ų | 127.7 | 88% | 0.876 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -97 | -6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 217 | G | 32.9 | Very low | 31.9 | Very low | 57 Ų | 57 | 128.8 Ų | 128.8 | 59% | 0.588 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -100.8 | -20.2 | -172 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 218 | I | 33.5 | Very low | 32 | Very low | 130 Ų | 130 | 132.3 Ų | 132.3 | 67% | 0.667 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -101.1 | -8.6 | -163.4 | -62.2 | 178.5 | 0 | 0 | 0 | 113.1 | A220 | I218-A220 VanDerWaalsContact C-N 3.3Å; I218-A220 PolarHBondContact O-N 2.95Å |
| 219 | L | 34.2 | Very low | 32.1 | Very low | 150 Ų | 150 | 130 Ų | 130 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -80 | -0.8 | 177.9 | -83 | 157.2 | 0 | 0 | 0 | 115 | ||
| 220 | A | 34.6 | Very low | 32.3 | Very low | 84 Ų | 84 | 134.6 Ų | 134.6 | 69% | 0.694 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -96 | -12.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115 | I218 | I218-A220 VanDerWaalsContact C-N 3.3Å; I218-A220 PolarHBondContact O-N 2.95Å |
| 221 | L | 33.9 | Very low | 32.3 | Very low | 142 Ų | 142 | 136.2 Ų | 136.2 | 74% | 0.743 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -96.5 | -18.3 | -172.8 | -74.2 | 161.5 | 0 | 0 | 0 | 114.3 | R223 | L221-R223 VanDerWaalsContact C-N 3.31Å; L221-R223 PolarHBondContact O-N 3.43Å |
| 222 | N | 32.2 | Very low | 32.4 | Very low | 121 Ų | 121 | 138.9 Ų | 138.9 | 65% | 0.647 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | 5.2 | -173.5 | -149.4 | 11.5 | 0 | 0 | 0 | 114.9 | ||
| 223 | R | 33.6 | Very low | 32.4 | Very low | 217 Ų | 217 | 141 Ų | 141 | 82% | 0.819 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | -6.1 | 176.6 | -79.1 | -173.3 | -172.1 | -175.7 | 3.5 | 114.7 | L221 | L221-R223 VanDerWaalsContact C-N 3.31Å; L221-R223 PolarHBondContact O-N 3.43Å |
| 224 | K | 32.5 | Very low | 32.5 | Very low | 192 Ų | 192 | 141.1 Ų | 141.1 | 84% | 0.835 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -100.3 | -14 | -178.4 | -89.6 | 179.8 | 174.9 | 179.9 | 0 | 115.2 | T226 | K224-T226 PolarHBondContact O-N 3.33Š|
| 225 | A | 32 | Very low | 32.4 | Very low | 79 Ų | 79 | 139.8 Ų | 139.8 | 65% | 0.653 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -81.9 | -8.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 226 | T | 35.3 | Very low | 32.4 | Very low | 118 Ų | 118 | 136.2 Ų | 136.2 | 72% | 0.724 | 78% | 0.779 | S | S | * | * | G | 310 helix | trans | -95 | 8.8 | -174.6 | 33.3 | 0 | 0 | 0 | 0 | 115.4 | K224 | K224-T226 PolarHBondContact O-N 3.33Š|
| 227 | N | 33.1 | Very low | 32.2 | Very low | 139 Ų | 139 | 139.3 Ų | 139.3 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -111.1 | 9 | 180 | -81.2 | -57.5 | 0 | 0 | 0 | 115.5 | ||
| 228 | L | 32.9 | Very low | 32 | Very low | 174 Ų | 174 | 141.4 Ų | 141.4 | 91% | 0.911 | 78% | 0.783 | S | S | * | * | trans | -109.8 | 54 | -175.6 | -135.3 | 76.6 | 0 | 0 | 0 | 112.9 | ||||
| 229 | A | 31.9 | Very low | 31.7 | Very low | 100 Ų | 100 | 140.9 Ų | 140.9 | 83% | 0.826 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -137.3 | 19.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 230 | K | 31.7 | Very low | 31.4 | Very low | 194 Ų | 194 | 143.5 Ų | 143.5 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | -134.8 | 66.8 | 179.3 | -83.4 | -177.1 | 176.2 | 174.6 | 0 | 112.3 | ||||
| 231 | L | 31.8 | Very low | 31.2 | Very low | 181 Ų | 181 | 144 Ų | 144 | 95% | 0.948 | 79% | 0.793 | S | S | * | * | trans | -146 | 123 | 155 | -74.8 | 179.8 | 0 | 0 | 0 | 110.1 | ||||
| 232 | R | 30.3 | Very low | 31 | Very low | 239 Ų | 239 | 146.6 Ų | 146.6 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 145.3 | 178.7 | -177.6 | -179.4 | -169.9 | 164.1 | 1.5 | 109.3 | ||
| 233 | P | 29.1 | Very low | 30.7 | Very low | 118 Ų | 118 | 148.7 Ų | 148.7 | 77% | 0.766 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 145.2 | -175.3 | 34.5 | -31.5 | 0 | 0 | 0 | 111.7 | ||
| 234 | P | 32.3 | Very low | 30.4 | Very low | 124 Ų | 124 | 143.8 Ų | 143.8 | 81% | 0.805 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -99.9 | 144.2 | 153.9 | 32.2 | -20.4 | 0 | 0 | 0 | 111.1 | ||
| 235 | S | 29.4 | Very low | 30.2 | Very low | 127 Ų | 127 | 141.9 Ų | 141.9 | 89% | 0.888 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 146.1 | 177.3 | 41.2 | 0 | 0 | 0 | 0 | 116 | ||
| 236 | G | 30.2 | Very low | 30.1 | Very low | 68 Ų | 68 | 147.5 Ų | 147.5 | 70% | 0.701 | 81% | 0.814 | S | S | * | * | trans | 140.7 | 116.2 | 148 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 237 | L | 28.8 | Very low | 29.9 | Very low | 172 Ų | 172 | 148.4 Ų | 148.4 | 90% | 0.901 | 82% | 0.819 | S | S | * | * | trans | 85.3 | 149.9 | 144.3 | -75.4 | 153.7 | 0 | 0 | 0 | 119.6 | ||||
| 238 | P | 28.9 | Very low | 29.6 | Very low | 100 Ų | 100 | 148 Ų | 148 | 65% | 0.649 | 82% | 0.822 | S | S | * | * | -132 | -155.8 | -112.3 | 48.1 | -29.8 | 0 | 0 | 0 | 113.2 | |||||
| 239 | P | 27.2 | Very low | 29.6 | Very low | 120 Ų | 120 | 149.1 Ų | 149.1 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -83.9 | 143.9 | -132.9 | 37.1 | -20.3 | 0 | 0 | 0 | 114.4 | ||||
| 240 | F | 29.2 | Very low | 29.5 | Very low | 205 Ų | 205 | 149.9 Ų | 149.9 | 90% | 0.899 | 81% | 0.814 | S | S | * | * | trans | -113.4 | 125.4 | 167.8 | -93.9 | -86.2 | 0 | 0 | 0 | 112.5 | ||||
| 241 | S | 29.2 | Very low | 29.7 | Very low | 95 Ų | 95 | 148.7 Ų | 148.7 | 66% | 0.664 | 81% | 0.811 | S | S | * | * | trans | -71.4 | 150.4 | 179 | 42.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 242 | K | 28.9 | Very low | 29.8 | Very low | 196 Ų | 196 | 147 Ų | 147 | 85% | 0.852 | 80% | 0.804 | S | S | * | * | trans | 55.3 | 108.1 | 148.9 | -68.5 | 179.4 | 178.2 | 177.3 | 0 | 117.7 | ||||
| 243 | L | 26.4 | Very low | 30.2 | Very low | 164 Ų | 164 | 141.6 Ų | 141.6 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -117.9 | 106.2 | 146.8 | -119.4 | 84.4 | 0 | 0 | 0 | 108.9 | ||||
| 244 | S | 27.1 | Very low | 30.6 | Very low | 115 Ų | 115 | 145.3 Ų | 145.3 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | -85.6 | 121.7 | 159.9 | -71.5 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 245 | I | 28.9 | Very low | 30.7 | Very low | 151 Ų | 151 | 144.8 Ų | 144.8 | 77% | 0.774 | 81% | 0.806 | S | S | * | * | trans | -95.3 | 111.7 | 169.4 | -64.5 | 175.3 | 0 | 0 | 0 | 107.3 | ||||
| 246 | K | 30.7 | Very low | 31 | Very low | 198 Ų | 198 | 143.9 Ų | 143.9 | 86% | 0.861 | 80% | 0.8 | S | S | * | * | trans | -109.1 | 125.3 | 170.1 | -157.1 | 172.9 | -176.1 | -178.3 | 0 | 107.4 | ||||
| 247 | V | 31 | Very low | 31.3 | Very low | 136 Ų | 136 | 149.3 Ų | 149.3 | 82% | 0.824 | 81% | 0.807 | S | S | * | * | trans | -61.4 | 134.5 | -177.7 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 248 | T | 26.7 | Very low | 31.7 | Very low | 132 Ų | 132 | 149.5 Ų | 149.5 | 81% | 0.81 | 80% | 0.803 | S | S | * | * | trans | -81.3 | 142.7 | -178.9 | 41.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 249 | K | 32.9 | Very low | 32.1 | Very low | 197 Ų | 197 | 151.5 Ų | 151.5 | 86% | 0.857 | 81% | 0.808 | S | S | * | * | trans | -130.3 | 109.7 | 150.5 | -121.5 | -176.1 | -179.7 | -179.7 | 0 | 107.4 | ||||
| 250 | T | 29.4 | Very low | 32.8 | Very low | 115 Ų | 115 | 149.9 Ų | 149.9 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | trans | 42.9 | 137.6 | 144.3 | 28.9 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 251 | E | 36.5 | Very low | 33.1 | Very low | 169 Ų | 169 | 148.2 Ų | 148.2 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | trans | 101.6 | 92.3 | 151.4 | -68.7 | 166.4 | -174.3 | 0 | 0 | 118.7 | ||||
| 252 | D | 33.3 | Very low | 33.5 | Very low | 147 Ų | 147 | 152.3 Ų | 152.3 | 79% | 0.786 | 80% | 0.801 | S | S | * | * | 64.7 | 119.7 | 122.6 | -57.1 | -23.5 | 0 | 0 | 0 | 122.9 | |||||
| 253 | S | 38.3 | Very low | 33.9 | Very low | 125 Ų | 125 | 148.4 Ų | 148.4 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | 116.8 | 130.7 | 139.6 | -51.6 | 0 | 0 | 0 | 0 | 117 | ||||
| 254 | E | 36.9 | Very low | 34.5 | Very low | 195 Ų | 195 | 145.2 Ų | 145.2 | 91% | 0.911 | 78% | 0.784 | S | S | * | * | trans | -76.4 | 171.4 | -157.7 | -90.1 | -163.8 | 113.9 | 0 | 0 | 118.3 | ||||
| 255 | P | 35.2 | Very low | 35.1 | Very low | 113 Ų | 113 | 144.5 Ų | 144.5 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -117.6 | 174.7 | -156.7 | 42.5 | -29.8 | 0 | 0 | 0 | 115.7 | ||||
| 256 | S | 36.2 | Very low | 35.8 | Very low | 109 Ų | 109 | 143.8 Ų | 143.8 | 76% | 0.762 | 78% | 0.777 | S | S | * | * | trans | -169 | 103.3 | 155.9 | 55.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 257 | E | 35.3 | Very low | 36.3 | Very low | 181 Ų | 181 | 141.5 Ų | 141.5 | 85% | 0.846 | 77% | 0.774 | S | S | * | * | 73.6 | 139.9 | 86.9 | -78.5 | -154.5 | 142.4 | 0 | 0 | 116.5 | |||||
| 258 | Q | 37.1 | Very low | 36.5 | Very low | 177 Ų | 177 | 138.1 Ų | 138.1 | 83% | 0.827 | 77% | 0.767 | S | S | * | * | trans | 89.1 | 137.5 | 168.6 | -60.7 | 178.3 | 3.3 | 0 | 0 | 117.7 | ||||
| 259 | D | 37.8 | Very low | 37.2 | Very low | 142 Ų | 142 | 141 Ų | 141 | 76% | 0.759 | 77% | 0.77 | S | S | * | * | cis | -174 | 161.1 | -20.3 | -146.2 | -32.2 | 0 | 0 | 0 | 106.5 | ||||
| 260 | S | 41.5 | Very low | 37.6 | Very low | 85 Ų | 85 | 136.8 Ų | 136.8 | 59% | 0.594 | 77% | 0.766 | S | S | * | * | trans | 80.9 | 101.5 | 147.4 | -56.1 | 0 | 0 | 0 | 0 | 123 | ||||
| 261 | E | 36.6 | Very low | 38.5 | Very low | 171 Ų | 171 | 136.8 Ų | 136.8 | 80% | 0.799 | 77% | 0.768 | S | S | * | * | 75 | 139.1 | 110.3 | -72.5 | -162 | 120.5 | 0 | 0 | 125 | |||||
| 262 | K | 37.1 | Very low | 38.6 | Very low | 181 Ų | 181 | 140.7 Ų | 140.7 | 79% | 0.787 | 78% | 0.776 | S | S | * | * | trans | 80.4 | 146.2 | 147.4 | -84.6 | -168.7 | 174.2 | -168 | 0 | 119.6 | ||||
| 263 | V | 37.2 | Very low | 38.9 | Very low | 114 Ų | 114 | 137.6 Ų | 137.6 | 69% | 0.691 | 78% | 0.778 | S | S | * | * | cis | -179.7 | 159.1 | -17.5 | 123.7 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 264 | S | 39.5 | Very low | 39.1 | Very low | 96 Ų | 96 | 137.1 Ų | 137.1 | 67% | 0.671 | 78% | 0.775 | S | S | * | * | trans | 76.3 | 120 | 154 | 54.3 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 265 | S | 39.5 | Very low | 39.3 | Very low | 100 Ų | 100 | 133.8 Ų | 133.8 | 70% | 0.699 | 77% | 0.773 | S | S | * | * | 29.1 | 143.1 | 125 | 50.9 | 0 | 0 | 0 | 0 | 119.5 | |||||
| 266 | D | 42.4 | Very low | 39.5 | Very low | 137 Ų | 137 | 133.5 Ų | 133.5 | 73% | 0.733 | 77% | 0.773 | S | S | * | * | -173 | 164.7 | 58.2 | -131.5 | -21 | 0 | 0 | 0 | 113.6 | |||||
| 267 | D | 41.6 | Very low | 39.8 | Very low | 150 Ų | 150 | 133.5 Ų | 133.5 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | trans | 1 | 142.2 | 163.2 | -68.5 | -41.6 | 0 | 0 | 0 | 124.9 | ||||
| 268 | G | 35.8 | Very low | 40.2 | Very low | 64 Ų | 64 | 131.9 Ų | 131.9 | 66% | 0.66 | 78% | 0.776 | S | S | * | * | 120.7 | 132.7 | 112.2 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 269 | H | 41.1 | Very low | 40.3 | Very low | 192 Ų | 192 | 127.2 Ų | 127.2 | 89% | 0.889 | 78% | 0.776 | S | S | * | * | trans | 94 | 110.2 | 149.8 | -72.4 | 69.1 | 0 | 0 | 0 | 121.4 | ||||
| 270 | S | 41.5 | Very low | 40.4 | Very low | 110 Ų | 110 | 124.5 Ų | 124.5 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | -77.5 | 165.6 | 147.1 | -65.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 271 | P | 47.2 | Very low | 40.1 | Very low | 114 Ų | 114 | 124.7 Ų | 124.7 | 74% | 0.74 | 80% | 0.796 | S | S | * | * | -154.4 | 155.6 | 100.5 | 35.7 | -15.9 | 0 | 0 | 0 | 117.9 | |||||
| 272 | R | 39.3 | Very low | 40.2 | Very low | 252 Ų | 252 | 120.3 Ų | 120.3 | 95% | 0.951 | 80% | 0.797 | S | S | * | * | trans | 46.6 | 133.7 | 136.4 | -65.5 | 178 | 170.8 | -150.2 | -3 | 122.7 | ||||
| 273 | G | 39.7 | Very low | 40.2 | Very low | 81 Ų | 81 | 115.6 Ų | 115.6 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | -168 | 125.5 | 152.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 274 | S | 41.9 | Very low | 40 | Very low | 115 Ų | 115 | 114.4 Ų | 114.4 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | -93 | 157.8 | -162.1 | -41.7 | 0 | 0 | 0 | 0 | 115 | ||||
| 275 | S | 42.3 | Very low | 39.8 | Very low | 126 Ų | 126 | 113.4 Ų | 113.4 | 88% | 0.881 | 82% | 0.816 | S | S | * | * | 160.3 | 154.2 | 114.6 | 51.3 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 276 | S | 39 | Very low | 39.6 | Very low | 106 Ų | 106 | 112.1 Ų | 112.1 | 74% | 0.741 | 82% | 0.818 | S | S | * | * | trans | -88.9 | 154 | -158.6 | 47.8 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 277 | S | 43.3 | Very low | 39.1 | Very low | 109 Ų | 109 | 109.5 Ų | 109.5 | 76% | 0.762 | 82% | 0.824 | S | S | * | * | 171 | 119 | 111.3 | 45.6 | 0 | 0 | 0 | 0 | 114 | |||||
| 278 | T | 41.9 | Very low | 39 | Very low | 148 Ų | 148 | 108.9 Ų | 108.9 | 91% | 0.908 | 83% | 0.825 | S | S | * | * | trans | 34.6 | 123.4 | 140.2 | 31.7 | 0 | 0 | 0 | 0 | 123 | ||||
| 279 | G | 40.2 | Very low | 39.2 | Very low | 79 Ų | 79 | 114 Ų | 114 | 81% | 0.814 | 83% | 0.834 | S | S | * | * | 137.2 | 118.3 | 123.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 280 | G | 40.4 | Very low | 38.8 | Very low | 84 Ų | 84 | 109.7 Ų | 109.7 | 87% | 0.866 | 83% | 0.831 | S | S | * | * | trans | 107.1 | 111 | 152 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 281 | G | 34.9 | Very low | 38.7 | Very low | 89 Ų | 89 | 113.8 Ų | 113.8 | 92% | 0.918 | 84% | 0.836 | S | S | * | * | trans | -73.7 | 162.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 282 | G | 38.1 | Very low | 38.3 | Very low | 79 Ų | 79 | 113.9 Ų | 113.9 | 81% | 0.814 | 83% | 0.83 | S | S | * | * | trans | -179 | 119.3 | 171 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 283 | G | 37.3 | Very low | 38.8 | Very low | 83 Ų | 83 | 108 Ų | 108 | 86% | 0.856 | 83% | 0.825 | S | S | * | * | trans | -63.8 | 157.6 | -164.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 284 | G | 33 | Very low | 38.8 | Very low | 89 Ų | 89 | 108.8 Ų | 108.8 | 92% | 0.918 | 82% | 0.817 | S | S | * | * | trans | -65.5 | 134.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 285 | G | 35 | Very low | 38.8 | Very low | 75 Ų | 75 | 109.1 Ų | 109.1 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -127.6 | 107.6 | 158.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | G287 | G285-G287 PolarHBondContact O-N 3.42Š| ||
| 286 | G | 35.5 | Very low | 39.2 | Very low | 73 Ų | 73 | 108 Ų | 108 | 75% | 0.753 | 80% | 0.8 | S | S | * | * | trans | -60.4 | 131.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | V288 | G286-V288 PolarHBondContact O-N 2.99Š| ||
| 287 | G | 31.5 | Very low | 40.1 | Very low | 82 Ų | 82 | 108.7 Ų | 108.7 | 85% | 0.845 | 80% | 0.801 | S | S | * | * | trans | -60.8 | 96.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | G285 M289 | G285-G287 PolarHBondContact O-N 3.42Å; G287-M289 PolarHBondContact O-N 3.3Å | ||
| 288 | V | 39.8 | Very low | 41.1 | Very low | 136 Ų | 136 | 109.5 Ų | 109.5 | 82% | 0.824 | 80% | 0.801 | S | S | * | * | trans | -68.3 | 114.5 | 153.9 | -107 | 0 | 0 | 0 | 0 | 106.4 | G286 A290 | G286-V288 PolarHBondContact O-N 2.99Å; V288-A290 PolarHBondContact O-N 2.96Å | ||
| 289 | M | 39.7 | Very low | 42.7 | Very low | 173 Ų | 173 | 109.6 Ų | 109.6 | 85% | 0.852 | 79% | 0.785 | S | S | * | * | trans | -50.4 | 115.4 | 168.9 | -68.3 | -70.5 | -139.2 | 0 | 0 | 108.3 | G287 F291 | G287-M289 PolarHBondContact O-N 3.3Å; M289-F291 PolarHBondContact O-N 3.24Å; M289-F291 VanDerWaalsContact O-N 3.14Å | ||
| 290 | A | 33.6 | Very low | 44.4 | Very low | 101 Ų | 101 | 106.1 Ų | 106.1 | 84% | 0.835 | 75% | 0.748 | S | S | * | * | trans | -66.2 | 110.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | V288 N292 | V288-A290 PolarHBondContact O-N 2.96Å; A290-N292 PolarHBondContact O-N 3.47Å | ||
| 291 | F | 39.2 | Very low | 46.4 | Very low | 196 Ų | 196 | 102.3 Ų | 102.3 | 86% | 0.86 | 71% | 0.708 | S | S | * | * | trans | -66.2 | 119.8 | 168.1 | -80 | -86.8 | 0 | 0 | 0 | 108.6 | M289 P293 | M289-F291 PolarHBondContact O-N 3.24Å; M289-F291 VanDerWaalsContact O-N 3.14Å; F291-P293 WeakPolarHBondContact O-CD 3.49Å | ||
| 292 | N | 39 | Very low | 48.5 | Very low | 115 Ų | 115 | 101.2 Ų | 101.2 | 62% | 0.615 | 68% | 0.683 | S | S | * | * | trans | -69.2 | 123 | 171.8 | -117.3 | -18.7 | 0 | 0 | 0 | 108.3 | A290 S294 D295 | A290-N292 PolarHBondContact O-N 3.47Å; N292-S294 PolarHBondContact O-N 2.91Å; N292-D295 PolarHBondContact O-N 3.38Å | ||
| 293 | P | 49.6 | Very low | 50.4 | Low | 130 Ų | 130 | 101.5 Ų | 101.5 | 84% | 0.844 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | 1.2 | 179.8 | -17.5 | 30.7 | 0 | 0 | 0 | 114.7 | F291 | F291-P293 WeakPolarHBondContact O-CD 3.49Š|
| 294 | S | 40.1 | Very low | 52.3 | Low | 97 Ų | 97 | 104.1 Ų | 104.1 | 68% | 0.678 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96 | -12.8 | -174.3 | -35.2 | 0 | 0 | 0 | 0 | 113.7 | N292 | N292-S294 PolarHBondContact O-N 2.91Š|
| 295 | D | 40.5 | Very low | 54.5 | Low | 122 Ų | 122 | 101 Ų | 101 | 65% | 0.652 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -79.1 | 127 | 177.4 | -72.4 | -36.5 | 0 | 0 | 0 | 109.3 | N292 | N292-D295 PolarHBondContact O-N 3.38Š|
| 296 | P | 51.8 | Low | 56.6 | Low | 102 Ų | 102 | 97.4 Ų | 97.4 | 66% | 0.662 | 59% | 0.588 | S | S | * | * | P | Polyproline II helix | trans | -58 | 141 | 177.7 | 24.5 | -32.3 | 0 | 0 | 0 | 109.2 | V298 | P296-V298 PolarHBondContact O-N 3.13Š|
| 297 | P | 57.3 | Low | 58.7 | Low | 120 Ų | 120 | 98.1 Ų | 98.1 | 78% | 0.779 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 121.2 | -179.7 | 22.6 | -32.1 | 0 | 0 | 0 | 109 | R299 | P297-R299 PolarHBondContact O-N 2.92Š|
| 298 | V | 65.9 | Low | 61.3 | Low | 126 Ų | 126 | 94.3 Ų | 94.3 | 76% | 0.764 | 53% | 0.534 | S | S | * | . | trans | -61.5 | 107 | 178.6 | -179.7 | 0 | 0 | 0 | 0 | 107.5 | P296 | P296-V298 PolarHBondContact O-N 3.13Š| ||
| 299 | R | 73.7 | Confident | 63.2 | Low | 151 Ų | 151 | 92.9 Ų | 92.9 | 57% | 0.57 | 52% | 0.518 | S | S | * | . | trans | -66 | 142.3 | 176 | -68.9 | -171 | 179.7 | -141.9 | 1.9 | 109.7 | P297 L301 | P297-R299 PolarHBondContact O-N 2.92Å; R299-L301 VanDerWaalsContact C-N 3.31Å; R299-L301 PolarHBondContact O-N 2.88Å | ||
| 300 | I | 77.2 | Confident | 65.1 | Low | 6 Ų | 6 | 85 Ų | 85 | 3% | 0.031 | 48% | 0.479 | C | S | . | . | S | Bend | trans | -63.3 | -40.8 | 178 | -66.1 | 163.1 | 0 | 0 | 0 | 111.2 | V343 L436 F456 Q459 E463 | I300-V343 HydrophobicContact CG2-CG1 3.81Å; I300-L436 HydrophobicContact CG2-CD1 3.57Å; I300-F456 HydrophobicContact CD1-CE2 4.46Å; I300-F456 HydrophobicContact CG2-CE2 4.43Å; I300-F456 HydrophobicContact CG2-CZ 4.24Å; I300-Q459 HydrophobicContact CD1-CB 4.17Å; I300-Q459 HydrophobicContact CD1-CG 3.58Å; I300-Q459 HydrophobicContact CG1-CG 4.35Å; I300-E463 WeakPolarHBondContact CG1-OE1 3.13Å; I300-E463 PolarHBondContact N-OE1 3.06Å; I300-E463 PolarHBondContact N-OE2 3.23Å |
| 301 | L | 82.4 | Confident | 66.9 | Low | 4 Ų | 4 | 82.7 Ų | 82.7 | 2% | 0.021 | 46% | 0.456 | C | S | . | . | trans | -121 | 132.5 | 179.2 | -67.1 | 174.4 | 0 | 0 | 0 | 110.5 | R299 W339 V343 G432 Y433 L436 | R299-L301 VanDerWaalsContact C-N 3.31Å; R299-L301 PolarHBondContact O-N 2.88Å; L301-W339 HydrophobicContact CD2-CH2 4.33Å; L301-W339 HydrophobicContact CD2-CZ2 4.07Å; L301-V343 HydrophobicContact CD2-CG1 4.19Å; L301-V343 HydrophobicContact CD2-CG2 4.04Å; L301-G432 VanDerWaalsContact CD1-C 3.48Å; L301-Y433 HydrophobicContact CD1-CD1 4.25Å; L301-Y433 HydrophobicContact CD1-CD2 4.28Å; L301-Y433 HydrophobicContact CD1-CE1 4.35Å; L301-Y433 HydrophobicContact CD1-CE2 4.37Å; L301-Y433 HydrophobicContact CD1-CG 4.2Å; L301-L436 HydrophobicContact CD1-CD1 3.76Å; L301-L436 HydrophobicContact CD2-CD1 4.22Å; L301-L436 HydrophobicContact CG-CD1 3.9Å | ||
| 302 | T | 78.9 | Confident | 68.2 | Low | 65 Ų | 65 | 74.7 Ų | 74.7 | 40% | 0.399 | 42% | 0.423 | S | S | . | . | trans | -95.3 | 157 | 161 | 63.9 | 0 | 0 | 0 | 0 | 109 | Q304 S305 A306 | T302-Q304 PolarHBondContact O-N 2.76Å; T302-Q304 VanDerWaalsContact O-N 3.14Å; T302-S305 PolarHBondContact N-OG 3.14Å; T302-S305 PolarHBondContact O-N 2.99Å; T302-S305 PolarHBondContact O-OG 2.63Å; T302-S305 PolarHBondContact OG1-N 3.18Å; T302-S305 VanDerWaalsContact OG1-N 3.16Å; T302-S305 PolarHBondContact OG1-OG 2.7Å; T302-A306 PolarHBondContact O-N 2.78Å | ||
| 303 | P | 78.6 | Confident | 69.3 | Low | 86 Ų | 86 | 71.1 Ų | 71.1 | 56% | 0.558 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.9 | -34.5 | 173.7 | -27.1 | 35.7 | 0 | 0 | 0 | 112.6 | A306 | P303-A306 PolarHBondContact O-N 2.99Š|
| 304 | Q | 75.4 | Confident | 69.8 | Low | 137 Ų | 137 | 71.8 Ų | 71.8 | 64% | 0.64 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -37.9 | 177.2 | -63.3 | 76.9 | 19.8 | 0 | 0 | 112.6 | T302 A306 I307 | T302-Q304 PolarHBondContact O-N 2.76Å; T302-Q304 VanDerWaalsContact O-N 3.14Å; Q304-A306 VanDerWaalsContact C-N 3.26Å; Q304-A306 PolarHBondContact O-N 2.69Å; Q304-I307 WeakPolarHBondContact O-CG1 3.46Å |
| 305 | S | 79.4 | Confident | 70.6 | Confident | 24 Ų | 24 | 72.7 Ų | 72.7 | 17% | 0.168 | 41% | 0.405 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.4 | -16.4 | 176.3 | 70.6 | 0 | 0 | 0 | 0 | 112.9 | T302 I307 W339 | T302-S305 PolarHBondContact N-OG 3.14Å; T302-S305 PolarHBondContact O-N 2.99Å; T302-S305 PolarHBondContact O-OG 2.63Å; T302-S305 PolarHBondContact OG1-N 3.18Å; T302-S305 VanDerWaalsContact OG1-N 3.16Å; T302-S305 PolarHBondContact OG1-OG 2.7Å; S305-I307 VanDerWaalsContact C-N 3.35Å; S305-W339 PolarHBondContact O-NE1 3.12Å |
| 306 | A | 80.5 | Confident | 71.6 | Confident | 0 Ų | 0 | 70.5 Ų | 70.5 | 0% | 0 | 39% | 0.394 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | -15.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | T302 P303 Q304 F308 D428 V429 | T302-A306 PolarHBondContact O-N 2.78Å; P303-A306 PolarHBondContact O-N 2.99Å; Q304-A306 VanDerWaalsContact C-N 3.26Å; Q304-A306 PolarHBondContact O-N 2.69Å; A306-F308 PolarHBondContact O-N 3.34Å; A306-D428 HydrophobicContact CB-CB 4.32Å; A306-V429 HydrophobicContact CB-CB 4.33Å; A306-V429 HydrophobicContact CB-CG2 3.77Å |
| 307 | I | 79.8 | Confident | 72.1 | Confident | 87 Ų | 87 | 67.8 Ų | 67.8 | 45% | 0.446 | 38% | 0.376 | S | S | . | . | trans | -57.8 | 127 | -179.4 | -59.2 | 174.4 | 0 | 0 | 0 | 109.7 | Q304 S305 E309 | Q304-I307 WeakPolarHBondContact O-CG1 3.46Å; S305-I307 VanDerWaalsContact C-N 3.35Å; I307-E309 HydrophobicContact CG2-CG 3.98Å | ||
| 308 | F | 85.3 | Confident | 72.1 | Confident | 3 Ų | 3 | 68.1 Ų | 68.1 | 1% | 0.013 | 38% | 0.381 | C | S | . | . | trans | -139.7 | 79.4 | -177.8 | -170.2 | -94.6 | 0 | 0 | 0 | 109.3 | A306 L332 L335 W339 G369 Q372 | A306-F308 PolarHBondContact O-N 3.34Å; F308-L332 HydrophobicContact CE1-CD1 3.6Å; F308-L332 HydrophobicContact CZ-CD1 3.8Å; F308-L335 HydrophobicContact CD1-CD2 4.3Å; F308-L335 HydrophobicContact CD2-CD2 4.26Å; F308-L335 HydrophobicContact CD2-CG 4.12Å; F308-L335 HydrophobicContact CE1-CD2 4.02Å; F308-L335 HydrophobicContact CE2-CB 4.47Å; F308-L335 HydrophobicContact CE2-CD2 4Å; F308-L335 HydrophobicContact CE2-CG 3.66Å; F308-L335 HydrophobicContact CG-CD2 4.41Å; F308-L335 HydrophobicContact CZ-CB 4.44Å; F308-L335 HydrophobicContact CZ-CD2 3.86Å; F308-L335 HydrophobicContact CZ-CG 3.89Å; F308-W339 HydrophobicContact CD2-CB 3.85Å; F308-W339 AromaticContact CD2-CD1 3.76Å; F308-W339 HydrophobicContact CD2-CD2 4.24Å; F308-W339 AromaticContact CD2-CG 3.64Å; F308-W339 HydrophobicContact CD2-CG 3.64Å; F308-W339 HydrophobicContact CE2-CB 3.85Å; F308-W339 HydrophobicContact CE2-CG 4.08Å; F308-G369 VanDerWaalsContact CE1-CA 3.48Å; F308-Q372 HydrophobicContact CD1-CB 4.34Å; F308-Q372 HydrophobicContact CD1-CG 4.28Å | ||
| 309 | E | 78.8 | Confident | 71.9 | Confident | 105 Ų | 105 | 66.9 Ų | 66.9 | 49% | 0.491 | 37% | 0.374 | S | S | . | . | trans | -109.5 | 131.3 | -178.3 | -67.8 | -176.6 | 172.1 | 0 | 0 | 110 | I307 P311 L335 | I307-E309 HydrophobicContact CG2-CG 3.98Å; E309-P311 WeakPolarHBondContact O-CD 3.47Å; E309-L335 VanDerWaalsContact O-CD2 3.29Å; E309-L335 WeakPolarHBondContact O-CD2 3.47Å | ||
| 310 | L | 80 | Confident | 71.5 | Confident | 7 Ų | 7 | 62.8 Ų | 62.8 | 4% | 0.037 | 36% | 0.362 | C | S | . | . | trans | -96 | 119.8 | 177.1 | -176.4 | 65.3 | 0 | 0 | 0 | 108.4 | V312 T328 R331 L332 L335 Q376 F377 F521 | L310-V312 VanDerWaalsContact C-N 3.32Å; L310-V312 HydrophobicContact CD2-CG2 4.41Å; L310-V312 HydrophobicContact CG-CG2 4.39Å; L310-V312 WeakPolarHBondContact O-CG2 3.39Å; L310-V312 PolarHBondContact O-N 3.01Å; L310-T328 HydrophobicContact CD2-CG2 3.61Å; L310-R331 HydrophobicContact CD1-CB 3.74Å; L310-L332 HydrophobicContact CD1-CB 4.32Å; L310-L332 HydrophobicContact CD2-CB 4.05Å; L310-L332 HydrophobicContact CD2-CD1 4.46Å; L310-L335 HydrophobicContact CB-CD2 4.19Å; L310-L335 HydrophobicContact CD1-CD2 4.07Å; L310-Q376 PolarHBondContact O-OE1 2.85Å; L310-Q376 VanDerWaalsContact O-OE1 3.1Å; L310-F377 HydrophobicContact CD2-CD1 4.39Å; L310-F377 HydrophobicContact CD2-CE1 4.33Å; L310-F521 HydrophobicContact CD1-CE1 4.35Å | ||
| 311 | P | 71.8 | Confident | 71.3 | Confident | 54 Ų | 54 | 64.5 Ų | 64.5 | 35% | 0.351 | 37% | 0.372 | S | S | . | . | trans | -66.3 | 92.8 | 169.2 | -21.3 | 33.9 | 0 | 0 | 0 | 109.9 | E309 R331 F521 | E309-P311 WeakPolarHBondContact O-CD 3.47Å; P311-R331 PolarHBondContact O-NH1 3.44Å; P311-F521 HydrophobicContact CB-CD1 4.15Å; P311-F521 HydrophobicContact CG-CD1 3.7Å; P311-F521 HydrophobicContact CG-CE1 4.08Å; P311-F521 HydrophobicContact CG-CG 4.34Å | ||
| 312 | V | 66.6 | Low | 71 | Confident | 28 Ų | 28 | 65.9 Ų | 65.9 | 17% | 0.17 | 38% | 0.378 | C | S | . | . | trans | -75 | 130.8 | -178.9 | -178.7 | 0 | 0 | 0 | 0 | 109.6 | L310 L314 Y324 Q376 F377 | L310-V312 VanDerWaalsContact C-N 3.32Å; L310-V312 HydrophobicContact CD2-CG2 4.41Å; L310-V312 HydrophobicContact CG-CG2 4.39Å; L310-V312 WeakPolarHBondContact O-CG2 3.39Å; L310-V312 PolarHBondContact O-N 3.01Å; V312-L314 PolarHBondContact O-N 3.26Å; V312-L314 VanDerWaalsContact O-N 3.11Å; V312-Y324 HydrophobicContact CG1-CE2 4.24Å; V312-Y324 WeakPolarHBondContact CG1-OH 3.48Å; V312-Q376 HydrophobicContact CG2-CB 3.9Å; V312-F377 HydrophobicContact CG1-CB 4.41Å; V312-F377 HydrophobicContact CG2-CD1 4.46Å | ||
| 313 | P | 61.4 | Low | 70.8 | Confident | 40 Ų | 40 | 68.4 Ų | 68.4 | 26% | 0.26 | 39% | 0.386 | S | S | . | . | trans | -61.8 | 114 | 171.8 | -16.5 | 28.1 | 0 | 0 | 0 | 110.7 | Y324 E327 | P313-Y324 HydrophobicContact CB-CE2 4.44Å; P313-Y324 WeakPolarHBondContact O-CE2 3.24Å; P313-E327 HydrophobicContact CG-CG 4.45Å | ||
| 314 | L | 60.5 | Low | 70.9 | Confident | 143 Ų | 143 | 65.3 Ų | 65.3 | 75% | 0.749 | 36% | 0.363 | S | S | * | . | S | Bend | trans | -86.8 | 146.5 | 169.3 | -67.9 | 170.3 | 0 | 0 | 0 | 110 | V312 L316 | V312-L314 PolarHBondContact O-N 3.26Å; V312-L314 VanDerWaalsContact O-N 3.11Å; L314-L316 HydrophobicContact CD2-CD1 3.76Å |
| 315 | P | 57.8 | Low | 71.3 | Confident | 116 Ų | 116 | 59 Ų | 59 | 75% | 0.753 | 33% | 0.333 | S | S | * | . | S | Bend | cis | -80.7 | 149.6 | -0.1 | 32.6 | -34.3 | 0 | 0 | 0 | 112.8 | ||
| 316 | L | 61.5 | Low | 71.4 | Confident | 77 Ų | 77 | 57.8 Ų | 57.8 | 40% | 0.403 | 33% | 0.325 | S | S | . | . | P | Polyproline II helix | trans | -59.5 | 135.1 | 171.3 | -72 | 110.7 | 0 | 0 | 0 | 110.3 | L314 S318 F377 | L314-L316 HydrophobicContact CD2-CD1 3.76Å; L316-S318 PolarHBondContact O-N 3.31Å; L316-F377 HydrophobicContact CD2-CB 4.38Å |
| 317 | P | 60.9 | Low | 71.5 | Confident | 45 Ų | 45 | 61.2 Ų | 61.2 | 29% | 0.292 | 34% | 0.341 | S | S | . | . | P | Polyproline II helix | trans | -69.7 | 132.1 | -179.6 | 30.3 | -35.6 | 0 | 0 | 0 | 110.3 | V319 N321 Y324 | P317-V319 WeakPolarHBondContact CB-O 3.2Å; P317-V319 PolarHBondContact O-N 3.48Å; P317-N321 HydrophobicContact CB-CB 3.98Å; P317-N321 HydrophobicContact CG-CB 4.26Å; P317-Y324 HydrophobicContact CG-CD1 3.5Å; P317-Y324 HydrophobicContact CG-CD2 4.06Å; P317-Y324 HydrophobicContact CG-CE1 3.89Å; P317-Y324 HydrophobicContact CG-CE2 4.38Å; P317-Y324 HydrophobicContact CG-CG 3.58Å |
| 318 | S | 57.6 | Low | 71.7 | Confident | 126 Ų | 126 | 57.3 Ų | 57.3 | 88% | 0.881 | 32% | 0.322 | S | S | * | . | S | Bend | trans | -73.2 | -11.8 | 175.7 | 54.9 | 0 | 0 | 0 | 0 | 113.6 | L316 | L316-S318 PolarHBondContact O-N 3.31Š|
| 319 | V | 62.3 | Low | 71.8 | Confident | 101 Ų | 101 | 57.3 Ų | 57.3 | 61% | 0.612 | 32% | 0.322 | S | S | * | . | S | Bend | trans | -130.5 | 153.7 | 179.8 | -68.3 | 0 | 0 | 0 | 0 | 109.7 | P317 N321 | P317-V319 WeakPolarHBondContact CB-O 3.2Å; P317-V319 PolarHBondContact O-N 3.48Å; V319-N321 PolarHBondContact O-N 3.11Å |
| 320 | L | 65.1 | Low | 72.2 | Confident | 64 Ų | 64 | 54.1 Ų | 54.1 | 34% | 0.335 | 31% | 0.311 | S | S | . | . | trans | -57.2 | 104.3 | 177.3 | -170.7 | 80.3 | 0 | 0 | 0 | 110.1 | I325 A385 M386 | L320-I325 HydrophobicContact CD1-CD1 3.56Å; L320-I325 HydrophobicContact CG-CD1 4Å; L320-A385 HydrophobicContact CB-CB 4.39Å; L320-A385 HydrophobicContact CD1-CB 3.91Å; L320-M386 HydrophobicContact CD1-CG 4.17Å | ||
| 321 | N | 72.8 | Confident | 72.6 | Confident | 43 Ų | 43 | 56.3 Ų | 56.3 | 23% | 0.23 | 32% | 0.319 | C | S | . | . | trans | -109.3 | 107.4 | 179.4 | -177.5 | -14.4 | 0 | 0 | 0 | 109.3 | P317 V319 Q323 Y324 I325 | P317-N321 HydrophobicContact CB-CB 3.98Å; P317-N321 HydrophobicContact CG-CB 4.26Å; V319-N321 PolarHBondContact O-N 3.11Å; N321-Q323 PolarHBondContact O-N 3.43Å; N321-Q323 WeakPolarHBondContact OD1-CB 3.12Å; N321-Q323 PolarHBondContact OD1-N 3.32Å; N321-Y324 WeakPolarHBondContact O-CB 3.29Å; N321-Y324 PolarHBondContact O-N 2.96Å; N321-Y324 VanDerWaalsContact O-N 3.11Å; N321-Y324 PolarHBondContact OD1-N 3.15Å; N321-I325 WeakPolarHBondContact O-CG1 3.34Å; N321-I325 PolarHBondContact O-N 3.04Å | ||
| 322 | M | 75.8 | Confident | 73.5 | Confident | 32 Ų | 32 | 53.8 Ų | 53.8 | 16% | 0.158 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.1 | -35.7 | -179.8 | -172.5 | 59.8 | 65.2 | 0 | 0 | 112.5 | F53 Y324 I325 C326 | F53-M322 HydrophobicContact CB-CE 4.13Å; F53-M322 HydrophobicContact CD2-CE 3.32Å; F53-M322 HydrophobicContact CE2-CE 4Å; F53-M322 HydrophobicContact CG-CE 4.04Å; M322-Y324 VanDerWaalsContact C-N 3.33Å; M322-Y324 PolarHBondContact O-N 2.97Å; M322-I325 PolarHBondContact O-N 3.34Å; M322-C326 WeakPolarHBondContact O-CB 3.39Å; M322-C326 PolarHBondContact O-N 2.98Å; M322-C326 PolarHBondContact O-SG 2.86Å |
| 323 | Q | 75 | Confident | 74.7 | Confident | 118 Ų | 118 | 52.8 Ų | 52.8 | 55% | 0.551 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -65.4 | -41 | 177.9 | -62.1 | -179.4 | -50.8 | 0 | 0 | 111.1 | N321 C326 E327 | N321-Q323 PolarHBondContact O-N 3.43Å; N321-Q323 WeakPolarHBondContact OD1-CB 3.12Å; N321-Q323 PolarHBondContact OD1-N 3.32Å; Q323-C326 PolarHBondContact O-N 3.19Å; Q323-E327 VanDerWaalsContact O-CB 3.24Å; Q323-E327 WeakPolarHBondContact O-CB 3.32Å; Q323-E327 PolarHBondContact O-N 3.05Å |
| 324 | Y | 80.8 | Confident | 76 | Confident | 21 Ų | 21 | 51.1 Ų | 51.1 | 8% | 0.082 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 175.7 | 175.2 | -93.4 | 0 | 0 | 0 | 111.7 | V312 P313 P317 N321 M322 C326 E327 T328 F377 | V312-Y324 HydrophobicContact CG1-CE2 4.24Å; V312-Y324 WeakPolarHBondContact CG1-OH 3.48Å; P313-Y324 HydrophobicContact CB-CE2 4.44Å; P313-Y324 WeakPolarHBondContact O-CE2 3.24Å; P317-Y324 HydrophobicContact CG-CD1 3.5Å; P317-Y324 HydrophobicContact CG-CD2 4.06Å; P317-Y324 HydrophobicContact CG-CE1 3.89Å; P317-Y324 HydrophobicContact CG-CE2 4.38Å; P317-Y324 HydrophobicContact CG-CG 3.58Å; N321-Y324 WeakPolarHBondContact O-CB 3.29Å; N321-Y324 PolarHBondContact O-N 2.96Å; N321-Y324 VanDerWaalsContact O-N 3.11Å; N321-Y324 PolarHBondContact OD1-N 3.15Å; M322-Y324 VanDerWaalsContact C-N 3.33Å; M322-Y324 PolarHBondContact O-N 2.97Å; Y324-C326 VanDerWaalsContact C-N 3.33Å; Y324-C326 PolarHBondContact O-N 3.15Å; Y324-E327 PolarHBondContact O-N 2.93Å; Y324-T328 VanDerWaalsContact O-CB 3.26Å; Y324-T328 WeakPolarHBondContact O-CB 3.28Å; Y324-T328 PolarHBondContact O-N 2.97Å; Y324-T328 PolarHBondContact O-OG1 3.06Å; Y324-F377 HydrophobicContact CE1-CB 4.34Å |
| 325 | I | 83.8 | Confident | 77.4 | Confident | 4 Ų | 4 | 45.7 Ų | 45.7 | 2% | 0.021 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -58.4 | -49 | 176.6 | -69.2 | 157.7 | 0 | 0 | 0 | 110 | L320 N321 M322 T328 A329 M382 M386 F495 | L320-I325 HydrophobicContact CD1-CD1 3.56Å; L320-I325 HydrophobicContact CG-CD1 4Å; N321-I325 WeakPolarHBondContact O-CG1 3.34Å; N321-I325 PolarHBondContact O-N 3.04Å; M322-I325 PolarHBondContact O-N 3.34Å; I325-T328 PolarHBondContact O-N 2.87Å; I325-A329 VanDerWaalsContact O-CB 3.22Å; I325-A329 WeakPolarHBondContact O-CB 3.35Å; I325-A329 PolarHBondContact O-N 3.17Å; I325-M382 HydrophobicContact CG1-SD 3.87Å; I325-M386 HydrophobicContact CD1-CE 3.59Å; I325-M386 HydrophobicContact CG1-CE 4.21Å; I325-M386 HydrophobicContact CG2-CE 3.8Å; I325-F495 HydrophobicContact CG2-CD1 4.01Å |
| 326 | C | 82.3 | Confident | 79.1 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -67.4 | -40.9 | -179 | -63.4 | 0 | 0 | 0 | 0 | 113 | M322 Q323 Y324 T328 A329 S330 F495 G498 L499 | M322-C326 WeakPolarHBondContact O-CB 3.39Å; M322-C326 PolarHBondContact O-N 2.98Å; M322-C326 PolarHBondContact O-SG 2.86Å; Q323-C326 PolarHBondContact O-N 3.19Å; Y324-C326 VanDerWaalsContact C-N 3.33Å; Y324-C326 PolarHBondContact O-N 3.15Å; C326-T328 VanDerWaalsContact C-N 3.35Å; C326-A329 PolarHBondContact O-N 2.95Å; C326-S330 WeakPolarHBondContact O-CB 3.38Å; C326-S330 PolarHBondContact O-N 2.95Å; C326-S330 PolarHBondContact O-OG 3.11Å; C326-F495 VanDerWaalsContact CA-O 3.24Å; C326-F495 WeakPolarHBondContact CA-O 3.27Å; C326-F495 PolarHBondContact SG-O 3.26Å; C326-G498 VanDerWaalsContact SG-CA 3.52Å; C326-G498 PolarHBondContact SG-N 2.85Å; C326-L499 HydrophobicContact CB-CB 4.16Å; C326-L499 HydrophobicContact CB-CD1 3.49Å; C326-L499 VanDerWaalsContact CB-CD1 3.49Å; C326-L499 HydrophobicContact CB-CG 3.52Å; C326-L499 VanDerWaalsContact O-CD1 3.32Å; C326-L499 WeakPolarHBondContact O-CD1 3.48Å |
| 327 | E | 80.8 | Confident | 80.4 | Confident | 72 Ų | 72 | 36.8 Ų | 36.8 | 34% | 0.336 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -63.9 | -41.6 | 175.7 | 179.1 | 63.6 | -167.6 | 0 | 0 | 111.3 | P313 Q323 Y324 S330 R331 | P313-E327 HydrophobicContact CG-CG 4.45Å; Q323-E327 VanDerWaalsContact O-CB 3.24Å; Q323-E327 WeakPolarHBondContact O-CB 3.32Å; Q323-E327 PolarHBondContact O-N 3.05Å; Y324-E327 PolarHBondContact O-N 2.93Å; E327-S330 WeakPolarHBondContact CA-OG 3.3Å; E327-S330 PolarHBondContact O-OG 3.36Å; E327-R331 WeakPolarHBondContact O-CB 3.35Å; E327-R331 VanDerWaalsContact O-CG 3.23Å; E327-R331 WeakPolarHBondContact O-CG 3.25Å; E327-R331 PolarHBondContact O-N 3.43Å; E327-R331 IonicContact OE1-CZ 3.82Å; E327-R331 IonicContact OE1-NE 3.14Å; E327-R331 PolarHBondContact OE1-NE 3.08Å; E327-R331 IonicContact OE1-NH2 3.66Å; E327-R331 PolarHBondContact OE1-NH2 2.72Å |
| 328 | T | 84.8 | Confident | 81.6 | Confident | 5 Ų | 5 | 37 Ų | 37 | 3% | 0.031 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.7 | -44.6 | 176.7 | -55.7 | 0 | 0 | 0 | 0 | 110.4 | L310 Y324 I325 C326 L332 F377 | L310-T328 HydrophobicContact CD2-CG2 3.61Å; Y324-T328 VanDerWaalsContact O-CB 3.26Å; Y324-T328 WeakPolarHBondContact O-CB 3.28Å; Y324-T328 PolarHBondContact O-N 2.97Å; Y324-T328 PolarHBondContact O-OG1 3.06Å; I325-T328 PolarHBondContact O-N 2.87Å; C326-T328 VanDerWaalsContact C-N 3.35Å; T328-L332 WeakPolarHBondContact O-CB 3.49Å; T328-L332 PolarHBondContact O-N 3.25Å; T328-F377 HydrophobicContact CG2-CD1 3.75Å; T328-F377 HydrophobicContact CG2-CE1 4.11Å; T328-F377 HydrophobicContact CG2-CG 4.01Å |
| 329 | A | 88.5 | Confident | 83.1 | Confident | 3 Ų | 3 | 31.5 Ų | 31.5 | 3% | 0.025 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -66.3 | -38.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | I325 C326 L332 L333 F366 F495 F496 | I325-A329 VanDerWaalsContact O-CB 3.22Å; I325-A329 WeakPolarHBondContact O-CB 3.35Å; I325-A329 PolarHBondContact O-N 3.17Å; C326-A329 PolarHBondContact O-N 2.95Å; A329-L332 PolarHBondContact O-N 2.96Å; A329-L333 WeakPolarHBondContact O-CB 3.27Å; A329-L333 PolarHBondContact O-N 3.4Å; A329-F366 HydrophobicContact CB-CE2 4.28Å; A329-F366 HydrophobicContact CB-CZ 4.11Å; A329-F495 HydrophobicContact CB-CB 3.78Å; A329-F495 WeakPolarHBondContact CB-O 3.37Å; A329-F496 HydrophobicContact CB-CD1 4.3Å; A329-F496 HydrophobicContact CB-CE1 3.94Å; A329-F496 HydrophobicContact CB-CE2 4.31Å; A329-F496 HydrophobicContact CB-CZ 3.95Å; A329-F496 WeakPolarHBondContact O-CE1 3.47Å |
| 330 | S | 87 | Confident | 84.4 | Confident | 37 Ų | 37 | 26.7 Ų | 26.7 | 26% | 0.259 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -67 | -45.7 | 177 | 67.3 | 0 | 0 | 0 | 0 | 111.4 | C326 E327 L332 L333 F334 | C326-S330 WeakPolarHBondContact O-CB 3.38Å; C326-S330 PolarHBondContact O-N 2.95Å; C326-S330 PolarHBondContact O-OG 3.11Å; E327-S330 WeakPolarHBondContact CA-OG 3.3Å; E327-S330 PolarHBondContact O-OG 3.36Å; S330-L332 VanDerWaalsContact C-N 3.32Å; S330-L332 PolarHBondContact O-N 3.19Å; S330-L333 PolarHBondContact O-N 3.2Å; S330-F334 WeakPolarHBondContact O-CB 3.45Å; S330-F334 PolarHBondContact O-N 3.2Å |
| 331 | R | 87.6 | Confident | 85.3 | Confident | 54 Ų | 54 | 28.3 Ų | 28.3 | 20% | 0.204 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -59.7 | -43.2 | 172.9 | -72.2 | 174.4 | 173.7 | -143.6 | -7.7 | 111.6 | L310 P311 E327 F334 L335 F521 | L310-R331 HydrophobicContact CD1-CB 3.74Å; P311-R331 PolarHBondContact O-NH1 3.44Å; E327-R331 WeakPolarHBondContact O-CB 3.35Å; E327-R331 VanDerWaalsContact O-CG 3.23Å; E327-R331 WeakPolarHBondContact O-CG 3.25Å; E327-R331 PolarHBondContact O-N 3.43Å; E327-R331 IonicContact OE1-CZ 3.82Å; E327-R331 IonicContact OE1-NE 3.14Å; E327-R331 PolarHBondContact OE1-NE 3.08Å; E327-R331 IonicContact OE1-NH2 3.66Å; E327-R331 PolarHBondContact OE1-NH2 2.72Å; R331-F334 PolarHBondContact O-N 2.98Å; R331-L335 WeakPolarHBondContact O-CB 3.38Å; R331-L335 PolarHBondContact O-N 3.28Å; R331-F521 HydrophobicContact CB-CE1 4.03Å; R331-F521 HydrophobicContact CB-CZ 4.32Å; R331-F521 HydrophobicContact CG-CE1 4.18Å |
| 332 | L | 91.2 | Very high | 85.7 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.6 | -41.4 | 178.1 | 178 | 63.6 | 0 | 0 | 0 | 112.3 | F308 L310 T328 A329 S330 F334 L335 S336 F366 L370 | F308-L332 HydrophobicContact CE1-CD1 3.6Å; F308-L332 HydrophobicContact CZ-CD1 3.8Å; L310-L332 HydrophobicContact CD1-CB 4.32Å; L310-L332 HydrophobicContact CD2-CB 4.05Å; L310-L332 HydrophobicContact CD2-CD1 4.46Å; T328-L332 WeakPolarHBondContact O-CB 3.49Å; T328-L332 PolarHBondContact O-N 3.25Å; A329-L332 PolarHBondContact O-N 2.96Å; S330-L332 VanDerWaalsContact C-N 3.32Å; S330-L332 PolarHBondContact O-N 3.19Å; L332-F334 VanDerWaalsContact C-N 3.33Å; L332-L335 PolarHBondContact O-N 3.5Å; L332-S336 VanDerWaalsContact O-CB 3.27Å; L332-S336 WeakPolarHBondContact O-CB 3.46Å; L332-S336 PolarHBondContact O-N 2.9Å; L332-S336 PolarHBondContact O-OG 3.45Å; L332-F366 HydrophobicContact CB-CE2 4.26Å; L332-F366 HydrophobicContact CD2-CD2 4.19Å; L332-F366 HydrophobicContact CD2-CE2 3.72Å; L332-F366 HydrophobicContact CD2-CZ 4.28Å; L332-F366 HydrophobicContact CG-CD2 4.23Å; L332-F366 HydrophobicContact CG-CE2 4.04Å; L332-L370 HydrophobicContact CD2-CB 3.82Å; L332-L370 HydrophobicContact CD2-CD1 3.63Å; L332-L370 HydrophobicContact CD2-CG 4.35Å |
| 333 | L | 91.3 | Very high | 86.1 | Confident | 7 Ų | 7 | 27.8 Ų | 27.8 | 4% | 0.037 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61.8 | -44.8 | 175.1 | 177.5 | 65.5 | 0 | 0 | 0 | 110.7 | A329 S330 S336 V337 W362 F366 F496 I505 I512 | A329-L333 WeakPolarHBondContact O-CB 3.27Å; A329-L333 PolarHBondContact O-N 3.4Å; S330-L333 PolarHBondContact O-N 3.2Å; L333-S336 PolarHBondContact O-N 3.39Å; L333-V337 WeakPolarHBondContact O-CG2 3.42Å; L333-V337 PolarHBondContact O-N 3.48Å; L333-V337 VanDerWaalsContact O-N 3.07Å; L333-W362 HydrophobicContact CD1-CE3 3.88Å; L333-W362 HydrophobicContact CD1-CZ3 4.47Å; L333-F366 HydrophobicContact CB-CD2 4.14Å; L333-F366 HydrophobicContact CB-CE2 4.46Å; L333-F366 HydrophobicContact CD1-CB 4.44Å; L333-F366 HydrophobicContact CD1-CD2 4.34Å; L333-F496 HydrophobicContact CB-CE1 4.07Å; L333-F496 HydrophobicContact CB-CZ 4.03Å; L333-F496 HydrophobicContact CD2-CE1 3.87Å; L333-F496 HydrophobicContact CD2-CZ 4.07Å; L333-I505 HydrophobicContact CD1-CG2 4.25Å; L333-I505 HydrophobicContact CD2-CD1 4.04Å; L333-I505 HydrophobicContact CD2-CG2 3.68Å; L333-I512 HydrophobicContact CD2-CD1 4.09Å; L333-I512 HydrophobicContact CG-CD1 4.17Å |
| 334 | F | 89.1 | Confident | 85.9 | Confident | 6 Ų | 6 | 26.4 Ų | 26.4 | 3% | 0.026 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.4 | -47.6 | 176.3 | -176.7 | -92.1 | 0 | 0 | 0 | 111.9 | S330 R331 L332 S336 V337 H338 I512 M515 V517 I520 F521 | S330-F334 WeakPolarHBondContact O-CB 3.45Å; S330-F334 PolarHBondContact O-N 3.2Å; R331-F334 PolarHBondContact O-N 2.98Å; L332-F334 VanDerWaalsContact C-N 3.33Å; F334-S336 VanDerWaalsContact C-N 3.33Å; F334-S336 PolarHBondContact O-N 2.9Å; F334-V337 PolarHBondContact O-N 3.37Å; F334-H338 PolarHBondContact O-N 3.18Å; F334-I512 HydrophobicContact CD2-CB 4.39Å; F334-I512 HydrophobicContact CD2-CG1 4.34Å; F334-I512 HydrophobicContact CD2-CG2 3.59Å; F334-I512 HydrophobicContact CE2-CG2 4.02Å; F334-I512 HydrophobicContact CG-CG2 4.38Å; F334-M515 HydrophobicContact CE2-CB 3.83Å; F334-M515 HydrophobicContact CZ-CB 4.35Å; F334-V517 HydrophobicContact CE1-CB 4.36Å; F334-V517 HydrophobicContact CE1-CG1 4.33Å; F334-V517 HydrophobicContact CE1-CG2 4.3Å; F334-I520 HydrophobicContact CB-CD1 4.35Å; F334-I520 HydrophobicContact CD1-CB 4.25Å; F334-I520 HydrophobicContact CD1-CD1 3.87Å; F334-I520 HydrophobicContact CD1-CG1 4.41Å; F334-I520 HydrophobicContact CD1-CG2 4.34Å; F334-I520 HydrophobicContact CD2-CD1 3.19Å; F334-I520 HydrophobicContact CD2-CG1 4.33Å; F334-I520 HydrophobicContact CE1-CB 4.07Å; F334-I520 HydrophobicContact CE1-CD1 3.9Å; F334-I520 HydrophobicContact CE1-CG1 4.09Å; F334-I520 HydrophobicContact CE2-CD1 3.23Å; F334-I520 HydrophobicContact CE2-CG1 4.01Å; F334-I520 HydrophobicContact CG-CD1 3.53Å; F334-I520 HydrophobicContact CZ-CB 4.36Å; F334-I520 HydrophobicContact CZ-CD1 3.59Å; F334-I520 HydrophobicContact CZ-CG1 3.88Å; F334-F521 AromaticContact CD1-CE2 3.74Å; F334-F521 HydrophobicContact CD1-CE2 3.74Å; F334-F521 HydrophobicContact CD1-CZ 4.33Å; F334-F521 HydrophobicContact CE1-CE2 4.09Å |
| 335 | L | 90 | Very high | 85.3 | Confident | 28 Ų | 28 | 27.6 Ų | 27.6 | 15% | 0.147 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -58.7 | -44 | 175.4 | -178.8 | 64.5 | 0 | 0 | 0 | 111.6 | F308 E309 L310 R331 L332 V337 H338 W339 F521 | F308-L335 HydrophobicContact CD1-CD2 4.3Å; F308-L335 HydrophobicContact CD2-CD2 4.26Å; F308-L335 HydrophobicContact CD2-CG 4.12Å; F308-L335 HydrophobicContact CE1-CD2 4.02Å; F308-L335 HydrophobicContact CE2-CB 4.47Å; F308-L335 HydrophobicContact CE2-CD2 4Å; F308-L335 HydrophobicContact CE2-CG 3.66Å; F308-L335 HydrophobicContact CG-CD2 4.41Å; F308-L335 HydrophobicContact CZ-CB 4.44Å; F308-L335 HydrophobicContact CZ-CD2 3.86Å; F308-L335 HydrophobicContact CZ-CG 3.89Å; E309-L335 VanDerWaalsContact O-CD2 3.29Å; E309-L335 WeakPolarHBondContact O-CD2 3.47Å; L310-L335 HydrophobicContact CB-CD2 4.19Å; L310-L335 HydrophobicContact CD1-CD2 4.07Å; R331-L335 WeakPolarHBondContact O-CB 3.38Å; R331-L335 PolarHBondContact O-N 3.28Å; L332-L335 PolarHBondContact O-N 3.5Å; L335-V337 PolarHBondContact O-N 2.87Å; L335-H338 PolarHBondContact O-N 3.45Å; L335-W339 WeakPolarHBondContact O-CB 3.18Å; L335-W339 PolarHBondContact O-N 3.13Å; L335-F521 HydrophobicContact CB-CZ 4.25Å |
| 336 | S | 92 | Very high | 84.6 | Confident | 3 Ų | 3 | 28.1 Ų | 28.1 | 2% | 0.021 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.4 | -45.1 | 179 | -62.6 | 0 | 0 | 0 | 0 | 112.4 | L332 L333 F334 L340 | L332-S336 VanDerWaalsContact O-CB 3.27Å; L332-S336 WeakPolarHBondContact O-CB 3.46Å; L332-S336 PolarHBondContact O-N 2.9Å; L332-S336 PolarHBondContact O-OG 3.45Å; L333-S336 PolarHBondContact O-N 3.39Å; F334-S336 VanDerWaalsContact C-N 3.33Å; F334-S336 PolarHBondContact O-N 2.9Å; S336-L340 PolarHBondContact O-N 3.33Å |
| 337 | V | 89.2 | Confident | 83.4 | Confident | 4 Ų | 4 | 35.6 Ų | 35.6 | 2% | 0.024 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -69.7 | -44.9 | 179.1 | 173.2 | 0 | 0 | 0 | 0 | 110.8 | L333 F334 L335 L340 K341 L358 I509 I512 L513 | L333-V337 WeakPolarHBondContact O-CG2 3.42Å; L333-V337 PolarHBondContact O-N 3.48Å; L333-V337 VanDerWaalsContact O-N 3.07Å; F334-V337 PolarHBondContact O-N 3.37Å; L335-V337 PolarHBondContact O-N 2.87Å; V337-L340 PolarHBondContact O-N 2.95Å; V337-K341 PolarHBondContact O-N 3.33Å; V337-L358 HydrophobicContact CG1-CD1 3.9Å; V337-L358 HydrophobicContact CG2-CD2 4.41Å; V337-I509 HydrophobicContact CG2-CD1 3.84Å; V337-I512 HydrophobicContact CB-CG2 3.63Å; V337-I512 HydrophobicContact CG1-CB 4.38Å; V337-I512 HydrophobicContact CG1-CG2 3.54Å; V337-I512 HydrophobicContact CG2-CG2 4.11Å; V337-L513 HydrophobicContact CG1-CD2 3.6Å; V337-L513 HydrophobicContact CG1-CG 3.99Å |
| 338 | H | 86 | Confident | 82.3 | Confident | 50 Ų | 50 | 33.7 Ų | 33.7 | 23% | 0.231 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -73 | -35.7 | -177.6 | -164.2 | -77.6 | 0 | 0 | 0 | 113.1 | F334 L335 L340 K341 S342 V517 | F334-H338 PolarHBondContact O-N 3.18Å; L335-H338 PolarHBondContact O-N 3.45Å; H338-L340 PolarHBondContact O-N 3.4Å; H338-K341 WeakPolarHBondContact O-CB 3.36Å; H338-K341 PolarHBondContact O-N 2.98Å; H338-S342 PolarHBondContact O-N 3.5Å; H338-V517 HydrophobicContact CB-CG2 4.08Å; H338-V517 WeakPolarHBondContact CD2-CG2 3.06Å; H338-V517 WeakPolarHBondContact CE1-CG2 3.3Å; H338-V517 WeakPolarHBondContact ND1-CG2 3.37Å; H338-V517 WeakPolarHBondContact NE2-CG2 3.46Å |
| 339 | W | 90.5 | Very high | 81 | Confident | 10 Ų | 10 | 41 Ų | 41 | 4% | 0.038 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -55.9 | -44.6 | 172.8 | 178.1 | 86.3 | 0 | 0 | 0 | 110.2 | L301 S305 F308 L335 K341 S342 V343 G432 K435 L436 | L301-W339 HydrophobicContact CD2-CH2 4.33Å; L301-W339 HydrophobicContact CD2-CZ2 4.07Å; S305-W339 PolarHBondContact O-NE1 3.12Å; F308-W339 HydrophobicContact CD2-CB 3.85Å; F308-W339 AromaticContact CD2-CD1 3.76Å; F308-W339 HydrophobicContact CD2-CD2 4.24Å; F308-W339 AromaticContact CD2-CG 3.64Å; F308-W339 HydrophobicContact CD2-CG 3.64Å; F308-W339 HydrophobicContact CE2-CB 3.85Å; F308-W339 HydrophobicContact CE2-CG 4.08Å; L335-W339 WeakPolarHBondContact O-CB 3.18Å; L335-W339 PolarHBondContact O-N 3.13Å; W339-K341 PolarHBondContact O-N 2.93Å; W339-S342 PolarHBondContact O-N 2.85Å; W339-S342 VanDerWaalsContact O-N 3.1Å; W339-S342 PolarHBondContact O-OG 3.23Å; W339-V343 HydrophobicContact CH2-CG2 4.17Å; W339-V343 HydrophobicContact CZ2-CG2 4.4Å; W339-V343 HydrophobicContact CZ3-CG2 4.26Å; W339-G432 VanDerWaalsContact CH2-CA 3.49Å; W339-K435 HydrophobicContact CE3-CD 3.94Å; W339-K435 HydrophobicContact CH2-CB 4.25Å; W339-K435 HydrophobicContact CH2-CD 4.16Å; W339-K435 HydrophobicContact CZ3-CB 3.8Å; W339-K435 HydrophobicContact CZ3-CD 3.73Å; W339-K435 HydrophobicContact CZ3-CG 4.44Å; W339-L436 HydrophobicContact CH2-CG 4.36Å; W339-L436 HydrophobicContact CZ3-CD2 4.5Å |
| 340 | L | 88.4 | Confident | 79.7 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.3 | -43.8 | 178 | -171.6 | 70.6 | 0 | 0 | 0 | 112.2 | S336 V337 H338 S342 V343 L346 L358 L436 F439 | S336-L340 PolarHBondContact O-N 3.33Å; V337-L340 PolarHBondContact O-N 2.95Å; H338-L340 PolarHBondContact O-N 3.4Å; L340-S342 PolarHBondContact O-N 2.99Å; L340-V343 PolarHBondContact O-N 3.15Å; L340-L346 HydrophobicContact CD1-CD2 3.87Å; L340-L346 HydrophobicContact CD2-CD2 4.24Å; L340-L346 HydrophobicContact CG-CD2 3.59Å; L340-L346 WeakPolarHBondContact O-CD2 3.47Å; L340-L358 HydrophobicContact CD2-CD1 4.43Å; L340-L358 HydrophobicContact CD2-CD2 3.59Å; L340-L358 HydrophobicContact CD2-CG 4.03Å; L340-L436 HydrophobicContact CD1-CD2 3.82Å; L340-F439 HydrophobicContact CD1-CB 4.31Å; L340-F439 HydrophobicContact CD1-CD1 4.22Å; L340-F439 HydrophobicContact CD1-CD2 4.49Å; L340-F439 HydrophobicContact CD1-CG 4.08Å; L340-F439 HydrophobicContact CD2-CD1 4.19Å; L340-F439 HydrophobicContact CD2-CD2 3.34Å; L340-F439 HydrophobicContact CD2-CE1 4.22Å; L340-F439 HydrophobicContact CD2-CE2 3.38Å; L340-F439 HydrophobicContact CD2-CG 3.76Å; L340-F439 HydrophobicContact CD2-CZ 3.83Å |
| 341 | K | 83.7 | Confident | 78.7 | Confident | 98 Ų | 98 | 49 Ų | 49 | 43% | 0.426 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.5 | -27.1 | 175.3 | -174 | -178.6 | 173.9 | -174.4 | 0 | 113.1 | V337 H338 W339 V343 L513 | V337-K341 PolarHBondContact O-N 3.33Å; H338-K341 WeakPolarHBondContact O-CB 3.36Å; H338-K341 PolarHBondContact O-N 2.98Å; W339-K341 PolarHBondContact O-N 2.93Å; K341-V343 VanDerWaalsContact C-N 3.32Å; K341-L513 HydrophobicContact CD-CD2 4.49Å; K341-L513 PolarHBondContact NZ-O 3.15Å |
| 342 | S | 82.5 | Confident | 78 | Confident | 59 Ų | 59 | 50 Ų | 50 | 41% | 0.413 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | -9.4 | -179.8 | 74.8 | 0 | 0 | 0 | 0 | 114.5 | H338 W339 L340 P344 | H338-S342 PolarHBondContact O-N 3.5Å; W339-S342 PolarHBondContact O-N 2.85Å; W339-S342 VanDerWaalsContact O-N 3.1Å; W339-S342 PolarHBondContact O-OG 3.23Å; L340-S342 PolarHBondContact O-N 2.99Å; S342-P344 VanDerWaalsContact O-CD 3.3Å; S342-P344 WeakPolarHBondContact O-CD 3.44Å |
| 343 | V | 84.4 | Confident | 77.4 | Confident | 4 Ų | 4 | 51.4 Ų | 51.4 | 2% | 0.024 | 28% | 0.281 | C | S | . | . | trans | -72.6 | 115.4 | -178.9 | 177.6 | 0 | 0 | 0 | 0 | 109.9 | I300 L301 W339 L340 K341 S345 L346 L436 | I300-V343 HydrophobicContact CG2-CG1 3.81Å; L301-V343 HydrophobicContact CD2-CG1 4.19Å; L301-V343 HydrophobicContact CD2-CG2 4.04Å; W339-V343 HydrophobicContact CH2-CG2 4.17Å; W339-V343 HydrophobicContact CZ2-CG2 4.4Å; W339-V343 HydrophobicContact CZ3-CG2 4.26Å; L340-V343 PolarHBondContact O-N 3.15Å; K341-V343 VanDerWaalsContact C-N 3.32Å; V343-S345 VanDerWaalsContact C-N 3.31Å; V343-S345 PolarHBondContact O-N 3.16Å; V343-L346 HydrophobicContact CB-CB 4.1Å; V343-L346 HydrophobicContact CG1-CB 4.3Å; V343-L346 VanDerWaalsContact O-CB 3.28Å; V343-L346 WeakPolarHBondContact O-CB 3.46Å; V343-L346 PolarHBondContact O-N 3.36Å; V343-L436 HydrophobicContact CG1-CD1 4.38Å; V343-L436 HydrophobicContact CG1-CD2 4.26Å; V343-L436 HydrophobicContact CG2-CD2 4.26Å | ||
| 344 | P | 71.3 | Confident | 76.8 | Confident | 90 Ų | 90 | 52.1 Ų | 52.1 | 58% | 0.584 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -36.3 | -169.9 | -25.4 | 34.4 | 0 | 0 | 0 | 114.3 | S342 L346 | S342-P344 VanDerWaalsContact O-CD 3.3Å; S342-P344 WeakPolarHBondContact O-CD 3.44Å; P344-L346 PolarHBondContact O-N 3.07Å |
| 345 | S | 68.1 | Low | 76.6 | Confident | 45 Ų | 45 | 54.4 Ų | 54.4 | 32% | 0.315 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | -2.5 | -179.5 | -48.1 | 0 | 0 | 0 | 0 | 113.6 | V343 E347 F456 | V343-S345 VanDerWaalsContact C-N 3.31Å; V343-S345 PolarHBondContact O-N 3.16Å; S345-E347 PolarHBondContact O-N 3.46Å; S345-E347 VanDerWaalsContact O-N 3.15Å; S345-F456 WeakPolarHBondContact O-CE2 3.43Å |
| 346 | L | 67.5 | Low | 76.3 | Confident | 16 Ų | 16 | 56.2 Ų | 56.2 | 8% | 0.084 | 30% | 0.304 | C | S | . | . | trans | -85.3 | 39.6 | 175.9 | -151.6 | 78.5 | 0 | 0 | 0 | 111.5 | L340 V343 P344 L348 L436 F439 F456 | L340-L346 HydrophobicContact CD1-CD2 3.87Å; L340-L346 HydrophobicContact CD2-CD2 4.24Å; L340-L346 HydrophobicContact CG-CD2 3.59Å; L340-L346 WeakPolarHBondContact O-CD2 3.47Å; V343-L346 HydrophobicContact CB-CB 4.1Å; V343-L346 HydrophobicContact CG1-CB 4.3Å; V343-L346 VanDerWaalsContact O-CB 3.28Å; V343-L346 WeakPolarHBondContact O-CB 3.46Å; V343-L346 PolarHBondContact O-N 3.36Å; P344-L346 PolarHBondContact O-N 3.07Å; L346-L348 HydrophobicContact CD1-CD1 4.01Å; L346-L348 HydrophobicContact CD2-CD1 4.49Å; L346-L348 HydrophobicContact CG-CD1 3.94Å; L346-L348 PolarHBondContact O-N 3.03Å; L346-L436 HydrophobicContact CD1-CD2 4.47Å; L346-F439 HydrophobicContact CD1-CD1 4.06Å; L346-F439 HydrophobicContact CD1-CE1 3.82Å; L346-F439 HydrophobicContact CD2-CE1 3.98Å; L346-F439 HydrophobicContact CD2-CZ 4.41Å; L346-F439 HydrophobicContact CG-CE1 4.31Å; L346-F456 HydrophobicContact CD1-CD1 4.33Å; L346-F456 HydrophobicContact CD1-CE1 3.64Å; L346-F456 HydrophobicContact CD1-CE2 3.95Å; L346-F456 HydrophobicContact CD1-CZ 3.42Å; L346-F456 VanDerWaalsContact CD1-CZ 3.42Å | ||
| 347 | E | 58.3 | Low | 76 | Confident | 156 Ų | 156 | 56.2 Ų | 56.2 | 73% | 0.729 | 30% | 0.304 | S | S | * | . | trans | -68.3 | 62.4 | 166.8 | -74.3 | -172.7 | 164.4 | 0 | 0 | 110.2 | S345 Q349 | S345-E347 PolarHBondContact O-N 3.46Å; S345-E347 VanDerWaalsContact O-N 3.15Å; E347-Q349 HydrophobicContact CB-CG 4.37Å; E347-Q349 PolarHBondContact O-N 2.72Å | ||
| 348 | L | 56.3 | Low | 76 | Confident | 32 Ų | 32 | 56 Ų | 56 | 17% | 0.168 | 30% | 0.303 | C | S | . | . | trans | -71.8 | 68.8 | 163.8 | -81.9 | 158.8 | 0 | 0 | 0 | 108.2 | L346 P350 V353 F439 | L346-L348 HydrophobicContact CD1-CD1 4.01Å; L346-L348 HydrophobicContact CD2-CD1 4.49Å; L346-L348 HydrophobicContact CG-CD1 3.94Å; L346-L348 PolarHBondContact O-N 3.03Å; L348-P350 CarbonylContact O-C 3.28Å; L348-P350 WeakPolarHBondContact O-CA 3.34Å; L348-V353 HydrophobicContact CD2-CG1 3.92Å; L348-F439 HydrophobicContact CD1-CE1 3.48Å; L348-F439 VanDerWaalsContact CD1-CE1 3.48Å; L348-F439 HydrophobicContact CD1-CZ 3.86Å | ||
| 349 | Q | 57.6 | Low | 76.2 | Confident | 160 Ų | 160 | 56.6 Ų | 56.6 | 75% | 0.748 | 30% | 0.304 | S | S | * | . | S | Bend | trans | -67.1 | 107.6 | 167.5 | -67.4 | -83.4 | -41.2 | 0 | 0 | 107 | E347 | E347-Q349 HydrophobicContact CB-CG 4.37Å; E347-Q349 PolarHBondContact O-N 2.72Å |
| 350 | P | 62.8 | Low | 76 | Confident | 74 Ų | 74 | 58.9 Ų | 58.9 | 48% | 0.481 | 32% | 0.315 | S | S | . | . | S | Bend | cis | -109.1 | 157.8 | 16.3 | 36.2 | -29.5 | 0 | 0 | 0 | 116.4 | L348 S352 V353 | L348-P350 CarbonylContact O-C 3.28Å; L348-P350 WeakPolarHBondContact O-CA 3.34Å; P350-S352 PolarHBondContact O-N 3.17Å; P350-V353 HydrophobicContact CG-CG2 4.4Å; P350-V353 PolarHBondContact O-N 3.17Å |
| 351 | D | 65.9 | Low | 76.2 | Confident | 132 Ų | 132 | 59.3 Ų | 59.3 | 71% | 0.706 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -36.2 | -33.5 | 177.2 | -59.5 | -10.2 | 0 | 0 | 0 | 115.7 | V353 E354 E355 | D351-V353 VanDerWaalsContact C-N 3.29Å; D351-V353 PolarHBondContact O-N 2.92Å; D351-E354 PolarHBondContact O-N 3.38Å; D351-E355 PolarHBondContact O-N 3.11Å; D351-E355 VanDerWaalsContact O-N 3.12Å |
| 352 | S | 72.3 | Confident | 76.6 | Confident | 75 Ų | 75 | 54.7 Ų | 54.7 | 52% | 0.524 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.4 | -30.6 | 178 | 68 | 0 | 0 | 0 | 0 | 114.6 | P350 M356 | P350-S352 PolarHBondContact O-N 3.17Å; S352-M356 VanDerWaalsContact O-CB 3.23Å; S352-M356 WeakPolarHBondContact O-CB 3.48Å; S352-M356 PolarHBondContact O-N 3.02Å; S352-M356 VanDerWaalsContact O-N 3.14Å |
| 353 | V | 77.7 | Confident | 77.2 | Confident | 30 Ų | 30 | 52.1 Ų | 52.1 | 18% | 0.182 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -76.6 | -45.6 | -178.9 | -178.5 | 0 | 0 | 0 | 0 | 109.7 | L348 P350 D351 E355 M356 V357 | L348-V353 HydrophobicContact CD2-CG1 3.92Å; P350-V353 HydrophobicContact CG-CG2 4.4Å; P350-V353 PolarHBondContact O-N 3.17Å; D351-V353 VanDerWaalsContact C-N 3.29Å; D351-V353 PolarHBondContact O-N 2.92Å; V353-E355 PolarHBondContact O-N 3.07Å; V353-M356 PolarHBondContact O-N 3.05Å; V353-V357 HydrophobicContact CG1-CG2 4.2Å; V353-V357 VanDerWaalsContact O-CG2 3.27Å; V353-V357 WeakPolarHBondContact O-CG2 3.23Å; V353-V357 PolarHBondContact O-N 3.22Å |
| 354 | E | 80.1 | Confident | 77.7 | Confident | 22 Ų | 22 | 52.8 Ų | 52.8 | 10% | 0.103 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -57.2 | -50.4 | 175.6 | -171 | -165.6 | 164.5 | 0 | 0 | 111 | D351 M356 V357 L358 F439 L513 | D351-E354 PolarHBondContact O-N 3.38Å; E354-M356 VanDerWaalsContact C-N 3.3Å; E354-M356 PolarHBondContact O-N 3.45Å; E354-V357 PolarHBondContact O-N 3.35Å; E354-L358 HydrophobicContact CG-CD1 4.1Å; E354-L358 WeakPolarHBondContact O-CB 3.34Å; E354-L358 PolarHBondContact O-N 2.75Å; E354-F439 HydrophobicContact CG-CZ 4.4Å; E354-L513 WeakPolarHBondContact OE1-CD2 3.16Å |
| 355 | E | 84.2 | Confident | 78.8 | Confident | 55 Ų | 55 | 48.6 Ų | 48.6 | 26% | 0.257 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -57.1 | -44.3 | 177.4 | -173.8 | -168.5 | 131.6 | 0 | 0 | 111.6 | D351 V353 K359 P510 L513 | D351-E355 PolarHBondContact O-N 3.11Å; D351-E355 VanDerWaalsContact O-N 3.12Å; V353-E355 PolarHBondContact O-N 3.07Å; E355-K359 HydrophobicContact CG-CD 4.33Å; E355-K359 WeakPolarHBondContact O-CB 3.46Å; E355-K359 VanDerWaalsContact O-CG 3.29Å; E355-K359 WeakPolarHBondContact O-CG 3.45Å; E355-K359 PolarHBondContact O-N 2.92Å; E355-K359 WeakPolarHBondContact OE1-CE 3.43Å; E355-K359 IonicContact OE1-NZ 3.56Å; E355-K359 PolarHBondContact OE1-NZ 3.19Å; E355-P510 HydrophobicContact CG-CB 4.3Å; E355-P510 HydrophobicContact CG-CG 3.99Å; E355-P510 WeakPolarHBondContact OE1-CG 3.46Å; E355-L513 HydrophobicContact CB-CD1 3.88Å; E355-L513 HydrophobicContact CG-CD1 4.07Å |
| 356 | M | 82.8 | Confident | 80.1 | Confident | 65 Ų | 65 | 46.5 Ų | 46.5 | 32% | 0.32 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -67.1 | -42.5 | -179.5 | -179.7 | 177.2 | 51.6 | 0 | 0 | 112.2 | S352 V353 E354 Q360 F448 | S352-M356 VanDerWaalsContact O-CB 3.23Å; S352-M356 WeakPolarHBondContact O-CB 3.48Å; S352-M356 PolarHBondContact O-N 3.02Å; S352-M356 VanDerWaalsContact O-N 3.14Å; V353-M356 PolarHBondContact O-N 3.05Å; E354-M356 VanDerWaalsContact C-N 3.3Å; E354-M356 PolarHBondContact O-N 3.45Å; M356-Q360 PolarHBondContact O-N 3.47Å; M356-F448 HydrophobicContact CE-CD1 3.46Å; M356-F448 VanDerWaalsContact CE-CD1 3.46Å; M356-F448 HydrophobicContact CE-CE1 3.55Å; M356-F448 HydrophobicContact CG-CE1 4Å; M356-F448 HydrophobicContact SD-CD1 4.45Å; M356-F448 HydrophobicContact SD-CE1 4.05Å |
| 357 | V | 87.2 | Confident | 81.5 | Confident | 3 Ų | 3 | 45.7 Ų | 45.7 | 2% | 0.018 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -68.1 | -44.3 | 178.3 | 178.9 | 0 | 0 | 0 | 0 | 109.9 | V353 E354 K359 Q360 R361 F439 F448 L453 | V353-V357 HydrophobicContact CG1-CG2 4.2Å; V353-V357 VanDerWaalsContact O-CG2 3.27Å; V353-V357 WeakPolarHBondContact O-CG2 3.23Å; V353-V357 PolarHBondContact O-N 3.22Å; E354-V357 PolarHBondContact O-N 3.35Å; V357-K359 PolarHBondContact O-N 2.81Å; V357-Q360 CarbonylContact O-C 3.12Å; V357-Q360 WeakPolarHBondContact O-CA 3.36Å; V357-Q360 PolarHBondContact O-N 3.39Å; V357-R361 HydrophobicContact CG1-CG 4.18Å; V357-R361 WeakPolarHBondContact O-CB 3.33Å; V357-R361 PolarHBondContact O-N 3.03Å; V357-F439 HydrophobicContact CB-CD2 4.44Å; V357-F439 HydrophobicContact CB-CE2 3.62Å; V357-F439 HydrophobicContact CB-CZ 3.79Å; V357-F439 HydrophobicContact CG1-CD2 3.57Å; V357-F439 HydrophobicContact CG1-CE1 4.23Å; V357-F439 HydrophobicContact CG1-CE2 3.22Å; V357-F439 HydrophobicContact CG1-CG 4.21Å; V357-F439 HydrophobicContact CG1-CZ 3.62Å; V357-F439 WeakPolarHBondContact CG1-O 3.44Å; V357-F448 HydrophobicContact CG2-CD1 4Å; V357-F448 HydrophobicContact CG2-CE1 3.68Å; V357-L453 HydrophobicContact CG2-CD2 4.41Å |
| 358 | L | 89.3 | Confident | 83.3 | Confident | 1 Ų | 1 | 38.3 Ų | 38.3 | 1% | 0.005 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.4 | -45.4 | 175 | -85.1 | 170.5 | 0 | 0 | 0 | 111.8 | V337 L340 E354 Q360 R361 W362 F439 I509 L513 | V337-L358 HydrophobicContact CG1-CD1 3.9Å; V337-L358 HydrophobicContact CG2-CD2 4.41Å; L340-L358 HydrophobicContact CD2-CD1 4.43Å; L340-L358 HydrophobicContact CD2-CD2 3.59Å; L340-L358 HydrophobicContact CD2-CG 4.03Å; E354-L358 HydrophobicContact CG-CD1 4.1Å; E354-L358 WeakPolarHBondContact O-CB 3.34Å; E354-L358 PolarHBondContact O-N 2.75Å; L358-Q360 PolarHBondContact O-N 3.07Å; L358-Q360 VanDerWaalsContact O-N 3.13Å; L358-R361 PolarHBondContact O-N 3.49Å; L358-R361 VanDerWaalsContact O-N 3.14Å; L358-W362 WeakPolarHBondContact O-CA 3.25Å; L358-W362 VanDerWaalsContact O-CB 3.23Å; L358-W362 WeakPolarHBondContact O-CB 3.42Å; L358-W362 PolarHBondContact O-N 3.4Å; L358-F439 HydrophobicContact CD2-CE2 4.28Å; L358-F439 HydrophobicContact CG-CE2 3.97Å; L358-I509 HydrophobicContact CB-CG2 3.75Å; L358-I509 HydrophobicContact CD1-CG2 4.28Å; L358-L513 HydrophobicContact CD1-CD1 4Å; L358-L513 HydrophobicContact CD1-CD2 3.72Å; L358-L513 HydrophobicContact CD1-CG 4.17Å |
| 359 | K | 88.6 | Confident | 85.1 | Confident | 62 Ų | 62 | 36.8 Ų | 36.8 | 27% | 0.27 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -54.9 | -33.4 | 173.7 | -80.3 | 171.7 | 166.2 | 169 | 0 | 112.9 | E355 V357 E506 I509 P510 | E355-K359 HydrophobicContact CG-CD 4.33Å; E355-K359 WeakPolarHBondContact O-CB 3.46Å; E355-K359 VanDerWaalsContact O-CG 3.29Å; E355-K359 WeakPolarHBondContact O-CG 3.45Å; E355-K359 PolarHBondContact O-N 2.92Å; E355-K359 WeakPolarHBondContact OE1-CE 3.43Å; E355-K359 IonicContact OE1-NZ 3.56Å; E355-K359 PolarHBondContact OE1-NZ 3.19Å; V357-K359 PolarHBondContact O-N 2.81Å; K359-E506 HydrophobicContact CB-CG 4.47Å; K359-E506 WeakPolarHBondContact CE-O 3.4Å; K359-E506 HydrophobicContact CG-CB 4.25Å; K359-E506 WeakPolarHBondContact CG-O 3.42Å; K359-E506 WeakPolarHBondContact O-CG 3.33Å; K359-I509 HydrophobicContact CG-CB 4.31Å; K359-I509 HydrophobicContact CG-CG2 4.42Å; K359-P510 VanDerWaalsContact CE-CG 3.49Å |
| 360 | Q | 88.2 | Confident | 86.9 | Confident | 57 Ų | 57 | 29.3 Ų | 29.3 | 27% | 0.266 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -83.2 | -34.9 | 177.7 | -67.8 | -170.3 | 25.5 | 0 | 0 | 113.3 | M356 V357 L358 S444 K488 | M356-Q360 PolarHBondContact O-N 3.47Å; V357-Q360 CarbonylContact O-C 3.12Å; V357-Q360 WeakPolarHBondContact O-CA 3.36Å; V357-Q360 PolarHBondContact O-N 3.39Å; L358-Q360 PolarHBondContact O-N 3.07Å; L358-Q360 VanDerWaalsContact O-N 3.13Å; Q360-S444 VanDerWaalsContact OE1-CB 3.23Å; Q360-K488 WeakPolarHBondContact O-CE 3.19Å; Q360-K488 PolarHBondContact O-NZ 3.35Å |
| 361 | R | 90.8 | Very high | 88.4 | Confident | 9 Ų | 9 | 26.1 Ų | 26.1 | 3% | 0.034 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -111.8 | 0.5 | -168.9 | -60.8 | -63.3 | -175.4 | 177.4 | 1.8 | 115.3 | V357 L358 C363 E364 I365 A441 D443 S444 | V357-R361 HydrophobicContact CG1-CG 4.18Å; V357-R361 WeakPolarHBondContact O-CB 3.33Å; V357-R361 PolarHBondContact O-N 3.03Å; L358-R361 PolarHBondContact O-N 3.49Å; L358-R361 VanDerWaalsContact O-N 3.14Å; R361-C363 PolarHBondContact O-N 2.84Å; R361-E364 WeakPolarHBondContact CD-OE1 3.42Å; R361-E364 IonicContact CZ-OE1 3.42Å; R361-E364 IonicContact NE-OE1 3.54Å; R361-E364 IonicContact NH1-OE1 3.44Å; R361-E364 PolarHBondContact NH1-OE1 2.96Å; R361-E364 PolarHBondContact O-N 3.27Å; R361-I365 PolarHBondContact O-N 3.05Å; R361-A441 PolarHBondContact NH2-O 3.34Å; R361-D443 IonicContact CZ-OD1 2.63Å; R361-D443 IonicContact CZ-OD2 2.76Å; R361-D443 IonicContact NH1-OD1 3.38Å; R361-D443 IonicContact NH1-OD2 3.74Å; R361-D443 PolarHBondContact NH1-OD2 3.29Å; R361-D443 VanDerWaalsContact NH1-OD2 3.14Å; R361-D443 IonicContact NH2-OD1 2.63Å; R361-D443 PolarHBondContact NH2-OD1 2.82Å; R361-D443 IonicContact NH2-OD2 2.84Å; R361-D443 PolarHBondContact NH2-OD2 2.96Å; R361-S444 PolarHBondContact NH2-OG 2.95Å |
| 362 | W | 92.8 | Very high | 89.8 | Confident | 2 Ų | 2 | 20.8 Ų | 20.8 | 1% | 0.008 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -51 | -38.7 | -174.3 | 74.4 | -94.3 | 0 | 0 | 0 | 112.8 | L333 L358 I365 F366 K488 V492 F496 I505 E506 I509 | L333-W362 HydrophobicContact CD1-CE3 3.88Å; L333-W362 HydrophobicContact CD1-CZ3 4.47Å; L358-W362 WeakPolarHBondContact O-CA 3.25Å; L358-W362 VanDerWaalsContact O-CB 3.23Å; L358-W362 WeakPolarHBondContact O-CB 3.42Å; L358-W362 PolarHBondContact O-N 3.4Å; W362-I365 PolarHBondContact O-N 2.85Å; W362-F366 HydrophobicContact CE3-CB 4.1Å; W362-F366 HydrophobicContact CZ3-CB 4.25Å; W362-F366 HydrophobicContact CZ3-CD1 4.35Å; W362-F366 HydrophobicContact CZ3-CG 4.3Å; W362-F366 WeakPolarHBondContact O-CB 3.12Å; W362-F366 PolarHBondContact O-N 3.47Å; W362-K488 HydrophobicContact CZ2-CB 4.2Å; W362-V492 HydrophobicContact CH2-CG2 3.56Å; W362-V492 HydrophobicContact CZ2-CG2 3.73Å; W362-F496 HydrophobicContact CZ3-CE2 4.37Å; W362-I505 HydrophobicContact CD2-CB 4.08Å; W362-I505 HydrophobicContact CD2-CG2 3.59Å; W362-I505 HydrophobicContact CE3-CB 4.4Å; W362-I505 HydrophobicContact CE3-CG2 3.77Å; W362-I505 HydrophobicContact CG-CG2 4.05Å; W362-I505 HydrophobicContact CH2-CB 4.16Å; W362-I505 HydrophobicContact CH2-CG1 3.75Å; W362-I505 HydrophobicContact CH2-CG2 4.37Å; W362-I505 HydrophobicContact CZ2-CB 3.78Å; W362-I505 HydrophobicContact CZ2-CG1 3.79Å; W362-I505 HydrophobicContact CZ2-CG2 4.2Å; W362-I505 HydrophobicContact CZ3-CB 4.45Å; W362-I505 HydrophobicContact CZ3-CG1 4.17Å; W362-I505 HydrophobicContact CZ3-CG2 4.16Å; W362-E506 PolarHBondContact NE1-OE1 3.36Å; W362-I509 HydrophobicContact CB-CD1 4.03Å |
| 363 | C | 94.3 | Very high | 90.7 | Very high | 5 Ų | 5 | 17.2 Ų | 17.2 | 3% | 0.034 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -66 | -39.5 | -178.1 | -171 | 0 | 0 | 0 | 0 | 111.8 | R361 L367 K488 | R361-C363 PolarHBondContact O-N 2.84Å; C363-L367 WeakPolarHBondContact O-CB 3.23Å; C363-L367 WeakPolarHBondContact O-CG 3.17Å; C363-L367 PolarHBondContact O-N 3.34Å; C363-K488 HydrophobicContact CB-CD 4.45Å; C363-K488 HydrophobicContact CB-CG 3.88Å |
| 364 | E | 95.1 | Very high | 91.3 | Very high | 18 Ų | 18 | 16.1 Ų | 16.1 | 8% | 0.084 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -67.3 | -43.1 | 178.1 | -59.1 | -178.3 | -131.7 | 0 | 0 | 110.4 | R361 L367 L368 A438 L483 R484 | R361-E364 WeakPolarHBondContact CD-OE1 3.42Å; R361-E364 IonicContact CZ-OE1 3.42Å; R361-E364 IonicContact NE-OE1 3.54Å; R361-E364 IonicContact NH1-OE1 3.44Å; R361-E364 PolarHBondContact NH1-OE1 2.96Å; R361-E364 PolarHBondContact O-N 3.27Å; E364-L367 PolarHBondContact O-N 3.1Å; E364-L368 WeakPolarHBondContact O-CG 3.15Å; E364-L368 PolarHBondContact O-N 3.22Å; E364-A438 HydrophobicContact CB-CB 4.37Å; E364-L483 HydrophobicContact CB-CB 4.28Å; E364-L483 HydrophobicContact CB-CD1 4.27Å; E364-L483 HydrophobicContact CG-CB 4.02Å; E364-R484 VanDerWaalsContact CD-NE 3.29Å; E364-R484 IonicContact OE1-CZ 2.78Å; E364-R484 IonicContact OE1-NE 3.41Å; E364-R484 PolarHBondContact OE1-NE 3.03Å; E364-R484 IonicContact OE2-CZ 3.49Å; E364-R484 IonicContact OE2-NE 3.23Å; E364-R484 PolarHBondContact OE2-NE 2.94Å; E364-R484 IonicContact OE2-NH2 3.11Å |
| 365 | I | 94.7 | Very high | 91.5 | Very high | 2 Ų | 2 | 20 Ų | 20 | 1% | 0.01 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -66.7 | -44.1 | 178 | -50.9 | -53.4 | 0 | 0 | 0 | 111.1 | R361 W362 L368 G369 K435 A438 F439 | R361-I365 PolarHBondContact O-N 3.05Å; W362-I365 PolarHBondContact O-N 2.85Å; I365-L368 PolarHBondContact O-N 2.93Å; I365-G369 PolarHBondContact O-N 3.36Å; I365-K435 HydrophobicContact CD1-CB 4.5Å; I365-K435 VanDerWaalsContact CD1-O 3.27Å; I365-K435 WeakPolarHBondContact CD1-O 3.26Å; I365-A438 HydrophobicContact CD1-CB 4.09Å; I365-F439 HydrophobicContact CD1-CB 3.86Å |
| 366 | F | 95.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -60.3 | -45.8 | 176 | 171.6 | -100.4 | 0 | 0 | 0 | 111.4 | A329 L332 L333 W362 G369 L370 V491 F495 F496 | A329-F366 HydrophobicContact CB-CE2 4.28Å; A329-F366 HydrophobicContact CB-CZ 4.11Å; L332-F366 HydrophobicContact CB-CE2 4.26Å; L332-F366 HydrophobicContact CD2-CD2 4.19Å; L332-F366 HydrophobicContact CD2-CE2 3.72Å; L332-F366 HydrophobicContact CD2-CZ 4.28Å; L332-F366 HydrophobicContact CG-CD2 4.23Å; L332-F366 HydrophobicContact CG-CE2 4.04Å; L333-F366 HydrophobicContact CB-CD2 4.14Å; L333-F366 HydrophobicContact CB-CE2 4.46Å; L333-F366 HydrophobicContact CD1-CB 4.44Å; L333-F366 HydrophobicContact CD1-CD2 4.34Å; W362-F366 HydrophobicContact CE3-CB 4.1Å; W362-F366 HydrophobicContact CZ3-CB 4.25Å; W362-F366 HydrophobicContact CZ3-CD1 4.35Å; W362-F366 HydrophobicContact CZ3-CG 4.3Å; W362-F366 WeakPolarHBondContact O-CB 3.12Å; W362-F366 PolarHBondContact O-N 3.47Å; F366-G369 PolarHBondContact O-N 3.07Å; F366-L370 HydrophobicContact CE1-CD2 4.42Å; F366-L370 HydrophobicContact CZ-CD1 4.32Å; F366-L370 VanDerWaalsContact O-CB 3.31Å; F366-L370 WeakPolarHBondContact O-CB 3.44Å; F366-L370 PolarHBondContact O-N 2.94Å; F366-V491 HydrophobicContact CD1-CG1 3.98Å; F366-V491 HydrophobicContact CE1-CG1 3.86Å; F366-F495 HydrophobicContact CE1-CD2 4.04Å; F366-F495 HydrophobicContact CE1-CG 4.3Å; F366-F495 HydrophobicContact CZ-CB 4.19Å; F366-F495 HydrophobicContact CZ-CD2 4.4Å; F366-F495 HydrophobicContact CZ-CG 4.19Å; F366-F496 HydrophobicContact CD2-CZ 4.06Å; F366-F496 AromaticContact CE1-CE2 3.99Å; F366-F496 HydrophobicContact CE1-CE2 3.99Å; F366-F496 HydrophobicContact CE1-CZ 4.38Å; F366-F496 AromaticContact CE2-CE2 3.98Å; F366-F496 HydrophobicContact CE2-CE2 3.98Å; F366-F496 AromaticContact CE2-CZ 3.54Å; F366-F496 HydrophobicContact CE2-CZ 3.54Å; F366-F496 AromaticContact CZ-CE2 3.67Å; F366-F496 HydrophobicContact CZ-CE2 3.67Å; F366-F496 AromaticContact CZ-CZ 3.72Å; F366-F496 HydrophobicContact CZ-CZ 3.72Å |
| 367 | L | 96.7 | Very high | 91.3 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65.5 | -40.3 | 179.2 | -73.4 | 174 | 0 | 0 | 0 | 112 | C363 E364 L370 M371 L414 L483 F486 V491 | C363-L367 WeakPolarHBondContact O-CB 3.23Å; C363-L367 WeakPolarHBondContact O-CG 3.17Å; C363-L367 PolarHBondContact O-N 3.34Å; E364-L367 PolarHBondContact O-N 3.1Å; L367-L370 HydrophobicContact CD2-CD2 4.15Å; L367-L370 WeakPolarHBondContact O-CB 3.37Å; L367-L370 PolarHBondContact O-N 2.77Å; L367-M371 VanDerWaalsContact O-CG 3.3Å; L367-M371 WeakPolarHBondContact O-CG 3.44Å; L367-M371 PolarHBondContact O-N 3.02Å; L367-L414 HydrophobicContact CD2-CD2 3.62Å; L367-L483 HydrophobicContact CB-CD2 3.91Å; L367-L483 HydrophobicContact CD1-CD2 4.37Å; L367-F486 HydrophobicContact CD1-CB 3.92Å; L367-F486 HydrophobicContact CD1-CD1 4.44Å; L367-F486 HydrophobicContact CD1-CD2 3.42Å; L367-F486 VanDerWaalsContact CD1-CD2 3.42Å; L367-F486 HydrophobicContact CD1-CE2 4Å; L367-F486 HydrophobicContact CD1-CG 3.66Å; L367-V491 HydrophobicContact CD2-CG1 4.37Å |
| 368 | L | 96.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 20.2 Ų | 20.2 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -63 | -41.9 | 173.1 | -75.3 | 171.4 | 0 | 0 | 0 | 112 | E364 I365 L370 M371 Q372 F417 L434 K435 A438 L480 L483 | E364-L368 WeakPolarHBondContact O-CG 3.15Å; E364-L368 PolarHBondContact O-N 3.22Å; I365-L368 PolarHBondContact O-N 2.93Å; L368-L370 VanDerWaalsContact C-N 3.33Å; L368-M371 PolarHBondContact O-N 3.35Å; L368-Q372 PolarHBondContact O-N 3.34Å; L368-F417 HydrophobicContact CD2-CZ 4.34Å; L368-L434 HydrophobicContact CD1-CB 4.3Å; L368-L434 HydrophobicContact CD2-CB 4.42Å; L368-K435 HydrophobicContact CB-CG 3.86Å; L368-K435 HydrophobicContact CD1-CB 4.42Å; L368-K435 HydrophobicContact CD1-CG 3.94Å; L368-A438 HydrophobicContact CD1-CB 3.97Å; L368-L480 HydrophobicContact CD1-CD2 4.42Å; L368-L483 HydrophobicContact CD1-CD1 3.79Å; L368-L483 HydrophobicContact CD2-CD1 4.02Å; L368-L483 HydrophobicContact CG-CD1 3.73Å; L368-L483 HydrophobicContact CG-CD2 4.32Å |
| 369 | G | 95 | Very high | 91.1 | Very high | 0 Ų | 0 | 20.2 Ų | 20.2 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -62.7 | -39.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | F308 I365 F366 M371 Q372 C373 | F308-G369 VanDerWaalsContact CE1-CA 3.48Å; I365-G369 PolarHBondContact O-N 3.36Å; F366-G369 PolarHBondContact O-N 3.07Å; G369-M371 VanDerWaalsContact C-N 3.33Å; G369-M371 PolarHBondContact O-N 3.22Å; G369-Q372 PolarHBondContact O-N 3.35Å; G369-C373 PolarHBondContact O-N 3.11Å |
| 370 | L | 94.4 | Very high | 91.1 | Very high | 4 Ų | 4 | 18.5 Ų | 18.5 | 2% | 0.021 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -62.7 | -41.1 | 177.7 | -173.3 | 75.7 | 0 | 0 | 0 | 111.3 | L332 F366 L367 L368 A374 F377 L379 F495 | L332-L370 HydrophobicContact CD2-CB 3.82Å; L332-L370 HydrophobicContact CD2-CD1 3.63Å; L332-L370 HydrophobicContact CD2-CG 4.35Å; F366-L370 HydrophobicContact CE1-CD2 4.42Å; F366-L370 HydrophobicContact CZ-CD1 4.32Å; F366-L370 VanDerWaalsContact O-CB 3.31Å; F366-L370 WeakPolarHBondContact O-CB 3.44Å; F366-L370 PolarHBondContact O-N 2.94Å; L367-L370 HydrophobicContact CD2-CD2 4.15Å; L367-L370 WeakPolarHBondContact O-CB 3.37Å; L367-L370 PolarHBondContact O-N 2.77Å; L368-L370 VanDerWaalsContact C-N 3.33Å; L370-A374 WeakPolarHBondContact O-CA 3.37Å; L370-A374 PolarHBondContact O-N 3.29Å; L370-A374 VanDerWaalsContact O-N 3.1Å; L370-F377 HydrophobicContact CD1-CE2 4.13Å; L370-F377 HydrophobicContact CD1-CZ 3.65Å; L370-F377 HydrophobicContact CG-CZ 4.47Å; L370-L379 HydrophobicContact CD1-CD1 4.32Å; L370-L379 HydrophobicContact CD2-CD1 4.24Å; L370-L379 HydrophobicContact CD2-CD2 4.03Å; L370-L379 HydrophobicContact CG-CD1 4.32Å; L370-L379 HydrophobicContact CG-CD2 3.82Å; L370-F495 HydrophobicContact CD1-CE1 4.13Å; L370-F495 HydrophobicContact CD1-CZ 4.43Å; L370-F495 HydrophobicContact CD2-CE1 4.01Å; L370-F495 HydrophobicContact CD2-CE2 3.83Å; L370-F495 HydrophobicContact CD2-CZ 3.47Å; L370-F495 VanDerWaalsContact CD2-CZ 3.47Å |
| 371 | M | 95.1 | Very high | 91.1 | Very high | 7 Ų | 7 | 21.5 Ų | 21.5 | 3% | 0.034 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -70.3 | -40.7 | 176.3 | -64 | -53 | 123.1 | 0 | 0 | 112.2 | L367 L368 G369 C373 A374 L379 L414 F417 L418 I421 F431 | L367-M371 VanDerWaalsContact O-CG 3.3Å; L367-M371 WeakPolarHBondContact O-CG 3.44Å; L367-M371 PolarHBondContact O-N 3.02Å; L368-M371 PolarHBondContact O-N 3.35Å; G369-M371 VanDerWaalsContact C-N 3.33Å; G369-M371 PolarHBondContact O-N 3.22Å; M371-C373 VanDerWaalsContact C-N 3.28Å; M371-C373 PolarHBondContact O-N 3.5Å; M371-A374 VanDerWaalsContact O-CB 3.25Å; M371-A374 WeakPolarHBondContact O-CB 2.98Å; M371-A374 PolarHBondContact O-N 3.16Å; M371-L379 HydrophobicContact CE-CD2 3.62Å; M371-L379 HydrophobicContact SD-CD2 4.15Å; M371-L414 HydrophobicContact CE-CD2 4.19Å; M371-F417 HydrophobicContact CE-CD1 4.1Å; M371-F417 HydrophobicContact CG-CD1 3.66Å; M371-F417 HydrophobicContact CG-CE1 3.44Å; M371-F417 VanDerWaalsContact CG-CE1 3.44Å; M371-F417 HydrophobicContact CG-CZ 4.23Å; M371-F417 HydrophobicContact SD-CD1 3.87Å; M371-F417 HydrophobicContact SD-CE1 4.29Å; M371-L418 HydrophobicContact SD-CB 3.98Å; M371-L418 HydrophobicContact SD-CD1 4.05Å; M371-I421 HydrophobicContact CB-CB 4.49Å; M371-I421 HydrophobicContact CB-CG1 4.05Å; M371-I421 HydrophobicContact CB-CG2 4.17Å; M371-I421 HydrophobicContact CG-CG1 4.05Å; M371-F431 HydrophobicContact CB-CE1 4.33Å |
| 372 | Q | 94.3 | Very high | 90.9 | Very high | 20 Ų | 20 | 22.1 Ų | 22.1 | 9% | 0.093 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62 | -37.3 | 177 | -172.2 | 171.3 | 10.2 | 0 | 0 | 112.1 | F308 L368 G369 D428 F431 | F308-Q372 HydrophobicContact CD1-CB 4.34Å; F308-Q372 HydrophobicContact CD1-CG 4.28Å; L368-Q372 PolarHBondContact O-N 3.34Å; G369-Q372 PolarHBondContact O-N 3.35Å; Q372-D428 PolarHBondContact NE2-OD1 3.06Å; Q372-F431 HydrophobicContact CB-CD1 4Å; Q372-F431 HydrophobicContact CB-CD2 4.07Å; Q372-F431 HydrophobicContact CB-CE1 4Å; Q372-F431 HydrophobicContact CB-CE2 4.08Å; Q372-F431 HydrophobicContact CB-CG 4.03Å; Q372-F431 HydrophobicContact CB-CZ 4.03Å; Q372-F431 HydrophobicContact CG-CB 4.42Å; Q372-F431 HydrophobicContact CG-CD1 4.46Å; Q372-F431 HydrophobicContact CG-CD2 3.74Å; Q372-F431 HydrophobicContact CG-CE2 4.02Å; Q372-F431 HydrophobicContact CG-CG 3.97Å; Q372-F431 HydrophobicContact CG-CZ 4.49Å |
| 373 | C | 91.8 | Very high | 90.7 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 13% | 0.133 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.5 | 8.5 | 178.5 | -58.2 | 0 | 0 | 0 | 0 | 113.8 | G369 M371 S375 Q376 F377 | G369-C373 PolarHBondContact O-N 3.11Å; M371-C373 VanDerWaalsContact C-N 3.28Å; M371-C373 PolarHBondContact O-N 3.5Å; C373-S375 VanDerWaalsContact C-N 3.27Å; C373-S375 PolarHBondContact O-N 3.02Å; C373-Q376 WeakPolarHBondContact O-CB 3.49Å; C373-Q376 PolarHBondContact O-N 2.73Å; C373-F377 HydrophobicContact CB-CD1 4.44Å; C373-F377 HydrophobicContact CB-CE1 3.69Å; C373-F377 WeakPolarHBondContact O-CD1 3.42Å; C373-F377 WeakPolarHBondContact O-CE1 3.34Å |
| 374 | A | 90.6 | Very high | 90.5 | Very high | 7 Ų | 7 | 25.1 Ų | 25.1 | 6% | 0.058 | 15% | 0.152 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -34.8 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114 | L370 M371 C378 L379 L418 | L370-A374 WeakPolarHBondContact O-CA 3.37Å; L370-A374 PolarHBondContact O-N 3.29Å; L370-A374 VanDerWaalsContact O-N 3.1Å; M371-A374 VanDerWaalsContact O-CB 3.25Å; M371-A374 WeakPolarHBondContact O-CB 2.98Å; M371-A374 PolarHBondContact O-N 3.16Å; A374-C378 PolarHBondContact O-N 3.41Å; A374-C378 VanDerWaalsContact O-N 3.16Å; A374-L379 HydrophobicContact CB-CB 3.85Å; A374-L379 HydrophobicContact CB-CD2 3.93Å; A374-L379 PolarHBondContact O-N 2.92Å; A374-L418 HydrophobicContact CB-CD1 3.47Å; A374-L418 VanDerWaalsContact CB-CD1 3.47Å |
| 375 | S | 84 | Confident | 90 | Very high | 102 Ų | 102 | 26 Ų | 26 | 71% | 0.713 | 16% | 0.162 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -71.7 | -31.4 | 177.9 | 56.7 | 0 | 0 | 0 | 0 | 112.9 | C373 F377 | C373-S375 VanDerWaalsContact C-N 3.27Å; C373-S375 PolarHBondContact O-N 3.02Å; S375-F377 VanDerWaalsContact C-N 3.26Å; S375-F377 PolarHBondContact O-N 3.38Å |
| 376 | Q | 83.7 | Confident | 89.6 | Confident | 64 Ų | 64 | 26 Ų | 26 | 30% | 0.299 | 16% | 0.162 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -28.3 | -174.8 | -58.6 | -179.3 | 14.5 | 0 | 0 | 112.5 | L310 V312 C373 | L310-Q376 PolarHBondContact O-OE1 2.85Å; L310-Q376 VanDerWaalsContact O-OE1 3.1Å; V312-Q376 HydrophobicContact CG2-CB 3.9Å; C373-Q376 WeakPolarHBondContact O-CB 3.49Å; C373-Q376 PolarHBondContact O-N 2.73Å |
| 377 | F | 79.2 | Confident | 89.3 | Confident | 5 Ų | 5 | 26.7 Ų | 26.7 | 2% | 0.022 | 17% | 0.167 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -130.1 | 18.7 | -179.8 | 58.3 | -99.8 | 0 | 0 | 0 | 114.2 | L310 V312 L316 Y324 T328 L370 C373 S375 L379 M382 | L310-F377 HydrophobicContact CD2-CD1 4.39Å; L310-F377 HydrophobicContact CD2-CE1 4.33Å; V312-F377 HydrophobicContact CG1-CB 4.41Å; V312-F377 HydrophobicContact CG2-CD1 4.46Å; L316-F377 HydrophobicContact CD2-CB 4.38Å; Y324-F377 HydrophobicContact CE1-CB 4.34Å; T328-F377 HydrophobicContact CG2-CD1 3.75Å; T328-F377 HydrophobicContact CG2-CE1 4.11Å; T328-F377 HydrophobicContact CG2-CG 4.01Å; L370-F377 HydrophobicContact CD1-CE2 4.13Å; L370-F377 HydrophobicContact CD1-CZ 3.65Å; L370-F377 HydrophobicContact CG-CZ 4.47Å; C373-F377 HydrophobicContact CB-CD1 4.44Å; C373-F377 HydrophobicContact CB-CE1 3.69Å; C373-F377 WeakPolarHBondContact O-CD1 3.42Å; C373-F377 WeakPolarHBondContact O-CE1 3.34Å; S375-F377 VanDerWaalsContact C-N 3.26Å; S375-F377 PolarHBondContact O-N 3.38Å; F377-L379 HydrophobicContact CD2-CB 4.41Å; F377-L379 HydrophobicContact CE2-CB 3.79Å; F377-L379 HydrophobicContact CE2-CD1 4Å; F377-L379 HydrophobicContact CE2-CG 4.37Å; F377-M382 HydrophobicContact CD2-CE 3.21Å; F377-M382 HydrophobicContact CD2-SD 4.18Å; F377-M382 HydrophobicContact CE2-CE 3.39Å; F377-M382 HydrophobicContact CG-CE 4.44Å |
| 378 | C | 83.9 | Confident | 88.8 | Confident | 60 Ų | 60 | 30 Ų | 30 | 41% | 0.405 | 19% | 0.188 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.8 | 53.1 | 175.5 | -60.5 | 0 | 0 | 0 | 0 | 114 | A374 G380 N381 M382 | A374-C378 PolarHBondContact O-N 3.41Å; A374-C378 VanDerWaalsContact O-N 3.16Å; C378-G380 VanDerWaalsContact C-N 3.29Å; C378-G380 PolarHBondContact O-N 3.46Å; C378-N381 HydrophobicContact CB-CB 4.32Å; C378-N381 PolarHBondContact O-N 3.21Å; C378-N381 VanDerWaalsContact O-N 3.08Å; C378-M382 PolarHBondContact O-N 3.47Å |
| 379 | L | 88.6 | Confident | 88.1 | Confident | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.005 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -51.5 | -42.8 | -176.4 | -179.7 | 62 | 0 | 0 | 0 | 113.9 | L370 M371 A374 F377 N381 M382 L383 L418 F495 | L370-L379 HydrophobicContact CD1-CD1 4.32Å; L370-L379 HydrophobicContact CD2-CD1 4.24Å; L370-L379 HydrophobicContact CD2-CD2 4.03Å; L370-L379 HydrophobicContact CG-CD1 4.32Å; L370-L379 HydrophobicContact CG-CD2 3.82Å; M371-L379 HydrophobicContact CE-CD2 3.62Å; M371-L379 HydrophobicContact SD-CD2 4.15Å; A374-L379 HydrophobicContact CB-CB 3.85Å; A374-L379 HydrophobicContact CB-CD2 3.93Å; A374-L379 PolarHBondContact O-N 2.92Å; F377-L379 HydrophobicContact CD2-CB 4.41Å; F377-L379 HydrophobicContact CE2-CB 3.79Å; F377-L379 HydrophobicContact CE2-CD1 4Å; F377-L379 HydrophobicContact CE2-CG 4.37Å; L379-N381 VanDerWaalsContact C-N 3.3Å; L379-N381 PolarHBondContact O-N 3.18Å; L379-M382 HydrophobicContact CD1-CE 3.89Å; L379-M382 WeakPolarHBondContact O-CB 3.37Å; L379-M382 PolarHBondContact O-N 3.1Å; L379-M382 VanDerWaalsContact O-N 3.11Å; L379-L383 HydrophobicContact CD1-CD1 4.13Å; L379-L383 HydrophobicContact CD1-CD2 4.3Å; L379-L383 HydrophobicContact CD1-CG 3.93Å; L379-L383 HydrophobicContact CD2-CD1 4.45Å; L379-L383 HydrophobicContact CG-CD1 3.91Å; L379-L383 HydrophobicContact CG-CG 4.16Å; L379-L383 WeakPolarHBondContact O-CG 3.24Å; L379-L383 PolarHBondContact O-N 2.81Å; L379-L418 HydrophobicContact CB-CD2 4.34Å; L379-L418 HydrophobicContact CD2-CD1 4.44Å; L379-L418 HydrophobicContact CD2-CD2 4.4Å; L379-L418 HydrophobicContact CG-CD2 4.32Å; L379-F495 HydrophobicContact CD1-CE1 4.1Å; L379-F495 HydrophobicContact CD1-CZ 4.19Å |
| 380 | G | 88.9 | Confident | 87.7 | Confident | 25 Ų | 25 | 33 Ų | 33 | 26% | 0.258 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -58 | -41 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | C378 T384 | C378-G380 VanDerWaalsContact C-N 3.29Å; C378-G380 PolarHBondContact O-N 3.46Å; G380-T384 WeakPolarHBondContact O-CB 3.25Å; G380-T384 PolarHBondContact O-N 2.88Å; G380-T384 PolarHBondContact O-OG1 3.04Å |
| 381 | N | 86.4 | Confident | 87.4 | Confident | 121 Ų | 121 | 36.7 Ų | 36.7 | 65% | 0.647 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -67.8 | -41 | 176.4 | -67.5 | -7.4 | 0 | 0 | 0 | 111.1 | C378 L379 T384 A385 | C378-N381 HydrophobicContact CB-CB 4.32Å; C378-N381 PolarHBondContact O-N 3.21Å; C378-N381 VanDerWaalsContact O-N 3.08Å; L379-N381 VanDerWaalsContact C-N 3.3Å; L379-N381 PolarHBondContact O-N 3.18Å; N381-T384 PolarHBondContact O-N 3.21Å; N381-A385 WeakPolarHBondContact O-CB 3.45Å; N381-A385 PolarHBondContact O-N 3.03Å |
| 382 | M | 86.7 | Confident | 86.8 | Confident | 22 Ų | 22 | 38.1 Ų | 38.1 | 11% | 0.108 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.8 | -46 | 177.1 | -62.6 | -163 | -51.3 | 0 | 0 | 111.8 | I325 F377 C378 L379 T384 A385 M386 | I325-M382 HydrophobicContact CG1-SD 3.87Å; F377-M382 HydrophobicContact CD2-CE 3.21Å; F377-M382 HydrophobicContact CD2-SD 4.18Å; F377-M382 HydrophobicContact CE2-CE 3.39Å; F377-M382 HydrophobicContact CG-CE 4.44Å; C378-M382 PolarHBondContact O-N 3.47Å; L379-M382 HydrophobicContact CD1-CE 3.89Å; L379-M382 WeakPolarHBondContact O-CB 3.37Å; L379-M382 PolarHBondContact O-N 3.1Å; L379-M382 VanDerWaalsContact O-N 3.11Å; M382-T384 VanDerWaalsContact C-N 3.33Å; M382-T384 PolarHBondContact O-N 2.84Å; M382-A385 PolarHBondContact O-N 2.78Å; M382-M386 WeakPolarHBondContact O-CB 3.26Å; M382-M386 VanDerWaalsContact O-CG 3.25Å; M382-M386 WeakPolarHBondContact O-CG 3.42Å; M382-M386 PolarHBondContact O-N 3.36Å |
| 383 | L | 90.1 | Very high | 86 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.5 | -40.7 | 178 | -68.4 | 174.5 | 0 | 0 | 0 | 111.7 | L379 M386 A387 I411 L414 Q415 F495 | L379-L383 HydrophobicContact CD1-CD1 4.13Å; L379-L383 HydrophobicContact CD1-CD2 4.3Å; L379-L383 HydrophobicContact CD1-CG 3.93Å; L379-L383 HydrophobicContact CD2-CD1 4.45Å; L379-L383 HydrophobicContact CG-CD1 3.91Å; L379-L383 HydrophobicContact CG-CG 4.16Å; L379-L383 WeakPolarHBondContact O-CG 3.24Å; L379-L383 PolarHBondContact O-N 2.81Å; L383-M386 HydrophobicContact CD2-SD 4.28Å; L383-M386 PolarHBondContact O-N 3.47Å; L383-A387 WeakPolarHBondContact O-CB 3.13Å; L383-A387 PolarHBondContact O-N 3.38Å; L383-I411 HydrophobicContact CB-CG2 4.32Å; L383-L414 HydrophobicContact CD1-CB 3.79Å; L383-L414 HydrophobicContact CD2-CB 4.11Å; L383-L414 HydrophobicContact CD2-CD1 3.81Å; L383-Q415 HydrophobicContact CB-CG 3.86Å; L383-Q415 HydrophobicContact CD1-CG 3.97Å; L383-F495 HydrophobicContact CD2-CZ 4.3Å |
| 384 | T | 89 | Confident | 85.7 | Confident | 69 Ų | 69 | 40.4 Ų | 40.4 | 42% | 0.423 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64.5 | -42 | 176.5 | -56.3 | 0 | 0 | 0 | 0 | 111.7 | G380 N381 M382 A387 T388 Q415 | G380-T384 WeakPolarHBondContact O-CB 3.25Å; G380-T384 PolarHBondContact O-N 2.88Å; G380-T384 PolarHBondContact O-OG1 3.04Å; N381-T384 PolarHBondContact O-N 3.21Å; M382-T384 VanDerWaalsContact C-N 3.33Å; M382-T384 PolarHBondContact O-N 2.84Å; T384-A387 PolarHBondContact O-N 3.22Å; T384-T388 WeakPolarHBondContact O-CB 3.22Å; T384-T388 PolarHBondContact O-N 2.96Å; T384-T388 PolarHBondContact O-OG1 2.65Å; T384-Q415 PolarHBondContact OG1-NE2 3.22Å |
| 385 | A | 84.4 | Confident | 85.5 | Confident | 37 Ų | 37 | 45.8 Ų | 45.8 | 31% | 0.306 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -66.2 | -39.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | L320 N381 M382 T388 Y389 | L320-A385 HydrophobicContact CB-CB 4.39Å; L320-A385 HydrophobicContact CD1-CB 3.91Å; N381-A385 WeakPolarHBondContact O-CB 3.45Å; N381-A385 PolarHBondContact O-N 3.03Å; M382-A385 PolarHBondContact O-N 2.78Å; A385-T388 PolarHBondContact O-N 2.78Å; A385-Y389 WeakPolarHBondContact O-CB 3.46Å; A385-Y389 PolarHBondContact O-N 3.03Å |
| 386 | M | 87.7 | Confident | 85.5 | Confident | 3 Ų | 3 | 47.5 Ų | 47.5 | 2% | 0.015 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.4 | -45.8 | 172.9 | -72.2 | 173 | 177.8 | 0 | 0 | 111.7 | L320 I325 M382 L383 T388 Y389 L390 I411 L494 F495 | L320-M386 HydrophobicContact CD1-CG 4.17Å; I325-M386 HydrophobicContact CD1-CE 3.59Å; I325-M386 HydrophobicContact CG1-CE 4.21Å; I325-M386 HydrophobicContact CG2-CE 3.8Å; M382-M386 WeakPolarHBondContact O-CB 3.26Å; M382-M386 VanDerWaalsContact O-CG 3.25Å; M382-M386 WeakPolarHBondContact O-CG 3.42Å; M382-M386 PolarHBondContact O-N 3.36Å; L383-M386 HydrophobicContact CD2-SD 4.28Å; L383-M386 PolarHBondContact O-N 3.47Å; M386-T388 PolarHBondContact O-N 3.27Å; M386-Y389 PolarHBondContact O-N 3.03Å; M386-L390 VanDerWaalsContact O-CB 3.31Å; M386-L390 WeakPolarHBondContact O-CB 3.34Å; M386-L390 PolarHBondContact O-N 3.2Å; M386-I411 HydrophobicContact CB-CD1 4.17Å; M386-L494 HydrophobicContact SD-CD2 4.45Å; M386-F495 HydrophobicContact CE-CE1 4.48Å |
| 387 | A | 88.6 | Confident | 85.2 | Confident | 13 Ų | 13 | 47.5 Ų | 47.5 | 11% | 0.107 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.5 | -45.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L383 T384 Y389 L390 H391 I411 | L383-A387 WeakPolarHBondContact O-CB 3.13Å; L383-A387 PolarHBondContact O-N 3.38Å; T384-A387 PolarHBondContact O-N 3.22Å; A387-Y389 VanDerWaalsContact C-N 3.34Å; A387-Y389 PolarHBondContact O-N 3.4Å; A387-L390 PolarHBondContact O-N 2.75Å; A387-H391 WeakPolarHBondContact O-CB 3.24Å; A387-H391 PolarHBondContact O-N 3.28Å; A387-I411 HydrophobicContact CB-CG2 3.96Å |
| 388 | T | 86.9 | Confident | 85 | Confident | 70 Ų | 70 | 49.5 Ų | 49.5 | 43% | 0.429 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 178.2 | -55.5 | 0 | 0 | 0 | 0 | 111.3 | T384 A385 M386 H391 T392 | T384-T388 WeakPolarHBondContact O-CB 3.22Å; T384-T388 PolarHBondContact O-N 2.96Å; T384-T388 PolarHBondContact O-OG1 2.65Å; A385-T388 PolarHBondContact O-N 2.78Å; M386-T388 PolarHBondContact O-N 3.27Å; T388-H391 PolarHBondContact O-N 2.7Å; T388-T392 PolarHBondContact O-N 3.39Å; T388-T392 PolarHBondContact O-OG1 3.35Å |
| 389 | Y | 81.9 | Confident | 84.6 | Confident | 61 Ų | 61 | 47.4 Ų | 47.4 | 24% | 0.239 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -65 | -44.3 | 176.3 | -178.3 | -90.8 | 0 | 0 | 0 | 111.7 | P50 F53 A385 M386 A387 H391 T392 C393 | P50-Y389 PolarHBondContact O-OH 2.92Å; F53-Y389 AromaticContact CD1-CD1 3.91Å; F53-Y389 HydrophobicContact CD1-CD1 3.91Å; F53-Y389 AromaticContact CD1-CE1 3.31Å; F53-Y389 HydrophobicContact CD1-CE1 3.31Å; F53-Y389 AromaticContact CE1-CD1 3.72Å; F53-Y389 HydrophobicContact CE1-CD1 3.72Å; F53-Y389 AromaticContact CE1-CE1 3.6Å; F53-Y389 HydrophobicContact CE1-CE1 3.6Å; F53-Y389 HydrophobicContact CG-CE1 4.13Å; F53-Y389 HydrophobicContact CZ-CD1 4.49Å; A385-Y389 WeakPolarHBondContact O-CB 3.46Å; A385-Y389 PolarHBondContact O-N 3.03Å; M386-Y389 PolarHBondContact O-N 3.03Å; A387-Y389 VanDerWaalsContact C-N 3.34Å; A387-Y389 PolarHBondContact O-N 3.4Å; Y389-H391 PolarHBondContact O-N 3.45Å; Y389-T392 WeakPolarHBondContact O-CB 3.3Å; Y389-T392 PolarHBondContact O-N 3.36Å; Y389-C393 WeakPolarHBondContact CE1-SG 3.2Å; Y389-C393 VanDerWaalsContact CZ-SG 3.6Å; Y389-C393 PolarHBondContact O-N 3.13Å; Y389-C393 PolarHBondContact O-SG 2.73Å |
| 390 | L | 86 | Confident | 84.3 | Confident | 1 Ų | 1 | 49.7 Ų | 49.7 | 1% | 0.005 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.6 | -46.9 | 176.5 | -177.9 | 71.8 | 0 | 0 | 0 | 111.1 | M386 A387 T392 C393 F394 L399 Y404 V407 Q408 I411 | M386-L390 VanDerWaalsContact O-CB 3.31Å; M386-L390 WeakPolarHBondContact O-CB 3.34Å; M386-L390 PolarHBondContact O-N 3.2Å; A387-L390 PolarHBondContact O-N 2.75Å; L390-T392 VanDerWaalsContact C-N 3.34Å; L390-T392 PolarHBondContact O-N 3.46Å; L390-C393 WeakPolarHBondContact O-CB 3.31Å; L390-C393 PolarHBondContact O-N 2.97Å; L390-F394 PolarHBondContact O-N 3.17Å; L390-L399 HydrophobicContact CD1-CD1 3.55Å; L390-L399 HydrophobicContact CG-CD1 4.49Å; L390-Y404 HydrophobicContact CD1-CD2 4.45Å; L390-Y404 HydrophobicContact CD2-CD2 4.03Å; L390-Y404 HydrophobicContact CD2-CE2 4.07Å; L390-Y404 HydrophobicContact CG-CD2 3.75Å; L390-Y404 HydrophobicContact CG-CE2 3.93Å; L390-V407 HydrophobicContact CD1-CB 4.14Å; L390-V407 HydrophobicContact CD1-CG1 4.03Å; L390-V407 HydrophobicContact CD2-CB 3.87Å; L390-V407 HydrophobicContact CD2-CG1 3.79Å; L390-Q408 HydrophobicContact CD2-CB 3.85Å; L390-I411 HydrophobicContact CD2-CD1 3.96Å |
| 391 | H | 87.2 | Confident | 84.2 | Confident | 82 Ų | 82 | 52.2 Ų | 52.2 | 38% | 0.38 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.4 | -41.7 | 176.1 | -172 | 72.3 | 0 | 0 | 0 | 112.1 | A387 T388 Y389 C393 F394 L395 Y404 | A387-H391 WeakPolarHBondContact O-CB 3.24Å; A387-H391 PolarHBondContact O-N 3.28Å; T388-H391 PolarHBondContact O-N 2.7Å; Y389-H391 PolarHBondContact O-N 3.45Å; H391-C393 VanDerWaalsContact C-N 3.31Å; H391-C393 PolarHBondContact O-N 3.03Å; H391-F394 WeakPolarHBondContact O-CB 3.4Å; H391-F394 PolarHBondContact O-N 2.94Å; H391-L395 WeakPolarHBondContact O-CG 3.17Å; H391-L395 PolarHBondContact O-N 2.8Å; H391-Y404 HydrophobicContact CB-CE2 4.22Å; H391-Y404 AromaticContact ND1-CZ 3.73Å; H391-Y404 PolarHBondContact ND1-OH 2.82Å |
| 392 | T | 83.1 | Confident | 84.2 | Confident | 38 Ų | 38 | 53.9 Ų | 53.9 | 23% | 0.233 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 174.8 | -56.1 | 0 | 0 | 0 | 0 | 111.5 | T388 Y389 L390 F394 L395 L396 | T388-T392 PolarHBondContact O-N 3.39Å; T388-T392 PolarHBondContact O-OG1 3.35Å; Y389-T392 WeakPolarHBondContact O-CB 3.3Å; Y389-T392 PolarHBondContact O-N 3.36Å; L390-T392 VanDerWaalsContact C-N 3.34Å; L390-T392 PolarHBondContact O-N 3.46Å; T392-F394 VanDerWaalsContact C-N 3.33Å; T392-F394 PolarHBondContact O-N 3.3Å; T392-L395 PolarHBondContact O-N 3.44Å; T392-L396 HydrophobicContact CG2-CD1 4.13Å; T392-L396 VanDerWaalsContact O-CG 3.3Å; T392-L396 WeakPolarHBondContact O-CG 3.33Å; T392-L396 PolarHBondContact O-N 3.47Å |
| 393 | C | 78.4 | Confident | 83.9 | Confident | 4 Ų | 4 | 54.4 Ų | 54.4 | 3% | 0.027 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.2 | -37.5 | 177.7 | -65.1 | 0 | 0 | 0 | 0 | 112.5 | L54 Y389 L390 H391 L396 G397 A398 L399 | L54-C393 HydrophobicContact CD2-CB 4.11Å; Y389-C393 WeakPolarHBondContact CE1-SG 3.2Å; Y389-C393 VanDerWaalsContact CZ-SG 3.6Å; Y389-C393 PolarHBondContact O-N 3.13Å; Y389-C393 PolarHBondContact O-SG 2.73Å; L390-C393 WeakPolarHBondContact O-CB 3.31Å; L390-C393 PolarHBondContact O-N 2.97Å; H391-C393 VanDerWaalsContact C-N 3.31Å; H391-C393 PolarHBondContact O-N 3.03Å; C393-L396 PolarHBondContact O-N 3.31Å; C393-G397 PolarHBondContact O-N 3.04Å; C393-A398 HydrophobicContact CB-CB 4.45Å; C393-A398 WeakPolarHBondContact O-CB 3.41Å; C393-A398 PolarHBondContact O-N 2.95Å; C393-L399 HydrophobicContact CB-CD1 3.61Å; C393-L399 HydrophobicContact CB-CG 4.12Å |
| 394 | F | 84.4 | Confident | 83.7 | Confident | 63 Ų | 63 | 56.1 Ų | 56.1 | 28% | 0.276 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.1 | -47.8 | 173 | 174.2 | -108.5 | 0 | 0 | 0 | 111.6 | L390 H391 T392 L396 G397 V401 Y404 | L390-F394 PolarHBondContact O-N 3.17Å; H391-F394 WeakPolarHBondContact O-CB 3.4Å; H391-F394 PolarHBondContact O-N 2.94Å; T392-F394 VanDerWaalsContact C-N 3.33Å; T392-F394 PolarHBondContact O-N 3.3Å; F394-L396 VanDerWaalsContact C-N 3.26Å; F394-L396 PolarHBondContact O-N 3.02Å; F394-G397 PolarHBondContact O-N 3.27Å; F394-V401 HydrophobicContact CE2-CB 4.39Å; F394-V401 HydrophobicContact CE2-CG2 3.86Å; F394-V401 HydrophobicContact CZ-CG2 4.3Å; F394-Y404 HydrophobicContact CB-CD2 3.56Å; F394-Y404 HydrophobicContact CB-CE2 4.07Å; F394-Y404 HydrophobicContact CB-CG 3.85Å; F394-Y404 HydrophobicContact CD1-CD1 4.31Å; F394-Y404 HydrophobicContact CD1-CE1 4.39Å; F394-Y404 HydrophobicContact CD1-CG 4.43Å; F394-Y404 HydrophobicContact CD2-CD1 4.12Å; F394-Y404 HydrophobicContact CD2-CD2 4.41Å; F394-Y404 AromaticContact CD2-CG 3.81Å; F394-Y404 HydrophobicContact CD2-CG 3.81Å; F394-Y404 HydrophobicContact CE2-CD1 4.43Å; F394-Y404 HydrophobicContact CE2-CG 4.5Å; F394-Y404 HydrophobicContact CG-CD1 4.06Å; F394-Y404 AromaticContact CG-CD2 3.98Å; F394-Y404 HydrophobicContact CG-CD2 3.98Å; F394-Y404 HydrophobicContact CG-CE2 4.48Å; F394-Y404 AromaticContact CG-CG 3.76Å; F394-Y404 HydrophobicContact CG-CG 3.76Å |
| 395 | L | 86.3 | Confident | 83.7 | Confident | 121 Ų | 121 | 58.5 Ų | 58.5 | 63% | 0.634 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -62.3 | -31.2 | 177.3 | -66.6 | 178.5 | 0 | 0 | 0 | 113.3 | H391 T392 G397 | H391-L395 WeakPolarHBondContact O-CG 3.17Å; H391-L395 PolarHBondContact O-N 2.8Å; T392-L395 PolarHBondContact O-N 3.44Å; L395-G397 PolarHBondContact O-N 2.92Å |
| 396 | L | 84.1 | Confident | 83.9 | Confident | 138 Ų | 138 | 59.8 Ų | 59.8 | 72% | 0.723 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.1 | -0.7 | 174.9 | -67.8 | 173 | 0 | 0 | 0 | 113.5 | T392 C393 F394 A398 | T392-L396 HydrophobicContact CG2-CD1 4.13Å; T392-L396 VanDerWaalsContact O-CG 3.3Å; T392-L396 WeakPolarHBondContact O-CG 3.33Å; T392-L396 PolarHBondContact O-N 3.47Å; C393-L396 PolarHBondContact O-N 3.31Å; F394-L396 VanDerWaalsContact C-N 3.26Å; F394-L396 PolarHBondContact O-N 3.02Å; L396-A398 PolarHBondContact O-N 3.5Å |
| 397 | G | 78.6 | Confident | 83.9 | Confident | 63 Ų | 63 | 60 Ų | 60 | 65% | 0.649 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.5 | 20 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | C393 F394 L395 L399 | C393-G397 PolarHBondContact O-N 3.04Å; F394-G397 PolarHBondContact O-N 3.27Å; L395-G397 PolarHBondContact O-N 2.92Å; G397-L399 VanDerWaalsContact C-N 3.32Å |
| 398 | A | 75.2 | Confident | 84 | Confident | 48 Ų | 48 | 61.6 Ų | 61.6 | 40% | 0.397 | 34% | 0.335 | S | S | . | . | trans | -82 | -12.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | L54 C393 L396 | L54-A398 HydrophobicContact CD2-CB 4.17Å; C393-A398 HydrophobicContact CB-CB 4.45Å; C393-A398 WeakPolarHBondContact O-CB 3.41Å; C393-A398 PolarHBondContact O-N 2.95Å; L396-A398 PolarHBondContact O-N 3.5Å | ||
| 399 | L | 75.3 | Confident | 84.3 | Confident | 15 Ų | 15 | 64.6 Ų | 64.6 | 8% | 0.079 | 34% | 0.344 | C | S | . | . | S | Bend | trans | -130.4 | 145.5 | -176.6 | -61.4 | 170.9 | 0 | 0 | 0 | 110 | L57 L390 C393 G397 | L57-L399 HydrophobicContact CB-CD2 3.71Å; L57-L399 HydrophobicContact CD1-CD2 3.86Å; L57-L399 HydrophobicContact CD2-CD2 4.5Å; L57-L399 HydrophobicContact CG-CD2 4.24Å; L390-L399 HydrophobicContact CD1-CD1 3.55Å; L390-L399 HydrophobicContact CG-CD1 4.49Å; C393-L399 HydrophobicContact CB-CD1 3.61Å; C393-L399 HydrophobicContact CB-CG 4.12Å; G397-L399 VanDerWaalsContact C-N 3.32Å |
| 400 | S | 82.1 | Confident | 84.8 | Confident | 50 Ų | 50 | 62.5 Ų | 62.5 | 35% | 0.35 | 34% | 0.336 | S | S | . | . | trans | -69.2 | 156.6 | 165.6 | 61.8 | 0 | 0 | 0 | 0 | 110.7 | E402 Q403 Y404 | S400-E402 PolarHBondContact O-N 3.24Å; S400-Q403 VanDerWaalsContact N-OE1 3.16Å; S400-Q403 PolarHBondContact O-N 3.05Å; S400-Q403 WeakPolarHBondContact OG-CB 3.47Å; S400-Q403 VanDerWaalsContact OG-CD 3.31Å; S400-Q403 WeakPolarHBondContact OG-CG 3.41Å; S400-Q403 PolarHBondContact OG-N 3.38Å; S400-Q403 PolarHBondContact OG-OE1 2.76Å; S400-Y404 PolarHBondContact O-N 3.14Å | ||
| 401 | V | 87 | Confident | 85.1 | Confident | 78 Ų | 78 | 62.5 Ų | 62.5 | 47% | 0.473 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -55.3 | -44.9 | 174.5 | 179.9 | 0 | 0 | 0 | 0 | 110.2 | F394 Q403 Y404 E405 | F394-V401 HydrophobicContact CE2-CB 4.39Å; F394-V401 HydrophobicContact CE2-CG2 3.86Å; F394-V401 HydrophobicContact CZ-CG2 4.3Å; V401-Q403 PolarHBondContact O-N 2.63Å; V401-Y404 WeakPolarHBondContact O-CB 3.49Å; V401-Y404 PolarHBondContact O-N 3.38Å; V401-E405 HydrophobicContact CG1-CG 4.28Å; V401-E405 WeakPolarHBondContact O-CG 3.25Å; V401-E405 PolarHBondContact O-N 3.06Å |
| 402 | E | 85.4 | Confident | 85.5 | Confident | 155 Ų | 155 | 61.9 Ų | 61.9 | 72% | 0.724 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -59.8 | -46.1 | -180 | -62.4 | 172.3 | -173.3 | 0 | 0 | 112.3 | S400 E406 | S400-E402 PolarHBondContact O-N 3.24Å; E402-E406 WeakPolarHBondContact O-CB 3.24Å; E402-E406 PolarHBondContact O-N 2.76Å |
| 403 | Q | 80.4 | Confident | 86 | Confident | 33 Ų | 33 | 61.6 Ų | 61.6 | 15% | 0.154 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -66.5 | -38.3 | 177.4 | -73.7 | 168.8 | -51.8 | 0 | 0 | 112.1 | L57 S60 S400 V401 V407 | L57-Q403 PolarHBondContact O-NE2 2.82Å; S60-Q403 PolarHBondContact OG-NE2 3.21Å; S400-Q403 VanDerWaalsContact N-OE1 3.16Å; S400-Q403 PolarHBondContact O-N 3.05Å; S400-Q403 WeakPolarHBondContact OG-CB 3.47Å; S400-Q403 VanDerWaalsContact OG-CD 3.31Å; S400-Q403 WeakPolarHBondContact OG-CG 3.41Å; S400-Q403 PolarHBondContact OG-N 3.38Å; S400-Q403 PolarHBondContact OG-OE1 2.76Å; V401-Q403 PolarHBondContact O-N 2.63Å; Q403-V407 VanDerWaalsContact O-CG2 3.3Å; Q403-V407 WeakPolarHBondContact O-CG2 3.28Å; Q403-V407 PolarHBondContact O-N 3.29Å; Q403-V407 VanDerWaalsContact O-N 3.14Å |
| 404 | Y | 85.3 | Confident | 86.8 | Confident | 37 Ų | 37 | 61.5 Ų | 61.5 | 15% | 0.145 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -62.5 | -51.8 | 176.8 | 171.5 | -106.3 | 0 | 0 | 0 | 110.8 | L390 H391 F394 S400 V401 E406 V407 Q408 | L390-Y404 HydrophobicContact CD1-CD2 4.45Å; L390-Y404 HydrophobicContact CD2-CD2 4.03Å; L390-Y404 HydrophobicContact CD2-CE2 4.07Å; L390-Y404 HydrophobicContact CG-CD2 3.75Å; L390-Y404 HydrophobicContact CG-CE2 3.93Å; H391-Y404 HydrophobicContact CB-CE2 4.22Å; H391-Y404 AromaticContact ND1-CZ 3.73Å; H391-Y404 PolarHBondContact ND1-OH 2.82Å; F394-Y404 HydrophobicContact CB-CD2 3.56Å; F394-Y404 HydrophobicContact CB-CE2 4.07Å; F394-Y404 HydrophobicContact CB-CG 3.85Å; F394-Y404 HydrophobicContact CD1-CD1 4.31Å; F394-Y404 HydrophobicContact CD1-CE1 4.39Å; F394-Y404 HydrophobicContact CD1-CG 4.43Å; F394-Y404 HydrophobicContact CD2-CD1 4.12Å; F394-Y404 HydrophobicContact CD2-CD2 4.41Å; F394-Y404 AromaticContact CD2-CG 3.81Å; F394-Y404 HydrophobicContact CD2-CG 3.81Å; F394-Y404 HydrophobicContact CE2-CD1 4.43Å; F394-Y404 HydrophobicContact CE2-CG 4.5Å; F394-Y404 HydrophobicContact CG-CD1 4.06Å; F394-Y404 AromaticContact CG-CD2 3.98Å; F394-Y404 HydrophobicContact CG-CD2 3.98Å; F394-Y404 HydrophobicContact CG-CE2 4.48Å; F394-Y404 AromaticContact CG-CG 3.76Å; F394-Y404 HydrophobicContact CG-CG 3.76Å; S400-Y404 PolarHBondContact O-N 3.14Å; V401-Y404 WeakPolarHBondContact O-CB 3.49Å; V401-Y404 PolarHBondContact O-N 3.38Å; Y404-E406 PolarHBondContact O-N 3.47Å; Y404-V407 PolarHBondContact O-N 3.05Å; Y404-Q408 HydrophobicContact CE2-CB 4.39Å; Y404-Q408 WeakPolarHBondContact O-CB 3.3Å; Y404-Q408 PolarHBondContact O-N 2.67Å |
| 405 | E | 90 | Very high | 87.3 | Confident | 119 Ų | 119 | 61.2 Ų | 61.2 | 56% | 0.556 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -60.8 | -45.1 | 179.9 | -71.4 | 179.3 | 162.6 | 0 | 0 | 111.6 | V401 V407 Q408 E409 | V401-E405 HydrophobicContact CG1-CG 4.28Å; V401-E405 WeakPolarHBondContact O-CG 3.25Å; V401-E405 PolarHBondContact O-N 3.06Å; E405-V407 PolarHBondContact O-N 2.91Å; E405-Q408 PolarHBondContact O-N 3.11Å; E405-E409 VanDerWaalsContact O-CB 3.32Å; E405-E409 WeakPolarHBondContact O-CB 3.39Å; E405-E409 PolarHBondContact O-N 3.31Å |
| 406 | E | 88 | Confident | 87.8 | Confident | 64 Ų | 64 | 57.6 Ų | 57.6 | 30% | 0.299 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62.7 | -45.7 | -178.8 | -158.4 | -175.2 | 175.7 | 0 | 0 | 111.8 | E402 Y404 H410 I490 | E402-E406 WeakPolarHBondContact O-CB 3.24Å; E402-E406 PolarHBondContact O-N 2.76Å; Y404-E406 PolarHBondContact O-N 3.47Å; E406-H410 PolarHBondContact O-N 3.48Å; E406-H410 PolarHBondContact O-ND1 3.34Å; E406-I490 HydrophobicContact CB-CD1 4.4Å; E406-I490 HydrophobicContact CG-CD1 3.54Å |
| 407 | V | 88.6 | Confident | 88.3 | Confident | 7 Ų | 7 | 51 Ų | 51 | 4% | 0.042 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -73.2 | -39 | 179.6 | -178.2 | 0 | 0 | 0 | 0 | 111.2 | L57 L390 Q403 Y404 E405 E409 H410 I411 I490 L494 | L57-V407 HydrophobicContact CD2-CG2 4.41Å; L390-V407 HydrophobicContact CD1-CB 4.14Å; L390-V407 HydrophobicContact CD1-CG1 4.03Å; L390-V407 HydrophobicContact CD2-CB 3.87Å; L390-V407 HydrophobicContact CD2-CG1 3.79Å; Q403-V407 VanDerWaalsContact O-CG2 3.3Å; Q403-V407 WeakPolarHBondContact O-CG2 3.28Å; Q403-V407 PolarHBondContact O-N 3.29Å; Q403-V407 VanDerWaalsContact O-N 3.14Å; Y404-V407 PolarHBondContact O-N 3.05Å; E405-V407 PolarHBondContact O-N 2.91Å; V407-E409 PolarHBondContact O-N 2.9Å; V407-H410 PolarHBondContact O-N 3.35Å; V407-I411 HydrophobicContact CG1-CD1 4.12Å; V407-I411 HydrophobicContact CG1-CG1 4.48Å; V407-I411 WeakPolarHBondContact O-CG1 3.48Å; V407-I411 PolarHBondContact O-N 3.36Å; V407-I490 HydrophobicContact CG2-CG2 4.48Å; V407-L494 HydrophobicContact CG1-CD2 3.95Å |
| 408 | Q | 90.8 | Very high | 89.1 | Confident | 47 Ų | 47 | 48.4 Ų | 48.4 | 22% | 0.22 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.1 | -39.7 | 178.8 | -179.6 | 64.5 | 16.7 | 0 | 0 | 111.8 | L390 Y404 E405 H410 I411 T412 | L390-Q408 HydrophobicContact CD2-CB 3.85Å; Y404-Q408 HydrophobicContact CE2-CB 4.39Å; Y404-Q408 WeakPolarHBondContact O-CB 3.3Å; Y404-Q408 PolarHBondContact O-N 2.67Å; E405-Q408 PolarHBondContact O-N 3.11Å; Q408-H410 VanDerWaalsContact C-N 3.29Å; Q408-H410 PolarHBondContact O-N 3Å; Q408-I411 PolarHBondContact O-N 3.47Å; Q408-T412 WeakPolarHBondContact O-CB 3.18Å; Q408-T412 PolarHBondContact O-N 3.38Å; Q408-T412 PolarHBondContact O-OG1 3.43Å |
| 409 | E | 92.3 | Very high | 90.1 | Very high | 133 Ų | 133 | 51.2 Ų | 51.2 | 62% | 0.621 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -56.9 | -45 | 173.8 | -177.5 | -177.7 | -174.4 | 0 | 0 | 110.8 | E405 V407 T412 C413 | E405-E409 VanDerWaalsContact O-CB 3.32Å; E405-E409 WeakPolarHBondContact O-CB 3.39Å; E405-E409 PolarHBondContact O-N 3.31Å; V407-E409 PolarHBondContact O-N 2.9Å; E409-T412 PolarHBondContact O-N 3.47Å; E409-C413 WeakPolarHBondContact O-CB 3.33Å; E409-C413 PolarHBondContact O-N 3.11Å |
| 410 | H | 92.1 | Very high | 91 | Very high | 17 Ų | 17 | 54.7 Ų | 54.7 | 8% | 0.079 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -68.5 | -40.3 | 179.8 | -74.4 | 68.7 | 0 | 0 | 0 | 112.6 | E406 V407 Q408 T412 C413 L414 N487 I490 | E406-H410 PolarHBondContact O-N 3.48Å; E406-H410 PolarHBondContact O-ND1 3.34Å; V407-H410 PolarHBondContact O-N 3.35Å; Q408-H410 VanDerWaalsContact C-N 3.29Å; Q408-H410 PolarHBondContact O-N 3Å; H410-T412 VanDerWaalsContact C-N 3.34Å; H410-C413 PolarHBondContact O-N 3.1Å; H410-L414 WeakPolarHBondContact O-CG 3.47Å; H410-L414 PolarHBondContact O-N 3.4Å; H410-N487 WeakPolarHBondContact NE2-CB 3.49Å; H410-N487 PolarHBondContact NE2-N 3.05Å; H410-I490 HydrophobicContact CB-CG2 3.7Å; H410-I490 VanDerWaalsContact CE1-CD1 3.46Å; H410-I490 WeakPolarHBondContact CE1-CD1 3.43Å; H410-I490 WeakPolarHBondContact ND1-CD1 3.4Å |
| 411 | I | 92 | Very high | 91.6 | Very high | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 174.9 | -64.1 | 170.9 | 0 | 0 | 0 | 110.3 | L383 M386 A387 L390 V407 Q408 C413 L414 Q415 L494 | L383-I411 HydrophobicContact CB-CG2 4.32Å; M386-I411 HydrophobicContact CB-CD1 4.17Å; A387-I411 HydrophobicContact CB-CG2 3.96Å; L390-I411 HydrophobicContact CD2-CD1 3.96Å; V407-I411 HydrophobicContact CG1-CD1 4.12Å; V407-I411 HydrophobicContact CG1-CG1 4.48Å; V407-I411 WeakPolarHBondContact O-CG1 3.48Å; V407-I411 PolarHBondContact O-N 3.36Å; Q408-I411 PolarHBondContact O-N 3.47Å; I411-C413 VanDerWaalsContact C-N 3.34Å; I411-C413 PolarHBondContact O-N 2.89Å; I411-L414 PolarHBondContact O-N 3.03Å; I411-Q415 WeakPolarHBondContact O-CG 3.3Å; I411-Q415 PolarHBondContact O-N 2.98Å; I411-L494 HydrophobicContact CD1-CD2 4.04Å; I411-L494 HydrophobicContact CG1-CD1 4.19Å; I411-L494 HydrophobicContact CG1-CD2 3.93Å |
| 412 | T | 95.1 | Very high | 91.9 | Very high | 68 Ų | 68 | 54.5 Ų | 54.5 | 42% | 0.417 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.8 | -42.4 | 177.7 | -53 | 0 | 0 | 0 | 0 | 111 | Q408 E409 H410 Q415 A416 | Q408-T412 WeakPolarHBondContact O-CB 3.18Å; Q408-T412 PolarHBondContact O-N 3.38Å; Q408-T412 PolarHBondContact O-OG1 3.43Å; E409-T412 PolarHBondContact O-N 3.47Å; H410-T412 VanDerWaalsContact C-N 3.34Å; T412-Q415 PolarHBondContact O-N 3.34Å; T412-A416 WeakPolarHBondContact O-CB 3.32Å; T412-A416 PolarHBondContact O-N 2.9Å |
| 413 | C | 95.2 | Very high | 92.3 | Very high | 33 Ų | 33 | 53.1 Ų | 53.1 | 22% | 0.223 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.6 | -40.3 | 175.6 | -170.4 | 0 | 0 | 0 | 0 | 112 | E409 H410 I411 A416 F417 F486 | E409-C413 WeakPolarHBondContact O-CB 3.33Å; E409-C413 PolarHBondContact O-N 3.11Å; H410-C413 PolarHBondContact O-N 3.1Å; I411-C413 VanDerWaalsContact C-N 3.34Å; I411-C413 PolarHBondContact O-N 2.89Å; C413-A416 PolarHBondContact O-N 3.33Å; C413-F417 WeakPolarHBondContact O-CB 3.32Å; C413-F417 PolarHBondContact O-N 3.24Å; C413-F486 HydrophobicContact CB-CE1 3.8Å; C413-F486 HydrophobicContact CB-CZ 4.05Å; C413-F486 WeakPolarHBondContact SG-CZ 3.36Å |
| 414 | L | 95 | Very high | 92.9 | Very high | 1 Ų | 1 | 52.4 Ų | 52.4 | 1% | 0.005 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.5 | -42.9 | 174 | -75.9 | 171.8 | 0 | 0 | 0 | 112 | L367 M371 L383 H410 I411 F417 L418 F486 L494 F495 | L367-L414 HydrophobicContact CD2-CD2 3.62Å; M371-L414 HydrophobicContact CE-CD2 4.19Å; L383-L414 HydrophobicContact CD1-CB 3.79Å; L383-L414 HydrophobicContact CD2-CB 4.11Å; L383-L414 HydrophobicContact CD2-CD1 3.81Å; H410-L414 WeakPolarHBondContact O-CG 3.47Å; H410-L414 PolarHBondContact O-N 3.4Å; I411-L414 PolarHBondContact O-N 3.03Å; L414-F417 PolarHBondContact O-N 2.89Å; L414-L418 WeakPolarHBondContact O-CB 3.43Å; L414-L418 PolarHBondContact O-N 2.7Å; L414-F486 HydrophobicContact CB-CE1 4.44Å; L414-F486 HydrophobicContact CD2-CD1 4.28Å; L414-F486 HydrophobicContact CD2-CE1 3.59Å; L414-F486 HydrophobicContact CD2-CZ 3.75Å; L414-F486 HydrophobicContact CG-CD1 4.4Å; L414-F486 HydrophobicContact CG-CE1 3.6Å; L414-F486 HydrophobicContact CG-CZ 4.12Å; L414-L494 HydrophobicContact CD1-CD1 3.93Å; L414-F495 HydrophobicContact CD1-CE2 3.89Å; L414-F495 HydrophobicContact CD1-CZ 4.14Å |
| 415 | Q | 95.1 | Very high | 93.3 | Very high | 58 Ų | 58 | 58.2 Ų | 58.2 | 27% | 0.271 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.1 | -45.7 | 176.7 | -71.4 | 174.7 | -48.3 | 0 | 0 | 111.5 | L383 T384 I411 T412 F417 L418 Q419 | L383-Q415 HydrophobicContact CB-CG 3.86Å; L383-Q415 HydrophobicContact CD1-CG 3.97Å; T384-Q415 PolarHBondContact OG1-NE2 3.22Å; I411-Q415 WeakPolarHBondContact O-CG 3.3Å; I411-Q415 PolarHBondContact O-N 2.98Å; T412-Q415 PolarHBondContact O-N 3.34Å; Q415-F417 VanDerWaalsContact C-N 3.3Å; Q415-F417 PolarHBondContact O-N 2.83Å; Q415-L418 PolarHBondContact O-N 2.85Å; Q415-Q419 PolarHBondContact O-N 3.41Å |
| 416 | A | 95.2 | Very high | 93.5 | Very high | 44 Ų | 44 | 53.3 Ų | 53.3 | 36% | 0.364 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -65.5 | -32.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T412 C413 R420 | T412-A416 WeakPolarHBondContact O-CB 3.32Å; T412-A416 PolarHBondContact O-N 2.9Å; C413-A416 PolarHBondContact O-N 3.33Å; A416-R420 PolarHBondContact O-N 3Å |
| 417 | F | 95.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -71.4 | -43.4 | 174.5 | -173.8 | -136.6 | 0 | 0 | 0 | 111.8 | L368 M371 C413 L414 Q415 Q419 R420 I421 L479 T482 L483 | L368-F417 HydrophobicContact CD2-CZ 4.34Å; M371-F417 HydrophobicContact CE-CD1 4.1Å; M371-F417 HydrophobicContact CG-CD1 3.66Å; M371-F417 HydrophobicContact CG-CE1 3.44Å; M371-F417 VanDerWaalsContact CG-CE1 3.44Å; M371-F417 HydrophobicContact CG-CZ 4.23Å; M371-F417 HydrophobicContact SD-CD1 3.87Å; M371-F417 HydrophobicContact SD-CE1 4.29Å; C413-F417 WeakPolarHBondContact O-CB 3.32Å; C413-F417 PolarHBondContact O-N 3.24Å; L414-F417 PolarHBondContact O-N 2.89Å; Q415-F417 VanDerWaalsContact C-N 3.3Å; Q415-F417 PolarHBondContact O-N 2.83Å; F417-Q419 VanDerWaalsContact C-N 3.34Å; F417-Q419 PolarHBondContact O-N 2.84Å; F417-R420 PolarHBondContact O-N 2.75Å; F417-I421 HydrophobicContact CD2-CG1 4.23Å; F417-I421 HydrophobicContact CE2-CD1 3.97Å; F417-I421 HydrophobicContact CE2-CG1 3.94Å; F417-I421 HydrophobicContact CZ-CD1 4.03Å; F417-I421 HydrophobicContact CZ-CG1 4.11Å; F417-I421 WeakPolarHBondContact O-CG1 3.32Å; F417-I421 PolarHBondContact O-N 3.49Å; F417-L479 HydrophobicContact CE2-CB 4.2Å; F417-L479 HydrophobicContact CE2-CD2 4.3Å; F417-T482 HydrophobicContact CB-CG2 4.28Å; F417-T482 HydrophobicContact CD2-CG2 4.07Å; F417-T482 HydrophobicContact CG-CG2 4.22Å; F417-L483 HydrophobicContact CD1-CD2 4.47Å; F417-L483 HydrophobicContact CE1-CD2 3.53Å; F417-L483 HydrophobicContact CZ-CD2 3.67Å; F417-L483 HydrophobicContact CZ-CG 4.33Å |
| 418 | L | 95.6 | Very high | 93.9 | Very high | 9 Ų | 9 | 57 Ų | 57 | 5% | 0.047 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -56.9 | -47.4 | 174.1 | 177.1 | 60.7 | 0 | 0 | 0 | 111.2 | M371 A374 L379 L414 Q415 R420 I421 E422 | M371-L418 HydrophobicContact SD-CB 3.98Å; M371-L418 HydrophobicContact SD-CD1 4.05Å; A374-L418 HydrophobicContact CB-CD1 3.47Å; A374-L418 VanDerWaalsContact CB-CD1 3.47Å; L379-L418 HydrophobicContact CB-CD2 4.34Å; L379-L418 HydrophobicContact CD2-CD1 4.44Å; L379-L418 HydrophobicContact CD2-CD2 4.4Å; L379-L418 HydrophobicContact CG-CD2 4.32Å; L414-L418 WeakPolarHBondContact O-CB 3.43Å; L414-L418 PolarHBondContact O-N 2.7Å; Q415-L418 PolarHBondContact O-N 2.85Å; L418-R420 VanDerWaalsContact C-N 3.34Å; L418-R420 PolarHBondContact O-N 3.41Å; L418-I421 PolarHBondContact O-N 2.81Å; L418-I421 VanDerWaalsContact O-N 3.13Å; L418-E422 HydrophobicContact CD1-CG 4.21Å; L418-E422 HydrophobicContact CG-CG 4.47Å; L418-E422 WeakPolarHBondContact O-CG 3.49Å; L418-E422 PolarHBondContact O-N 3.09Å |
| 419 | Q | 94.8 | Very high | 94 | Very high | 106 Ų | 106 | 56.1 Ų | 56.1 | 50% | 0.495 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -57.3 | -46.3 | 177.2 | -177 | -177.7 | -9.5 | 0 | 0 | 111.9 | Q415 F417 I421 E422 E423 | Q415-Q419 PolarHBondContact O-N 3.41Å; F417-Q419 VanDerWaalsContact C-N 3.34Å; F417-Q419 PolarHBondContact O-N 2.84Å; Q419-I421 VanDerWaalsContact C-N 3.29Å; Q419-I421 PolarHBondContact O-N 2.81Å; Q419-E422 PolarHBondContact O-N 3.44Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.48Å; Q419-E423 PolarHBondContact NE2-OE1 2.95Å; Q419-E423 WeakPolarHBondContact O-CG 3.21Å; Q419-E423 PolarHBondContact O-N 2.92Å |
| 420 | R | 95 | Very high | 94.1 | Very high | 88 Ų | 88 | 50.4 Ų | 50.4 | 33% | 0.332 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.1 | -33.7 | 177.7 | -77.7 | -172 | -69.1 | 155.6 | -5.2 | 113.2 | A416 F417 L418 A424 L479 T482 | A416-R420 PolarHBondContact O-N 3Å; F417-R420 PolarHBondContact O-N 2.75Å; L418-R420 VanDerWaalsContact C-N 3.34Å; L418-R420 PolarHBondContact O-N 3.41Å; R420-A424 VanDerWaalsContact O-CB 3.23Å; R420-A424 WeakPolarHBondContact O-CB 3.44Å; R420-A424 PolarHBondContact O-N 2.8Å; R420-L479 HydrophobicContact CB-CD2 4.19Å; R420-T482 VanDerWaalsContact CZ-OG1 3.26Å; R420-T482 PolarHBondContact NH1-OG1 3.29Å; R420-T482 PolarHBondContact NH2-OG1 2.85Å |
| 421 | I | 95 | Very high | 94.2 | Very high | 8 Ų | 8 | 50 Ų | 50 | 4% | 0.041 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -69.7 | -41.1 | 174 | -67 | -72.4 | 0 | 0 | 0 | 110.8 | M371 F417 L418 Q419 E423 A424 K425 P426 F431 L479 | M371-I421 HydrophobicContact CB-CB 4.49Å; M371-I421 HydrophobicContact CB-CG1 4.05Å; M371-I421 HydrophobicContact CB-CG2 4.17Å; M371-I421 HydrophobicContact CG-CG1 4.05Å; F417-I421 HydrophobicContact CD2-CG1 4.23Å; F417-I421 HydrophobicContact CE2-CD1 3.97Å; F417-I421 HydrophobicContact CE2-CG1 3.94Å; F417-I421 HydrophobicContact CZ-CD1 4.03Å; F417-I421 HydrophobicContact CZ-CG1 4.11Å; F417-I421 WeakPolarHBondContact O-CG1 3.32Å; F417-I421 PolarHBondContact O-N 3.49Å; L418-I421 PolarHBondContact O-N 2.81Å; L418-I421 VanDerWaalsContact O-N 3.13Å; Q419-I421 VanDerWaalsContact C-N 3.29Å; Q419-I421 PolarHBondContact O-N 2.81Å; I421-E423 VanDerWaalsContact C-N 3.31Å; I421-E423 PolarHBondContact O-N 3.31Å; I421-A424 PolarHBondContact O-N 3.24Å; I421-K425 PolarHBondContact O-N 2.82Å; I421-P426 HydrophobicContact CD1-CG 4.35Å; I421-P426 WeakPolarHBondContact O-CD 3.23Å; I421-F431 HydrophobicContact CD1-CE1 4.27Å; I421-F431 HydrophobicContact CD1-CZ 4.47Å; I421-F431 HydrophobicContact CG2-CE1 4.35Å; I421-F431 HydrophobicContact CG2-CZ 3.65Å; I421-L479 HydrophobicContact CD1-CD1 3.71Å; I421-L479 HydrophobicContact CD1-CD2 4.04Å; I421-L479 HydrophobicContact CD1-CG 4.35Å |
| 422 | E | 93.2 | Very high | 94.3 | Very high | 116 Ų | 116 | 50 Ų | 50 | 54% | 0.542 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.9 | -32.9 | 176.6 | -72.9 | 177.8 | 177.3 | 0 | 0 | 112.7 | L418 Q419 K425 | L418-E422 HydrophobicContact CD1-CG 4.21Å; L418-E422 HydrophobicContact CG-CG 4.47Å; L418-E422 WeakPolarHBondContact O-CG 3.49Å; L418-E422 PolarHBondContact O-N 3.09Å; Q419-E422 PolarHBondContact O-N 3.44Å; E422-K425 WeakPolarHBondContact O-CE 3.32Å; E422-K425 WeakPolarHBondContact O-CG 3.4Å |
| 423 | E | 93.8 | Very high | 94.3 | Very high | 126 Ų | 126 | 46.8 Ų | 46.8 | 59% | 0.589 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -72.5 | -45 | 172.5 | -72.6 | 169.5 | -172 | 0 | 0 | 111.5 | Q419 I421 | Q419-E423 WeakPolarHBondContact CG-OE1 3.48Å; Q419-E423 PolarHBondContact NE2-OE1 2.95Å; Q419-E423 WeakPolarHBondContact O-CG 3.21Å; Q419-E423 PolarHBondContact O-N 2.92Å; I421-E423 VanDerWaalsContact C-N 3.31Å; I421-E423 PolarHBondContact O-N 3.31Å |
| 424 | A | 93.1 | Very high | 94.3 | Very high | 19 Ų | 19 | 45.2 Ų | 45.2 | 16% | 0.157 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -70.3 | -32.3 | 179 | 0 | 0 | 0 | 0 | 0 | 112.7 | R420 I421 P426 R472 L479 | R420-A424 VanDerWaalsContact O-CB 3.23Å; R420-A424 WeakPolarHBondContact O-CB 3.44Å; R420-A424 PolarHBondContact O-N 2.8Å; I421-A424 PolarHBondContact O-N 3.24Å; A424-P426 HydrophobicContact CB-CG 4.34Å; A424-R472 VanDerWaalsContact O-CZ 3.24Å; A424-R472 PolarHBondContact O-NH1 3.46Å; A424-R472 PolarHBondContact O-NH2 3.4Å; A424-L479 HydrophobicContact CB-CD1 4.42Å |
| 425 | K | 94 | Very high | 94.3 | Very high | 159 Ų | 159 | 45.2 Ų | 45.2 | 69% | 0.691 | 23% | 0.227 | S | C | * | . | trans | 45.8 | 62.2 | -175 | -56 | -177.9 | -178.8 | 175.2 | 0 | 113.3 | I421 E422 R472 | I421-K425 PolarHBondContact O-N 2.82Å; E422-K425 WeakPolarHBondContact O-CE 3.32Å; E422-K425 WeakPolarHBondContact O-CG 3.4Å; K425-R472 PolarHBondContact O-NH2 3.11Å | ||
| 426 | P | 93.6 | Very high | 94.1 | Very high | 15 Ų | 15 | 42.4 Ų | 42.4 | 10% | 0.097 | 21% | 0.214 | C | C | . | . | trans | -64.5 | 138.4 | 176.6 | -14.5 | 29.3 | 0 | 0 | 0 | 111.1 | I421 A424 E430 F431 L476 L479 | I421-P426 HydrophobicContact CD1-CG 4.35Å; I421-P426 WeakPolarHBondContact O-CD 3.23Å; A424-P426 HydrophobicContact CB-CG 4.34Å; P426-E430 VanDerWaalsContact CA-OE2 3.23Å; P426-E430 WeakPolarHBondContact CA-OE2 3.47Å; P426-E430 HydrophobicContact CB-CB 4.08Å; P426-F431 HydrophobicContact CB-CD2 3.75Å; P426-F431 HydrophobicContact CB-CE2 3.68Å; P426-F431 HydrophobicContact CB-CG 4.23Å; P426-F431 HydrophobicContact CB-CZ 4.1Å; P426-F431 HydrophobicContact CG-CD2 4.47Å; P426-F431 HydrophobicContact CG-CE1 4.38Å; P426-F431 HydrophobicContact CG-CE2 3.95Å; P426-F431 HydrophobicContact CG-CZ 3.91Å; P426-F431 WeakPolarHBondContact O-CD2 3.34Å; P426-F431 WeakPolarHBondContact O-CE2 3.47Å; P426-L476 HydrophobicContact CB-CD2 4.01Å; P426-L476 HydrophobicContact CG-CD2 4.12Å; P426-L479 HydrophobicContact CG-CD1 4.32Å | ||
| 427 | T | 93 | Very high | 94.1 | Very high | 75 Ų | 75 | 40.7 Ų | 40.7 | 46% | 0.46 | 20% | 0.199 | S | C | . | . | trans | -71 | 164.5 | 170.2 | 64.4 | 0 | 0 | 0 | 0 | 110.8 | V429 E430 F431 | T427-V429 PolarHBondContact O-N 2.94Å; T427-E430 PolarHBondContact N-OE2 3.38Å; T427-E430 PolarHBondContact O-N 3.16Å; T427-E430 VanDerWaalsContact O-N 3.09Å; T427-E430 VanDerWaalsContact OG1-CG 3.26Å; T427-E430 WeakPolarHBondContact OG1-CG 3.33Å; T427-E430 PolarHBondContact OG1-N 3.47Å; T427-E430 PolarHBondContact OG1-OE2 2.86Å; T427-F431 WeakPolarHBondContact O-CD2 3.46Å; T427-F431 PolarHBondContact O-N 3.29Å | ||
| 428 | D | 92.3 | Very high | 93.9 | Very high | 75 Ų | 75 | 40.9 Ų | 40.9 | 40% | 0.401 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -57.7 | -37 | 178 | -65.8 | -39.5 | 0 | 0 | 0 | 112.6 | A306 Q372 F431 G432 | A306-D428 HydrophobicContact CB-CB 4.32Å; Q372-D428 PolarHBondContact NE2-OD1 3.06Å; D428-F431 PolarHBondContact O-N 3.43Å; D428-G432 PolarHBondContact O-N 3.24Å |
| 429 | V | 92.4 | Very high | 93.7 | Very high | 27 Ų | 27 | 40.4 Ų | 40.4 | 16% | 0.164 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -66.7 | -45.1 | 176.2 | 178.8 | 0 | 0 | 0 | 0 | 110.9 | A306 T427 G432 Y433 | A306-V429 HydrophobicContact CB-CB 4.33Å; A306-V429 HydrophobicContact CB-CG2 3.77Å; T427-V429 PolarHBondContact O-N 2.94Å; V429-G432 WeakPolarHBondContact O-CA 3.27Å; V429-G432 PolarHBondContact O-N 2.76Å; V429-G432 VanDerWaalsContact O-N 3.15Å; V429-Y433 HydrophobicContact CG1-CD2 3.77Å; V429-Y433 HydrophobicContact CG1-CE2 3.49Å; V429-Y433 VanDerWaalsContact CG1-CE2 3.49Å; V429-Y433 VanDerWaalsContact O-CD2 3.22Å; V429-Y433 WeakPolarHBondContact O-CD2 3.32Å; V429-Y433 PolarHBondContact O-N 2.89Å |
| 430 | E | 94.7 | Very high | 93.4 | Very high | 14 Ų | 14 | 35.4 Ų | 35.4 | 7% | 0.065 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.6 | -43.5 | 175.9 | -70.6 | 170.1 | 146.5 | 0 | 0 | 111.4 | P426 T427 G432 Y433 L434 L464 V468 R472 L476 | P426-E430 VanDerWaalsContact CA-OE2 3.23Å; P426-E430 WeakPolarHBondContact CA-OE2 3.47Å; P426-E430 HydrophobicContact CB-CB 4.08Å; T427-E430 PolarHBondContact N-OE2 3.38Å; T427-E430 PolarHBondContact O-N 3.16Å; T427-E430 VanDerWaalsContact O-N 3.09Å; T427-E430 VanDerWaalsContact OG1-CG 3.26Å; T427-E430 WeakPolarHBondContact OG1-CG 3.33Å; T427-E430 PolarHBondContact OG1-N 3.47Å; T427-E430 PolarHBondContact OG1-OE2 2.86Å; E430-G432 VanDerWaalsContact C-N 3.29Å; E430-G432 PolarHBondContact O-N 3.14Å; E430-Y433 PolarHBondContact O-N 3.28Å; E430-L434 VanDerWaalsContact O-CG 3.31Å; E430-L434 WeakPolarHBondContact O-CG 3.23Å; E430-L434 PolarHBondContact O-N 3.43Å; E430-L464 HydrophobicContact CG-CD1 4.37Å; E430-V468 HydrophobicContact CG-CG1 4.5Å; E430-R472 IonicContact OE1-CZ 2.87Å; E430-R472 IonicContact OE1-NE 2.82Å; E430-R472 PolarHBondContact OE1-NE 3.01Å; E430-R472 IonicContact OE1-NH2 2.76Å; E430-R472 PolarHBondContact OE1-NH2 3.43Å; E430-R472 IonicContact OE2-CZ 2.87Å; E430-R472 IonicContact OE2-NE 3.29Å; E430-R472 IonicContact OE2-NH2 3.21Å; E430-R472 PolarHBondContact OE2-NH2 3.28Å; E430-L476 HydrophobicContact CB-CD1 4.11Å; E430-L476 HydrophobicContact CB-CD2 4.33Å; E430-L476 HydrophobicContact CG-CD1 3.78Å |
| 431 | F | 94.9 | Very high | 93 | Very high | 9 Ų | 9 | 31.6 Ų | 31.6 | 4% | 0.039 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.4 | -42.2 | 171.4 | -89.9 | -67.3 | 0 | 0 | 0 | 112 | M371 Q372 I421 P426 T427 D428 L434 K435 | M371-F431 HydrophobicContact CB-CE1 4.33Å; Q372-F431 HydrophobicContact CB-CD1 4Å; Q372-F431 HydrophobicContact CB-CD2 4.07Å; Q372-F431 HydrophobicContact CB-CE1 4Å; Q372-F431 HydrophobicContact CB-CE2 4.08Å; Q372-F431 HydrophobicContact CB-CG 4.03Å; Q372-F431 HydrophobicContact CB-CZ 4.03Å; Q372-F431 HydrophobicContact CG-CB 4.42Å; Q372-F431 HydrophobicContact CG-CD1 4.46Å; Q372-F431 HydrophobicContact CG-CD2 3.74Å; Q372-F431 HydrophobicContact CG-CE2 4.02Å; Q372-F431 HydrophobicContact CG-CG 3.97Å; Q372-F431 HydrophobicContact CG-CZ 4.49Å; I421-F431 HydrophobicContact CD1-CE1 4.27Å; I421-F431 HydrophobicContact CD1-CZ 4.47Å; I421-F431 HydrophobicContact CG2-CE1 4.35Å; I421-F431 HydrophobicContact CG2-CZ 3.65Å; P426-F431 HydrophobicContact CB-CD2 3.75Å; P426-F431 HydrophobicContact CB-CE2 3.68Å; P426-F431 HydrophobicContact CB-CG 4.23Å; P426-F431 HydrophobicContact CB-CZ 4.1Å; P426-F431 HydrophobicContact CG-CD2 4.47Å; P426-F431 HydrophobicContact CG-CE1 4.38Å; P426-F431 HydrophobicContact CG-CE2 3.95Å; P426-F431 HydrophobicContact CG-CZ 3.91Å; P426-F431 WeakPolarHBondContact O-CD2 3.34Å; P426-F431 WeakPolarHBondContact O-CE2 3.47Å; T427-F431 WeakPolarHBondContact O-CD2 3.46Å; T427-F431 PolarHBondContact O-N 3.29Å; D428-F431 PolarHBondContact O-N 3.43Å; F431-L434 PolarHBondContact O-N 3.42Å; F431-K435 VanDerWaalsContact O-CG 3.32Å; F431-K435 WeakPolarHBondContact O-CG 3.16Å; F431-K435 PolarHBondContact O-N 2.92Å |
| 432 | G | 93.6 | Very high | 92.3 | Very high | 1 Ų | 1 | 33.8 Ų | 33.8 | 1% | 0.01 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -57.6 | -50.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L301 W339 D428 V429 E430 L434 K435 L436 | L301-G432 VanDerWaalsContact CD1-C 3.48Å; W339-G432 VanDerWaalsContact CH2-CA 3.49Å; D428-G432 PolarHBondContact O-N 3.24Å; V429-G432 WeakPolarHBondContact O-CA 3.27Å; V429-G432 PolarHBondContact O-N 2.76Å; V429-G432 VanDerWaalsContact O-N 3.15Å; E430-G432 VanDerWaalsContact C-N 3.29Å; E430-G432 PolarHBondContact O-N 3.14Å; G432-L434 PolarHBondContact O-N 2.85Å; G432-K435 PolarHBondContact O-N 3.21Å; G432-L436 WeakPolarHBondContact O-CG 3.41Å; G432-L436 PolarHBondContact O-N 3.29Å |
| 433 | Y | 94.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.7 | -41.2 | 176.1 | -76.7 | -66.2 | 0 | 0 | 0 | 112.4 | L301 V429 E430 K435 L436 I437 T460 E463 L464 Q467 | L301-Y433 HydrophobicContact CD1-CD1 4.25Å; L301-Y433 HydrophobicContact CD1-CD2 4.28Å; L301-Y433 HydrophobicContact CD1-CE1 4.35Å; L301-Y433 HydrophobicContact CD1-CE2 4.37Å; L301-Y433 HydrophobicContact CD1-CG 4.2Å; V429-Y433 HydrophobicContact CG1-CD2 3.77Å; V429-Y433 HydrophobicContact CG1-CE2 3.49Å; V429-Y433 VanDerWaalsContact CG1-CE2 3.49Å; V429-Y433 VanDerWaalsContact O-CD2 3.22Å; V429-Y433 WeakPolarHBondContact O-CD2 3.32Å; V429-Y433 PolarHBondContact O-N 2.89Å; E430-Y433 PolarHBondContact O-N 3.28Å; Y433-K435 VanDerWaalsContact C-N 3.35Å; Y433-K435 PolarHBondContact O-N 3.41Å; Y433-L436 PolarHBondContact O-N 2.83Å; Y433-I437 VanDerWaalsContact O-CG1 3.24Å; Y433-I437 WeakPolarHBondContact O-CG1 3.41Å; Y433-I437 PolarHBondContact O-N 3.13Å; Y433-T460 HydrophobicContact CD1-CG2 3.66Å; Y433-T460 HydrophobicContact CE1-CG2 4.42Å; Y433-E463 HydrophobicContact CE1-CB 3.72Å; Y433-E463 PolarHBondContact OH-OE2 2.95Å; Y433-L464 HydrophobicContact CD1-CB 4.37Å; Y433-L464 HydrophobicContact CD2-CB 4.41Å; Y433-L464 HydrophobicContact CD2-CD1 3.97Å; Y433-L464 HydrophobicContact CG-CB 4.09Å; Y433-L464 HydrophobicContact CG-CD1 4.18Å; Y433-Q467 PolarHBondContact OH-NE2 3.5Å |
| 434 | L | 95.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.3 | -42.3 | 175.5 | -71.3 | 175.3 | 0 | 0 | 0 | 112.2 | L368 E430 F431 G432 I437 A438 L476 L479 L480 | L368-L434 HydrophobicContact CD1-CB 4.3Å; L368-L434 HydrophobicContact CD2-CB 4.42Å; E430-L434 VanDerWaalsContact O-CG 3.31Å; E430-L434 WeakPolarHBondContact O-CG 3.23Å; E430-L434 PolarHBondContact O-N 3.43Å; F431-L434 PolarHBondContact O-N 3.42Å; G432-L434 PolarHBondContact O-N 2.85Å; L434-I437 PolarHBondContact O-N 3.45Å; L434-A438 WeakPolarHBondContact O-CB 3.48Å; L434-A438 PolarHBondContact O-N 3.38Å; L434-L476 HydrophobicContact CD1-CD2 4.3Å; L434-L476 HydrophobicContact CD2-CB 4.25Å; L434-L476 WeakPolarHBondContact CD2-O 3.35Å; L434-L479 HydrophobicContact CD1-CD1 4.03Å; L434-L480 HydrophobicContact CB-CD2 4.29Å; L434-L480 HydrophobicContact CD2-CD1 4.18Å; L434-L480 HydrophobicContact CD2-CD2 3.96Å; L434-L480 HydrophobicContact CD2-CG 3.97Å |
| 435 | K | 94.5 | Very high | 88.2 | Confident | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62 | -44.1 | 174.8 | -71.2 | 171.2 | -168.7 | 172.1 | 0 | 111.3 | W339 I365 L368 F431 G432 Y433 A438 F439 | W339-K435 HydrophobicContact CE3-CD 3.94Å; W339-K435 HydrophobicContact CH2-CB 4.25Å; W339-K435 HydrophobicContact CH2-CD 4.16Å; W339-K435 HydrophobicContact CZ3-CB 3.8Å; W339-K435 HydrophobicContact CZ3-CD 3.73Å; W339-K435 HydrophobicContact CZ3-CG 4.44Å; I365-K435 HydrophobicContact CD1-CB 4.5Å; I365-K435 VanDerWaalsContact CD1-O 3.27Å; I365-K435 WeakPolarHBondContact CD1-O 3.26Å; L368-K435 HydrophobicContact CB-CG 3.86Å; L368-K435 HydrophobicContact CD1-CB 4.42Å; L368-K435 HydrophobicContact CD1-CG 3.94Å; F431-K435 VanDerWaalsContact O-CG 3.32Å; F431-K435 WeakPolarHBondContact O-CG 3.16Å; F431-K435 PolarHBondContact O-N 2.92Å; G432-K435 PolarHBondContact O-N 3.21Å; Y433-K435 VanDerWaalsContact C-N 3.35Å; Y433-K435 PolarHBondContact O-N 3.41Å; K435-A438 PolarHBondContact O-N 3.47Å; K435-F439 VanDerWaalsContact O-CB 3.27Å; K435-F439 WeakPolarHBondContact O-CB 3.32Å; K435-F439 PolarHBondContact O-N 2.98Å |
| 436 | L | 92.9 | Very high | 86.5 | Confident | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.4 | -39.8 | 178.3 | -69.3 | 179.7 | 0 | 0 | 0 | 112.5 | I300 L301 W339 L340 V343 L346 G432 Y433 F439 S440 F456 T460 | I300-L436 HydrophobicContact CG2-CD1 3.57Å; L301-L436 HydrophobicContact CD1-CD1 3.76Å; L301-L436 HydrophobicContact CD2-CD1 4.22Å; L301-L436 HydrophobicContact CG-CD1 3.9Å; W339-L436 HydrophobicContact CH2-CG 4.36Å; W339-L436 HydrophobicContact CZ3-CD2 4.5Å; L340-L436 HydrophobicContact CD1-CD2 3.82Å; V343-L436 HydrophobicContact CG1-CD1 4.38Å; V343-L436 HydrophobicContact CG1-CD2 4.26Å; V343-L436 HydrophobicContact CG2-CD2 4.26Å; L346-L436 HydrophobicContact CD1-CD2 4.47Å; G432-L436 WeakPolarHBondContact O-CG 3.41Å; G432-L436 PolarHBondContact O-N 3.29Å; Y433-L436 PolarHBondContact O-N 2.83Å; L436-F439 PolarHBondContact O-N 3.33Å; L436-S440 WeakPolarHBondContact O-CB 3.23Å; L436-S440 PolarHBondContact O-N 3.36Å; L436-S440 PolarHBondContact O-OG 3.22Å; L436-F456 HydrophobicContact CB-CE1 4.22Å; L436-F456 HydrophobicContact CD1-CZ 4.34Å; L436-F456 HydrophobicContact CD2-CE1 4.07Å; L436-F456 HydrophobicContact CD2-CZ 4.02Å; L436-T460 HydrophobicContact CB-CG2 3.53Å; L436-T460 HydrophobicContact CD1-CG2 4.23Å |
| 437 | I | 93.3 | Very high | 84.6 | Confident | 8 Ų | 8 | 31 Ų | 31 | 4% | 0.041 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.5 | -43.6 | 175.5 | -64.3 | 166.2 | 0 | 0 | 0 | 110.4 | Y433 L434 S440 A441 T460 L464 L477 L480 | Y433-I437 VanDerWaalsContact O-CG1 3.24Å; Y433-I437 WeakPolarHBondContact O-CG1 3.41Å; Y433-I437 PolarHBondContact O-N 3.13Å; L434-I437 PolarHBondContact O-N 3.45Å; I437-S440 PolarHBondContact O-N 3.39Å; I437-S440 PolarHBondContact O-OG 2.72Å; I437-A441 PolarHBondContact O-N 3.06Å; I437-T460 HydrophobicContact CD1-CG2 4.42Å; I437-T460 HydrophobicContact CG1-CG2 3.64Å; I437-L464 HydrophobicContact CD1-CD2 4.01Å; I437-L477 HydrophobicContact CD1-CD2 3.92Å; I437-L480 HydrophobicContact CB-CD1 4.07Å; I437-L480 HydrophobicContact CG2-CD1 3.48Å; I437-L480 VanDerWaalsContact CG2-CD1 3.48Å |
| 438 | A | 92.9 | Very high | 83.2 | Confident | 3 Ų | 3 | 28.6 Ų | 28.6 | 3% | 0.025 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.5 | -42.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E364 I365 L368 L434 K435 L480 L483 | E364-A438 HydrophobicContact CB-CB 4.37Å; I365-A438 HydrophobicContact CD1-CB 4.09Å; L368-A438 HydrophobicContact CD1-CB 3.97Å; L434-A438 WeakPolarHBondContact O-CB 3.48Å; L434-A438 PolarHBondContact O-N 3.38Å; K435-A438 PolarHBondContact O-N 3.47Å; A438-L480 HydrophobicContact CB-CD2 4.19Å; A438-L483 HydrophobicContact CB-CD1 4.49Å |
| 439 | F | 90.9 | Very high | 81.9 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.2 | -43.1 | 177 | 178.1 | -107.6 | 0 | 0 | 0 | 112.1 | L340 L346 L348 E354 V357 L358 I365 K435 L436 A441 L453 | L340-F439 HydrophobicContact CD1-CB 4.31Å; L340-F439 HydrophobicContact CD1-CD1 4.22Å; L340-F439 HydrophobicContact CD1-CD2 4.49Å; L340-F439 HydrophobicContact CD1-CG 4.08Å; L340-F439 HydrophobicContact CD2-CD1 4.19Å; L340-F439 HydrophobicContact CD2-CD2 3.34Å; L340-F439 HydrophobicContact CD2-CE1 4.22Å; L340-F439 HydrophobicContact CD2-CE2 3.38Å; L340-F439 HydrophobicContact CD2-CG 3.76Å; L340-F439 HydrophobicContact CD2-CZ 3.83Å; L346-F439 HydrophobicContact CD1-CD1 4.06Å; L346-F439 HydrophobicContact CD1-CE1 3.82Å; L346-F439 HydrophobicContact CD2-CE1 3.98Å; L346-F439 HydrophobicContact CD2-CZ 4.41Å; L346-F439 HydrophobicContact CG-CE1 4.31Å; L348-F439 HydrophobicContact CD1-CE1 3.48Å; L348-F439 VanDerWaalsContact CD1-CE1 3.48Å; L348-F439 HydrophobicContact CD1-CZ 3.86Å; E354-F439 HydrophobicContact CG-CZ 4.4Å; V357-F439 HydrophobicContact CB-CD2 4.44Å; V357-F439 HydrophobicContact CB-CE2 3.62Å; V357-F439 HydrophobicContact CB-CZ 3.79Å; V357-F439 HydrophobicContact CG1-CD2 3.57Å; V357-F439 HydrophobicContact CG1-CE1 4.23Å; V357-F439 HydrophobicContact CG1-CE2 3.22Å; V357-F439 HydrophobicContact CG1-CG 4.21Å; V357-F439 HydrophobicContact CG1-CZ 3.62Å; V357-F439 WeakPolarHBondContact CG1-O 3.44Å; L358-F439 HydrophobicContact CD2-CE2 4.28Å; L358-F439 HydrophobicContact CG-CE2 3.97Å; I365-F439 HydrophobicContact CD1-CB 3.86Å; K435-F439 VanDerWaalsContact O-CB 3.27Å; K435-F439 WeakPolarHBondContact O-CB 3.32Å; K435-F439 PolarHBondContact O-N 2.98Å; L436-F439 PolarHBondContact O-N 3.33Å; F439-A441 VanDerWaalsContact C-N 3.31Å; F439-A441 PolarHBondContact O-N 2.81Å; F439-L453 HydrophobicContact CE1-CD1 4.49Å |
| 440 | S | 88.4 | Confident | 81 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | 7 | -175.3 | 60.3 | 0 | 0 | 0 | 0 | 115.3 | L436 I437 T442 L453 Q457 | L436-S440 WeakPolarHBondContact O-CB 3.23Å; L436-S440 PolarHBondContact O-N 3.36Å; L436-S440 PolarHBondContact O-OG 3.22Å; I437-S440 PolarHBondContact O-N 3.39Å; I437-S440 PolarHBondContact O-OG 2.72Å; S440-T442 PolarHBondContact O-N 3.36Å; S440-L453 WeakPolarHBondContact O-CG 3.5Å; S440-Q457 WeakPolarHBondContact OG-CA 3.48Å; S440-Q457 VanDerWaalsContact OG-CB 3.26Å; S440-Q457 WeakPolarHBondContact OG-CB 3.31Å; S440-Q457 WeakPolarHBondContact OG-CG 3.34Å |
| 441 | A | 87.3 | Confident | 80.2 | Confident | 9 Ų | 9 | 33.8 Ų | 33.8 | 7% | 0.074 | 23% | 0.228 | C | C | . | . | trans | -69.6 | 126.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R361 I437 F439 D443 | R361-A441 PolarHBondContact NH2-O 3.34Å; I437-A441 PolarHBondContact O-N 3.06Å; F439-A441 VanDerWaalsContact C-N 3.31Å; F439-A441 PolarHBondContact O-N 2.81Å; A441-D443 VanDerWaalsContact CB-OD1 3.22Å; A441-D443 WeakPolarHBondContact CB-OD1 3.27Å | ||
| 442 | T | 79.3 | Confident | 79.4 | Confident | 54 Ų | 54 | 38.9 Ų | 38.9 | 33% | 0.331 | 25% | 0.252 | S | S | . | . | trans | -93.9 | 10.9 | -171.9 | 59.6 | 0 | 0 | 0 | 0 | 115.1 | S440 S444 V450 L453 A454 | S440-T442 PolarHBondContact O-N 3.36Å; T442-S444 VanDerWaalsContact C-N 3.26Å; T442-S444 PolarHBondContact O-N 3.42Å; T442-V450 HydrophobicContact CG2-CG1 4.02Å; T442-L453 HydrophobicContact CG2-CB 4.33Å; T442-L453 HydrophobicContact CG2-CD2 4.3Å; T442-L453 HydrophobicContact CG2-CG 4.49Å; T442-A454 HydrophobicContact CG2-CB 4.19Å | ||
| 443 | D | 73.5 | Confident | 78.9 | Confident | 89 Ų | 89 | 39.2 Ų | 39.2 | 48% | 0.476 | 25% | 0.253 | S | S | . | . | trans | -73.5 | -11.9 | -176.3 | 54.4 | -74.1 | 0 | 0 | 0 | 114.6 | R361 A441 R484 | R361-D443 IonicContact CZ-OD1 2.63Å; R361-D443 IonicContact CZ-OD2 2.76Å; R361-D443 IonicContact NH1-OD1 3.38Å; R361-D443 IonicContact NH1-OD2 3.74Å; R361-D443 PolarHBondContact NH1-OD2 3.29Å; R361-D443 VanDerWaalsContact NH1-OD2 3.14Å; R361-D443 IonicContact NH2-OD1 2.63Å; R361-D443 PolarHBondContact NH2-OD1 2.82Å; R361-D443 IonicContact NH2-OD2 2.84Å; R361-D443 PolarHBondContact NH2-OD2 2.96Å; A441-D443 VanDerWaalsContact CB-OD1 3.22Å; A441-D443 WeakPolarHBondContact CB-OD1 3.27Å; D443-R484 IonicContact OD1-CZ 3.01Å; D443-R484 IonicContact OD1-NH1 3.98Å; D443-R484 PolarHBondContact OD1-NH1 2.65Å; D443-R484 IonicContact OD1-NH2 3.57Å; D443-R484 PolarHBondContact OD1-NH2 3.19Å; D443-R484 IonicContact OD2-CZ 3.34Å; D443-R484 VanDerWaalsContact OD2-CZ 3.23Å; D443-R484 IonicContact OD2-NH1 3.71Å; D443-R484 PolarHBondContact OD2-NH1 3.45Å; D443-R484 IonicContact OD2-NH2 3.68Å; D443-R484 PolarHBondContact OD2-NH2 3.19Å | ||
| 444 | S | 64.4 | Low | 78.5 | Confident | 33 Ų | 33 | 40.2 Ų | 40.2 | 23% | 0.231 | 26% | 0.262 | C | S | . | . | S | Bend | trans | -86.8 | 121 | 174.3 | -63.2 | 0 | 0 | 0 | 0 | 109.5 | Q360 R361 T442 G446 F448 | Q360-S444 VanDerWaalsContact OE1-CB 3.23Å; R361-S444 PolarHBondContact NH2-OG 2.95Å; T442-S444 VanDerWaalsContact C-N 3.26Å; T442-S444 PolarHBondContact O-N 3.42Å; S444-G446 PolarHBondContact O-N 2.84Å; S444-F448 WeakPolarHBondContact O-CE2 3.4Å |
| 445 | G | 56.1 | Low | 78 | Confident | 91 Ų | 91 | 44 Ų | 44 | 94% | 0.938 | 28% | 0.282 | S | S | * | . | trans | -66.1 | 33.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 446 | G | 58.9 | Low | 77.6 | Confident | 24 Ų | 24 | 45.4 Ų | 45.4 | 25% | 0.247 | 29% | 0.288 | C | S | . | . | trans | -72.8 | 149.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | S444 F448 | S444-G446 PolarHBondContact O-N 2.84Å; G446-F448 WeakPolarHBondContact O-CD2 3.27Å; G446-F448 PolarHBondContact O-N 2.85Å | ||
| 447 | T | 53.9 | Low | 77.4 | Confident | 138 Ų | 138 | 47.6 Ų | 47.6 | 85% | 0.847 | 30% | 0.298 | S | S | * | . | trans | -71.8 | 62.8 | 170.6 | 54.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 448 | F | 63.9 | Low | 77.3 | Confident | 26 Ų | 26 | 54 Ų | 54 | 11% | 0.114 | 32% | 0.322 | C | S | . | . | trans | -77.6 | 162.2 | 174.3 | -58.4 | -74.4 | 0 | 0 | 0 | 109.2 | M356 V357 S444 G446 V450 | M356-F448 HydrophobicContact CE-CD1 3.46Å; M356-F448 VanDerWaalsContact CE-CD1 3.46Å; M356-F448 HydrophobicContact CE-CE1 3.55Å; M356-F448 HydrophobicContact CG-CE1 4Å; M356-F448 HydrophobicContact SD-CD1 4.45Å; M356-F448 HydrophobicContact SD-CE1 4.05Å; V357-F448 HydrophobicContact CG2-CD1 4Å; V357-F448 HydrophobicContact CG2-CE1 3.68Å; S444-F448 WeakPolarHBondContact O-CE2 3.4Å; G446-F448 WeakPolarHBondContact O-CD2 3.27Å; G446-F448 PolarHBondContact O-N 2.85Å; F448-V450 HydrophobicContact CB-CG2 3.98Å; F448-V450 PolarHBondContact O-N 2.79Å | ||
| 449 | N | 63.7 | Low | 77.1 | Confident | 98 Ų | 98 | 57.8 Ų | 57.8 | 52% | 0.524 | 34% | 0.339 | S | S | . | . | trans | -72.3 | 71.8 | 153.5 | -158 | -24.1 | 0 | 0 | 0 | 107.5 | A451 H452 L453 | N449-A451 PolarHBondContact O-N 3.29Å; N449-H452 PolarHBondContact ND2-CD2 2.8Å; N449-H452 PolarHBondContact ND2-NE2 3.34Å; N449-H452 PolarHBondContact O-N 3.43Å; N449-L453 PolarHBondContact O-N 3.39Å | ||
| 450 | V | 73.4 | Confident | 77.1 | Confident | 70 Ų | 70 | 57.8 Ų | 57.8 | 42% | 0.424 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -51.4 | -32.1 | -171.3 | 178 | 0 | 0 | 0 | 0 | 110.5 | T442 F448 A454 | T442-V450 HydrophobicContact CG2-CG1 4.02Å; F448-V450 HydrophobicContact CB-CG2 3.98Å; F448-V450 PolarHBondContact O-N 2.79Å; V450-A454 WeakPolarHBondContact O-CB 3.29Å; V450-A454 PolarHBondContact O-N 2.97Å |
| 451 | A | 79.4 | Confident | 77.3 | Confident | 57 Ų | 57 | 59 Ų | 59 | 47% | 0.471 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.7 | -46.9 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | N449 N455 | N449-A451 PolarHBondContact O-N 3.29Å; A451-N455 WeakPolarHBondContact O-CB 3.48Å; A451-N455 PolarHBondContact O-N 3.07Å; A451-N455 PolarHBondContact O-ND2 3.25Å; A451-N455 PolarHBondContact O-OD1 3.15Å |
| 452 | H | 78.6 | Confident | 77.5 | Confident | 116 Ų | 116 | 66.8 Ų | 66.8 | 54% | 0.537 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -67.8 | -44.6 | 179.8 | -69.6 | -67.3 | 0 | 0 | 0 | 111.7 | N449 A454 N455 F456 | N449-H452 PolarHBondContact ND2-CD2 2.8Å; N449-H452 PolarHBondContact ND2-NE2 3.34Å; N449-H452 PolarHBondContact O-N 3.43Å; H452-A454 VanDerWaalsContact C-N 3.34Å; H452-A454 PolarHBondContact O-N 3.34Å; H452-N455 PolarHBondContact O-N 3.34Å; H452-F456 WeakPolarHBondContact O-CB 3.39Å; H452-F456 PolarHBondContact O-N 2.88Å |
| 453 | L | 82.4 | Confident | 78 | Confident | 8 Ų | 8 | 65.5 Ų | 65.5 | 4% | 0.042 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.3 | -40.4 | 179.9 | -161.2 | 67.5 | 0 | 0 | 0 | 111.2 | V357 F439 S440 T442 N449 F456 Q457 | V357-L453 HydrophobicContact CG2-CD2 4.41Å; F439-L453 HydrophobicContact CE1-CD1 4.49Å; S440-L453 WeakPolarHBondContact O-CG 3.5Å; T442-L453 HydrophobicContact CG2-CB 4.33Å; T442-L453 HydrophobicContact CG2-CD2 4.3Å; T442-L453 HydrophobicContact CG2-CG 4.49Å; N449-L453 PolarHBondContact O-N 3.39Å; L453-F456 PolarHBondContact O-N 3.45Å; L453-Q457 WeakPolarHBondContact O-CB 2.97Å; L453-Q457 PolarHBondContact O-N 3.42Å |
| 454 | A | 84.7 | Confident | 78.9 | Confident | 21 Ų | 21 | 61.3 Ų | 61.3 | 17% | 0.174 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -65.7 | -36.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | T442 V450 H452 R458 | T442-A454 HydrophobicContact CG2-CB 4.19Å; V450-A454 WeakPolarHBondContact O-CB 3.29Å; V450-A454 PolarHBondContact O-N 2.97Å; H452-A454 VanDerWaalsContact C-N 3.34Å; H452-A454 PolarHBondContact O-N 3.34Å; A454-R458 WeakPolarHBondContact O-CB 3.38Å; A454-R458 VanDerWaalsContact O-CG 3.27Å; A454-R458 WeakPolarHBondContact O-CG 3.22Å; A454-R458 PolarHBondContact O-N 3.37Å |
| 455 | N | 85.4 | Confident | 80.2 | Confident | 80 Ų | 80 | 62.3 Ų | 62.3 | 43% | 0.428 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.4 | -45 | 173.9 | -73.8 | -18.1 | 0 | 0 | 0 | 111.2 | A451 H452 R458 Q459 | A451-N455 WeakPolarHBondContact O-CB 3.48Å; A451-N455 PolarHBondContact O-N 3.07Å; A451-N455 PolarHBondContact O-ND2 3.25Å; A451-N455 PolarHBondContact O-OD1 3.15Å; H452-N455 PolarHBondContact O-N 3.34Å; N455-R458 PolarHBondContact O-N 3Å; N455-R458 PolarHBondContact OD1-NH2 3.24Å; N455-Q459 PolarHBondContact O-N 2.9Å |
| 456 | F | 86.9 | Confident | 81.8 | Confident | 29 Ų | 29 | 61.2 Ų | 61.2 | 13% | 0.127 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 176.3 | -175.9 | -94 | 0 | 0 | 0 | 111.6 | I300 S345 L346 L436 H452 L453 R458 Q459 T460 | I300-F456 HydrophobicContact CD1-CE2 4.46Å; I300-F456 HydrophobicContact CG2-CE2 4.43Å; I300-F456 HydrophobicContact CG2-CZ 4.24Å; S345-F456 WeakPolarHBondContact O-CE2 3.43Å; L346-F456 HydrophobicContact CD1-CD1 4.33Å; L346-F456 HydrophobicContact CD1-CE1 3.64Å; L346-F456 HydrophobicContact CD1-CE2 3.95Å; L346-F456 HydrophobicContact CD1-CZ 3.42Å; L346-F456 VanDerWaalsContact CD1-CZ 3.42Å; L436-F456 HydrophobicContact CB-CE1 4.22Å; L436-F456 HydrophobicContact CD1-CZ 4.34Å; L436-F456 HydrophobicContact CD2-CE1 4.07Å; L436-F456 HydrophobicContact CD2-CZ 4.02Å; H452-F456 WeakPolarHBondContact O-CB 3.39Å; H452-F456 PolarHBondContact O-N 2.88Å; L453-F456 PolarHBondContact O-N 3.45Å; F456-R458 VanDerWaalsContact C-N 3.34Å; F456-R458 PolarHBondContact O-N 3.18Å; F456-Q459 PolarHBondContact O-N 3.04Å; F456-T460 WeakPolarHBondContact O-CB 3.46Å; F456-T460 PolarHBondContact O-N 3.28Å; F456-T460 PolarHBondContact O-OG1 3.01Å |
| 457 | Q | 89.3 | Confident | 83.2 | Confident | 45 Ų | 45 | 63.5 Ų | 63.5 | 21% | 0.21 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.4 | -46.3 | 174.6 | -169 | 179.8 | 42.5 | 0 | 0 | 111.3 | S440 L453 Q459 T460 C461 | S440-Q457 WeakPolarHBondContact OG-CA 3.48Å; S440-Q457 VanDerWaalsContact OG-CB 3.26Å; S440-Q457 WeakPolarHBondContact OG-CB 3.31Å; S440-Q457 WeakPolarHBondContact OG-CG 3.34Å; L453-Q457 WeakPolarHBondContact O-CB 2.97Å; L453-Q457 PolarHBondContact O-N 3.42Å; Q457-Q459 PolarHBondContact O-N 2.93Å; Q457-T460 WeakPolarHBondContact O-CB 3.43Å; Q457-T460 PolarHBondContact O-N 2.87Å; Q457-C461 WeakPolarHBondContact O-CB 3.21Å; Q457-C461 PolarHBondContact O-N 2.85Å; Q457-C461 PolarHBondContact O-SG 2.63Å; Q457-C461 VanDerWaalsContact O-SG 3.36Å |
| 458 | R | 89.3 | Confident | 84.9 | Confident | 144 Ų | 144 | 58.3 Ų | 58.3 | 54% | 0.543 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.1 | -42.6 | 177.6 | -78.3 | -172.2 | -73.6 | -169.5 | -2 | 112.4 | A454 N455 F456 C461 R462 | A454-R458 WeakPolarHBondContact O-CB 3.38Å; A454-R458 VanDerWaalsContact O-CG 3.27Å; A454-R458 WeakPolarHBondContact O-CG 3.22Å; A454-R458 PolarHBondContact O-N 3.37Å; N455-R458 PolarHBondContact O-N 3Å; N455-R458 PolarHBondContact OD1-NH2 3.24Å; F456-R458 VanDerWaalsContact C-N 3.34Å; F456-R458 PolarHBondContact O-N 3.18Å; R458-C461 PolarHBondContact O-N 3.26Å; R458-R462 WeakPolarHBondContact O-CB 3.29Å; R458-R462 VanDerWaalsContact O-CG 3.27Å; R458-R462 WeakPolarHBondContact O-CG 3.34Å; R458-R462 PolarHBondContact O-N 3.4Å |
| 459 | Q | 89.6 | Confident | 86.3 | Confident | 82 Ų | 82 | 61.9 Ų | 61.9 | 38% | 0.383 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.6 | -46.3 | 176.5 | -177.5 | 61.5 | 21.8 | 0 | 0 | 111.1 | I300 N455 F456 Q457 C461 R462 E463 | I300-Q459 HydrophobicContact CD1-CB 4.17Å; I300-Q459 HydrophobicContact CD1-CG 3.58Å; I300-Q459 HydrophobicContact CG1-CG 4.35Å; N455-Q459 PolarHBondContact O-N 2.9Å; F456-Q459 PolarHBondContact O-N 3.04Å; Q457-Q459 PolarHBondContact O-N 2.93Å; Q459-C461 PolarHBondContact O-N 3.33Å; Q459-R462 PolarHBondContact O-N 2.94Å; Q459-E463 PolarHBondContact NE2-OE1 3.46Å; Q459-E463 PolarHBondContact O-N 3.35Å |
| 460 | T | 90.6 | Very high | 87.6 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -57.7 | -46.8 | 177.3 | -55 | 0 | 0 | 0 | 0 | 111.4 | Y433 L436 I437 F456 Q457 R462 E463 L464 | Y433-T460 HydrophobicContact CD1-CG2 3.66Å; Y433-T460 HydrophobicContact CE1-CG2 4.42Å; L436-T460 HydrophobicContact CB-CG2 3.53Å; L436-T460 HydrophobicContact CD1-CG2 4.23Å; I437-T460 HydrophobicContact CD1-CG2 4.42Å; I437-T460 HydrophobicContact CG1-CG2 3.64Å; F456-T460 WeakPolarHBondContact O-CB 3.46Å; F456-T460 PolarHBondContact O-N 3.28Å; F456-T460 PolarHBondContact O-OG1 3.01Å; Q457-T460 WeakPolarHBondContact O-CB 3.43Å; Q457-T460 PolarHBondContact O-N 2.87Å; T460-R462 PolarHBondContact O-N 3.22Å; T460-E463 PolarHBondContact O-N 3.28Å; T460-L464 PolarHBondContact O-N 2.91Å; T460-L464 VanDerWaalsContact O-N 3.08Å |
| 461 | C | 92 | Very high | 88.5 | Confident | 25 Ų | 25 | 65.7 Ų | 65.7 | 17% | 0.169 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.8 | -39.5 | 177 | -74 | 0 | 0 | 0 | 0 | 112.8 | Q457 R458 Q459 C465 | Q457-C461 WeakPolarHBondContact O-CB 3.21Å; Q457-C461 PolarHBondContact O-N 2.85Å; Q457-C461 PolarHBondContact O-SG 2.63Å; Q457-C461 VanDerWaalsContact O-SG 3.36Å; R458-C461 PolarHBondContact O-N 3.26Å; Q459-C461 PolarHBondContact O-N 3.33Å; C461-C465 WeakPolarHBondContact O-CB 3.43Å; C461-C465 PolarHBondContact O-N 3.46Å |
| 462 | R | 91.6 | Very high | 89.2 | Confident | 173 Ų | 173 | 65.9 Ų | 65.9 | 65% | 0.653 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -65.9 | -42.3 | 177.6 | -77.4 | 173.4 | 179.3 | -178 | -2.4 | 111.9 | R458 Q459 T460 C465 G466 | R458-R462 WeakPolarHBondContact O-CB 3.29Å; R458-R462 VanDerWaalsContact O-CG 3.27Å; R458-R462 WeakPolarHBondContact O-CG 3.34Å; R458-R462 PolarHBondContact O-N 3.4Å; Q459-R462 PolarHBondContact O-N 2.94Å; T460-R462 PolarHBondContact O-N 3.22Å; R462-C465 PolarHBondContact O-N 2.95Å; R462-G466 PolarHBondContact O-N 3.08Å |
| 463 | E | 90.5 | Very high | 89.9 | Confident | 27 Ų | 27 | 62.3 Ų | 62.3 | 13% | 0.126 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -66.6 | -38.4 | 177.7 | -76 | -173.5 | -156.3 | 0 | 0 | 112.6 | I300 Y433 Q459 T460 G466 Q467 | I300-E463 WeakPolarHBondContact CG1-OE1 3.13Å; I300-E463 PolarHBondContact N-OE1 3.06Å; I300-E463 PolarHBondContact N-OE2 3.23Å; Y433-E463 HydrophobicContact CE1-CB 3.72Å; Y433-E463 PolarHBondContact OH-OE2 2.95Å; Q459-E463 PolarHBondContact NE2-OE1 3.46Å; Q459-E463 PolarHBondContact O-N 3.35Å; T460-E463 PolarHBondContact O-N 3.28Å; E463-G466 PolarHBondContact O-N 2.96Å; E463-Q467 VanDerWaalsContact O-CG 3.27Å; E463-Q467 WeakPolarHBondContact O-CG 3.39Å; E463-Q467 PolarHBondContact O-N 3.43Å; E463-Q467 PolarHBondContact O-NE2 3.3Å |
| 464 | L | 91.9 | Very high | 90.5 | Very high | 1 Ų | 1 | 65.4 Ų | 65.4 | 1% | 0.005 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.8 | -48.5 | 174.2 | -178.6 | 62.1 | 0 | 0 | 0 | 111 | E430 Y433 I437 T460 G466 Q467 V468 Y473 L476 | E430-L464 HydrophobicContact CG-CD1 4.37Å; Y433-L464 HydrophobicContact CD1-CB 4.37Å; Y433-L464 HydrophobicContact CD2-CB 4.41Å; Y433-L464 HydrophobicContact CD2-CD1 3.97Å; Y433-L464 HydrophobicContact CG-CB 4.09Å; Y433-L464 HydrophobicContact CG-CD1 4.18Å; I437-L464 HydrophobicContact CD1-CD2 4.01Å; T460-L464 PolarHBondContact O-N 2.91Å; T460-L464 VanDerWaalsContact O-N 3.08Å; L464-G466 PolarHBondContact O-N 3.43Å; L464-Q467 PolarHBondContact O-N 3.5Å; L464-V468 HydrophobicContact CD1-CG1 4.42Å; L464-V468 WeakPolarHBondContact O-CG2 3.48Å; L464-V468 PolarHBondContact O-N 2.9Å; L464-Y473 HydrophobicContact CB-CD2 4.46Å; L464-Y473 HydrophobicContact CB-CE2 4.21Å; L464-Y473 HydrophobicContact CD2-CD2 4.13Å; L464-Y473 HydrophobicContact CD2-CE2 4.07Å; L464-Y473 HydrophobicContact CG-CD2 3.96Å; L464-Y473 HydrophobicContact CG-CE2 4.09Å; L464-L476 HydrophobicContact CD1-CD1 4.24Å |
| 465 | C | 92.4 | Very high | 90.9 | Very high | 53 Ų | 53 | 67.4 Ų | 67.4 | 36% | 0.358 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -57.6 | -35.2 | 176.5 | -176.2 | 0 | 0 | 0 | 0 | 112.2 | C461 R462 Q467 V468 Y473 | C461-C465 WeakPolarHBondContact O-CB 3.43Å; C461-C465 PolarHBondContact O-N 3.46Å; R462-C465 PolarHBondContact O-N 2.95Å; C465-Q467 VanDerWaalsContact C-N 3.27Å; C465-Q467 PolarHBondContact O-N 2.88Å; C465-V468 VanDerWaalsContact O-O 3.09Å; C465-Y473 HydrophobicContact CB-CD2 3.92Å; C465-Y473 HydrophobicContact CB-CE2 3.71Å; C465-Y473 HydrophobicContact CB-CG 4.44Å |
| 466 | G | 90 | Very high | 91.4 | Very high | 69 Ų | 69 | 63.6 Ų | 63.6 | 71% | 0.711 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.3 | -8.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | R462 E463 L464 | R462-G466 PolarHBondContact O-N 3.08Å; E463-G466 PolarHBondContact O-N 2.96Å; L464-G466 PolarHBondContact O-N 3.43Å |
| 467 | Q | 87 | Confident | 91.7 | Very high | 71 Ų | 71 | 64.6 Ų | 64.6 | 33% | 0.332 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.6 | -20.6 | -177.2 | -76.6 | 177.7 | 47.6 | 0 | 0 | 114.2 | Y433 E463 L464 C465 | Y433-Q467 PolarHBondContact OH-NE2 3.5Å; E463-Q467 VanDerWaalsContact O-CG 3.27Å; E463-Q467 WeakPolarHBondContact O-CG 3.39Å; E463-Q467 PolarHBondContact O-N 3.43Å; E463-Q467 PolarHBondContact O-NE2 3.3Å; L464-Q467 PolarHBondContact O-N 3.5Å; C465-Q467 VanDerWaalsContact C-N 3.27Å; C465-Q467 PolarHBondContact O-N 2.88Å |
| 468 | V | 91.2 | Very high | 92 | Very high | 29 Ų | 29 | 67.7 Ų | 67.7 | 18% | 0.176 | 36% | 0.355 | C | S | . | . | S | Bend | trans | -130.5 | 159.6 | -175.3 | -55.4 | 0 | 0 | 0 | 0 | 110.3 | E430 L464 C465 R472 Y473 | E430-V468 HydrophobicContact CG-CG1 4.5Å; L464-V468 HydrophobicContact CD1-CG1 4.42Å; L464-V468 WeakPolarHBondContact O-CG2 3.48Å; L464-V468 PolarHBondContact O-N 2.9Å; C465-V468 VanDerWaalsContact O-O 3.09Å; V468-R472 HydrophobicContact CB-CB 3.99Å; V468-R472 HydrophobicContact CB-CG 3.71Å; V468-R472 HydrophobicContact CG1-CG 4.01Å; V468-R472 HydrophobicContact CG2-CB 4.22Å; V468-R472 HydrophobicContact CG2-CG 4.1Å; V468-Y473 HydrophobicContact CG2-CD2 4.34Å |
| 469 | D | 91.9 | Very high | 92.2 | Very high | 101 Ų | 101 | 61.2 Ų | 61.2 | 54% | 0.54 | 33% | 0.33 | S | S | . | . | trans | -68 | 163.9 | 171.7 | 61.4 | 71 | 0 | 0 | 0 | 112.2 | D471 R472 Y473 | D469-D471 VanDerWaalsContact C-N 3.29Å; D469-D471 PolarHBondContact O-N 2.88Å; D469-D471 PolarHBondContact OD1-N 2.75Å; D469-R472 PolarHBondContact O-N 3.49Å; D469-R472 VanDerWaalsContact OD1-CB 3.24Å; D469-R472 WeakPolarHBondContact OD1-CB 3.22Å; D469-R472 PolarHBondContact OD1-N 2.68Å; D469-Y473 WeakPolarHBondContact O-CB 3.48Å; D469-Y473 PolarHBondContact O-N 2.95Å | ||
| 470 | D | 90.6 | Very high | 92.4 | Very high | 120 Ų | 120 | 58.4 Ų | 58.4 | 64% | 0.642 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -61.2 | -34.8 | -174.9 | -71 | -30.4 | 0 | 0 | 0 | 113.1 | T474 | D470-T474 WeakPolarHBondContact O-CB 3.49Å; D470-T474 PolarHBondContact O-N 2.94Å; D470-T474 PolarHBondContact O-OG1 3.35Å |
| 471 | D | 92.3 | Very high | 92.5 | Very high | 129 Ų | 129 | 62.2 Ų | 62.2 | 69% | 0.69 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -71.1 | -43.2 | 179.7 | -71.4 | -30.4 | 0 | 0 | 0 | 110.8 | D469 T474 S475 | D469-D471 VanDerWaalsContact C-N 3.29Å; D469-D471 PolarHBondContact O-N 2.88Å; D469-D471 PolarHBondContact OD1-N 2.75Å; D471-T474 PolarHBondContact O-N 3.23Å; D471-S475 VanDerWaalsContact O-CB 3.3Å; D471-S475 WeakPolarHBondContact O-CB 3.16Å; D471-S475 PolarHBondContact O-N 3.14Å; D471-S475 PolarHBondContact O-OG 2.9Å |
| 472 | R | 94.4 | Very high | 92.5 | Very high | 60 Ų | 60 | 61.9 Ų | 61.9 | 23% | 0.226 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64.2 | -45.6 | 174.5 | -178.2 | 61.6 | 174.2 | -170.2 | 2.5 | 110.9 | A424 K425 E430 V468 D469 T474 S475 L476 | A424-R472 VanDerWaalsContact O-CZ 3.24Å; A424-R472 PolarHBondContact O-NH1 3.46Å; A424-R472 PolarHBondContact O-NH2 3.4Å; K425-R472 PolarHBondContact O-NH2 3.11Å; E430-R472 IonicContact OE1-CZ 2.87Å; E430-R472 IonicContact OE1-NE 2.82Å; E430-R472 PolarHBondContact OE1-NE 3.01Å; E430-R472 IonicContact OE1-NH2 2.76Å; E430-R472 PolarHBondContact OE1-NH2 3.43Å; E430-R472 IonicContact OE2-CZ 2.87Å; E430-R472 IonicContact OE2-NE 3.29Å; E430-R472 IonicContact OE2-NH2 3.21Å; E430-R472 PolarHBondContact OE2-NH2 3.28Å; V468-R472 HydrophobicContact CB-CB 3.99Å; V468-R472 HydrophobicContact CB-CG 3.71Å; V468-R472 HydrophobicContact CG1-CG 4.01Å; V468-R472 HydrophobicContact CG2-CB 4.22Å; V468-R472 HydrophobicContact CG2-CG 4.1Å; D469-R472 PolarHBondContact O-N 3.49Å; D469-R472 VanDerWaalsContact OD1-CB 3.24Å; D469-R472 WeakPolarHBondContact OD1-CB 3.22Å; D469-R472 PolarHBondContact OD1-N 2.68Å; R472-T474 VanDerWaalsContact C-N 3.34Å; R472-T474 PolarHBondContact O-N 3.33Å; R472-S475 PolarHBondContact O-N 3.19Å; R472-L476 HydrophobicContact CG-CD1 4.12Å; R472-L476 WeakPolarHBondContact O-CB 3.24Å; R472-L476 VanDerWaalsContact O-CG 3.25Å; R472-L476 WeakPolarHBondContact O-CG 3.17Å; R472-L476 PolarHBondContact O-N 3.01Å |
| 473 | Y | 94.5 | Very high | 92.6 | Very high | 41 Ų | 41 | 53.9 Ų | 53.9 | 16% | 0.161 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -54.8 | -51.3 | 176.2 | -179 | -109 | 0 | 0 | 0 | 111.1 | L464 C465 V468 D469 S475 L476 L477 | L464-Y473 HydrophobicContact CB-CD2 4.46Å; L464-Y473 HydrophobicContact CB-CE2 4.21Å; L464-Y473 HydrophobicContact CD2-CD2 4.13Å; L464-Y473 HydrophobicContact CD2-CE2 4.07Å; L464-Y473 HydrophobicContact CG-CD2 3.96Å; L464-Y473 HydrophobicContact CG-CE2 4.09Å; C465-Y473 HydrophobicContact CB-CD2 3.92Å; C465-Y473 HydrophobicContact CB-CE2 3.71Å; C465-Y473 HydrophobicContact CB-CG 4.44Å; V468-Y473 HydrophobicContact CG2-CD2 4.34Å; D469-Y473 WeakPolarHBondContact O-CB 3.48Å; D469-Y473 PolarHBondContact O-N 2.95Å; Y473-S475 PolarHBondContact O-N 2.57Å; Y473-L476 PolarHBondContact O-N 2.81Å; Y473-L477 HydrophobicContact CD1-CD1 4.04Å; Y473-L477 HydrophobicContact CE1-CD1 3.41Å; Y473-L477 VanDerWaalsContact CE1-CD1 3.41Å; Y473-L477 HydrophobicContact CE1-CG 4.29Å; Y473-L477 HydrophobicContact CE2-CD1 4.2Å; Y473-L477 HydrophobicContact CE2-CG 4.39Å; Y473-L477 WeakPolarHBondContact O-CG 3.45Å; Y473-L477 PolarHBondContact O-N 2.84Å |
| 474 | T | 93.9 | Very high | 92.5 | Very high | 73 Ų | 73 | 57.7 Ų | 57.7 | 45% | 0.448 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | -179.9 | -57.1 | 0 | 0 | 0 | 0 | 111.3 | D470 D471 R472 L476 L477 L478 | D470-T474 WeakPolarHBondContact O-CB 3.49Å; D470-T474 PolarHBondContact O-N 2.94Å; D470-T474 PolarHBondContact O-OG1 3.35Å; D471-T474 PolarHBondContact O-N 3.23Å; R472-T474 VanDerWaalsContact C-N 3.34Å; R472-T474 PolarHBondContact O-N 3.33Å; T474-L476 VanDerWaalsContact C-N 3.33Å; T474-L476 PolarHBondContact O-N 3.12Å; T474-L477 PolarHBondContact O-N 3.47Å; T474-L478 HydrophobicContact CG2-CD1 4.21Å; T474-L478 WeakPolarHBondContact O-CG 3.32Å; T474-L478 PolarHBondContact O-N 2.9Å |
| 475 | S | 94.1 | Very high | 92.5 | Very high | 63 Ų | 63 | 61.1 Ų | 61.1 | 44% | 0.441 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -59 | -42.7 | 178.6 | -61.4 | 0 | 0 | 0 | 0 | 112.2 | D471 R472 Y473 L478 | D471-S475 VanDerWaalsContact O-CB 3.3Å; D471-S475 WeakPolarHBondContact O-CB 3.16Å; D471-S475 PolarHBondContact O-N 3.14Å; D471-S475 PolarHBondContact O-OG 2.9Å; R472-S475 PolarHBondContact O-N 3.19Å; Y473-S475 PolarHBondContact O-N 2.57Å; S475-L478 PolarHBondContact O-N 2.68Å |
| 476 | L | 95.4 | Very high | 92.4 | Very high | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.005 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65.7 | -44.6 | 176.8 | -69.5 | 171.3 | 0 | 0 | 0 | 111.7 | P426 E430 L434 L464 R472 Y473 T474 L478 L479 | P426-L476 HydrophobicContact CB-CD2 4.01Å; P426-L476 HydrophobicContact CG-CD2 4.12Å; E430-L476 HydrophobicContact CB-CD1 4.11Å; E430-L476 HydrophobicContact CB-CD2 4.33Å; E430-L476 HydrophobicContact CG-CD1 3.78Å; L434-L476 HydrophobicContact CD1-CD2 4.3Å; L434-L476 HydrophobicContact CD2-CB 4.25Å; L434-L476 WeakPolarHBondContact CD2-O 3.35Å; L464-L476 HydrophobicContact CD1-CD1 4.24Å; R472-L476 HydrophobicContact CG-CD1 4.12Å; R472-L476 WeakPolarHBondContact O-CB 3.24Å; R472-L476 VanDerWaalsContact O-CG 3.25Å; R472-L476 WeakPolarHBondContact O-CG 3.17Å; R472-L476 PolarHBondContact O-N 3.01Å; Y473-L476 PolarHBondContact O-N 2.81Å; T474-L476 VanDerWaalsContact C-N 3.33Å; T474-L476 PolarHBondContact O-N 3.12Å; L476-L478 VanDerWaalsContact C-N 3.28Å; L476-L478 PolarHBondContact O-N 3.36Å; L476-L479 HydrophobicContact CD2-CD1 4.33Å; L476-L479 VanDerWaalsContact O-CB 3.28Å; L476-L479 WeakPolarHBondContact O-CB 3.45Å; L476-L479 WeakPolarHBondContact O-CG 3.21Å; L476-L479 PolarHBondContact O-N 3.16Å; L476-L479 VanDerWaalsContact O-N 3.17Å |
| 477 | L | 94.4 | Very high | 92.4 | Very high | 49 Ų | 49 | 58.9 Ų | 58.9 | 26% | 0.257 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.4 | -33.1 | 179 | -70.8 | -173.4 | 0 | 0 | 0 | 112.9 | I437 Y473 T474 L479 L480 P481 | I437-L477 HydrophobicContact CD1-CD2 3.92Å; Y473-L477 HydrophobicContact CD1-CD1 4.04Å; Y473-L477 HydrophobicContact CE1-CD1 3.41Å; Y473-L477 VanDerWaalsContact CE1-CD1 3.41Å; Y473-L477 HydrophobicContact CE1-CG 4.29Å; Y473-L477 HydrophobicContact CE2-CD1 4.2Å; Y473-L477 HydrophobicContact CE2-CG 4.39Å; Y473-L477 WeakPolarHBondContact O-CG 3.45Å; Y473-L477 PolarHBondContact O-N 2.84Å; T474-L477 PolarHBondContact O-N 3.47Å; L477-L479 PolarHBondContact O-N 3.08Å; L477-L480 HydrophobicContact CD2-CD1 4.08Å; L477-L480 WeakPolarHBondContact O-CB 3.36Å; L477-L480 PolarHBondContact O-N 3.4Å; L477-L480 VanDerWaalsContact O-N 3.13Å; L477-P481 VanDerWaalsContact O-CD 3.25Å; L477-P481 WeakPolarHBondContact O-CD 3.41Å |
| 478 | L | 94.3 | Very high | 92.6 | Very high | 111 Ų | 111 | 59 Ų | 59 | 58% | 0.581 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.4 | -9.8 | 177.6 | -71.9 | 174.1 | 0 | 0 | 0 | 114 | T474 S475 L476 | T474-L478 HydrophobicContact CG2-CD1 4.21Å; T474-L478 WeakPolarHBondContact O-CG 3.32Å; T474-L478 PolarHBondContact O-N 2.9Å; S475-L478 PolarHBondContact O-N 2.68Å; L476-L478 VanDerWaalsContact C-N 3.28Å; L476-L478 PolarHBondContact O-N 3.36Å |
| 479 | L | 94.3 | Very high | 92.3 | Very high | 7 Ų | 7 | 61.5 Ų | 61.5 | 4% | 0.037 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.4 | -35.6 | 171.1 | -61.1 | 170.3 | 0 | 0 | 0 | 111.7 | F417 R420 I421 A424 P426 L434 L476 L477 T482 | F417-L479 HydrophobicContact CE2-CB 4.2Å; F417-L479 HydrophobicContact CE2-CD2 4.3Å; R420-L479 HydrophobicContact CB-CD2 4.19Å; I421-L479 HydrophobicContact CD1-CD1 3.71Å; I421-L479 HydrophobicContact CD1-CD2 4.04Å; I421-L479 HydrophobicContact CD1-CG 4.35Å; A424-L479 HydrophobicContact CB-CD1 4.42Å; P426-L479 HydrophobicContact CG-CD1 4.32Å; L434-L479 HydrophobicContact CD1-CD1 4.03Å; L476-L479 HydrophobicContact CD2-CD1 4.33Å; L476-L479 VanDerWaalsContact O-CB 3.28Å; L476-L479 WeakPolarHBondContact O-CB 3.45Å; L476-L479 WeakPolarHBondContact O-CG 3.21Å; L476-L479 PolarHBondContact O-N 3.16Å; L476-L479 VanDerWaalsContact O-N 3.17Å; L477-L479 PolarHBondContact O-N 3.08Å; L479-T482 WeakPolarHBondContact O-CB 3.26Å; L479-T482 PolarHBondContact O-N 3.13Å; L479-T482 PolarHBondContact O-OG1 3.18Å |
| 480 | L | 94.2 | Very high | 92 | Very high | 23 Ų | 23 | 57 Ų | 57 | 12% | 0.12 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.3 | -40.9 | -171.9 | -61.7 | 174.3 | 0 | 0 | 0 | 115 | L368 L434 I437 A438 L477 T482 L483 | L368-L480 HydrophobicContact CD1-CD2 4.42Å; L434-L480 HydrophobicContact CB-CD2 4.29Å; L434-L480 HydrophobicContact CD2-CD1 4.18Å; L434-L480 HydrophobicContact CD2-CD2 3.96Å; L434-L480 HydrophobicContact CD2-CG 3.97Å; I437-L480 HydrophobicContact CB-CD1 4.07Å; I437-L480 HydrophobicContact CG2-CD1 3.48Å; I437-L480 VanDerWaalsContact CG2-CD1 3.48Å; A438-L480 HydrophobicContact CB-CD2 4.19Å; L477-L480 HydrophobicContact CD2-CD1 4.08Å; L477-L480 WeakPolarHBondContact O-CB 3.36Å; L477-L480 PolarHBondContact O-N 3.4Å; L477-L480 VanDerWaalsContact O-N 3.13Å; L480-T482 PolarHBondContact O-N 3.09Å; L480-T482 VanDerWaalsContact O-N 3.11Å; L480-L483 HydrophobicContact CD2-CD1 3.91Å; L480-L483 WeakPolarHBondContact O-CB 3.49Å; L480-L483 PolarHBondContact O-N 3.12Å; L480-L483 VanDerWaalsContact O-N 3.07Å |
| 481 | P | 92.6 | Very high | 92 | Very high | 81 Ų | 81 | 51.3 Ų | 51.3 | 53% | 0.526 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -56.2 | -30.2 | 178.7 | -28.3 | 35.5 | 0 | 0 | 0 | 113.9 | L477 L483 R484 | L477-P481 VanDerWaalsContact O-CD 3.25Å; L477-P481 WeakPolarHBondContact O-CD 3.41Å; P481-L483 VanDerWaalsContact C-N 3.28Å; P481-L483 PolarHBondContact O-N 3.41Å; P481-R484 WeakPolarHBondContact O-CB 3.4Å; P481-R484 PolarHBondContact O-N 3.02Å |
| 482 | T | 91.6 | Very high | 91.8 | Very high | 18 Ų | 18 | 45.8 Ų | 45.8 | 11% | 0.11 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64.5 | -36 | -179.6 | -51.2 | 0 | 0 | 0 | 0 | 111.4 | F417 R420 L479 L480 R484 S485 F486 | F417-T482 HydrophobicContact CB-CG2 4.28Å; F417-T482 HydrophobicContact CD2-CG2 4.07Å; F417-T482 HydrophobicContact CG-CG2 4.22Å; R420-T482 VanDerWaalsContact CZ-OG1 3.26Å; R420-T482 PolarHBondContact NH1-OG1 3.29Å; R420-T482 PolarHBondContact NH2-OG1 2.85Å; L479-T482 WeakPolarHBondContact O-CB 3.26Å; L479-T482 PolarHBondContact O-N 3.13Å; L479-T482 PolarHBondContact O-OG1 3.18Å; L480-T482 PolarHBondContact O-N 3.09Å; L480-T482 VanDerWaalsContact O-N 3.11Å; T482-R484 PolarHBondContact O-N 3Å; T482-S485 WeakPolarHBondContact O-CB 3.37Å; T482-S485 PolarHBondContact O-N 3.36Å; T482-S485 PolarHBondContact O-OG 3.36Å; T482-F486 HydrophobicContact CG2-CE2 4.08Å |
| 483 | L | 92.7 | Very high | 91.2 | Very high | 5 Ų | 5 | 44.8 Ų | 44.8 | 3% | 0.026 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.1 | -23.8 | -179.6 | -59.9 | 173.4 | 0 | 0 | 0 | 112.3 | E364 L367 L368 F417 A438 L480 P481 S485 | E364-L483 HydrophobicContact CB-CB 4.28Å; E364-L483 HydrophobicContact CB-CD1 4.27Å; E364-L483 HydrophobicContact CG-CB 4.02Å; L367-L483 HydrophobicContact CB-CD2 3.91Å; L367-L483 HydrophobicContact CD1-CD2 4.37Å; L368-L483 HydrophobicContact CD1-CD1 3.79Å; L368-L483 HydrophobicContact CD2-CD1 4.02Å; L368-L483 HydrophobicContact CG-CD1 3.73Å; L368-L483 HydrophobicContact CG-CD2 4.32Å; F417-L483 HydrophobicContact CD1-CD2 4.47Å; F417-L483 HydrophobicContact CE1-CD2 3.53Å; F417-L483 HydrophobicContact CZ-CD2 3.67Å; F417-L483 HydrophobicContact CZ-CG 4.33Å; A438-L483 HydrophobicContact CB-CD1 4.49Å; L480-L483 HydrophobicContact CD2-CD1 3.91Å; L480-L483 WeakPolarHBondContact O-CB 3.49Å; L480-L483 PolarHBondContact O-N 3.12Å; L480-L483 VanDerWaalsContact O-N 3.07Å; P481-L483 VanDerWaalsContact C-N 3.28Å; P481-L483 PolarHBondContact O-N 3.41Å; L483-S485 VanDerWaalsContact C-N 3.35Å |
| 484 | R | 89.4 | Confident | 90.8 | Very high | 107 Ų | 107 | 43 Ų | 43 | 40% | 0.404 | 23% | 0.231 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.3 | -15.8 | -179.8 | -53.1 | -55.4 | -177.7 | 76.2 | -11 | 114.3 | E364 D443 P481 T482 | E364-R484 VanDerWaalsContact CD-NE 3.29Å; E364-R484 IonicContact OE1-CZ 2.78Å; E364-R484 IonicContact OE1-NE 3.41Å; E364-R484 PolarHBondContact OE1-NE 3.03Å; E364-R484 IonicContact OE2-CZ 3.49Å; E364-R484 IonicContact OE2-NE 3.23Å; E364-R484 PolarHBondContact OE2-NE 2.94Å; E364-R484 IonicContact OE2-NH2 3.11Å; D443-R484 IonicContact OD1-CZ 3.01Å; D443-R484 IonicContact OD1-NH1 3.98Å; D443-R484 PolarHBondContact OD1-NH1 2.65Å; D443-R484 IonicContact OD1-NH2 3.57Å; D443-R484 PolarHBondContact OD1-NH2 3.19Å; D443-R484 IonicContact OD2-CZ 3.34Å; D443-R484 VanDerWaalsContact OD2-CZ 3.23Å; D443-R484 IonicContact OD2-NH1 3.71Å; D443-R484 PolarHBondContact OD2-NH1 3.45Å; D443-R484 IonicContact OD2-NH2 3.68Å; D443-R484 PolarHBondContact OD2-NH2 3.19Å; P481-R484 WeakPolarHBondContact O-CB 3.4Å; P481-R484 PolarHBondContact O-N 3.02Å; T482-R484 PolarHBondContact O-N 3Å |
| 485 | S | 90.5 | Very high | 90.5 | Very high | 72 Ų | 72 | 39.6 Ų | 39.6 | 50% | 0.503 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | -20.8 | 179.5 | 68.2 | 0 | 0 | 0 | 0 | 113.2 | T482 L483 | T482-S485 WeakPolarHBondContact O-CB 3.37Å; T482-S485 PolarHBondContact O-N 3.36Å; T482-S485 PolarHBondContact O-OG 3.36Å; L483-S485 VanDerWaalsContact C-N 3.35Å |
| 486 | F | 91.8 | Very high | 90 | Very high | 15 Ų | 15 | 36.7 Ų | 36.7 | 7% | 0.066 | 19% | 0.19 | C | C | . | . | trans | -77.6 | 127.3 | -173.9 | -68.1 | -76.3 | 0 | 0 | 0 | 113.1 | L367 C413 L414 T482 K488 V491 | L367-F486 HydrophobicContact CD1-CB 3.92Å; L367-F486 HydrophobicContact CD1-CD1 4.44Å; L367-F486 HydrophobicContact CD1-CD2 3.42Å; L367-F486 VanDerWaalsContact CD1-CD2 3.42Å; L367-F486 HydrophobicContact CD1-CE2 4Å; L367-F486 HydrophobicContact CD1-CG 3.66Å; C413-F486 HydrophobicContact CB-CE1 3.8Å; C413-F486 HydrophobicContact CB-CZ 4.05Å; C413-F486 WeakPolarHBondContact SG-CZ 3.36Å; L414-F486 HydrophobicContact CB-CE1 4.44Å; L414-F486 HydrophobicContact CD2-CD1 4.28Å; L414-F486 HydrophobicContact CD2-CE1 3.59Å; L414-F486 HydrophobicContact CD2-CZ 3.75Å; L414-F486 HydrophobicContact CG-CD1 4.4Å; L414-F486 HydrophobicContact CG-CE1 3.6Å; L414-F486 HydrophobicContact CG-CZ 4.12Å; T482-F486 HydrophobicContact CG2-CE2 4.08Å; F486-K488 PolarHBondContact O-N 3.1Å; F486-V491 HydrophobicContact CB-CG2 4.21Å | ||
| 487 | N | 89.7 | Confident | 88.8 | Confident | 61 Ų | 61 | 37.2 Ų | 37.2 | 33% | 0.326 | 19% | 0.194 | S | C | . | . | trans | -74.6 | 116.5 | 167.9 | -174.2 | -18.5 | 0 | 0 | 0 | 110.3 | H410 Q489 I490 V491 | H410-N487 WeakPolarHBondContact NE2-CB 3.49Å; H410-N487 PolarHBondContact NE2-N 3.05Å; N487-Q489 PolarHBondContact O-N 2.99Å; N487-Q489 VanDerWaalsContact O-N 3.16Å; N487-Q489 WeakPolarHBondContact OD1-CB 3.27Å; N487-Q489 PolarHBondContact OD1-N 2.79Å; N487-I490 HydrophobicContact CB-CB 4.37Å; N487-I490 HydrophobicContact CB-CD1 4.01Å; N487-I490 HydrophobicContact CB-CG1 4.2Å; N487-I490 PolarHBondContact O-N 2.87Å; N487-V491 PolarHBondContact O-N 2.94Å; N487-V491 VanDerWaalsContact O-N 3.15Å | ||
| 488 | K | 90.1 | Very high | 86.9 | Confident | 72 Ų | 72 | 36.1 Ų | 36.1 | 31% | 0.313 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -51.4 | -39.9 | 179.1 | -59.9 | -176.5 | 177.8 | -177.2 | 0 | 112.9 | Q360 W362 C363 F486 I490 V491 V492 | Q360-K488 WeakPolarHBondContact O-CE 3.19Å; Q360-K488 PolarHBondContact O-NZ 3.35Å; W362-K488 HydrophobicContact CZ2-CB 4.2Å; C363-K488 HydrophobicContact CB-CD 4.45Å; C363-K488 HydrophobicContact CB-CG 3.88Å; F486-K488 PolarHBondContact O-N 3.1Å; K488-I490 VanDerWaalsContact C-N 3.33Å; K488-I490 PolarHBondContact O-N 3.45Å; K488-V491 PolarHBondContact O-N 3.48Å; K488-V492 WeakPolarHBondContact O-CG2 3.32Å; K488-V492 PolarHBondContact O-N 3.34Å |
| 489 | Q | 85.3 | Confident | 84.9 | Confident | 83 Ų | 83 | 35.2 Ų | 35.2 | 39% | 0.388 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -65.7 | -38.6 | -177.1 | -177.1 | 57.6 | 36.8 | 0 | 0 | 111.4 | N487 V492 E493 | N487-Q489 PolarHBondContact O-N 2.99Å; N487-Q489 VanDerWaalsContact O-N 3.16Å; N487-Q489 WeakPolarHBondContact OD1-CB 3.27Å; N487-Q489 PolarHBondContact OD1-N 2.79Å; Q489-V492 WeakPolarHBondContact O-CB 3.23Å; Q489-V492 PolarHBondContact O-N 2.85Å; Q489-E493 WeakPolarHBondContact CG-OE1 3.38Å; Q489-E493 PolarHBondContact NE2-OE1 2.88Å; Q489-E493 WeakPolarHBondContact O-CG 3.44Å; Q489-E493 PolarHBondContact O-N 3.26Å |
| 490 | I | 87 | Confident | 82.9 | Confident | 5 Ų | 5 | 36.1 Ų | 36.1 | 3% | 0.026 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -71.7 | -39.2 | 178.9 | -64.2 | 174.4 | 0 | 0 | 0 | 110.5 | E406 V407 H410 N487 K488 V492 E493 L494 | E406-I490 HydrophobicContact CB-CD1 4.4Å; E406-I490 HydrophobicContact CG-CD1 3.54Å; V407-I490 HydrophobicContact CG2-CG2 4.48Å; H410-I490 HydrophobicContact CB-CG2 3.7Å; H410-I490 VanDerWaalsContact CE1-CD1 3.46Å; H410-I490 WeakPolarHBondContact CE1-CD1 3.43Å; H410-I490 WeakPolarHBondContact ND1-CD1 3.4Å; N487-I490 HydrophobicContact CB-CB 4.37Å; N487-I490 HydrophobicContact CB-CD1 4.01Å; N487-I490 HydrophobicContact CB-CG1 4.2Å; N487-I490 PolarHBondContact O-N 2.87Å; K488-I490 VanDerWaalsContact C-N 3.33Å; K488-I490 PolarHBondContact O-N 3.45Å; I490-V492 VanDerWaalsContact C-N 3.29Å; I490-V492 PolarHBondContact O-N 2.77Å; I490-E493 PolarHBondContact O-N 2.94Å; I490-E493 VanDerWaalsContact O-N 3.12Å; I490-L494 HydrophobicContact CG2-CD1 4.01Å; I490-L494 HydrophobicContact CG2-CG 4.23Å; I490-L494 WeakPolarHBondContact O-CB 3.37Å; I490-L494 VanDerWaalsContact O-CG 3.31Å; I490-L494 WeakPolarHBondContact O-CG 3.27Å; I490-L494 PolarHBondContact O-N 3.46Å |
| 491 | V | 90 | Very high | 80.9 | Confident | 1 Ų | 1 | 37.1 Ų | 37.1 | 1% | 0.006 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.1 | -41.2 | 173.1 | 177.9 | 0 | 0 | 0 | 0 | 111 | F366 L367 F486 N487 K488 L494 F495 | F366-V491 HydrophobicContact CD1-CG1 3.98Å; F366-V491 HydrophobicContact CE1-CG1 3.86Å; L367-V491 HydrophobicContact CD2-CG1 4.37Å; F486-V491 HydrophobicContact CB-CG2 4.21Å; N487-V491 PolarHBondContact O-N 2.94Å; N487-V491 VanDerWaalsContact O-N 3.15Å; K488-V491 PolarHBondContact O-N 3.48Å; V491-L494 PolarHBondContact O-N 3.12Å; V491-F495 HydrophobicContact CG1-CD2 4.01Å; V491-F495 WeakPolarHBondContact O-CD2 3.39Å; V491-F495 PolarHBondContact O-N 3.5Å; V491-F495 VanDerWaalsContact O-N 3.08Å |
| 492 | V | 87.7 | Confident | 79.3 | Confident | 13 Ų | 13 | 39 Ų | 39 | 8% | 0.079 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.9 | -44.4 | 172.8 | 174 | 0 | 0 | 0 | 0 | 111.4 | W362 K488 Q489 I490 L494 F496 S497 I505 | W362-V492 HydrophobicContact CH2-CG2 3.56Å; W362-V492 HydrophobicContact CZ2-CG2 3.73Å; K488-V492 WeakPolarHBondContact O-CG2 3.32Å; K488-V492 PolarHBondContact O-N 3.34Å; Q489-V492 WeakPolarHBondContact O-CB 3.23Å; Q489-V492 PolarHBondContact O-N 2.85Å; I490-V492 VanDerWaalsContact C-N 3.29Å; I490-V492 PolarHBondContact O-N 2.77Å; V492-L494 PolarHBondContact O-N 3.21Å; V492-F496 HydrophobicContact CG1-CB 4.2Å; V492-F496 CarbonylContact O-C 3.56Å; V492-F496 WeakPolarHBondContact O-CA 3.1Å; V492-F496 WeakPolarHBondContact O-CB 3.27Å; V492-F496 PolarHBondContact O-N 2.99Å; V492-S497 PolarHBondContact O-N 3.1Å; V492-I505 HydrophobicContact CG2-CD1 4.48Å; V492-I505 HydrophobicContact CG2-CG1 3.6Å |
| 493 | E | 82 | Confident | 77.9 | Confident | 40 Ų | 40 | 42 Ų | 42 | 19% | 0.187 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.1 | -38.2 | -180 | -74.6 | 171 | -161.8 | 0 | 0 | 112.9 | Q489 I490 S497 | Q489-E493 WeakPolarHBondContact CG-OE1 3.38Å; Q489-E493 PolarHBondContact NE2-OE1 2.88Å; Q489-E493 WeakPolarHBondContact O-CG 3.44Å; Q489-E493 PolarHBondContact O-N 3.26Å; I490-E493 PolarHBondContact O-N 2.94Å; I490-E493 VanDerWaalsContact O-N 3.12Å; E493-S497 WeakPolarHBondContact O-CB 3.48Å; E493-S497 PolarHBondContact O-OG 3.37Å |
| 494 | L | 86.1 | Confident | 77.3 | Confident | 2 Ų | 2 | 45.8 Ų | 45.8 | 1% | 0.01 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -69 | -43.7 | 178.6 | -72.4 | 173.7 | 0 | 0 | 0 | 112.6 | M386 V407 I411 L414 I490 V491 V492 | M386-L494 HydrophobicContact SD-CD2 4.45Å; V407-L494 HydrophobicContact CG1-CD2 3.95Å; I411-L494 HydrophobicContact CD1-CD2 4.04Å; I411-L494 HydrophobicContact CG1-CD1 4.19Å; I411-L494 HydrophobicContact CG1-CD2 3.93Å; L414-L494 HydrophobicContact CD1-CD1 3.93Å; I490-L494 HydrophobicContact CG2-CD1 4.01Å; I490-L494 HydrophobicContact CG2-CG 4.23Å; I490-L494 WeakPolarHBondContact O-CB 3.37Å; I490-L494 VanDerWaalsContact O-CG 3.31Å; I490-L494 WeakPolarHBondContact O-CG 3.27Å; I490-L494 PolarHBondContact O-N 3.46Å; V491-L494 PolarHBondContact O-N 3.12Å; V492-L494 PolarHBondContact O-N 3.21Å |
| 495 | F | 87.7 | Confident | 77.1 | Confident | 3 Ų | 3 | 40.7 Ų | 40.7 | 1% | 0.013 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -107.6 | -22.4 | -168.8 | -68.2 | -73.3 | 0 | 0 | 0 | 114.7 | I325 C326 A329 F366 L370 L379 L383 M386 L414 V491 | I325-F495 HydrophobicContact CG2-CD1 4.01Å; C326-F495 VanDerWaalsContact CA-O 3.24Å; C326-F495 WeakPolarHBondContact CA-O 3.27Å; C326-F495 PolarHBondContact SG-O 3.26Å; A329-F495 HydrophobicContact CB-CB 3.78Å; A329-F495 WeakPolarHBondContact CB-O 3.37Å; F366-F495 HydrophobicContact CE1-CD2 4.04Å; F366-F495 HydrophobicContact CE1-CG 4.3Å; F366-F495 HydrophobicContact CZ-CB 4.19Å; F366-F495 HydrophobicContact CZ-CD2 4.4Å; F366-F495 HydrophobicContact CZ-CG 4.19Å; L370-F495 HydrophobicContact CD1-CE1 4.13Å; L370-F495 HydrophobicContact CD1-CZ 4.43Å; L370-F495 HydrophobicContact CD2-CE1 4.01Å; L370-F495 HydrophobicContact CD2-CE2 3.83Å; L370-F495 HydrophobicContact CD2-CZ 3.47Å; L370-F495 VanDerWaalsContact CD2-CZ 3.47Å; L379-F495 HydrophobicContact CD1-CE1 4.1Å; L379-F495 HydrophobicContact CD1-CZ 4.19Å; L383-F495 HydrophobicContact CD2-CZ 4.3Å; M386-F495 HydrophobicContact CE-CE1 4.48Å; L414-F495 HydrophobicContact CD1-CE2 3.89Å; L414-F495 HydrophobicContact CD1-CZ 4.14Å; V491-F495 HydrophobicContact CG1-CD2 4.01Å; V491-F495 WeakPolarHBondContact O-CD2 3.39Å; V491-F495 PolarHBondContact O-N 3.5Å; V491-F495 VanDerWaalsContact O-N 3.08Å |
| 496 | F | 83.8 | Confident | 76.9 | Confident | 1 Ų | 1 | 39.3 Ų | 39.3 | 0% | 0.004 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -123.4 | -5.9 | -169.2 | -60.9 | -91.9 | 0 | 0 | 0 | 115 | A329 L333 W362 F366 V492 G498 L499 I500 I505 | A329-F496 HydrophobicContact CB-CD1 4.3Å; A329-F496 HydrophobicContact CB-CE1 3.94Å; A329-F496 HydrophobicContact CB-CE2 4.31Å; A329-F496 HydrophobicContact CB-CZ 3.95Å; A329-F496 WeakPolarHBondContact O-CE1 3.47Å; L333-F496 HydrophobicContact CB-CE1 4.07Å; L333-F496 HydrophobicContact CB-CZ 4.03Å; L333-F496 HydrophobicContact CD2-CE1 3.87Å; L333-F496 HydrophobicContact CD2-CZ 4.07Å; W362-F496 HydrophobicContact CZ3-CE2 4.37Å; F366-F496 HydrophobicContact CD2-CZ 4.06Å; F366-F496 AromaticContact CE1-CE2 3.99Å; F366-F496 HydrophobicContact CE1-CE2 3.99Å; F366-F496 HydrophobicContact CE1-CZ 4.38Å; F366-F496 AromaticContact CE2-CE2 3.98Å; F366-F496 HydrophobicContact CE2-CE2 3.98Å; F366-F496 AromaticContact CE2-CZ 3.54Å; F366-F496 HydrophobicContact CE2-CZ 3.54Å; F366-F496 AromaticContact CZ-CE2 3.67Å; F366-F496 HydrophobicContact CZ-CE2 3.67Å; F366-F496 AromaticContact CZ-CZ 3.72Å; F366-F496 HydrophobicContact CZ-CZ 3.72Å; V492-F496 HydrophobicContact CG1-CB 4.2Å; V492-F496 CarbonylContact O-C 3.56Å; V492-F496 WeakPolarHBondContact O-CA 3.1Å; V492-F496 WeakPolarHBondContact O-CB 3.27Å; V492-F496 PolarHBondContact O-N 2.99Å; F496-G498 PolarHBondContact O-N 2.78Å; F496-L499 PolarHBondContact O-N 3.44Å; F496-I500 HydrophobicContact CB-CB 4.28Å; F496-I500 HydrophobicContact CB-CD1 3.94Å; F496-I500 HydrophobicContact CB-CG1 4.22Å; F496-I500 HydrophobicContact CD1-CD1 3.54Å; F496-I500 HydrophobicContact CD1-CG1 4.45Å; F496-I500 HydrophobicContact CE1-CD1 4.4Å; F496-I500 HydrophobicContact CG-CD1 4.07Å; F496-I500 PolarHBondContact O-N 3.21Å; F496-I505 HydrophobicContact CD1-CD1 4.22Å; F496-I505 HydrophobicContact CE1-CD1 4.43Å; F496-I505 HydrophobicContact CG-CD1 4.31Å |
| 497 | S | 70.3 | Confident | 76.6 | Confident | 13 Ų | 13 | 42.4 Ų | 42.4 | 9% | 0.091 | 23% | 0.232 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -17.2 | -175.8 | 54.9 | 0 | 0 | 0 | 0 | 115.1 | H56 V492 E493 | H56-S497 PolarHBondContact CD2-O 3.37Å; V492-S497 PolarHBondContact O-N 3.1Å; E493-S497 WeakPolarHBondContact O-CB 3.48Å; E493-S497 PolarHBondContact O-OG 3.37Å |
| 498 | G | 54.6 | Low | 76.4 | Confident | 25 Ų | 25 | 41.1 Ų | 41.1 | 26% | 0.258 | 23% | 0.226 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.2 | -20.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | C326 F496 | C326-G498 VanDerWaalsContact SG-CA 3.52Å; C326-G498 PolarHBondContact SG-N 2.85Å; F496-G498 PolarHBondContact O-N 2.78Å |
| 499 | L | 51.1 | Low | 76.2 | Confident | 93 Ų | 93 | 37.7 Ų | 37.7 | 49% | 0.487 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -121.3 | -27.4 | -172.8 | -73.3 | 175.6 | 0 | 0 | 0 | 113.4 | C326 F496 | C326-L499 HydrophobicContact CB-CB 4.16Å; C326-L499 HydrophobicContact CB-CD1 3.49Å; C326-L499 VanDerWaalsContact CB-CD1 3.49Å; C326-L499 HydrophobicContact CB-CG 3.52Å; C326-L499 VanDerWaalsContact O-CD1 3.32Å; C326-L499 WeakPolarHBondContact O-CD1 3.48Å; F496-L499 PolarHBondContact O-N 3.44Å |
| 500 | I | 52.3 | Low | 76.1 | Confident | 25 Ų | 25 | 34.5 Ų | 34.5 | 13% | 0.128 | 20% | 0.198 | C | C | . | . | trans | -118 | 112.6 | -170.5 | -55.8 | -172.8 | 0 | 0 | 0 | 105.4 | F496 L503 I505 | F496-I500 HydrophobicContact CB-CB 4.28Å; F496-I500 HydrophobicContact CB-CD1 3.94Å; F496-I500 HydrophobicContact CB-CG1 4.22Å; F496-I500 HydrophobicContact CD1-CD1 3.54Å; F496-I500 HydrophobicContact CD1-CG1 4.45Å; F496-I500 HydrophobicContact CE1-CD1 4.4Å; F496-I500 HydrophobicContact CG-CD1 4.07Å; F496-I500 PolarHBondContact O-N 3.21Å; I500-L503 HydrophobicContact CG2-CB 3.61Å; I500-L503 HydrophobicContact CG2-CD2 4.12Å; I500-L503 HydrophobicContact CG2-CG 4.06Å; I500-L503 WeakPolarHBondContact CG2-O 3.16Å; I500-I505 HydrophobicContact CD1-CD1 3.44Å; I500-I505 VanDerWaalsContact CD1-CD1 3.44Å | ||
| 501 | G | 52.6 | Low | 76 | Confident | 45 Ų | 45 | 41 Ų | 41 | 46% | 0.464 | 23% | 0.226 | S | C | . | . | S | Bend | trans | -64.6 | -141.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L503 | G501-L503 PolarHBondContact O-N 3.03Š|
| 502 | N | 58 | Low | 75.7 | Confident | 120 Ų | 120 | 41.5 Ų | 41.5 | 64% | 0.642 | 23% | 0.229 | S | C | * | . | S | Bend | trans | -67.7 | 26.1 | 172.6 | -64.6 | -25.4 | 0 | 0 | 0 | 113.8 | ||
| 503 | L | 63.7 | Low | 75.4 | Confident | 82 Ų | 82 | 42 Ų | 42 | 43% | 0.429 | 23% | 0.231 | S | C | . | . | trans | -88.5 | 121.1 | -177.7 | 177.1 | 66.4 | 0 | 0 | 0 | 109.6 | I500 G501 N507 V508 | I500-L503 HydrophobicContact CG2-CB 3.61Å; I500-L503 HydrophobicContact CG2-CD2 4.12Å; I500-L503 HydrophobicContact CG2-CG 4.06Å; I500-L503 WeakPolarHBondContact CG2-O 3.16Å; G501-L503 PolarHBondContact O-N 3.03Å; L503-N507 HydrophobicContact CD1-CB 4.04Å; L503-V508 HydrophobicContact CD1-CG2 4.32Å; L503-V508 HydrophobicContact CD2-CG2 3.49Å; L503-V508 VanDerWaalsContact CD2-CG2 3.49Å; L503-V508 HydrophobicContact CG-CG2 3.77Å | ||
| 504 | Q | 80.5 | Confident | 75.2 | Confident | 83 Ų | 83 | 48.1 Ų | 48.1 | 39% | 0.388 | 26% | 0.257 | S | S | . | . | trans | -72.3 | 131.4 | 173.4 | -70.1 | 178.3 | -30.4 | 0 | 0 | 109.9 | E506 N507 | Q504-E506 WeakPolarHBondContact CB-OE2 3.13Å; Q504-E506 PolarHBondContact O-N 3.14Å; Q504-E506 VanDerWaalsContact O-N 3.16Å; Q504-N507 WeakPolarHBondContact O-CB 3.35Å; Q504-N507 PolarHBondContact O-N 2.92Å | ||
| 505 | I | 84.9 | Confident | 74.8 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -55.6 | -33.8 | 179 | -61.9 | -60.4 | 0 | 0 | 0 | 111.1 | L333 W362 V492 F496 I500 N507 V508 I509 | L333-I505 HydrophobicContact CD1-CG2 4.25Å; L333-I505 HydrophobicContact CD2-CD1 4.04Å; L333-I505 HydrophobicContact CD2-CG2 3.68Å; W362-I505 HydrophobicContact CD2-CB 4.08Å; W362-I505 HydrophobicContact CD2-CG2 3.59Å; W362-I505 HydrophobicContact CE3-CB 4.4Å; W362-I505 HydrophobicContact CE3-CG2 3.77Å; W362-I505 HydrophobicContact CG-CG2 4.05Å; W362-I505 HydrophobicContact CH2-CB 4.16Å; W362-I505 HydrophobicContact CH2-CG1 3.75Å; W362-I505 HydrophobicContact CH2-CG2 4.37Å; W362-I505 HydrophobicContact CZ2-CB 3.78Å; W362-I505 HydrophobicContact CZ2-CG1 3.79Å; W362-I505 HydrophobicContact CZ2-CG2 4.2Å; W362-I505 HydrophobicContact CZ3-CB 4.45Å; W362-I505 HydrophobicContact CZ3-CG1 4.17Å; W362-I505 HydrophobicContact CZ3-CG2 4.16Å; V492-I505 HydrophobicContact CG2-CD1 4.48Å; V492-I505 HydrophobicContact CG2-CG1 3.6Å; F496-I505 HydrophobicContact CD1-CD1 4.22Å; F496-I505 HydrophobicContact CE1-CD1 4.43Å; F496-I505 HydrophobicContact CG-CD1 4.31Å; I500-I505 HydrophobicContact CD1-CD1 3.44Å; I500-I505 VanDerWaalsContact CD1-CD1 3.44Å; I505-N507 PolarHBondContact O-N 3.16Å; I505-N507 VanDerWaalsContact O-N 3.11Å; I505-V508 WeakPolarHBondContact O-CA 3.37Å; I505-V508 WeakPolarHBondContact O-CB 3.31Å; I505-V508 PolarHBondContact O-N 3.24Å; I505-I509 HydrophobicContact CG2-CD1 4.12Å; I505-I509 HydrophobicContact CG2-CG1 4.38Å; I505-I509 WeakPolarHBondContact O-CG1 3.49Å; I505-I509 PolarHBondContact O-N 3.48Å |
| 506 | E | 86.4 | Confident | 73.8 | Confident | 43 Ų | 43 | 55.5 Ų | 55.5 | 20% | 0.201 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -54.5 | -31.7 | 175.9 | -65.1 | 81.6 | -179 | 0 | 0 | 112.9 | K359 W362 Q504 V508 P510 | K359-E506 HydrophobicContact CB-CG 4.47Å; K359-E506 WeakPolarHBondContact CE-O 3.4Å; K359-E506 HydrophobicContact CG-CB 4.25Å; K359-E506 WeakPolarHBondContact CG-O 3.42Å; K359-E506 WeakPolarHBondContact O-CG 3.33Å; W362-E506 PolarHBondContact NE1-OE1 3.36Å; Q504-E506 WeakPolarHBondContact CB-OE2 3.13Å; Q504-E506 PolarHBondContact O-N 3.14Å; Q504-E506 VanDerWaalsContact O-N 3.16Å; E506-V508 VanDerWaalsContact C-N 3.34Å; E506-P510 WeakPolarHBondContact O-CD 3.46Å |
| 507 | N | 85 | Confident | 72.8 | Confident | 81 Ų | 81 | 57.2 Ų | 57.2 | 43% | 0.433 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -80.6 | -17.9 | 177 | -63.1 | -33.3 | 0 | 0 | 0 | 112.6 | L503 Q504 I505 F511 | L503-N507 HydrophobicContact CD1-CB 4.04Å; Q504-N507 WeakPolarHBondContact O-CB 3.35Å; Q504-N507 PolarHBondContact O-N 2.92Å; I505-N507 PolarHBondContact O-N 3.16Å; I505-N507 VanDerWaalsContact O-N 3.11Å; N507-F511 WeakPolarHBondContact O-CD2 3.38Å; N507-F511 WeakPolarHBondContact O-CE2 3.42Å |
| 508 | V | 85.3 | Confident | 71.9 | Confident | 33 Ų | 33 | 62.2 Ų | 62.2 | 20% | 0.2 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -89.4 | -32 | -180 | -170.5 | 0 | 0 | 0 | 0 | 111.6 | L503 I505 E506 P510 F511 I512 | L503-V508 HydrophobicContact CD1-CG2 4.32Å; L503-V508 HydrophobicContact CD2-CG2 3.49Å; L503-V508 VanDerWaalsContact CD2-CG2 3.49Å; L503-V508 HydrophobicContact CG-CG2 3.77Å; I505-V508 WeakPolarHBondContact O-CA 3.37Å; I505-V508 WeakPolarHBondContact O-CB 3.31Å; I505-V508 PolarHBondContact O-N 3.24Å; E506-V508 VanDerWaalsContact C-N 3.34Å; V508-P510 VanDerWaalsContact C-CD 3.4Å; V508-P510 VanDerWaalsContact C-N 3.34Å; V508-F511 WeakPolarHBondContact O-CA 3.27Å; V508-F511 WeakPolarHBondContact O-CB 3.34Å; V508-F511 PolarHBondContact O-N 3.28Å; V508-I512 HydrophobicContact CG1-CD1 3.9Å; V508-I512 HydrophobicContact CG1-CG1 4.03Å; V508-I512 PolarHBondContact O-N 2.93Å |
| 509 | I | 86.3 | Confident | 72 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -46.3 | -47.2 | 178.6 | -64 | -58.3 | 0 | 0 | 0 | 113.7 | V337 L358 K359 W362 I505 F511 I512 L513 | V337-I509 HydrophobicContact CG2-CD1 3.84Å; L358-I509 HydrophobicContact CB-CG2 3.75Å; L358-I509 HydrophobicContact CD1-CG2 4.28Å; K359-I509 HydrophobicContact CG-CB 4.31Å; K359-I509 HydrophobicContact CG-CG2 4.42Å; W362-I509 HydrophobicContact CB-CD1 4.03Å; I505-I509 HydrophobicContact CG2-CD1 4.12Å; I505-I509 HydrophobicContact CG2-CG1 4.38Å; I505-I509 WeakPolarHBondContact O-CG1 3.49Å; I505-I509 PolarHBondContact O-N 3.48Å; I509-F511 PolarHBondContact O-N 2.94Å; I509-I512 HydrophobicContact CD1-CD1 4.41Å; I509-I512 PolarHBondContact O-N 3.44Å; I509-L513 HydrophobicContact CG2-CD1 4Å; I509-L513 HydrophobicContact CG2-CG 4.44Å; I509-L513 WeakPolarHBondContact O-CG 3.32Å; I509-L513 PolarHBondContact O-N 3.21Å |
| 510 | P | 83.7 | Confident | 72.3 | Confident | 17 Ų | 17 | 65.9 Ų | 65.9 | 11% | 0.11 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65.3 | -25.6 | -179.7 | -20.1 | 33.9 | 0 | 0 | 0 | 113.5 | E355 K359 E506 V508 K514 | E355-P510 HydrophobicContact CG-CB 4.3Å; E355-P510 HydrophobicContact CG-CG 3.99Å; E355-P510 WeakPolarHBondContact OE1-CG 3.46Å; K359-P510 VanDerWaalsContact CE-CG 3.49Å; E506-P510 WeakPolarHBondContact O-CD 3.46Å; V508-P510 VanDerWaalsContact C-CD 3.4Å; V508-P510 VanDerWaalsContact C-N 3.34Å; P510-K514 WeakPolarHBondContact O-CD 3.4Å; P510-K514 VanDerWaalsContact O-CG 3.31Å; P510-K514 WeakPolarHBondContact O-CG 3.28Å |
| 511 | F | 83.4 | Confident | 72.6 | Confident | 140 Ų | 140 | 66.4 Ų | 66.4 | 61% | 0.614 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -78.3 | -42.3 | 175.1 | -61.4 | -85.4 | 0 | 0 | 0 | 110.4 | N507 V508 I509 L513 K514 M515 | N507-F511 WeakPolarHBondContact O-CD2 3.38Å; N507-F511 WeakPolarHBondContact O-CE2 3.42Å; V508-F511 WeakPolarHBondContact O-CA 3.27Å; V508-F511 WeakPolarHBondContact O-CB 3.34Å; V508-F511 PolarHBondContact O-N 3.28Å; I509-F511 PolarHBondContact O-N 2.94Å; F511-L513 VanDerWaalsContact C-N 3.32Å; F511-L513 PolarHBondContact O-N 3.35Å; F511-K514 PolarHBondContact O-N 2.99Å; F511-K514 VanDerWaalsContact O-N 3.12Å; F511-M515 WeakPolarHBondContact O-CG 3.15Å; F511-M515 PolarHBondContact O-N 2.84Å; F511-M515 VanDerWaalsContact O-N 3.09Å |
| 512 | I | 84.4 | Confident | 72.1 | Confident | 13 Ų | 13 | 66.2 Ų | 66.2 | 7% | 0.067 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -57.7 | -45.8 | 175.8 | -66.8 | 168.3 | 0 | 0 | 0 | 110.8 | L333 F334 V337 V508 I509 K514 M515 | L333-I512 HydrophobicContact CD2-CD1 4.09Å; L333-I512 HydrophobicContact CG-CD1 4.17Å; F334-I512 HydrophobicContact CD2-CB 4.39Å; F334-I512 HydrophobicContact CD2-CG1 4.34Å; F334-I512 HydrophobicContact CD2-CG2 3.59Å; F334-I512 HydrophobicContact CE2-CG2 4.02Å; F334-I512 HydrophobicContact CG-CG2 4.38Å; V337-I512 HydrophobicContact CB-CG2 3.63Å; V337-I512 HydrophobicContact CG1-CB 4.38Å; V337-I512 HydrophobicContact CG1-CG2 3.54Å; V337-I512 HydrophobicContact CG2-CG2 4.11Å; V508-I512 HydrophobicContact CG1-CD1 3.9Å; V508-I512 HydrophobicContact CG1-CG1 4.03Å; V508-I512 PolarHBondContact O-N 2.93Å; I509-I512 HydrophobicContact CD1-CD1 4.41Å; I509-I512 PolarHBondContact O-N 3.44Å; I512-K514 PolarHBondContact O-N 2.97Å; I512-M515 PolarHBondContact O-N 2.73Å; I512-M515 VanDerWaalsContact O-N 3.13Å |
| 513 | L | 81.3 | Confident | 70.8 | Confident | 22 Ų | 22 | 69.1 Ų | 69.1 | 12% | 0.115 | 35% | 0.349 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | -26 | 179.4 | -74.8 | 170.1 | 0 | 0 | 0 | 114.1 | V337 K341 E354 E355 L358 I509 F511 | V337-L513 HydrophobicContact CG1-CD2 3.6Å; V337-L513 HydrophobicContact CG1-CG 3.99Å; K341-L513 HydrophobicContact CD-CD2 4.49Å; K341-L513 PolarHBondContact NZ-O 3.15Å; E354-L513 WeakPolarHBondContact OE1-CD2 3.16Å; E355-L513 HydrophobicContact CB-CD1 3.88Å; E355-L513 HydrophobicContact CG-CD1 4.07Å; L358-L513 HydrophobicContact CD1-CD1 4Å; L358-L513 HydrophobicContact CD1-CD2 3.72Å; L358-L513 HydrophobicContact CD1-CG 4.17Å; I509-L513 HydrophobicContact CG2-CD1 4Å; I509-L513 HydrophobicContact CG2-CG 4.44Å; I509-L513 WeakPolarHBondContact O-CG 3.32Å; I509-L513 PolarHBondContact O-N 3.21Å; F511-L513 VanDerWaalsContact C-N 3.32Å; F511-L513 PolarHBondContact O-N 3.35Å |
| 514 | K | 78.8 | Confident | 69.4 | Low | 169 Ų | 169 | 69.6 Ų | 69.6 | 74% | 0.735 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | -15.6 | 179.6 | -69.3 | 176.2 | -175.7 | -179.6 | 0 | 113.6 | P510 F511 I512 | P510-K514 WeakPolarHBondContact O-CD 3.4Å; P510-K514 VanDerWaalsContact O-CG 3.31Å; P510-K514 WeakPolarHBondContact O-CG 3.28Å; F511-K514 PolarHBondContact O-N 2.99Å; F511-K514 VanDerWaalsContact O-N 3.12Å; I512-K514 PolarHBondContact O-N 2.97Å |
| 515 | M | 76.7 | Confident | 67 | Low | 71 Ų | 71 | 69.6 Ų | 69.6 | 35% | 0.35 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -81.1 | 146.6 | 179 | -77.4 | -179.4 | 75.9 | 0 | 0 | 110.5 | F334 F511 I512 I520 | F334-M515 HydrophobicContact CE2-CB 3.83Å; F334-M515 HydrophobicContact CZ-CB 4.35Å; F511-M515 WeakPolarHBondContact O-CG 3.15Å; F511-M515 PolarHBondContact O-N 2.84Å; F511-M515 VanDerWaalsContact O-N 3.09Å; I512-M515 PolarHBondContact O-N 2.73Å; I512-M515 VanDerWaalsContact O-N 3.13Å; M515-I520 HydrophobicContact CE-CD1 3.71Å; M515-I520 HydrophobicContact CE-CG1 3.95Å; M515-I520 HydrophobicContact SD-CD1 4.49Å |
| 516 | D | 66 | Low | 64.4 | Low | 89 Ų | 89 | 76 Ų | 76 | 48% | 0.476 | 40% | 0.402 | S | S | . | . | trans | -88.8 | 139 | 176.8 | -161.9 | -9.4 | 0 | 0 | 0 | 109.9 | L518 Q519 | D516-L518 PolarHBondContact O-N 3.48Å; D516-Q519 HydrophobicContact CB-CG 4.24Å; D516-Q519 WeakPolarHBondContact O-CB 3.43Å; D516-Q519 PolarHBondContact O-N 3.14Å | ||
| 517 | V | 63.1 | Low | 62 | Low | 38 Ų | 38 | 77.1 Ų | 77.1 | 23% | 0.23 | 43% | 0.425 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.5 | -37.7 | -174.7 | -177.3 | 0 | 0 | 0 | 0 | 111.9 | F334 H338 Q519 I520 F521 | F334-V517 HydrophobicContact CE1-CB 4.36Å; F334-V517 HydrophobicContact CE1-CG1 4.33Å; F334-V517 HydrophobicContact CE1-CG2 4.3Å; H338-V517 HydrophobicContact CB-CG2 4.08Å; H338-V517 WeakPolarHBondContact CD2-CG2 3.06Å; H338-V517 WeakPolarHBondContact CE1-CG2 3.3Å; H338-V517 WeakPolarHBondContact ND1-CG2 3.37Å; H338-V517 WeakPolarHBondContact NE2-CG2 3.46Å; V517-Q519 PolarHBondContact O-N 3.05Å; V517-Q519 VanDerWaalsContact O-N 3.16Å; V517-I520 PolarHBondContact O-N 2.97Å; V517-I520 VanDerWaalsContact O-N 3.08Å; V517-F521 HydrophobicContact CG1-CD2 3.79Å; V517-F521 HydrophobicContact CG1-CE2 4.28Å; V517-F521 PolarHBondContact O-N 3.07Å |
| 518 | L | 52.5 | Low | 59.7 | Low | 118 Ų | 118 | 80.6 Ų | 80.6 | 62% | 0.618 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -61.6 | -23.9 | -178.4 | -62.2 | 177.4 | 0 | 0 | 0 | 112.3 | D516 I520 | D516-L518 PolarHBondContact O-N 3.48Å; L518-I520 VanDerWaalsContact C-N 3.29Å; L518-I520 PolarHBondContact O-N 3.33Å |
| 519 | Q | 55.2 | Low | 57.1 | Low | 141 Ų | 141 | 89 Ų | 89 | 66% | 0.659 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -73.7 | -19.3 | 178.8 | -65.8 | -179.1 | -1.4 | 0 | 0 | 113.2 | D516 V517 | D516-Q519 HydrophobicContact CB-CG 4.24Å; D516-Q519 WeakPolarHBondContact O-CB 3.43Å; D516-Q519 PolarHBondContact O-N 3.14Å; V517-Q519 PolarHBondContact O-N 3.05Å; V517-Q519 VanDerWaalsContact O-N 3.16Å |
| 520 | I | 57.7 | Low | 55.7 | Low | 53 Ų | 53 | 93.4 Ų | 93.4 | 27% | 0.272 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -106.1 | -41.4 | -173.8 | -59.1 | -158.1 | 0 | 0 | 0 | 112.6 | F334 M515 V517 L518 | F334-I520 HydrophobicContact CB-CD1 4.35Å; F334-I520 HydrophobicContact CD1-CB 4.25Å; F334-I520 HydrophobicContact CD1-CD1 3.87Å; F334-I520 HydrophobicContact CD1-CG1 4.41Å; F334-I520 HydrophobicContact CD1-CG2 4.34Å; F334-I520 HydrophobicContact CD2-CD1 3.19Å; F334-I520 HydrophobicContact CD2-CG1 4.33Å; F334-I520 HydrophobicContact CE1-CB 4.07Å; F334-I520 HydrophobicContact CE1-CD1 3.9Å; F334-I520 HydrophobicContact CE1-CG1 4.09Å; F334-I520 HydrophobicContact CE2-CD1 3.23Å; F334-I520 HydrophobicContact CE2-CG1 4.01Å; F334-I520 HydrophobicContact CG-CD1 3.53Å; F334-I520 HydrophobicContact CZ-CB 4.36Å; F334-I520 HydrophobicContact CZ-CD1 3.59Å; F334-I520 HydrophobicContact CZ-CG1 3.88Å; M515-I520 HydrophobicContact CE-CD1 3.71Å; M515-I520 HydrophobicContact CE-CG1 3.95Å; M515-I520 HydrophobicContact SD-CD1 4.49Å; V517-I520 PolarHBondContact O-N 2.97Å; V517-I520 VanDerWaalsContact O-N 3.08Å; L518-I520 VanDerWaalsContact C-N 3.29Å; L518-I520 PolarHBondContact O-N 3.33Å |
| 521 | F | 59.4 | Low | 54.2 | Low | 36 Ų | 36 | 97.4 Ų | 97.4 | 16% | 0.158 | 53% | 0.531 | C | S | . | . | H | α-helix | trans | -92.5 | -6.5 | -176.4 | -64.9 | -69.8 | 0 | 0 | 0 | 114.1 | L310 P311 R331 F334 L335 V517 | L310-F521 HydrophobicContact CD1-CE1 4.35Å; P311-F521 HydrophobicContact CB-CD1 4.15Å; P311-F521 HydrophobicContact CG-CD1 3.7Å; P311-F521 HydrophobicContact CG-CE1 4.08Å; P311-F521 HydrophobicContact CG-CG 4.34Å; R331-F521 HydrophobicContact CB-CE1 4.03Å; R331-F521 HydrophobicContact CB-CZ 4.32Å; R331-F521 HydrophobicContact CG-CE1 4.18Å; F334-F521 AromaticContact CD1-CE2 3.74Å; F334-F521 HydrophobicContact CD1-CE2 3.74Å; F334-F521 HydrophobicContact CD1-CZ 4.33Å; F334-F521 HydrophobicContact CE1-CE2 4.09Å; L335-F521 HydrophobicContact CB-CZ 4.25Å; V517-F521 HydrophobicContact CG1-CD2 3.79Å; V517-F521 HydrophobicContact CG1-CE2 4.28Å; V517-F521 PolarHBondContact O-N 3.07Å |
| 522 | G | 41.7 | Very low | 52.6 | Low | 41 Ų | 41 | 95.1 Ų | 95.1 | 42% | 0.423 | 53% | 0.527 | S | S | . | . | trans | 63.5 | 173.2 | -169 | 0 | 0 | 0 | 0 | 0 | 111 | V524 | G522-V524 VanDerWaalsContact C-N 3.29Å; G522-V524 PolarHBondContact O-N 2.9Å | ||
| 523 | Q | 30.8 | Very low | 50.7 | Low | 182 Ų | 182 | 99.9 Ų | 99.9 | 85% | 0.85 | 55% | 0.554 | S | S | * | * | trans | -64.3 | 89.1 | 175.3 | -74.3 | -179.1 | -23.9 | 0 | 0 | 110.3 | V525 | Q523-V525 PolarHBondContact O-N 3.41Š| ||
| 524 | V | 34.4 | Very low | 48.8 | Very low | 91 Ų | 91 | 104.8 Ų | 104.8 | 55% | 0.552 | 58% | 0.581 | S | S | * | * | trans | -82.4 | 98.1 | 155.3 | -176.2 | 0 | 0 | 0 | 0 | 105.1 | G522 | G522-V524 VanDerWaalsContact C-N 3.29Å; G522-V524 PolarHBondContact O-N 2.9Å | ||
| 525 | V | 29.9 | Very low | 46.8 | Very low | 84 Ų | 84 | 100.5 Ų | 100.5 | 51% | 0.509 | 57% | 0.571 | S | S | . | * | trans | -64.9 | 127.8 | 173.3 | 179.9 | 0 | 0 | 0 | 0 | 107.1 | Q523 G527 | Q523-V525 PolarHBondContact O-N 3.41Å; V525-G527 VanDerWaalsContact C-N 3.3Å; V525-G527 PolarHBondContact O-N 3.46Å | ||
| 526 | P | 29.5 | Very low | 44.7 | Very low | 135 Ų | 135 | 102.6 Ų | 102.6 | 88% | 0.877 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 93.7 | 172.4 | 26 | -29.5 | 0 | 0 | 0 | 107.9 | ||
| 527 | G | 37.2 | Very low | 43 | Very low | 65 Ų | 65 | 103.6 Ų | 103.6 | 67% | 0.67 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 168.3 | -15.8 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | V525 | V525-G527 VanDerWaalsContact C-N 3.3Å; V525-G527 PolarHBondContact O-N 3.46Å |
| 528 | D | 36.1 | Very low | 41.3 | Very low | 154 Ų | 154 | 109.1 Ų | 109.1 | 82% | 0.824 | 63% | 0.625 | S | S | * | * | trans | -110.2 | 31.2 | 178.2 | -74.5 | -35.9 | 0 | 0 | 0 | 113.7 | ||||
| 529 | L | 31.7 | Very low | 40.3 | Very low | 209 Ų | 209 | 108.3 Ų | 108.3 | 100% | 1.094 | 63% | 0.626 | S | S | * | * | trans | -114.7 | 0 | 170.2 | -99.1 | 158.2 | 0 | 0 | 0 | 111 |
Retrieved 529 of 529 residues in 104.9 ms
(Link to these results)