| 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 | 37.7 | Very low | 50.8 | Low | 248 Ų | 248 | 146.1 Ų | 146.1 | 100% | 1.222 | 75% | 0.746 | S | S | * | * | 0 | 105.4 | 0 | -65.3 | 175.5 | -177 | 0 | 0 | 107.5 | |||||
| 2 | R | 41.3 | Very low | 52 | Low | 251 Ų | 251 | 140.8 Ų | 140.8 | 95% | 0.947 | 73% | 0.725 | S | S | * | * | trans | -107.4 | 115.6 | 175.4 | -76.3 | -179.7 | 177.4 | 168.8 | -0.9 | 106.6 | ||||
| 3 | T | 43 | Very low | 52.7 | Low | 134 Ų | 134 | 138.9 Ų | 138.9 | 82% | 0.822 | 71% | 0.711 | S | S | * | * | trans | -62.3 | 133.8 | 170.4 | 33.4 | 0 | 0 | 0 | 0 | 108.8 | L5 | T3-L5 PolarHBondContact O-N 3.1Š| ||
| 4 | P | 51.1 | Low | 53.7 | Low | 123 Ų | 123 | 133.4 Ų | 133.4 | 80% | 0.799 | 69% | 0.692 | S | S | * | * | trans | -72.2 | 120.5 | 174.4 | 29.2 | -29 | 0 | 0 | 0 | 107.6 | L6 | P4-L6 VanDerWaalsContact C-N 3.33Å; P4-L6 PolarHBondContact O-N 2.93Å | ||
| 5 | L | 51.7 | Low | 54.4 | Low | 168 Ų | 168 | 130.5 Ų | 130.5 | 88% | 0.88 | 68% | 0.677 | S | S | * | * | trans | -63.2 | 98 | 168.7 | -117.3 | 139.9 | 0 | 0 | 0 | 107 | T3 P7 | T3-L5 PolarHBondContact O-N 3.1Å; L5-P7 WeakPolarHBondContact O-CD 3.23Å | ||
| 6 | L | 52.3 | Low | 55.2 | Low | 119 Ų | 119 | 129.4 Ų | 129.4 | 62% | 0.623 | 67% | 0.672 | S | S | * | * | trans | -57.1 | 119.1 | 174.6 | -146.8 | 144.6 | 0 | 0 | 0 | 106.8 | P4 R8 L10 | P4-L6 VanDerWaalsContact C-N 3.33Å; P4-L6 PolarHBondContact O-N 2.93Å; L6-R8 PolarHBondContact O-N 3.21Å; L6-R8 VanDerWaalsContact O-N 3.1Å; L6-L10 HydrophobicContact CD2-CB 4.48Å; L6-L10 HydrophobicContact CD2-CD1 4.09Å | ||
| 7 | P | 55.6 | Low | 55.8 | Low | 72 Ų | 72 | 129.2 Ų | 129.2 | 47% | 0.468 | 67% | 0.671 | S | S | . | * | trans | -65.3 | 121.1 | -168.7 | 20.8 | -28.7 | 0 | 0 | 0 | 108.6 | L5 A9 L10 | L5-P7 WeakPolarHBondContact O-CD 3.23Å; P7-A9 HydrophobicContact CB-CB 4.36Å; P7-A9 PolarHBondContact O-N 3.22Å; P7-L10 HydrophobicContact CG-CD1 3.81Å; P7-L10 HydrophobicContact CG-CG 4.04Å; P7-L10 PolarHBondContact O-N 3.42Å | ||
| 8 | R | 57.3 | Low | 56.2 | Low | 214 Ų | 214 | 127.3 Ų | 127.3 | 81% | 0.808 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -45.5 | -24 | 172.5 | -88.4 | 176.7 | 164.8 | 160.6 | -5.5 | 113 | L6 L10 L11 V12 | L6-R8 PolarHBondContact O-N 3.21Å; L6-R8 VanDerWaalsContact O-N 3.1Å; R8-L10 VanDerWaalsContact C-N 3.31Å; R8-L10 PolarHBondContact O-N 2.64Å; R8-L11 PolarHBondContact O-N 2.94Å; R8-V12 WeakPolarHBondContact O-CG2 3.28Å; R8-V12 PolarHBondContact O-N 3.26Å |
| 9 | A | 52.6 | Low | 56.6 | Low | 60 Ų | 60 | 127.2 Ų | 127.2 | 50% | 0.496 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -54.2 | -39.4 | 171 | 0 | 0 | 0 | 0 | 0 | 113.6 | P7 V12 Q13 | P7-A9 HydrophobicContact CB-CB 4.36Å; P7-A9 PolarHBondContact O-N 3.22Å; A9-V12 PolarHBondContact O-N 3.47Å; A9-Q13 WeakPolarHBondContact O-CB 3.41Å; A9-Q13 PolarHBondContact O-N 3.15Å |
| 10 | L | 56.7 | Low | 56.6 | Low | 94 Ų | 94 | 122.6 Ų | 122.6 | 49% | 0.492 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -70.5 | -34.9 | -178.5 | -69.3 | 171.9 | 0 | 0 | 0 | 112.8 | L6 P7 R8 S14 | L6-L10 HydrophobicContact CD2-CB 4.48Å; L6-L10 HydrophobicContact CD2-CD1 4.09Å; P7-L10 HydrophobicContact CG-CD1 3.81Å; P7-L10 HydrophobicContact CG-CG 4.04Å; P7-L10 PolarHBondContact O-N 3.42Å; R8-L10 VanDerWaalsContact C-N 3.31Å; R8-L10 PolarHBondContact O-N 2.64Å; L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.24Å; L10-S14 PolarHBondContact O-N 3.39Å |
| 11 | L | 59.6 | Low | 56.5 | Low | 124 Ų | 124 | 120.9 Ų | 120.9 | 65% | 0.649 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -70.3 | -42.9 | 175.9 | -68.7 | 175.1 | 0 | 0 | 0 | 111.1 | R8 S14 L15 | R8-L11 PolarHBondContact O-N 2.94Å; L11-S14 PolarHBondContact O-N 3.06Å; L11-L15 WeakPolarHBondContact O-CB 3.4Å; L11-L15 PolarHBondContact O-N 2.95Å |
| 12 | V | 65.7 | Low | 57 | Low | 82 Ų | 82 | 112 Ų | 112 | 50% | 0.497 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65.5 | -42.1 | 175.9 | 175 | 0 | 0 | 0 | 0 | 110.5 | R8 A9 L15 L16 | R8-V12 WeakPolarHBondContact O-CG2 3.28Å; R8-V12 PolarHBondContact O-N 3.26Å; A9-V12 PolarHBondContact O-N 3.47Å; V12-L15 PolarHBondContact O-N 2.98Å; V12-L16 HydrophobicContact CG1-CD1 3.55Å; V12-L16 WeakPolarHBondContact O-CB 3.49Å; V12-L16 WeakPolarHBondContact O-CD1 3.32Å; V12-L16 PolarHBondContact O-N 3.37Å |
| 13 | Q | 60.6 | Low | 57.2 | Low | 117 Ų | 117 | 108 Ų | 108 | 55% | 0.547 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -69.2 | -36.7 | 179.5 | -163.8 | 163.2 | 9.6 | 0 | 0 | 112.1 | A9 L17 | A9-Q13 WeakPolarHBondContact O-CB 3.41Å; A9-Q13 PolarHBondContact O-N 3.15Å; Q13-L17 WeakPolarHBondContact O-CB 3.37Å; Q13-L17 WeakPolarHBondContact O-CD1 3.45Å; Q13-L17 WeakPolarHBondContact O-CG 3.38Å; Q13-L17 PolarHBondContact O-N 3.06Å |
| 14 | S | 66.2 | Low | 57.2 | Low | 62 Ų | 62 | 111.8 Ų | 111.8 | 43% | 0.434 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -63.6 | -43.6 | 170.6 | -174.5 | 0 | 0 | 0 | 0 | 111.7 | L10 L11 L17 L18 | L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.24Å; L10-S14 PolarHBondContact O-N 3.39Å; L11-S14 PolarHBondContact O-N 3.06Å; S14-L17 PolarHBondContact O-N 3.33Å; S14-L18 WeakPolarHBondContact O-CD1 3.3Å; S14-L18 WeakPolarHBondContact O-CG 3.2Å; S14-L18 PolarHBondContact O-N 2.82Å |
| 15 | L | 65.4 | Low | 56.9 | Low | 89 Ų | 89 | 110.6 Ų | 110.6 | 47% | 0.466 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.3 | -41.9 | 177.4 | -168.4 | 68.6 | 0 | 0 | 0 | 112.1 | L11 V12 L18 L19 | L11-L15 WeakPolarHBondContact O-CB 3.4Å; L11-L15 PolarHBondContact O-N 2.95Å; V12-L15 PolarHBondContact O-N 2.98Å; L15-L18 PolarHBondContact O-N 3.43Å; L15-L19 HydrophobicContact CD1-CD1 4.5Å; L15-L19 HydrophobicContact CG-CD1 4Å; L15-L19 WeakPolarHBondContact O-CD1 3.36Å; L15-L19 PolarHBondContact O-N 2.97Å |
| 16 | L | 67.3 | Low | 56.3 | Low | 114 Ų | 114 | 107.7 Ų | 107.7 | 60% | 0.597 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.8 | -35.8 | 174.5 | -95.7 | 127.5 | 0 | 0 | 0 | 112.8 | V12 G20 | V12-L16 HydrophobicContact CG1-CD1 3.55Å; V12-L16 WeakPolarHBondContact O-CB 3.49Å; V12-L16 WeakPolarHBondContact O-CD1 3.32Å; V12-L16 PolarHBondContact O-N 3.37Å; L16-G20 WeakPolarHBondContact O-CA 3.44Å; L16-G20 PolarHBondContact O-N 3.28Å |
| 17 | L | 65.6 | Low | 56 | Low | 126 Ų | 126 | 105.5 Ų | 105.5 | 66% | 0.66 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -68.3 | -38.1 | 175 | -74.6 | 166.3 | 0 | 0 | 0 | 111.8 | Q13 S14 S21 | Q13-L17 WeakPolarHBondContact O-CB 3.37Å; Q13-L17 WeakPolarHBondContact O-CD1 3.45Å; Q13-L17 WeakPolarHBondContact O-CG 3.38Å; Q13-L17 PolarHBondContact O-N 3.06Å; S14-L17 PolarHBondContact O-N 3.33Å; L17-S21 PolarHBondContact O-N 3.13Å |
| 18 | L | 62 | Low | 55.1 | Low | 95 Ų | 95 | 110 Ų | 110 | 50% | 0.497 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -65.2 | -42.6 | 174.8 | -77.1 | 154.7 | 0 | 0 | 0 | 111.9 | S14 L15 S21 | S14-L18 WeakPolarHBondContact O-CD1 3.3Å; S14-L18 WeakPolarHBondContact O-CG 3.2Å; S14-L18 PolarHBondContact O-N 2.82Å; L15-L18 PolarHBondContact O-N 3.43Å; L18-S21 PolarHBondContact O-OG 3.33Å |
| 19 | L | 63.8 | Low | 54.5 | Low | 124 Ų | 124 | 107 Ų | 107 | 65% | 0.649 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -75.3 | -34 | 177.5 | -74.5 | 153 | 0 | 0 | 0 | 113 | L15 | L15-L19 HydrophobicContact CD1-CD1 4.5Å; L15-L19 HydrophobicContact CG-CD1 4Å; L15-L19 WeakPolarHBondContact O-CD1 3.36Å; L15-L19 PolarHBondContact O-N 2.97Å |
| 20 | G | 56 | Low | 53.9 | Low | 36 Ų | 36 | 112.1 Ų | 112.1 | 37% | 0.371 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -77 | -20.3 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | L16 G22 | L16-G20 WeakPolarHBondContact O-CA 3.44Å; L16-G20 PolarHBondContact O-N 3.28Å; G20-G22 PolarHBondContact O-N 3.2Å |
| 21 | S | 55.2 | Low | 53.2 | Low | 86 Ų | 86 | 113.8 Ų | 113.8 | 60% | 0.601 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -73.2 | -7.8 | 178.1 | 64.6 | 0 | 0 | 0 | 0 | 114.8 | L17 L18 | L17-S21 PolarHBondContact O-N 3.13Å; L18-S21 PolarHBondContact O-OG 3.33Å |
| 22 | G | 48.9 | Very low | 52 | Low | 63 Ų | 63 | 115.1 Ų | 115.1 | 65% | 0.649 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -81.6 | -8.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | G20 | G20-G22 PolarHBondContact O-N 3.2Š|
| 23 | H | 44.3 | Very low | 50.8 | Low | 167 Ų | 167 | 116.8 Ų | 116.8 | 77% | 0.773 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -100 | 4.2 | -172.2 | -74.9 | -70.4 | 0 | 0 | 0 | 115.8 | ||
| 24 | Y | 44.5 | Very low | 49.6 | Very low | 212 Ų | 212 | 118 Ų | 118 | 83% | 0.831 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -102.1 | 15.4 | -176 | -65.5 | -80.9 | 0 | 0 | 0 | 115.2 | ||
| 25 | A | 44.1 | Very low | 48.4 | Very low | 98 Ų | 98 | 120.3 Ų | 120.3 | 81% | 0.81 | 71% | 0.713 | S | S | * | * | trans | -143.1 | 65 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 26 | A | 39.4 | Very low | 46.8 | Very low | 108 Ų | 108 | 119.5 Ų | 119.5 | 89% | 0.893 | 73% | 0.726 | S | S | * | * | trans | -137.6 | 80.1 | 162.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 27 | G | 46 | Very low | 45.1 | Very low | 73 Ų | 73 | 123.6 Ų | 123.6 | 75% | 0.753 | 74% | 0.739 | S | S | * | * | trans | -149.6 | 85.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 28 | L | 35.9 | Very low | 43.7 | Very low | 166 Ų | 166 | 125.1 Ų | 125.1 | 87% | 0.869 | 75% | 0.746 | S | S | * | * | trans | -150.7 | 98 | 163.6 | -125.8 | 160.3 | 0 | 0 | 0 | 107.8 | ||||
| 29 | D | 45.8 | Very low | 42.5 | Very low | 151 Ų | 151 | 125.8 Ų | 125.8 | 81% | 0.807 | 76% | 0.756 | S | S | * | * | trans | -46.7 | 134 | 163.7 | -83.7 | -74.9 | 0 | 0 | 0 | 110.9 | ||||
| 30 | L | 39.5 | Very low | 41.3 | Very low | 168 Ų | 168 | 124.5 Ų | 124.5 | 88% | 0.88 | 76% | 0.763 | S | S | * | * | trans | -135.1 | 86.3 | 158.5 | -157 | 78.2 | 0 | 0 | 0 | 108.4 | ||||
| 31 | N | 42.2 | Very low | 40 | Very low | 129 Ų | 129 | 132.7 Ų | 132.7 | 69% | 0.69 | 79% | 0.789 | S | S | * | * | trans | -86 | 118.2 | 152.7 | -175.9 | 22.3 | 0 | 0 | 0 | 106.2 | ||||
| 32 | D | 32.8 | Very low | 39 | Very low | 152 Ų | 152 | 133.7 Ų | 133.7 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | trans | -159.1 | 125.9 | 139 | -97.8 | -34 | 0 | 0 | 0 | 111.2 | ||||
| 33 | T | 41.4 | Very low | 38.1 | Very low | 116 Ų | 116 | 133.6 Ų | 133.6 | 71% | 0.712 | 80% | 0.796 | S | S | * | * | trans | -69.4 | 127 | 172.1 | -66.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 34 | T | 35.8 | Very low | 37.5 | Very low | 142 Ų | 142 | 133.8 Ų | 133.8 | 87% | 0.871 | 80% | 0.796 | S | S | * | * | trans | -149.4 | 115.8 | 147.2 | -74.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 35 | S | 39.7 | Very low | 37.2 | Very low | 112 Ų | 112 | 129.9 Ų | 129.9 | 78% | 0.783 | 79% | 0.786 | S | S | * | * | trans | -51.3 | 130.8 | 171.6 | 153.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 36 | G | 32.2 | Very low | 36.7 | Very low | 72 Ų | 72 | 132.8 Ų | 132.8 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | -143.8 | 69.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 37 | K | 31.2 | Very low | 36.6 | Very low | 199 Ų | 199 | 132.2 Ų | 132.2 | 87% | 0.865 | 78% | 0.782 | S | S | * | * | trans | 13.1 | 105.1 | 149.2 | -160 | 171.2 | -173.6 | -179.7 | 0 | 118.1 | ||||
| 38 | I | 36.2 | Very low | 36.1 | Very low | 159 Ų | 159 | 135.6 Ų | 135.6 | 82% | 0.815 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -96.1 | 129.9 | 159.6 | -58.4 | 172.8 | 0 | 0 | 0 | 108.3 | ||
| 39 | P | 38.5 | Very low | 35.9 | Very low | 108 Ų | 108 | 131 Ų | 131 | 70% | 0.701 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 120.4 | 162.1 | 30.5 | -23.2 | 0 | 0 | 0 | 110.3 | ||
| 40 | A | 36.8 | Very low | 35.2 | Very low | 97 Ų | 97 | 131.9 Ų | 131.9 | 80% | 0.802 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 136.4 | 162.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 41 | F | 30.5 | Very low | 34.8 | Very low | 209 Ų | 209 | 129.5 Ų | 129.5 | 92% | 0.917 | 78% | 0.778 | S | S | * | * | trans | -125.4 | 138.2 | 164.4 | -118 | -87.2 | 0 | 0 | 0 | 110.2 | ||||
| 42 | S | 33 | Very low | 34.2 | Very low | 106 Ų | 106 | 129.5 Ų | 129.5 | 74% | 0.741 | 78% | 0.782 | S | S | * | * | trans | -95.3 | 146.4 | -160.7 | 59.2 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 43 | G | 31.5 | Very low | 34.1 | Very low | 62 Ų | 62 | 127.8 Ų | 127.8 | 64% | 0.639 | 78% | 0.782 | S | S | * | * | trans | 28.8 | 135 | 144.9 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 44 | H | 31.5 | Very low | 33.8 | Very low | 170 Ų | 170 | 126.9 Ų | 126.9 | 79% | 0.787 | 79% | 0.787 | S | S | * | * | -170.7 | 148 | 101.2 | -102.7 | 65.9 | 0 | 0 | 0 | 112.1 | |||||
| 45 | H | 36.7 | Very low | 33.6 | Very low | 131 Ų | 131 | 123.6 Ų | 123.6 | 61% | 0.606 | 78% | 0.78 | S | S | * | * | trans | -75.8 | 152.7 | 175.5 | 12.9 | -82.2 | 0 | 0 | 0 | 110.6 | ||||
| 46 | N | 33.9 | Very low | 33.4 | Very low | 158 Ų | 158 | 123 Ų | 123 | 85% | 0.845 | 78% | 0.777 | S | S | * | * | trans | -177.7 | 134 | 131.5 | -84.8 | -18.7 | 0 | 0 | 0 | 111.9 | ||||
| 47 | A | 37.2 | Very low | 33.6 | Very low | 96 Ų | 96 | 127.3 Ų | 127.3 | 79% | 0.793 | 78% | 0.777 | S | S | * | * | trans | -103 | 134.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 48 | T | 35.9 | Very low | 33.8 | Very low | 145 Ų | 145 | 124 Ų | 124 | 89% | 0.89 | 77% | 0.773 | S | S | * | * | trans | -164.1 | 127.1 | 158 | 5.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 49 | G | 32.8 | Very low | 33.6 | Very low | 70 Ų | 70 | 121.4 Ų | 121.4 | 72% | 0.722 | 77% | 0.77 | S | S | * | * | trans | -93.9 | 161.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 50 | L | 29.4 | Very low | 33.1 | Very low | 168 Ų | 168 | 121.5 Ų | 121.5 | 88% | 0.88 | 77% | 0.768 | S | S | * | * | trans | -177.3 | 118 | 141.9 | -137.3 | 78.6 | 0 | 0 | 0 | 111.7 | ||||
| 51 | V | 32.8 | Very low | 32.9 | Very low | 118 Ų | 118 | 124.4 Ų | 124.4 | 72% | 0.715 | 77% | 0.769 | S | S | * | * | 60.4 | 113.8 | 124.5 | 175 | 0 | 0 | 0 | 0 | 122.8 | |||||
| 52 | V | 28.8 | Very low | 33 | Very low | 130 Ų | 130 | 118.6 Ų | 118.6 | 79% | 0.788 | 75% | 0.754 | S | S | * | * | 62.9 | 125.2 | 124.8 | -176 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 53 | S | 30.5 | Very low | 32.9 | Very low | 115 Ų | 115 | 122.2 Ų | 122.2 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | -174 | 108.2 | 122.9 | -156.8 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 54 | A | 34.3 | Very low | 33.2 | Very low | 98 Ų | 98 | 127.2 Ų | 127.2 | 81% | 0.81 | 77% | 0.768 | S | S | * | * | 95.9 | 131.4 | 69 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 55 | G | 32 | Very low | 34 | Very low | 72 Ų | 72 | 124.8 Ų | 124.8 | 74% | 0.742 | 77% | 0.767 | S | S | * | * | trans | 135.7 | 71.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 56 | S | 36.8 | Very low | 34.2 | Very low | 101 Ų | 101 | 124.6 Ų | 124.6 | 71% | 0.706 | 78% | 0.781 | S | S | * | * | 62 | 129.6 | 88 | -122.2 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 57 | E | 35.7 | Very low | 34.2 | Very low | 162 Ų | 162 | 120.7 Ų | 120.7 | 76% | 0.757 | 78% | 0.777 | S | S | * | * | cis | -176.1 | 144.4 | 3.8 | 48 | -153.7 | 103.7 | 0 | 0 | 111.6 | ||||
| 58 | V | 35.7 | Very low | 34.6 | Very low | 129 Ų | 129 | 121.4 Ų | 121.4 | 78% | 0.782 | 78% | 0.777 | S | S | * | * | trans | 60.7 | 117 | 135.5 | 157.6 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 59 | S | 31.3 | Very low | 34.6 | Very low | 105 Ų | 105 | 123.9 Ų | 123.9 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | 79.1 | 140.7 | 76.6 | -106 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 60 | T | 28.7 | Very low | 34.9 | Very low | 110 Ų | 110 | 128.7 Ų | 128.7 | 68% | 0.675 | 79% | 0.787 | S | S | * | * | cis | 178.7 | 136.4 | 29.6 | -88.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 61 | I | 32.5 | Very low | 35.5 | Very low | 157 Ų | 157 | 125.5 Ų | 125.5 | 81% | 0.805 | 78% | 0.778 | S | S | * | * | trans | 52.5 | 140.2 | 138.2 | -80.8 | 164.1 | 0 | 0 | 0 | 125.1 | ||||
| 62 | S | 31.4 | Very low | 35.8 | Very low | 88 Ų | 88 | 126.2 Ų | 126.2 | 62% | 0.615 | 78% | 0.783 | S | S | * | * | trans | 104.8 | 127.4 | 138.4 | -125.6 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 63 | E | 32.6 | Very low | 36.4 | Very low | 182 Ų | 182 | 123.3 Ų | 123.3 | 85% | 0.85 | 78% | 0.78 | S | S | * | * | trans | 95.5 | 131.7 | 131.8 | -99.3 | 160.9 | 121.6 | 0 | 0 | 122.4 | ||||
| 64 | M | 37 | Very low | 36.8 | Very low | 167 Ų | 167 | 125.2 Ų | 125.2 | 82% | 0.823 | 78% | 0.78 | S | S | * | * | trans | -87.9 | 161.1 | 174.6 | -122.4 | -71.1 | 163.4 | 0 | 0 | 110.5 | ||||
| 65 | P | 48.5 | Very low | 37.2 | Very low | 118 Ų | 118 | 130.9 Ų | 130.9 | 77% | 0.766 | 78% | 0.782 | S | S | * | * | trans | -139.3 | 155.3 | 133.4 | 33.9 | -17.8 | 0 | 0 | 0 | 115.7 | ||||
| 66 | S | 41.2 | Very low | 38 | Very low | 128 Ų | 128 | 134.5 Ų | 134.5 | 90% | 0.895 | 79% | 0.785 | S | S | * | * | trans | -72.8 | 154.9 | 179.9 | -179.3 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 67 | G | 33.5 | Very low | 38.2 | Very low | 75 Ų | 75 | 140.8 Ų | 140.8 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | trans | 170.9 | 120.5 | 163.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 68 | S | 45.3 | Very low | 39.1 | Very low | 111 Ų | 111 | 137.8 Ų | 137.8 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | trans | -69.7 | 156.1 | -176 | 49.8 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 69 | E | 35.1 | Very low | 39.6 | Very low | 197 Ų | 197 | 139.9 Ų | 139.9 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | -178.7 | 156.8 | 116.5 | -91.5 | -165.9 | 139 | 0 | 0 | 113.1 | |||||
| 70 | L | 40.8 | Very low | 40.2 | Very low | 172 Ų | 172 | 143.7 Ų | 143.7 | 90% | 0.901 | 80% | 0.799 | S | S | * | * | trans | -80.8 | 150.3 | -166.7 | -130.5 | 96.2 | 0 | 0 | 0 | 113.8 | ||||
| 71 | S | 41.6 | Very low | 41 | Very low | 101 Ų | 101 | 148.1 Ų | 148.1 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | 155.9 | 142.5 | 120.8 | -168.5 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 72 | T | 39.6 | Very low | 41.8 | Very low | 133 Ų | 133 | 148 Ų | 148 | 82% | 0.816 | 81% | 0.806 | S | S | * | * | trans | 80.1 | 117.7 | 152.5 | -62.4 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 73 | G | 40.2 | Very low | 42.8 | Very low | 69 Ų | 69 | 150.8 Ų | 150.8 | 71% | 0.711 | 81% | 0.814 | S | S | * | * | trans | -93.1 | -178.9 | -167.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 74 | D | 38.4 | Very low | 43.7 | Very low | 154 Ų | 154 | 150.2 Ų | 150.2 | 82% | 0.824 | 81% | 0.812 | S | S | * | * | trans | -159.9 | 150.7 | 140.6 | -134 | -14 | 0 | 0 | 0 | 108.9 | ||||
| 75 | Y | 42.4 | Very low | 44.4 | Very low | 217 Ų | 217 | 147.5 Ų | 147.5 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | trans | -92.9 | 138.7 | -162.9 | -47.2 | -96 | 0 | 0 | 0 | 111.7 | ||||
| 76 | D | 48.9 | Very low | 44.2 | Very low | 149 Ų | 149 | 151.2 Ų | 151.2 | 80% | 0.797 | 81% | 0.813 | S | S | * | * | trans | -172.1 | 107.7 | 135.3 | -156.7 | 0.7 | 0 | 0 | 0 | 108.6 | ||||
| 77 | Y | 42.6 | Very low | 44.3 | Very low | 232 Ų | 232 | 153 Ų | 153 | 91% | 0.91 | 81% | 0.811 | S | S | * | * | trans | -132.9 | 113.4 | 169.3 | -129.1 | -92.4 | 0 | 0 | 0 | 108.8 | ||||
| 78 | S | 53.1 | Low | 44.9 | Very low | 100 Ų | 100 | 155 Ų | 155 | 70% | 0.699 | 81% | 0.813 | S | S | * | * | trans | -56.9 | 132.7 | -179.8 | -49.5 | 0 | 0 | 0 | 0 | 111.2 | E80 | S78-E80 PolarHBondContact O-N 2.96Å; S78-E80 VanDerWaalsContact O-N 3.09Å | ||
| 79 | E | 46.4 | Very low | 44.8 | Very low | 172 Ų | 172 | 152.4 Ų | 152.4 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -71.1 | 90.1 | 174.8 | 55.8 | -145.1 | 156.2 | 0 | 0 | 111.5 | Y81 | E79-Y81 PolarHBondContact O-N 3.49Š| ||
| 80 | E | 45.3 | Very low | 45.1 | Very low | 186 Ų | 186 | 153.1 Ų | 153.1 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | -77.4 | 112.7 | 160.2 | -81.6 | -167.3 | 162.6 | 0 | 0 | 109.2 | S78 D82 | S78-E80 PolarHBondContact O-N 2.96Å; S78-E80 VanDerWaalsContact O-N 3.09Å; E80-D82 PolarHBondContact O-N 3Å | ||
| 81 | Y | 44.3 | Very low | 45.7 | Very low | 202 Ų | 202 | 151.1 Ų | 151.1 | 79% | 0.792 | 80% | 0.795 | S | S | * | * | trans | -67 | 90.6 | 173.1 | -100.8 | -102.2 | 0 | 0 | 0 | 110.6 | E79 N83 | E79-Y81 PolarHBondContact O-N 3.49Å; Y81-N83 PolarHBondContact O-N 3.09Å | ||
| 82 | D | 49.5 | Very low | 46.1 | Very low | 156 Ų | 156 | 151.5 Ų | 151.5 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | trans | -70.3 | 105 | 158.7 | -95.1 | -33 | 0 | 0 | 0 | 109.2 | E80 E84 | E80-D82 PolarHBondContact O-N 3Å; D82-E84 VanDerWaalsContact C-N 3.29Å; D82-E84 PolarHBondContact O-N 3.34Å; D82-E84 VanDerWaalsContact O-N 3.1Å | ||
| 83 | N | 52.4 | Low | 46.3 | Very low | 145 Ų | 145 | 150.3 Ų | 150.3 | 78% | 0.775 | 78% | 0.776 | S | S | * | * | trans | -78.5 | 81.2 | 166.2 | -81.1 | -96.2 | 0 | 0 | 0 | 108.8 | Y81 | Y81-N83 PolarHBondContact O-N 3.09Š| ||
| 84 | E | 51 | Low | 46.9 | Very low | 171 Ų | 171 | 154.2 Ų | 154.2 | 80% | 0.799 | 78% | 0.781 | S | S | * | * | trans | -87.1 | 123.4 | 165.7 | -167.7 | 146.3 | 115.2 | 0 | 0 | 109.7 | D82 Q86 | D82-E84 VanDerWaalsContact C-N 3.29Å; D82-E84 PolarHBondContact O-N 3.34Å; D82-E84 VanDerWaalsContact O-N 3.1Å; E84-Q86 PolarHBondContact O-N 3.23Å | ||
| 85 | P | 52.5 | Low | 47.6 | Very low | 110 Ų | 110 | 150.8 Ų | 150.8 | 71% | 0.714 | 77% | 0.769 | S | S | * | * | trans | -69.2 | 116.5 | 173.6 | -11.3 | 25.8 | 0 | 0 | 0 | 109.3 | I87 | P85-I87 PolarHBondContact O-N 3.2Š| ||
| 86 | Q | 43.5 | Very low | 48 | Very low | 195 Ų | 195 | 146 Ų | 146 | 91% | 0.911 | 76% | 0.762 | S | S | * | * | trans | -58.7 | 107.7 | 168.8 | -71.3 | -163.4 | -10.6 | 0 | 0 | 109.9 | E84 S88 | E84-Q86 PolarHBondContact O-N 3.23Å; Q86-S88 PolarHBondContact O-N 2.98Å | ||
| 87 | I | 43.9 | Very low | 48.4 | Very low | 167 Ų | 167 | 150.4 Ų | 150.4 | 86% | 0.856 | 77% | 0.767 | S | S | * | * | trans | -67 | 103.9 | 167 | -66.5 | 169.6 | 0 | 0 | 0 | 106.9 | P85 G89 | P85-I87 PolarHBondContact O-N 3.2Å; I87-G89 PolarHBondContact O-N 2.67Å | ||
| 88 | S | 46 | Very low | 48.8 | Very low | 115 Ų | 115 | 145.1 Ų | 145.1 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | -63.8 | 116 | 175.9 | -173.4 | 0 | 0 | 0 | 0 | 110.6 | Q86 | Q86-S88 PolarHBondContact O-N 2.98Š| ||
| 89 | G | 42.9 | Very low | 48.8 | Very low | 58 Ų | 58 | 148.8 Ų | 148.8 | 60% | 0.598 | 77% | 0.765 | S | S | * | * | trans | 58.2 | 90.1 | 141.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | I87 V91 | I87-G89 PolarHBondContact O-N 2.67Å; G89-V91 PolarHBondContact O-N 3.04Å; G89-V91 VanDerWaalsContact O-N 3.14Å | ||
| 90 | Y | 42.2 | Very low | 48.8 | Very low | 212 Ų | 212 | 148.7 Ų | 148.7 | 83% | 0.831 | 77% | 0.765 | S | S | * | * | trans | -66.6 | 103.6 | 157.9 | -141.8 | -90.1 | 0 | 0 | 0 | 108.3 | I92 | Y90-I92 HydrophobicContact CD1-CD1 3.67Å; Y90-I92 HydrophobicContact CD1-CG1 3.64Å; Y90-I92 HydrophobicContact CE1-CD1 4.07Å; Y90-I92 HydrophobicContact CE1-CG1 3.86Å; Y90-I92 PolarHBondContact O-N 3.47Å | ||
| 91 | V | 53.5 | Low | 48.8 | Very low | 130 Ų | 130 | 146.2 Ų | 146.2 | 79% | 0.788 | 76% | 0.762 | S | S | * | * | trans | -85.9 | 95 | 168.5 | -178 | 0 | 0 | 0 | 0 | 107.5 | G89 D93 | G89-V91 PolarHBondContact O-N 3.04Å; G89-V91 VanDerWaalsContact O-N 3.14Å; V91-D93 PolarHBondContact O-N 2.92Å | ||
| 92 | I | 49.8 | Very low | 49.4 | Very low | 109 Ų | 109 | 143.9 Ų | 143.9 | 56% | 0.559 | 76% | 0.762 | S | S | * | * | trans | -75 | 99.7 | 158.9 | -71.6 | 137 | 0 | 0 | 0 | 106.2 | Y90 D94 | Y90-I92 HydrophobicContact CD1-CD1 3.67Å; Y90-I92 HydrophobicContact CD1-CG1 3.64Å; Y90-I92 HydrophobicContact CE1-CD1 4.07Å; Y90-I92 HydrophobicContact CE1-CG1 3.86Å; Y90-I92 PolarHBondContact O-N 3.47Å; I92-D94 HydrophobicContact CG2-CB 4.34Å; I92-D94 WeakPolarHBondContact CG2-OD1 3.24Å; I92-D94 PolarHBondContact O-N 3.25Å | ||
| 93 | D | 44.4 | Very low | 49.3 | Very low | 107 Ų | 107 | 145.1 Ų | 145.1 | 57% | 0.572 | 76% | 0.76 | S | S | * | * | trans | -80.4 | 94.6 | 162.8 | -177.8 | 51.2 | 0 | 0 | 0 | 107.8 | V91 S95 | V91-D93 PolarHBondContact O-N 2.92Å; D93-S95 PolarHBondContact O-N 3.44Å; D93-S95 WeakPolarHBondContact OD1-CB 3.24Å; D93-S95 PolarHBondContact OD1-OG 3.3Å; D93-S95 WeakPolarHBondContact OD2-CB 3.41Å | ||
| 94 | D | 53 | Low | 48.8 | Very low | 152 Ų | 152 | 144.1 Ų | 144.1 | 81% | 0.813 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | 24.4 | 176.7 | -93.6 | -28.6 | 0 | 0 | 0 | 113.3 | I92 | I92-D94 HydrophobicContact CG2-CB 4.34Å; I92-D94 WeakPolarHBondContact CG2-OD1 3.24Å; I92-D94 PolarHBondContact O-N 3.25Å |
| 95 | S | 53 | Low | 48.7 | Very low | 81 Ų | 81 | 144.8 Ų | 144.8 | 57% | 0.566 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | 6 | -172.7 | -52 | 0 | 0 | 0 | 0 | 114.5 | D93 R97 | D93-S95 PolarHBondContact O-N 3.44Å; D93-S95 WeakPolarHBondContact OD1-CB 3.24Å; D93-S95 PolarHBondContact OD1-OG 3.3Å; D93-S95 WeakPolarHBondContact OD2-CB 3.41Å; S95-R97 VanDerWaalsContact C-N 3.27Å; S95-R97 PolarHBondContact O-N 2.89Å |
| 96 | V | 50.5 | Low | 48.5 | Very low | 118 Ų | 118 | 149.6 Ų | 149.6 | 72% | 0.715 | 77% | 0.771 | S | S | * | * | trans | -73.6 | 81.7 | 176.2 | -173.8 | 0 | 0 | 0 | 0 | 110.4 | V98 | V96-V98 HydrophobicContact CG1-CG2 4Å; V96-V98 PolarHBondContact O-N 3.28Å | ||
| 97 | R | 57.4 | Low | 48.2 | Very low | 240 Ų | 240 | 147 Ų | 147 | 91% | 0.906 | 76% | 0.764 | S | S | * | * | trans | -72.1 | 103.2 | 160.5 | -69 | -176.6 | -176.3 | -141.1 | -0.2 | 108 | S95 E99 | S95-R97 VanDerWaalsContact C-N 3.27Å; S95-R97 PolarHBondContact O-N 2.89Å; R97-E99 PolarHBondContact O-N 2.98Å; R97-E99 VanDerWaalsContact O-N 3.12Å | ||
| 98 | V | 49.4 | Very low | 48.4 | Very low | 122 Ų | 122 | 148.4 Ų | 148.4 | 74% | 0.739 | 76% | 0.764 | S | S | * | * | trans | -73 | 99.3 | 167.6 | -171 | 0 | 0 | 0 | 0 | 107.6 | V96 Q100 | V96-V98 HydrophobicContact CG1-CG2 4Å; V96-V98 PolarHBondContact O-N 3.28Å; V98-Q100 PolarHBondContact O-N 2.89Å | ||
| 99 | E | 53 | Low | 48.1 | Very low | 177 Ų | 177 | 148.6 Ų | 148.6 | 83% | 0.827 | 76% | 0.76 | S | S | * | * | trans | -69.3 | 117.2 | 164.7 | -167 | 166.7 | 165.9 | 0 | 0 | 107.7 | R97 V101 | R97-E99 PolarHBondContact O-N 2.98Å; R97-E99 VanDerWaalsContact O-N 3.12Å; E99-V101 PolarHBondContact O-N 3.33Å; E99-V101 VanDerWaalsContact O-N 3.16Å | ||
| 100 | Q | 48.1 | Very low | 47.8 | Very low | 169 Ų | 169 | 154.9 Ų | 154.9 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | trans | -61.7 | 120.4 | -178.7 | -59.5 | -179 | 10.8 | 0 | 0 | 108.8 | V98 I102 | V98-Q100 PolarHBondContact O-N 2.89Å; Q100-I102 PolarHBondContact O-N 3.38Å | ||
| 101 | V | 44.8 | Very low | 47.6 | Very low | 135 Ų | 135 | 148.1 Ų | 148.1 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -61.7 | 100.2 | 173.7 | 172.1 | 0 | 0 | 0 | 0 | 108.7 | E99 K103 | E99-V101 PolarHBondContact O-N 3.33Å; E99-V101 VanDerWaalsContact O-N 3.16Å; V101-K103 PolarHBondContact O-N 2.96Å; V101-K103 VanDerWaalsContact O-N 3.14Å | ||
| 102 | I | 57.2 | Low | 46.7 | Very low | 153 Ų | 153 | 149.6 Ų | 149.6 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | -66.8 | 110 | 165.5 | -60 | 170.8 | 0 | 0 | 0 | 106.2 | Q100 P104 | Q100-I102 PolarHBondContact O-N 3.38Å; I102-P104 WeakPolarHBondContact O-CD 3.27Å | ||
| 103 | K | 47.8 | Very low | 46.4 | Very low | 181 Ų | 181 | 155 Ų | 155 | 79% | 0.787 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -53 | 124.1 | 170.8 | -72.1 | 175.4 | 179.6 | 175.4 | 0 | 108.7 | V101 K105 | V101-K103 PolarHBondContact O-N 2.96Å; V101-K103 VanDerWaalsContact O-N 3.14Å; K103-K105 PolarHBondContact O-N 3.43Å; K103-K105 VanDerWaalsContact O-N 3.15Å |
| 104 | P | 41.8 | Very low | 46 | Very low | 124 Ų | 124 | 156.9 Ų | 156.9 | 81% | 0.805 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 121.3 | 174.8 | -17.8 | 29.3 | 0 | 0 | 0 | 109.4 | I102 | I102-P104 WeakPolarHBondContact O-CD 3.27Š|
| 105 | K | 48.1 | Very low | 45.4 | Very low | 186 Ų | 186 | 154.4 Ų | 154.4 | 81% | 0.809 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 135.9 | 168.9 | -77.6 | -178.1 | 176.8 | 177.5 | 0 | 109 | K103 N107 | K103-K105 PolarHBondContact O-N 3.43Å; K103-K105 VanDerWaalsContact O-N 3.15Å; K105-N107 WeakPolarHBondContact CB-OD1 3.25Å; K105-N107 PolarHBondContact O-N 2.87Å; K105-N107 PolarHBondContact O-OD1 3.5Å |
| 106 | K | 48.5 | Very low | 44.7 | Very low | 211 Ų | 211 | 158.3 Ų | 158.3 | 92% | 0.917 | 81% | 0.81 | S | S | * | * | trans | -68.4 | 110.9 | 171.5 | -67.1 | -180 | 179.4 | 177.6 | 0 | 108.5 | ||||
| 107 | N | 37.7 | Very low | 44.4 | Very low | 140 Ų | 140 | 161.5 Ų | 161.5 | 75% | 0.749 | 82% | 0.815 | S | S | * | * | trans | -118 | 117.9 | 174.2 | -57 | 5.4 | 0 | 0 | 0 | 108.7 | K105 | K105-N107 WeakPolarHBondContact CB-OD1 3.25Å; K105-N107 PolarHBondContact O-N 2.87Å; K105-N107 PolarHBondContact O-OD1 3.5Å | ||
| 108 | K | 46.2 | Very low | 43.8 | Very low | 197 Ų | 197 | 156.4 Ų | 156.4 | 86% | 0.857 | 81% | 0.812 | S | S | * | * | trans | -86.4 | 142.4 | 166.8 | -69 | -178.7 | 176 | 179.7 | 0 | 108.8 | ||||
| 109 | T | 40.5 | Very low | 43.4 | Very low | 119 Ų | 119 | 160 Ų | 160 | 73% | 0.73 | 82% | 0.818 | S | S | * | * | trans | 79.8 | 133.5 | 148.2 | -50.2 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 110 | E | 37.8 | Very low | 42.9 | Very low | 189 Ų | 189 | 163.5 Ų | 163.5 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | trans | 62.3 | 135.1 | 162.3 | -81 | 172.5 | 158.6 | 0 | 0 | 117.7 | ||||
| 111 | G | 37.3 | Very low | 42.5 | Very low | 71 Ų | 71 | 165 Ų | 165 | 73% | 0.732 | 83% | 0.828 | S | S | * | * | cis | 178.2 | -167.1 | 4.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 112 | D | 33.7 | Very low | 42.3 | Very low | 161 Ų | 161 | 167.7 Ų | 167.7 | 86% | 0.861 | 83% | 0.828 | S | S | * | * | trans | 96.2 | 135.8 | 161.9 | -143.9 | 15.2 | 0 | 0 | 0 | 119.6 | ||||
| 113 | R | 43.1 | Very low | 41.3 | Very low | 223 Ų | 223 | 169.5 Ų | 169.5 | 84% | 0.842 | 83% | 0.83 | S | S | * | * | trans | -79.8 | 149.9 | -167.9 | -60.5 | 165.5 | 170.2 | 161.1 | -1.6 | 108.8 | ||||
| 114 | T | 37.5 | Very low | 40.7 | Very low | 145 Ų | 145 | 164.8 Ų | 164.8 | 89% | 0.89 | 83% | 0.833 | S | S | * | * | trans | -159.6 | 128.2 | 132.8 | 18.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 115 | S | 39.8 | Very low | 40.7 | Very low | 101 Ų | 101 | 164.2 Ų | 164.2 | 71% | 0.706 | 83% | 0.832 | S | S | * | * | trans | -57.6 | 135.5 | 172.6 | 42.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 116 | D | 37.8 | Very low | 40.4 | Very low | 163 Ų | 163 | 165.2 Ų | 165.2 | 87% | 0.872 | 84% | 0.837 | S | S | * | * | -158.1 | 124.9 | 123 | -96.9 | -38.3 | 0 | 0 | 0 | 112.1 | |||||
| 117 | K | 44.7 | Very low | 40.2 | Very low | 185 Ų | 185 | 161 Ų | 161 | 80% | 0.804 | 83% | 0.834 | S | S | * | * | trans | -98.4 | 154.2 | 165.8 | -102 | 176 | -179.4 | 166 | 0 | 106.6 | ||||
| 118 | P | 45 | Very low | 40.3 | Very low | 132 Ų | 132 | 157.9 Ų | 157.9 | 86% | 0.857 | 84% | 0.835 | S | S | * | * | -130.4 | 159 | 106.1 | 16.7 | 2.3 | 0 | 0 | 0 | 115.3 | |||||
| 119 | K | 40.1 | Very low | 40.3 | Very low | 197 Ų | 197 | 159 Ų | 159 | 86% | 0.857 | 84% | 0.84 | S | S | * | * | trans | -63.3 | 142 | -174.7 | -61.4 | 156.9 | 176.1 | 172.3 | 0 | 113.3 | ||||
| 120 | R | 42.6 | Very low | 40.5 | Very low | 251 Ų | 251 | 156.6 Ų | 156.6 | 95% | 0.947 | 84% | 0.838 | S | S | * | * | -160.9 | 123.9 | 126.4 | -127.6 | 170.8 | 163.5 | 142.1 | -4.5 | 111.5 | |||||
| 121 | K | 41.1 | Very low | 40.9 | Very low | 202 Ų | 202 | 158.7 Ų | 158.7 | 88% | 0.878 | 84% | 0.838 | S | S | * | * | trans | -119.1 | 156.4 | 170.3 | -93.7 | -157.2 | 177.6 | -173.9 | 0 | 109.9 | ||||
| 122 | K | 40.8 | Very low | 41.3 | Very low | 190 Ų | 190 | 167.3 Ų | 167.3 | 83% | 0.826 | 85% | 0.849 | S | S | * | * | trans | 81.1 | 138.9 | 165.1 | -88.9 | -179.6 | 176.6 | 175.5 | 0 | 115.6 | ||||
| 123 | K | 35.7 | Very low | 42 | Very low | 191 Ų | 191 | 166.9 Ų | 166.9 | 83% | 0.83 | 85% | 0.846 | S | S | * | * | cis | -166 | 130.9 | -0.2 | -158.4 | 179.4 | -177.9 | -169.9 | 0 | 105.2 | ||||
| 124 | G | 34.3 | Very low | 42.3 | Very low | 82 Ų | 82 | 165.6 Ų | 165.6 | 85% | 0.845 | 85% | 0.847 | S | S | * | * | trans | -149.5 | 89.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 125 | S | 42.1 | Very low | 43.1 | Very low | 113 Ų | 113 | 168.5 Ų | 168.5 | 79% | 0.79 | 85% | 0.847 | S | S | * | * | trans | -73.5 | 126.1 | 170.5 | 51.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 126 | K | 43.1 | Very low | 43.8 | Very low | 206 Ų | 206 | 172.5 Ų | 172.5 | 90% | 0.896 | 85% | 0.852 | S | S | * | * | trans | -163.1 | 124.6 | 137 | -111.1 | 166.2 | -175.7 | 175.2 | 0 | 110.7 | G128 | K126-G128 PolarHBondContact O-N 2.94Š| ||
| 127 | S | 44.3 | Very low | 44.9 | Very low | 123 Ų | 123 | 173.1 Ų | 173.1 | 86% | 0.86 | 85% | 0.847 | S | S | * | * | trans | -57 | 119.4 | 176.6 | 50 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 128 | G | 38.1 | Very low | 45.8 | Very low | 74 Ų | 74 | 172.2 Ų | 172.2 | 76% | 0.763 | 84% | 0.843 | S | S | * | * | trans | -117.6 | 96.2 | 163.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | K126 G130 | K126-G128 PolarHBondContact O-N 2.94Å; G128-G130 PolarHBondContact O-N 3.47Å | ||
| 129 | K | 47.7 | Very low | 46.9 | Very low | 221 Ų | 221 | 170.7 Ų | 170.7 | 96% | 0.961 | 83% | 0.827 | S | S | * | * | trans | -57 | 122.7 | 160.2 | -103.3 | 176.4 | 174 | 175.1 | 0 | 107.2 | ||||
| 130 | G | 44.3 | Very low | 48.7 | Very low | 68 Ų | 68 | 162.5 Ų | 162.5 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | 177.3 | 87.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | G128 | G128-G130 PolarHBondContact O-N 3.47Š| ||
| 131 | R | 46.3 | Very low | 50.4 | Low | 233 Ų | 233 | 151.2 Ų | 151.2 | 88% | 0.879 | 75% | 0.753 | S | S | * | * | trans | 68.8 | 104.5 | 154.9 | -61.1 | 177.4 | 173 | 165.8 | -2.1 | 115.3 | N133 | R131-N133 VanDerWaalsContact C-N 3.34Å; R131-N133 PolarHBondContact O-N 3.21Å | ||
| 132 | R | 46.2 | Very low | 51.9 | Low | 253 Ų | 253 | 146.6 Ų | 146.6 | 96% | 0.955 | 74% | 0.739 | S | S | * | * | trans | -48.3 | 101.6 | 158.2 | -71.5 | 175.5 | 176.2 | 162.2 | -2.2 | 107.7 | K134 | R132-K134 PolarHBondContact O-N 2.85Š| ||
| 133 | N | 46.9 | Very low | 53.5 | Low | 151 Ų | 151 | 140.6 Ų | 140.6 | 81% | 0.807 | 72% | 0.718 | S | S | * | * | trans | -56.2 | 107.5 | 168.3 | -76.8 | -31.2 | 0 | 0 | 0 | 106.4 | R131 K135 | R131-N133 VanDerWaalsContact C-N 3.34Å; R131-N133 PolarHBondContact O-N 3.21Å; N133-K135 PolarHBondContact O-N 2.91Å | ||
| 134 | K | 49.7 | Very low | 55.3 | Low | 197 Ų | 197 | 137.7 Ų | 137.7 | 86% | 0.857 | 71% | 0.711 | S | S | * | * | trans | -43.8 | 112.5 | 152.8 | -101.7 | 177.5 | 173.2 | 176.8 | 0 | 103.9 | R132 K136 | R132-K134 PolarHBondContact O-N 2.85Å; K134-K136 PolarHBondContact O-N 3.11Å | ||
| 135 | K | 53.7 | Low | 57.1 | Low | 206 Ų | 206 | 137.5 Ų | 137.5 | 90% | 0.896 | 69% | 0.687 | S | S | * | * | trans | -56.7 | 87.3 | 162.2 | -86 | 179.7 | 174.3 | 178.7 | 0 | 104.7 | N133 K137 | N133-K135 PolarHBondContact O-N 2.91Å; K135-K137 PolarHBondContact O-N 3.36Å | ||
| 136 | K | 55.9 | Low | 58.5 | Low | 185 Ų | 185 | 138.6 Ų | 138.6 | 80% | 0.804 | 68% | 0.68 | S | S | * | * | trans | -52.1 | 114.8 | 158.2 | -85.2 | -173 | 173.4 | -172.3 | 0 | 102.3 | K134 K138 | K134-K136 PolarHBondContact O-N 3.11Å; K136-K138 PolarHBondContact O-N 3.3Å | ||
| 137 | K | 59.5 | Low | 60.2 | Low | 176 Ų | 176 | 135.4 Ų | 135.4 | 77% | 0.765 | 67% | 0.673 | S | S | * | * | trans | -45.4 | 111.6 | 168.8 | -70.3 | 179 | 177 | -179.2 | 0 | 104.2 | K135 N139 | K135-K137 PolarHBondContact O-N 3.36Å; K137-N139 PolarHBondContact O-N 3.21Å | ||
| 138 | K | 64.7 | Low | 62.1 | Low | 166 Ų | 166 | 131.2 Ų | 131.2 | 72% | 0.722 | 64% | 0.639 | S | S | * | * | trans | -60.1 | 126.1 | 178.7 | -70.7 | -175.1 | 176.5 | -171.9 | 0 | 104.7 | K136 T143 | K136-K138 PolarHBondContact O-N 3.3Å; K138-T143 HydrophobicContact CB-CG2 3.73Å; K138-T143 HydrophobicContact CD-CG2 3.98Å | ||
| 139 | N | 68.8 | Low | 64.5 | Low | 99 Ų | 99 | 128.5 Ų | 128.5 | 53% | 0.529 | 61% | 0.608 | S | S | . | * | trans | -57.7 | 135 | 178.8 | -69.7 | -20.3 | 0 | 0 | 0 | 106.9 | K137 C141 D142 | K137-N139 PolarHBondContact O-N 3.21Å; N139-C141 PolarHBondContact O-N 3.41Å; N139-C141 VanDerWaalsContact O-N 3.11Å; N139-D142 PolarHBondContact O-N 3.47Å | ||
| 140 | P | 76.3 | Confident | 66.5 | Low | 26 Ų | 26 | 123.1 Ų | 123.1 | 17% | 0.169 | 59% | 0.589 | C | S | . | * | G | 310 helix | trans | -63.1 | -20 | -177.7 | 24.6 | -33.1 | 0 | 0 | 0 | 112.5 | D142 T143 N144 F145 Y156 | P140-D142 VanDerWaalsContact C-N 3.28Å; P140-D142 PolarHBondContact O-N 2.82Å; P140-T143 PolarHBondContact O-N 3.34Å; P140-N144 PolarHBondContact O-N 2.96Å; P140-F145 HydrophobicContact CB-CD2 4.4Å; P140-F145 PolarHBondContact O-N 2.89Å; P140-Y156 HydrophobicContact CB-CD2 4.46Å; P140-Y156 HydrophobicContact CG-CD1 3.39Å; P140-Y156 HydrophobicContact CG-CD2 3.33Å; P140-Y156 HydrophobicContact CG-CE1 3.69Å; P140-Y156 HydrophobicContact CG-CE2 3.64Å; P140-Y156 HydrophobicContact CG-CG 3.18Å |
| 141 | C | 78.3 | Confident | 68.5 | Low | 13 Ų | 13 | 123.3 Ų | 123.3 | 9% | 0.088 | 57% | 0.571 | C | S | . | * | G | 310 helix | trans | -55.3 | -38 | 166 | -76.3 | 0 | 0 | 0 | 0 | 113.4 | N139 F145 Q146 C154 | N139-C141 PolarHBondContact O-N 3.41Å; N139-C141 VanDerWaalsContact O-N 3.11Å; C141-F145 CarbonylContact O-C 3.54Å; C141-Q146 PolarHBondContact O-N 3.44Å; C141-C154 VanDerWaalsContact CA-SG 3.56Å; C141-C154 HydrophobicContact CB-CB 3.71Å; C141-C154 WeakPolarHBondContact CB-SG 3.47Å; C141-C154 WeakPolarHBondContact SG-CB 3.45Å; C141-C154 PolarHBondContact SG-O 2.88Å; C141-C154 VanDerWaalsContact SG-O 3.34Å; C141-C154 CovalentContact SG-SG 2.05Å; C141-C154 PolarHBondContact SG-SG 2.8Å |
| 142 | D | 73.5 | Confident | 70.5 | Confident | 106 Ų | 106 | 113.4 Ų | 113.4 | 57% | 0.567 | 54% | 0.542 | S | S | * | . | G | 310 helix | trans | -85.9 | -8.9 | -177.4 | -57.6 | -35.7 | 0 | 0 | 0 | 113.1 | N139 P140 | N139-D142 PolarHBondContact O-N 3.47Å; P140-D142 VanDerWaalsContact C-N 3.28Å; P140-D142 PolarHBondContact O-N 2.82Å |
| 143 | T | 74.1 | Confident | 72.5 | Confident | 63 Ų | 63 | 107.9 Ų | 107.9 | 39% | 0.387 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.9 | -58.1 | -174.4 | 63.9 | 0 | 0 | 0 | 0 | 113.4 | K138 P140 | K138-T143 HydrophobicContact CB-CG2 3.73Å; K138-T143 HydrophobicContact CD-CG2 3.98Å; P140-T143 PolarHBondContact O-N 3.34Å |
| 144 | N | 72.8 | Confident | 74.4 | Confident | 130 Ų | 130 | 102.7 Ų | 102.7 | 70% | 0.695 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.3 | -22.8 | -170.5 | -63.9 | -40.5 | 0 | 0 | 0 | 112.7 | P140 | P140-N144 PolarHBondContact O-N 2.96Š|
| 145 | F | 73.7 | Confident | 76.1 | Confident | 79 Ų | 79 | 95.4 Ų | 95.4 | 35% | 0.346 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -115.6 | 25.5 | -176.4 | -61 | -87.3 | 0 | 0 | 0 | 112 | P140 C141 N147 F148 V162 | P140-F145 HydrophobicContact CB-CD2 4.4Å; P140-F145 PolarHBondContact O-N 2.89Å; C141-F145 CarbonylContact O-C 3.54Å; F145-N147 PolarHBondContact O-N 3.49Å; F145-F148 HydrophobicContact CB-CB 3.95Å; F145-F148 HydrophobicContact CD1-CB 4.4Å; F145-F148 HydrophobicContact CD1-CD2 4.23Å; F145-F148 HydrophobicContact CD1-CG 4.32Å; F145-F148 VanDerWaalsContact O-CB 3.28Å; F145-F148 WeakPolarHBondContact O-CB 3.41Å; F145-F148 PolarHBondContact O-N 3.29Å; F145-V162 HydrophobicContact CB-CG1 4.16Å; F145-V162 HydrophobicContact CB-CG2 4.42Å; F145-V162 HydrophobicContact CD1-CB 4.23Å; F145-V162 HydrophobicContact CD1-CG1 4.35Å; F145-V162 HydrophobicContact CD1-CG2 4.18Å; F145-V162 HydrophobicContact CD2-CB 4.44Å; F145-V162 HydrophobicContact CD2-CG2 3.55Å; F145-V162 HydrophobicContact CE1-CB 4.43Å; F145-V162 HydrophobicContact CE1-CG2 4.31Å; F145-V162 HydrophobicContact CE2-CG2 3.69Å; F145-V162 HydrophobicContact CG-CB 4.22Å; F145-V162 HydrophobicContact CG-CG1 4.17Å; F145-V162 HydrophobicContact CG-CG2 3.79Å; F145-V162 HydrophobicContact CZ-CG2 4.07Å |
| 146 | Q | 71 | Confident | 77.5 | Confident | 136 Ų | 136 | 90.5 Ų | 90.5 | 64% | 0.636 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | 124.8 | 173.1 | -166 | 167.1 | 46.6 | 0 | 0 | 108.1 | C141 F148 | C141-Q146 PolarHBondContact O-N 3.44Å; Q146-F148 VanDerWaalsContact C-N 3.32Å; Q146-F148 PolarHBondContact O-N 2.86Å |
| 147 | N | 77.9 | Confident | 78.6 | Confident | 138 Ų | 138 | 85.1 Ų | 85.1 | 74% | 0.738 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.4 | 19.6 | -174.4 | -39.5 | -47.6 | 0 | 0 | 0 | 115.3 | F145 | F145-N147 PolarHBondContact O-N 3.49Š|
| 148 | F | 84.4 | Confident | 78.9 | Confident | 36 Ų | 36 | 83 Ų | 83 | 16% | 0.158 | 42% | 0.422 | C | S | . | . | S | Bend | trans | -66.1 | -42.7 | 170.5 | 178.5 | -98 | 0 | 0 | 0 | 111.3 | F145 Q146 V162 C164 R174 | F145-F148 HydrophobicContact CB-CB 3.95Å; F145-F148 HydrophobicContact CD1-CB 4.4Å; F145-F148 HydrophobicContact CD1-CD2 4.23Å; F145-F148 HydrophobicContact CD1-CG 4.32Å; F145-F148 VanDerWaalsContact O-CB 3.28Å; F145-F148 WeakPolarHBondContact O-CB 3.41Å; F145-F148 PolarHBondContact O-N 3.29Å; Q146-F148 VanDerWaalsContact C-N 3.32Å; Q146-F148 PolarHBondContact O-N 2.86Å; F148-V162 HydrophobicContact CD1-CG1 4.07Å; F148-V162 HydrophobicContact CE1-CG1 4.47Å; F148-C164 WeakPolarHBondContact CD1-SG 3.24Å; F148-C164 VanDerWaalsContact CE1-SG 3.53Å; F148-R174 HydrophobicContact CD1-CG 4.5Å; F148-R174 HydrophobicContact CD2-CG 4.39Å; F148-R174 VanDerWaalsContact CD2-NH1 3.3Å; F148-R174 HydrophobicContact CE1-CG 4.08Å; F148-R174 HydrophobicContact CE2-CG 4Å; F148-R174 VanDerWaalsContact CE2-NE 3.33Å; F148-R174 VanDerWaalsContact CE2-NH2 3.29Å; F148-R174 HydrophobicContact CZ-CG 3.8Å; F148-R174 WeakPolarHBondContact O-CB 3.09Å; F148-R174 WeakPolarHBondContact O-CG 3.41Å |
| 149 | C | 88.8 | Confident | 78.6 | Confident | 16 Ų | 16 | 82.5 Ų | 82.5 | 11% | 0.108 | 43% | 0.428 | C | S | . | . | trans | -90.5 | 126.6 | 171.8 | -46.8 | 0 | 0 | 0 | 0 | 109.5 | C164 | C149-C164 WeakPolarHBondContact CA-SG 3.31Å; C149-C164 HydrophobicContact CB-CB 3.76Å; C149-C164 WeakPolarHBondContact CB-SG 3.44Å; C149-C164 WeakPolarHBondContact SG-CA 3.4Å; C149-C164 WeakPolarHBondContact SG-CB 3.33Å; C149-C164 CovalentContact SG-SG 2.02Å; C149-C164 PolarHBondContact SG-SG 3.18Å | ||
| 150 | I | 89 | Confident | 78.3 | Confident | 109 Ų | 109 | 84.1 Ų | 84.1 | 56% | 0.559 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -85.5 | -55.2 | -178.8 | -54.6 | 171.7 | 0 | 0 | 0 | 109.8 | R174 | I150-R174 PolarHBondContact N-O 3Š|
| 151 | H | 87.8 | Confident | 78.1 | Confident | 71 Ų | 71 | 86.1 Ų | 86.1 | 33% | 0.329 | 45% | 0.454 | S | S | . | . | S | Bend | trans | -120.6 | 75.5 | 179.8 | -64.7 | -69.1 | 0 | 0 | 0 | 111.1 | C166 D167 Y170 C175 | H151-C166 WeakPolarHBondContact O-CA 3.45Å; H151-D167 PolarHBondContact O-N 3.36Å; H151-Y170 HydrophobicContact CB-CD1 3.65Å; H151-Y170 HydrophobicContact CB-CD2 3.71Å; H151-Y170 HydrophobicContact CB-CE1 3.98Å; H151-Y170 HydrophobicContact CB-CE2 4.04Å; H151-Y170 HydrophobicContact CB-CG 3.49Å; H151-Y170 VanDerWaalsContact CB-CG 3.49Å; H151-Y170 AromaticContact CD2-CD1 3.41Å; H151-Y170 VanDerWaalsContact CD2-CD1 3.41Å; H151-Y170 WeakPolarHBondContact CD2-CD1 3.35Å; H151-Y170 AromaticContact CD2-CE1 3.08Å; H151-Y170 WeakPolarHBondContact CD2-CE1 3.4Å; H151-Y170 AromaticContact CD2-CZ 3.64Å; H151-Y170 AromaticContact CE1-CZ 3.98Å; H151-Y170 AromaticContact CG-CD1 3.66Å; H151-Y170 AromaticContact CG-CE1 3.47Å; H151-Y170 VanDerWaalsContact CG-CE1 3.47Å; H151-Y170 AromaticContact CG-CE2 3.97Å; H151-Y170 AromaticContact CG-CG 3.96Å; H151-Y170 AromaticContact CG-CZ 3.62Å; H151-Y170 AromaticContact ND1-CZ 3.85Å; H151-Y170 AromaticContact NE2-CE1 3.56Å; H151-Y170 AromaticContact NE2-CZ 3.86Å; H151-C175 HydrophobicContact CB-CB 4.3Å; H151-C175 WeakPolarHBondContact O-CB 3.32Å |
| 152 | G | 87 | Confident | 78.3 | Confident | 25 Ų | 25 | 86.3 Ų | 86.3 | 26% | 0.258 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 161.3 | -173 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | K165 | G152-K165 CarbonylContact C-O 3.44Å; G152-K165 WeakPolarHBondContact CA-O 3.29Å |
| 153 | E | 88.5 | Confident | 78.8 | Confident | 137 Ų | 137 | 84.2 Ų | 84.2 | 64% | 0.64 | 45% | 0.446 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 133.6 | -176.8 | -64 | -174.4 | 167 | 0 | 0 | 112.1 | K165 | E153-K165 HydrophobicContact CB-CB 4.48Å; E153-K165 PolarHBondContact N-O 3.32Å; E153-K165 PolarHBondContact O-N 2.86Å |
| 154 | C | 87.4 | Confident | 79.5 | Confident | 43 Ų | 43 | 82.3 Ų | 82.3 | 29% | 0.291 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 122.8 | 173.1 | -178.7 | 0 | 0 | 0 | 0 | 110.7 | C141 V162 | C141-C154 VanDerWaalsContact CA-SG 3.56Å; C141-C154 HydrophobicContact CB-CB 3.71Å; C141-C154 WeakPolarHBondContact CB-SG 3.47Å; C141-C154 WeakPolarHBondContact SG-CB 3.45Å; C141-C154 PolarHBondContact SG-O 2.88Å; C141-C154 VanDerWaalsContact SG-O 3.34Å; C141-C154 CovalentContact SG-SG 2.05Å; C141-C154 PolarHBondContact SG-SG 2.8Å; C154-V162 WeakPolarHBondContact SG-CG1 3.41Å |
| 155 | V | 85.6 | Confident | 80.3 | Confident | 44 Ų | 44 | 82.6 Ų | 82.6 | 27% | 0.267 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.8 | 123.3 | 176 | -176.5 | 0 | 0 | 0 | 0 | 109.1 | I157 T163 K165 | V155-I157 HydrophobicContact CG1-CG1 4.35Å; V155-T163 PolarHBondContact N-O 3.02Å; V155-T163 PolarHBondContact O-N 2.86Å; V155-K165 HydrophobicContact CG2-CD 3.92Å; V155-K165 HydrophobicContact CG2-CG 3.94Å |
| 156 | Y | 81.9 | Confident | 81.1 | Confident | 102 Ų | 102 | 81 Ų | 81 | 40% | 0.4 | 43% | 0.428 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 119.9 | 170.9 | 178.1 | -115.7 | 0 | 0 | 0 | 110.1 | P140 E158 V162 | P140-Y156 HydrophobicContact CB-CD2 4.46Å; P140-Y156 HydrophobicContact CG-CD1 3.39Å; P140-Y156 HydrophobicContact CG-CD2 3.33Å; P140-Y156 HydrophobicContact CG-CE1 3.69Å; P140-Y156 HydrophobicContact CG-CE2 3.64Å; P140-Y156 HydrophobicContact CG-CG 3.18Å; Y156-E158 HydrophobicContact CD1-CG 4.32Å; Y156-E158 HydrophobicContact CE1-CG 3.87Å; Y156-V162 HydrophobicContact CD2-CG2 3.74Å; Y156-V162 HydrophobicContact CE2-CG2 4.49Å |
| 157 | I | 79.4 | Confident | 81.8 | Confident | 72 Ų | 72 | 78.5 Ų | 78.5 | 37% | 0.369 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 116.1 | 173.1 | -54.2 | 173.6 | 0 | 0 | 0 | 107 | V155 N159 L160 A161 T163 | V155-I157 HydrophobicContact CG1-CG1 4.35Å; I157-N159 PolarHBondContact O-N 3.35Å; I157-L160 HydrophobicContact CB-CB 4.31Å; I157-L160 HydrophobicContact CG2-CB 3.99Å; I157-L160 HydrophobicContact CG2-CD1 4.12Å; I157-L160 PolarHBondContact O-N 3.39Å; I157-L160 VanDerWaalsContact O-N 3.14Å; I157-A161 PolarHBondContact N-O 2.83Å; I157-T163 HydrophobicContact CD1-CG2 4.47Å |
| 158 | E | 65.8 | Low | 81.7 | Confident | 132 Ų | 132 | 76.5 Ų | 76.5 | 62% | 0.617 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.8 | 119 | 177.9 | -71.3 | -171.1 | 160.3 | 0 | 0 | 109 | Y156 | Y156-E158 HydrophobicContact CD1-CG 4.32Å; Y156-E158 HydrophobicContact CE1-CG 3.87Å |
| 159 | N | 59.7 | Low | 81.1 | Confident | 155 Ų | 155 | 78.1 Ų | 78.1 | 83% | 0.829 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.1 | 3.6 | 178.9 | -44.6 | -40.1 | 0 | 0 | 0 | 118.4 | I157 | I157-N159 PolarHBondContact O-N 3.35Š|
| 160 | L | 62.3 | Low | 80.8 | Confident | 134 Ų | 134 | 79.9 Ų | 79.9 | 70% | 0.702 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -132.5 | 10.4 | -173.5 | -74 | 161.7 | 0 | 0 | 0 | 116.2 | I157 | I157-L160 HydrophobicContact CB-CB 4.31Å; I157-L160 HydrophobicContact CG2-CB 3.99Å; I157-L160 HydrophobicContact CG2-CD1 4.12Å; I157-L160 PolarHBondContact O-N 3.39Å; I157-L160 VanDerWaalsContact O-N 3.14Å |
| 161 | A | 71.6 | Confident | 80.4 | Confident | 67 Ų | 67 | 80.2 Ų | 80.2 | 55% | 0.554 | 43% | 0.427 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 86.8 | 171.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | I157 | I157-A161 PolarHBondContact N-O 2.83Å |
| 162 | V | 82 | Confident | 80.2 | Confident | 17 Ų | 17 | 78.5 Ų | 78.5 | 10% | 0.103 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 128.5 | -179.3 | 171.7 | 0 | 0 | 0 | 0 | 108.9 | F145 F148 C154 Y156 | F145-V162 HydrophobicContact CB-CG1 4.16Å; F145-V162 HydrophobicContact CB-CG2 4.42Å; F145-V162 HydrophobicContact CD1-CB 4.23Å; F145-V162 HydrophobicContact CD1-CG1 4.35Å; F145-V162 HydrophobicContact CD1-CG2 4.18Å; F145-V162 HydrophobicContact CD2-CB 4.44Å; F145-V162 HydrophobicContact CD2-CG2 3.55Å; F145-V162 HydrophobicContact CE1-CB 4.43Å; F145-V162 HydrophobicContact CE1-CG2 4.31Å; F145-V162 HydrophobicContact CE2-CG2 3.69Å; F145-V162 HydrophobicContact CG-CB 4.22Å; F145-V162 HydrophobicContact CG-CG1 4.17Å; F145-V162 HydrophobicContact CG-CG2 3.79Å; F145-V162 HydrophobicContact CZ-CG2 4.07Å; F148-V162 HydrophobicContact CD1-CG1 4.07Å; F148-V162 HydrophobicContact CE1-CG1 4.47Å; C154-V162 WeakPolarHBondContact SG-CG1 3.41Å; Y156-V162 HydrophobicContact CD2-CG2 3.74Å; Y156-V162 HydrophobicContact CE2-CG2 4.49Å |
| 163 | T | 84.8 | Confident | 80 | Confident | 62 Ų | 62 | 85.8 Ų | 85.8 | 38% | 0.38 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 153.3 | 177.4 | 56.3 | 0 | 0 | 0 | 0 | 110.8 | V155 I157 | V155-T163 PolarHBondContact N-O 3.02Å; V155-T163 PolarHBondContact O-N 2.86Å; I157-T163 HydrophobicContact CD1-CG2 4.47Å |
| 164 | C | 88.8 | Confident | 80 | Confident | 24 Ų | 24 | 85.3 Ų | 85.3 | 16% | 0.162 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.1 | 131.7 | 175.1 | -63.7 | 0 | 0 | 0 | 0 | 110.5 | F148 C149 E173 C175 | F148-C164 WeakPolarHBondContact CD1-SG 3.24Å; F148-C164 VanDerWaalsContact CE1-SG 3.53Å; C149-C164 WeakPolarHBondContact CA-SG 3.31Å; C149-C164 HydrophobicContact CB-CB 3.76Å; C149-C164 WeakPolarHBondContact CB-SG 3.44Å; C149-C164 WeakPolarHBondContact SG-CA 3.4Å; C149-C164 WeakPolarHBondContact SG-CB 3.33Å; C149-C164 CovalentContact SG-SG 2.02Å; C149-C164 PolarHBondContact SG-SG 3.18Å; C164-E173 PolarHBondContact SG-O 2.9Å; C164-C175 WeakPolarHBondContact CB-SG 3.41Å |
| 165 | K | 89.3 | Confident | 80 | Confident | 135 Ų | 135 | 83.3 Ų | 83.3 | 59% | 0.587 | 43% | 0.434 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93 | 108 | 163.6 | -75.8 | -172.8 | 174.9 | -176.5 | 0 | 108.3 | G152 E153 V155 | G152-K165 CarbonylContact C-O 3.44Å; G152-K165 WeakPolarHBondContact CA-O 3.29Å; E153-K165 HydrophobicContact CB-CB 4.48Å; E153-K165 PolarHBondContact N-O 3.32Å; E153-K165 PolarHBondContact O-N 2.86Å; V155-K165 HydrophobicContact CG2-CD 3.92Å; V155-K165 HydrophobicContact CG2-CG 3.94Å |
| 166 | C | 90.3 | Very high | 79.9 | Confident | 46 Ų | 46 | 83.5 Ų | 83.5 | 31% | 0.311 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.4 | 148.3 | -176.5 | -53.2 | 0 | 0 | 0 | 0 | 112.8 | H151 Y170 G172 C175 | H151-C166 WeakPolarHBondContact O-CA 3.45Å; C166-Y170 WeakPolarHBondContact CB-O 3.44Å; C166-G172 PolarHBondContact SG-O 2.85Å; C166-C175 WeakPolarHBondContact CA-SG 3.28Å; C166-C175 HydrophobicContact CB-CB 3.62Å; C166-C175 WeakPolarHBondContact CB-SG 3.38Å; C166-C175 PolarHBondContact N-SG 3.24Å; C166-C175 WeakPolarHBondContact SG-CA 3.38Å; C166-C175 WeakPolarHBondContact SG-CB 3.37Å; C166-C175 CovalentContact SG-SG 2.03Å; C166-C175 PolarHBondContact SG-SG 2.82Å |
| 167 | D | 86.4 | Confident | 79.9 | Confident | 84 Ų | 84 | 85.1 Ų | 85.1 | 45% | 0.449 | 46% | 0.456 | S | S | . | . | P | Polyproline II helix | trans | -68.2 | 158.2 | 172.1 | -66.8 | -30.4 | 0 | 0 | 0 | 111 | H151 E169 Y170 | H151-D167 PolarHBondContact O-N 3.36Å; D167-E169 PolarHBondContact O-N 2.88Å; D167-E169 VanDerWaalsContact O-N 3.13Å; D167-Y170 HydrophobicContact CB-CD2 4.21Å; D167-Y170 PolarHBondContact O-N 3.37Å |
| 168 | S | 75 | Confident | 79.9 | Confident | 96 Ų | 96 | 88.3 Ų | 88.3 | 67% | 0.671 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | 123.4 | 177 | 56.8 | 0 | 0 | 0 | 0 | 109.6 | ||
| 169 | E | 71.9 | Confident | 80.1 | Confident | 70 Ų | 70 | 84.5 Ų | 84.5 | 33% | 0.327 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.7 | -1.8 | -176.6 | -55.5 | 159.4 | -154.3 | 0 | 0 | 115.7 | D167 K178 S179 K181 | D167-E169 PolarHBondContact O-N 2.88Å; D167-E169 VanDerWaalsContact O-N 3.13Å; E169-K178 CarbonylContact O-C 3.52Å; E169-K178 WeakPolarHBondContact O-CA 3.36Å; E169-S179 PolarHBondContact O-N 3.44Å; E169-K181 HydrophobicContact CG-CB 4.25Å; E169-K181 HydrophobicContact CG-CD 3.83Å; E169-K181 WeakPolarHBondContact OE1-CD 3.21Å; E169-K181 IonicContact OE1-NZ 2.67Å; E169-K181 PolarHBondContact OE1-NZ 3Å |
| 170 | Y | 83.3 | Confident | 80.2 | Confident | 52 Ų | 52 | 85.4 Ų | 85.4 | 20% | 0.204 | 46% | 0.457 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.9 | 141.8 | 174 | -67.3 | -87.9 | 0 | 0 | 0 | 111.9 | H151 C166 D167 E177 K178 | H151-Y170 HydrophobicContact CB-CD1 3.65Å; H151-Y170 HydrophobicContact CB-CD2 3.71Å; H151-Y170 HydrophobicContact CB-CE1 3.98Å; H151-Y170 HydrophobicContact CB-CE2 4.04Å; H151-Y170 HydrophobicContact CB-CG 3.49Å; H151-Y170 VanDerWaalsContact CB-CG 3.49Å; H151-Y170 AromaticContact CD2-CD1 3.41Å; H151-Y170 VanDerWaalsContact CD2-CD1 3.41Å; H151-Y170 WeakPolarHBondContact CD2-CD1 3.35Å; H151-Y170 AromaticContact CD2-CE1 3.08Å; H151-Y170 WeakPolarHBondContact CD2-CE1 3.4Å; H151-Y170 AromaticContact CD2-CZ 3.64Å; H151-Y170 AromaticContact CE1-CZ 3.98Å; H151-Y170 AromaticContact CG-CD1 3.66Å; H151-Y170 AromaticContact CG-CE1 3.47Å; H151-Y170 VanDerWaalsContact CG-CE1 3.47Å; H151-Y170 AromaticContact CG-CE2 3.97Å; H151-Y170 AromaticContact CG-CG 3.96Å; H151-Y170 AromaticContact CG-CZ 3.62Å; H151-Y170 AromaticContact ND1-CZ 3.85Å; H151-Y170 AromaticContact NE2-CE1 3.56Å; H151-Y170 AromaticContact NE2-CZ 3.86Å; C166-Y170 WeakPolarHBondContact CB-O 3.44Å; D167-Y170 HydrophobicContact CB-CD2 4.21Å; D167-Y170 PolarHBondContact O-N 3.37Å; Y170-E177 CarbonylContact C-O 3.38Å; Y170-E177 WeakPolarHBondContact CA-O 3.36Å; Y170-K178 HydrophobicContact CD1-CB 4.29Å; Y170-K178 HydrophobicContact CE1-CB 4.07Å; Y170-K178 HydrophobicContact CE1-CD 4.46Å; Y170-K178 HydrophobicContact CE1-CG 4.27Å |
| 171 | F | 80.1 | Confident | 80 | Confident | 116 Ų | 116 | 85 Ų | 85 | 51% | 0.509 | 45% | 0.449 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.3 | 170.8 | -175 | -64.5 | -96.2 | 0 | 0 | 0 | 110.9 | C175 E177 | F171-C175 WeakPolarHBondContact O-CA 3.38Å; F171-E177 PolarHBondContact N-O 3.23Å; F171-E177 WeakPolarHBondContact O-CB 3.23Å; F171-E177 PolarHBondContact O-N 3.45Å |
| 172 | G | 82.3 | Confident | 79.3 | Confident | 36 Ų | 36 | 87.7 Ų | 87.7 | 37% | 0.371 | 46% | 0.459 | S | S | . | . | S | Bend | trans | 94.8 | 168.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | C166 R174 C175 | C166-G172 PolarHBondContact SG-O 2.85Å; G172-R174 PolarHBondContact O-N 3.49Å; G172-R174 VanDerWaalsContact O-N 3.07Å; G172-C175 PolarHBondContact O-N 3.44Å; G172-C175 VanDerWaalsContact O-N 3.14Å |
| 173 | E | 84.1 | Confident | 77.9 | Confident | 177 Ų | 177 | 94.9 Ų | 94.9 | 83% | 0.827 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -24 | -172.6 | -61.2 | -176.1 | 166.2 | 0 | 0 | 113.9 | C164 | C164-E173 PolarHBondContact SG-O 2.9Š|
| 174 | R | 87.2 | Confident | 76.6 | Confident | 128 Ų | 128 | 95.9 Ų | 95.9 | 48% | 0.483 | 50% | 0.501 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.4 | 5.9 | 179.3 | -67.7 | 179.7 | 172 | -113.4 | 8.6 | 114 | F148 I150 G172 G176 | F148-R174 HydrophobicContact CD1-CG 4.5Å; F148-R174 HydrophobicContact CD2-CG 4.39Å; F148-R174 VanDerWaalsContact CD2-NH1 3.3Å; F148-R174 HydrophobicContact CE1-CG 4.08Å; F148-R174 HydrophobicContact CE2-CG 4Å; F148-R174 VanDerWaalsContact CE2-NE 3.33Å; F148-R174 VanDerWaalsContact CE2-NH2 3.29Å; F148-R174 HydrophobicContact CZ-CG 3.8Å; F148-R174 WeakPolarHBondContact O-CB 3.09Å; F148-R174 WeakPolarHBondContact O-CG 3.41Å; I150-R174 PolarHBondContact N-O 3Å; G172-R174 PolarHBondContact O-N 3.49Å; G172-R174 VanDerWaalsContact O-N 3.07Å; R174-G176 VanDerWaalsContact C-N 3.28Å; R174-G176 PolarHBondContact O-N 3.42Å |
| 175 | C | 88.4 | Confident | 75 | Confident | 0 Ų | 0 | 102.7 Ų | 102.7 | 0% | 0 | 53% | 0.528 | C | S | . | . | S | Bend | trans | 57.8 | 37.2 | -176.6 | -43.5 | 0 | 0 | 0 | 0 | 113.6 | H151 C164 C166 F171 G172 | H151-C175 HydrophobicContact CB-CB 4.3Å; H151-C175 WeakPolarHBondContact O-CB 3.32Å; C164-C175 WeakPolarHBondContact CB-SG 3.41Å; C166-C175 WeakPolarHBondContact CA-SG 3.28Å; C166-C175 HydrophobicContact CB-CB 3.62Å; C166-C175 WeakPolarHBondContact CB-SG 3.38Å; C166-C175 PolarHBondContact N-SG 3.24Å; C166-C175 WeakPolarHBondContact SG-CA 3.38Å; C166-C175 WeakPolarHBondContact SG-CB 3.37Å; C166-C175 CovalentContact SG-SG 2.03Å; C166-C175 PolarHBondContact SG-SG 2.82Å; F171-C175 WeakPolarHBondContact O-CA 3.38Å; G172-C175 PolarHBondContact O-N 3.44Å; G172-C175 VanDerWaalsContact O-N 3.14Å |
| 176 | G | 83.8 | Confident | 73.6 | Confident | 48 Ų | 48 | 101.5 Ų | 101.5 | 50% | 0.495 | 53% | 0.528 | S | S | . | . | trans | -93 | -17.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | R174 | R174-G176 VanDerWaalsContact C-N 3.28Å; R174-G176 PolarHBondContact O-N 3.42Å | ||
| 177 | E | 81.9 | Confident | 72.2 | Confident | 136 Ų | 136 | 104.8 Ų | 104.8 | 64% | 0.636 | 54% | 0.543 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 120.9 | -178.9 | -64.6 | 169.6 | -149.1 | 0 | 0 | 108.9 | Y170 F171 | Y170-E177 CarbonylContact C-O 3.38Å; Y170-E177 WeakPolarHBondContact CA-O 3.36Å; F171-E177 PolarHBondContact N-O 3.23Å; F171-E177 WeakPolarHBondContact O-CB 3.23Å; F171-E177 PolarHBondContact O-N 3.45Å |
| 178 | K | 78.8 | Confident | 71.5 | Confident | 139 Ų | 139 | 105.5 Ų | 105.5 | 60% | 0.604 | 55% | 0.547 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86 | 114 | 172.3 | -171.7 | 171.5 | -177.4 | 169.9 | 0 | 108.2 | E169 Y170 M180 | E169-K178 CarbonylContact O-C 3.52Å; E169-K178 WeakPolarHBondContact O-CA 3.36Å; Y170-K178 HydrophobicContact CD1-CB 4.29Å; Y170-K178 HydrophobicContact CE1-CB 4.07Å; Y170-K178 HydrophobicContact CE1-CD 4.46Å; Y170-K178 HydrophobicContact CE1-CG 4.27Å; K178-M180 PolarHBondContact O-N 3.28Å |
| 179 | S | 69.9 | Low | 71.7 | Confident | 52 Ų | 52 | 104.8 Ų | 104.8 | 36% | 0.364 | 54% | 0.535 | S | S | . | . | trans | -70.6 | 124.9 | 170.4 | 176.6 | 0 | 0 | 0 | 0 | 108.3 | E169 K181 | E169-S179 PolarHBondContact O-N 3.44Å; S179-K181 VanDerWaalsContact C-N 3.29Å; S179-K181 PolarHBondContact O-N 3.43Å | ||
| 180 | M | 62.2 | Low | 72.1 | Confident | 174 Ų | 174 | 106.8 Ų | 106.8 | 86% | 0.857 | 55% | 0.547 | S | S | * | . | trans | -63.5 | 97.6 | 164.5 | -107.9 | 177.7 | 68.8 | 0 | 0 | 107.5 | K178 T182 | K178-M180 PolarHBondContact O-N 3.28Å; M180-T182 PolarHBondContact O-N 2.98Å | ||
| 181 | K | 57.8 | Low | 72.2 | Confident | 125 Ų | 125 | 107.1 Ų | 107.1 | 54% | 0.543 | 56% | 0.557 | S | S | . | * | trans | -64.8 | 99.9 | 168 | -157 | -175 | -154 | 167 | 0 | 106.4 | E169 S179 Q183 | E169-K181 HydrophobicContact CG-CB 4.25Å; E169-K181 HydrophobicContact CG-CD 3.83Å; E169-K181 WeakPolarHBondContact OE1-CD 3.21Å; E169-K181 IonicContact OE1-NZ 2.67Å; E169-K181 PolarHBondContact OE1-NZ 3Å; S179-K181 VanDerWaalsContact C-N 3.29Å; S179-K181 PolarHBondContact O-N 3.43Å; K181-Q183 PolarHBondContact O-N 2.89Å | ||
| 182 | T | 58.3 | Low | 72.6 | Confident | 124 Ų | 124 | 106.7 Ų | 106.7 | 76% | 0.761 | 56% | 0.555 | S | S | * | * | trans | -53.7 | 113.3 | 157.8 | 24.7 | 0 | 0 | 0 | 0 | 105.2 | M180 S184 | M180-T182 PolarHBondContact O-N 2.98Å; T182-S184 PolarHBondContact O-N 2.92Å | ||
| 183 | Q | 52.1 | Low | 73 | Confident | 169 Ų | 169 | 110.6 Ų | 110.6 | 79% | 0.79 | 57% | 0.566 | S | S | * | * | trans | -53.1 | 107.2 | 176.4 | -79.8 | -177.2 | -3.6 | 0 | 0 | 107.3 | K181 K185 | K181-Q183 PolarHBondContact O-N 2.89Å; Q183-K185 PolarHBondContact O-N 3.27Å | ||
| 184 | S | 57.4 | Low | 73.3 | Confident | 82 Ų | 82 | 104.5 Ų | 104.5 | 57% | 0.573 | 55% | 0.546 | S | S | * | . | trans | -64.8 | 88.9 | 159.2 | 55.3 | 0 | 0 | 0 | 0 | 105 | T182 D186 | T182-S184 PolarHBondContact O-N 2.92Å; S184-D186 PolarHBondContact O-N 2.92Å | ||
| 185 | K | 54 | Low | 73.6 | Confident | 167 Ų | 167 | 103.2 Ų | 103.2 | 73% | 0.726 | 55% | 0.549 | S | S | * | . | trans | -48 | 118.4 | 167.5 | -96.8 | 174.2 | 169.8 | 161.4 | 0 | 106.1 | Q183 D187 | Q183-K185 PolarHBondContact O-N 3.27Å; K185-D187 PolarHBondContact O-N 3.1Å | ||
| 186 | D | 59.7 | Low | 73.9 | Confident | 110 Ų | 110 | 105.9 Ų | 105.9 | 59% | 0.588 | 57% | 0.57 | S | S | * | * | trans | -30.7 | 104.9 | -164.9 | -61.4 | -75.7 | 0 | 0 | 0 | 113.2 | S184 N188 D189 L190 | S184-D186 PolarHBondContact O-N 2.92Å; D186-N188 PolarHBondContact O-N 3.11Å; D186-D189 HydrophobicContact CB-CB 4.49Å; D186-D189 PolarHBondContact O-N 2.63Å; D186-L190 PolarHBondContact O-N 2.92Å | ||
| 187 | D | 62.2 | Low | 74.4 | Confident | 115 Ų | 115 | 106.4 Ų | 106.4 | 62% | 0.615 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -52 | -24.2 | 174.3 | -67 | -44.9 | 0 | 0 | 0 | 111.4 | K185 S191 | K185-D187 PolarHBondContact O-N 3.1Å; D187-S191 WeakPolarHBondContact O-CB 3.28Å; D187-S191 PolarHBondContact O-N 2.81Å |
| 188 | N | 71.4 | Confident | 75.1 | Confident | 100 Ų | 100 | 104.8 Ų | 104.8 | 54% | 0.535 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.8 | -42.1 | 174.2 | -169.1 | 18.7 | 0 | 0 | 0 | 113.1 | D186 K192 | D186-N188 PolarHBondContact O-N 3.11Å; N188-K192 VanDerWaalsContact O-CG 3.25Å; N188-K192 WeakPolarHBondContact O-CG 3.46Å; N188-K192 PolarHBondContact O-N 3.45Å; N188-K192 WeakPolarHBondContact OD1-CE 3.3Å |
| 189 | D | 79.8 | Confident | 75.8 | Confident | 80 Ų | 80 | 102.7 Ų | 102.7 | 43% | 0.428 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -78 | -36.9 | -179.3 | -74.2 | -14.3 | 0 | 0 | 0 | 111.4 | D186 S191 K192 I193 | D186-D189 HydrophobicContact CB-CB 4.49Å; D186-D189 PolarHBondContact O-N 2.63Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.86Å; D189-K192 PolarHBondContact O-N 3.3Å; D189-K192 IonicContact OD1-NZ 2.98Å; D189-K192 PolarHBondContact OD1-NZ 3Å; D189-I193 WeakPolarHBondContact O-CD1 3.33Å; D189-I193 VanDerWaalsContact O-CG1 3.26Å; D189-I193 WeakPolarHBondContact O-CG1 3.48Å; D189-I193 PolarHBondContact O-N 3.24Å |
| 190 | L | 79.6 | Confident | 77.1 | Confident | 112 Ų | 112 | 104.6 Ų | 104.6 | 59% | 0.586 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -60.6 | -43 | 168.8 | -108.9 | 154.8 | 0 | 0 | 0 | 111.7 | D186 I193 A194 | D186-L190 PolarHBondContact O-N 2.92Å; L190-I193 PolarHBondContact O-N 3.46Å; L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 2.66Å |
| 191 | S | 85.6 | Confident | 78.8 | Confident | 59 Ų | 59 | 103.2 Ų | 103.2 | 41% | 0.413 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.1 | -42.2 | 175.8 | -176.4 | 0 | 0 | 0 | 0 | 112.1 | D187 D189 I193 A194 L195 | D187-S191 WeakPolarHBondContact O-CB 3.28Å; D187-S191 PolarHBondContact O-N 2.81Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.86Å; S191-I193 PolarHBondContact O-N 2.9Å; S191-A194 PolarHBondContact O-N 3.21Å; S191-L195 WeakPolarHBondContact O-CB 3.49Å; S191-L195 VanDerWaalsContact O-CG 3.26Å; S191-L195 WeakPolarHBondContact O-CG 3.42Å; S191-L195 PolarHBondContact O-N 2.92Å |
| 192 | K | 88.8 | Confident | 80.7 | Confident | 107 Ų | 107 | 101.1 Ų | 101.1 | 47% | 0.465 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.1 | -43.2 | 174.9 | -73.5 | 170.2 | -158.6 | 155.5 | 0 | 112.3 | N188 D189 L195 A196 | N188-K192 VanDerWaalsContact O-CG 3.25Å; N188-K192 WeakPolarHBondContact O-CG 3.46Å; N188-K192 PolarHBondContact O-N 3.45Å; N188-K192 WeakPolarHBondContact OD1-CE 3.3Å; D189-K192 PolarHBondContact O-N 3.3Å; D189-K192 IonicContact OD1-NZ 2.98Å; D189-K192 PolarHBondContact OD1-NZ 3Å; K192-L195 PolarHBondContact O-N 3.31Å; K192-A196 WeakPolarHBondContact O-CB 3.48Å; K192-A196 PolarHBondContact O-N 3.35Å |
| 193 | I | 90 | Very high | 82.5 | Confident | 118 Ų | 118 | 97.8 Ų | 97.8 | 61% | 0.605 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.2 | -43.9 | 177.4 | -66.6 | 164.1 | 0 | 0 | 0 | 110 | D189 L190 S191 L195 A196 A197 | D189-I193 WeakPolarHBondContact O-CD1 3.33Å; D189-I193 VanDerWaalsContact O-CG1 3.26Å; D189-I193 WeakPolarHBondContact O-CG1 3.48Å; D189-I193 PolarHBondContact O-N 3.24Å; L190-I193 PolarHBondContact O-N 3.46Å; S191-I193 PolarHBondContact O-N 2.9Å; I193-L195 PolarHBondContact O-N 3.04Å; I193-A196 PolarHBondContact O-N 3.08Å; I193-A197 WeakPolarHBondContact O-CB 3.34Å; I193-A197 PolarHBondContact O-N 3.25Å |
| 194 | A | 91 | Very high | 84.6 | Confident | 49 Ų | 49 | 93.1 Ų | 93.1 | 41% | 0.405 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | L190 S191 A196 A197 I198 | L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 2.66Å; S191-A194 PolarHBondContact O-N 3.21Å; A194-A196 PolarHBondContact O-N 2.94Å; A194-A197 PolarHBondContact O-N 3.03Å; A194-I198 VanDerWaalsContact O-CG1 3.28Å; A194-I198 WeakPolarHBondContact O-CG1 3.43Å; A194-I198 PolarHBondContact O-N 3.37Å |
| 195 | L | 92.1 | Very high | 86.5 | Confident | 102 Ų | 102 | 92.7 Ų | 92.7 | 53% | 0.534 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.3 | -38.9 | 176.2 | -72 | 172.3 | 0 | 0 | 0 | 112.5 | S191 K192 I193 T199 | S191-L195 WeakPolarHBondContact O-CB 3.49Å; S191-L195 VanDerWaalsContact O-CG 3.26Å; S191-L195 WeakPolarHBondContact O-CG 3.42Å; S191-L195 PolarHBondContact O-N 2.92Å; K192-L195 PolarHBondContact O-N 3.31Å; I193-L195 PolarHBondContact O-N 3.04Å; L195-T199 WeakPolarHBondContact O-CB 3.47Å; L195-T199 PolarHBondContact O-N 3.17Å; L195-T199 PolarHBondContact O-OG1 3.06Å |
| 196 | A | 94.8 | Very high | 88.5 | Confident | 55 Ų | 55 | 87.5 Ų | 87.5 | 46% | 0.455 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.1 | -46 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111 | K192 I193 A194 I198 T199 V200 | K192-A196 WeakPolarHBondContact O-CB 3.48Å; K192-A196 PolarHBondContact O-N 3.35Å; I193-A196 PolarHBondContact O-N 3.08Å; A194-A196 PolarHBondContact O-N 2.94Å; A196-I198 PolarHBondContact O-N 3.39Å; A196-T199 WeakPolarHBondContact O-CB 3.28Å; A196-T199 PolarHBondContact O-N 3.44Å; A196-V200 WeakPolarHBondContact O-CG2 3.25Å; A196-V200 PolarHBondContact O-N 3.02Å |
| 197 | A | 95.6 | Very high | 90.3 | Very high | 59 Ų | 59 | 88.3 Ų | 88.3 | 49% | 0.488 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | I193 A194 T199 V200 F201 | I193-A197 WeakPolarHBondContact O-CB 3.34Å; I193-A197 PolarHBondContact O-N 3.25Å; A194-A197 PolarHBondContact O-N 3.03Å; A197-T199 VanDerWaalsContact C-N 3.3Å; A197-T199 PolarHBondContact O-N 2.75Å; A197-V200 PolarHBondContact O-N 3.32Å; A197-F201 PolarHBondContact O-N 3.4Å |
| 198 | I | 95.6 | Very high | 91.9 | Very high | 102 Ų | 102 | 87.7 Ų | 87.7 | 52% | 0.523 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.5 | -42.4 | 176.5 | -66.9 | 164 | 0 | 0 | 0 | 110.6 | A194 A196 V200 F201 V202 | A194-I198 VanDerWaalsContact O-CG1 3.28Å; A194-I198 WeakPolarHBondContact O-CG1 3.43Å; A194-I198 PolarHBondContact O-N 3.37Å; A196-I198 PolarHBondContact O-N 3.39Å; I198-V200 PolarHBondContact O-N 3.48Å; I198-F201 PolarHBondContact O-N 3.44Å; I198-V202 HydrophobicContact CG2-CG2 4.28Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.41Å; I198-V202 PolarHBondContact O-N 2.95Å |
| 199 | T | 95 | Very high | 93 | Very high | 96 Ų | 96 | 85.3 Ų | 85.3 | 59% | 0.589 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.8 | -44.1 | -179.9 | -56.4 | 0 | 0 | 0 | 0 | 111.5 | L195 A196 A197 S203 | L195-T199 WeakPolarHBondContact O-CB 3.47Å; L195-T199 PolarHBondContact O-N 3.17Å; L195-T199 PolarHBondContact O-OG1 3.06Å; A196-T199 WeakPolarHBondContact O-CB 3.28Å; A196-T199 PolarHBondContact O-N 3.44Å; A197-T199 VanDerWaalsContact C-N 3.3Å; A197-T199 PolarHBondContact O-N 2.75Å; T199-S203 WeakPolarHBondContact O-CB 3.49Å; T199-S203 PolarHBondContact O-N 2.95Å; T199-S203 VanDerWaalsContact O-N 3.08Å |
| 200 | V | 97.2 | Very high | 93.7 | Very high | 91 Ų | 91 | 85.2 Ų | 85.2 | 55% | 0.552 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.4 | -47.8 | 176.1 | 174.7 | 0 | 0 | 0 | 0 | 110.4 | A196 A197 I198 V202 S203 V204 | A196-V200 WeakPolarHBondContact O-CG2 3.25Å; A196-V200 PolarHBondContact O-N 3.02Å; A197-V200 PolarHBondContact O-N 3.32Å; I198-V200 PolarHBondContact O-N 3.48Å; V200-V202 PolarHBondContact O-N 3.43Å; V200-S203 PolarHBondContact O-N 3.32Å; V200-S203 PolarHBondContact O-OG 2.97Å; V200-V204 HydrophobicContact CG1-CG2 4.5Å; V200-V204 WeakPolarHBondContact O-CG2 3.36Å; V200-V204 PolarHBondContact O-N 3.25Å |
| 201 | F | 97.2 | Very high | 94.5 | Very high | 146 Ų | 146 | 81.4 Ų | 81.4 | 64% | 0.64 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60.1 | -47.5 | -178.9 | -170.2 | -99.5 | 0 | 0 | 0 | 112.4 | A197 I198 S203 V204 V205 | A197-F201 PolarHBondContact O-N 3.4Å; I198-F201 PolarHBondContact O-N 3.44Å; F201-S203 VanDerWaalsContact C-N 3.28Å; F201-S203 PolarHBondContact O-N 2.97Å; F201-V204 PolarHBondContact O-N 2.89Å; F201-V205 HydrophobicContact CD1-CG2 4.11Å; F201-V205 HydrophobicContact CE1-CG2 3.79Å; F201-V205 HydrophobicContact CZ-CG2 4.08Å; F201-V205 WeakPolarHBondContact O-CG2 3.05Å; F201-V205 PolarHBondContact O-N 3.49Å |
| 202 | V | 96.6 | Very high | 94.9 | Very high | 81 Ų | 81 | 83.2 Ų | 83.2 | 49% | 0.491 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.5 | -40.3 | 177.7 | 172.8 | 0 | 0 | 0 | 0 | 111 | I198 V200 V205 T206 | I198-V202 HydrophobicContact CG2-CG2 4.28Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.41Å; I198-V202 PolarHBondContact O-N 2.95Å; V200-V202 PolarHBondContact O-N 3.43Å; V202-V205 PolarHBondContact O-N 3.46Å; V202-T206 PolarHBondContact O-N 2.91Å; V202-T206 PolarHBondContact O-OG1 3.47Å |
| 203 | S | 96.9 | Very high | 95.2 | Very high | 53 Ų | 53 | 81.2 Ų | 81.2 | 37% | 0.371 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.1 | -43 | 178.3 | 76.4 | 0 | 0 | 0 | 0 | 112.5 | T199 V200 F201 T206 L207 | T199-S203 WeakPolarHBondContact O-CB 3.49Å; T199-S203 PolarHBondContact O-N 2.95Å; T199-S203 VanDerWaalsContact O-N 3.08Å; V200-S203 PolarHBondContact O-N 3.32Å; V200-S203 PolarHBondContact O-OG 2.97Å; F201-S203 VanDerWaalsContact C-N 3.28Å; F201-S203 PolarHBondContact O-N 2.97Å; S203-T206 WeakPolarHBondContact CA-OG1 3.39Å; S203-T206 PolarHBondContact O-N 3.33Å; S203-T206 PolarHBondContact O-OG1 3.2Å; S203-T206 VanDerWaalsContact O-OG1 3.11Å; S203-L207 WeakPolarHBondContact O-CB 3.26Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.43Å; S203-L207 PolarHBondContact O-N 2.88Å |
| 204 | V | 97 | Very high | 95.4 | Very high | 71 Ų | 71 | 78.9 Ų | 78.9 | 43% | 0.43 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.3 | -46 | 178.4 | 174.4 | 0 | 0 | 0 | 0 | 110.4 | V200 F201 T206 L207 I208 | V200-V204 HydrophobicContact CG1-CG2 4.5Å; V200-V204 WeakPolarHBondContact O-CG2 3.36Å; V200-V204 PolarHBondContact O-N 3.25Å; F201-V204 PolarHBondContact O-N 2.89Å; V204-T206 VanDerWaalsContact C-N 3.31Å; V204-T206 PolarHBondContact O-N 3.37Å; V204-L207 PolarHBondContact O-N 3.34Å; V204-I208 HydrophobicContact CG1-CD1 3.83Å; V204-I208 HydrophobicContact CG1-CG1 4.48Å; V204-I208 VanDerWaalsContact O-CG1 3.29Å; V204-I208 WeakPolarHBondContact O-CG1 3.49Å; V204-I208 PolarHBondContact O-N 2.89Å |
| 205 | V | 96.6 | Very high | 95.4 | Very high | 73 Ų | 73 | 80 Ų | 80 | 44% | 0.442 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61 | -41.2 | 178.1 | 174.5 | 0 | 0 | 0 | 0 | 111.2 | F201 V202 I208 A209 | F201-V205 HydrophobicContact CD1-CG2 4.11Å; F201-V205 HydrophobicContact CE1-CG2 3.79Å; F201-V205 HydrophobicContact CZ-CG2 4.08Å; F201-V205 WeakPolarHBondContact O-CG2 3.05Å; F201-V205 PolarHBondContact O-N 3.49Å; V202-V205 PolarHBondContact O-N 3.46Å; V205-I208 PolarHBondContact O-N 2.79Å; V205-A209 WeakPolarHBondContact O-CB 3.26Å; V205-A209 PolarHBondContact O-N 3.5Å |
| 206 | T | 96.3 | Very high | 95.5 | Very high | 59 Ų | 59 | 79 Ų | 79 | 36% | 0.362 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -67.6 | -40.8 | 176.4 | 24.8 | 0 | 0 | 0 | 0 | 112.5 | V202 S203 V204 I208 A209 V210 | V202-T206 PolarHBondContact O-N 2.91Å; V202-T206 PolarHBondContact O-OG1 3.47Å; S203-T206 WeakPolarHBondContact CA-OG1 3.39Å; S203-T206 PolarHBondContact O-N 3.33Å; S203-T206 PolarHBondContact O-OG1 3.2Å; S203-T206 VanDerWaalsContact O-OG1 3.11Å; V204-T206 VanDerWaalsContact C-N 3.31Å; V204-T206 PolarHBondContact O-N 3.37Å; T206-I208 VanDerWaalsContact C-N 3.33Å; T206-I208 PolarHBondContact O-N 3.33Å; T206-A209 PolarHBondContact O-N 3Å; T206-V210 VanDerWaalsContact O-CG2 3.31Å; T206-V210 WeakPolarHBondContact O-CG2 3.5Å; T206-V210 PolarHBondContact O-N 3.34Å |
| 207 | L | 96.3 | Very high | 95.3 | Very high | 127 Ų | 127 | 81.5 Ų | 81.5 | 67% | 0.665 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -61.9 | -40.6 | 175.5 | -72.6 | 174.3 | 0 | 0 | 0 | 112 | S203 V204 G211 | S203-L207 WeakPolarHBondContact O-CB 3.26Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.43Å; S203-L207 PolarHBondContact O-N 2.88Å; V204-L207 PolarHBondContact O-N 3.34Å; L207-G211 PolarHBondContact O-N 3.01Å |
| 208 | I | 96.4 | Very high | 95.1 | Very high | 101 Ų | 101 | 84 Ų | 84 | 52% | 0.518 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.1 | -47.9 | 175.5 | -67 | 165.9 | 0 | 0 | 0 | 110.3 | V204 V205 T206 V210 G211 I212 | V204-I208 HydrophobicContact CG1-CD1 3.83Å; V204-I208 HydrophobicContact CG1-CG1 4.48Å; V204-I208 VanDerWaalsContact O-CG1 3.29Å; V204-I208 WeakPolarHBondContact O-CG1 3.49Å; V204-I208 PolarHBondContact O-N 2.89Å; V205-I208 PolarHBondContact O-N 2.79Å; T206-I208 VanDerWaalsContact C-N 3.33Å; T206-I208 PolarHBondContact O-N 3.33Å; I208-V210 PolarHBondContact O-N 3.5Å; I208-G211 PolarHBondContact O-N 3.32Å; I208-I212 HydrophobicContact CG2-CD1 3.91Å; I208-I212 WeakPolarHBondContact O-CG1 3.15Å; I208-I212 PolarHBondContact O-N 3.04Å |
| 209 | A | 94.8 | Very high | 94.8 | Very high | 50 Ų | 50 | 88.4 Ų | 88.4 | 41% | 0.413 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -45.9 | 179 | 0 | 0 | 0 | 0 | 0 | 112.1 | V205 T206 I212 V213 | V205-A209 WeakPolarHBondContact O-CB 3.26Å; V205-A209 PolarHBondContact O-N 3.5Å; T206-A209 PolarHBondContact O-N 3Å; A209-I212 PolarHBondContact O-N 2.85Å; A209-V213 WeakPolarHBondContact O-CG2 3.06Å; A209-V213 PolarHBondContact O-N 2.83Å |
| 210 | V | 95.1 | Very high | 94.5 | Very high | 79 Ų | 79 | 91.6 Ų | 91.6 | 48% | 0.479 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 175.8 | 173.5 | 0 | 0 | 0 | 0 | 110.8 | T206 I208 I212 V213 V214 | T206-V210 VanDerWaalsContact O-CG2 3.31Å; T206-V210 WeakPolarHBondContact O-CG2 3.5Å; T206-V210 PolarHBondContact O-N 3.34Å; I208-V210 PolarHBondContact O-N 3.5Å; V210-I212 VanDerWaalsContact C-N 3.33Å; V210-I212 PolarHBondContact O-N 2.92Å; V210-V213 PolarHBondContact O-N 2.81Å; V210-V214 HydrophobicContact CG1-CG2 4.15Å; V210-V214 WeakPolarHBondContact O-CB 3.33Å; V210-V214 VanDerWaalsContact O-CG2 3.29Å; V210-V214 WeakPolarHBondContact O-CG2 3.42Å; V210-V214 PolarHBondContact O-N 2.84Å |
| 211 | G | 95.3 | Very high | 94.1 | Very high | 32 Ų | 32 | 95.2 Ų | 95.2 | 33% | 0.33 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.2 | -43.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L207 I208 V214 T215 | L207-G211 PolarHBondContact O-N 3.01Å; I208-G211 PolarHBondContact O-N 3.32Å; G211-V214 PolarHBondContact O-N 2.82Å; G211-T215 WeakPolarHBondContact O-CB 3Å; G211-T215 WeakPolarHBondContact O-CG2 3.44Å; G211-T215 PolarHBondContact O-N 3.01Å; G211-T215 PolarHBondContact O-OG1 2.93Å |
| 212 | I | 95.1 | Very high | 93.5 | Very high | 97 Ų | 97 | 96.2 Ų | 96.2 | 50% | 0.497 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.6 | -47.3 | 175.5 | -66.3 | 165.7 | 0 | 0 | 0 | 110.5 | I208 A209 V210 V214 T215 V216 | I208-I212 HydrophobicContact CG2-CD1 3.91Å; I208-I212 WeakPolarHBondContact O-CG1 3.15Å; I208-I212 PolarHBondContact O-N 3.04Å; A209-I212 PolarHBondContact O-N 2.85Å; V210-I212 VanDerWaalsContact C-N 3.33Å; V210-I212 PolarHBondContact O-N 2.92Å; I212-V214 PolarHBondContact O-N 2.92Å; I212-T215 WeakPolarHBondContact CA-OG1 3.35Å; I212-T215 PolarHBondContact O-N 3.17Å; I212-T215 PolarHBondContact O-OG1 3.03Å; I212-V216 HydrophobicContact CG2-CG2 4.29Å; I212-V216 WeakPolarHBondContact O-CB 3.19Å; I212-V216 VanDerWaalsContact O-CG2 3.23Å; I212-V216 WeakPolarHBondContact O-CG2 3.12Å; I212-V216 PolarHBondContact O-N 3.34Å |
| 213 | V | 93.5 | Very high | 92.9 | Very high | 65 Ų | 65 | 98.2 Ų | 98.2 | 39% | 0.394 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.1 | -46.2 | 179.1 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | A209 V210 V216 Q217 | A209-V213 WeakPolarHBondContact O-CG2 3.06Å; A209-V213 PolarHBondContact O-N 2.83Å; V210-V213 PolarHBondContact O-N 2.81Å; V213-V216 PolarHBondContact O-N 2.9Å; V213-Q217 HydrophobicContact CG1-CG 4.46Å; V213-Q217 WeakPolarHBondContact O-CB 3.33Å; V213-Q217 WeakPolarHBondContact O-CG 2.98Å; V213-Q217 PolarHBondContact O-N 2.92Å |
| 214 | V | 94.5 | Very high | 92.3 | Very high | 69 Ų | 69 | 103.6 Ų | 103.6 | 42% | 0.418 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -46.7 | 178.9 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | V210 G211 I212 V216 Q217 L218 | V210-V214 HydrophobicContact CG1-CG2 4.15Å; V210-V214 WeakPolarHBondContact O-CB 3.33Å; V210-V214 VanDerWaalsContact O-CG2 3.29Å; V210-V214 WeakPolarHBondContact O-CG2 3.42Å; V210-V214 PolarHBondContact O-N 2.84Å; G211-V214 PolarHBondContact O-N 2.82Å; I212-V214 PolarHBondContact O-N 2.92Å; V214-V216 PolarHBondContact O-N 2.86Å; V214-Q217 PolarHBondContact O-N 2.66Å; V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.2Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 VanDerWaalsContact O-CG 3.27Å; V214-L218 WeakPolarHBondContact O-CG 2.98Å; V214-L218 PolarHBondContact O-N 2.84Å |
| 215 | T | 92.6 | Very high | 91.6 | Very high | 71 Ų | 71 | 106.7 Ų | 106.7 | 44% | 0.436 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 179.1 | 51.8 | 0 | 0 | 0 | 0 | 112.2 | G211 I212 L218 R219 | G211-T215 WeakPolarHBondContact O-CB 3Å; G211-T215 WeakPolarHBondContact O-CG2 3.44Å; G211-T215 PolarHBondContact O-N 3.01Å; G211-T215 PolarHBondContact O-OG1 2.93Å; I212-T215 WeakPolarHBondContact CA-OG1 3.35Å; I212-T215 PolarHBondContact O-N 3.17Å; I212-T215 PolarHBondContact O-OG1 3.03Å; T215-L218 PolarHBondContact O-N 3.45Å; T215-R219 WeakPolarHBondContact O-CB 3.38Å; T215-R219 VanDerWaalsContact O-CG 3.28Å; T215-R219 WeakPolarHBondContact O-CG 3.12Å; T215-R219 PolarHBondContact O-N 3.07Å |
| 216 | V | 92.4 | Very high | 90.8 | Very high | 83 Ų | 83 | 110 Ų | 110 | 50% | 0.503 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65 | -43.2 | 174 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | I212 V213 V214 R219 K220 | I212-V216 HydrophobicContact CG2-CG2 4.29Å; I212-V216 WeakPolarHBondContact O-CB 3.19Å; I212-V216 VanDerWaalsContact O-CG2 3.23Å; I212-V216 WeakPolarHBondContact O-CG2 3.12Å; I212-V216 PolarHBondContact O-N 3.34Å; V213-V216 PolarHBondContact O-N 2.9Å; V214-V216 PolarHBondContact O-N 2.86Å; V216-R219 PolarHBondContact O-N 3.45Å; V216-K220 WeakPolarHBondContact O-CB 3.46Å; V216-K220 PolarHBondContact O-N 3Å |
| 217 | Q | 90.9 | Very high | 90 | Very high | 107 Ų | 107 | 112.5 Ų | 112.5 | 50% | 0.5 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.3 | -40.9 | 177 | -75.2 | -151.5 | 68.9 | 0 | 0 | 112.5 | V213 V214 K220 R221 | V213-Q217 HydrophobicContact CG1-CG 4.46Å; V213-Q217 WeakPolarHBondContact O-CB 3.33Å; V213-Q217 WeakPolarHBondContact O-CG 2.98Å; V213-Q217 PolarHBondContact O-N 2.92Å; V214-Q217 PolarHBondContact O-N 2.66Å; Q217-K220 PolarHBondContact O-N 3.34Å; Q217-R221 WeakPolarHBondContact O-CG 3.01Å; Q217-R221 PolarHBondContact O-N 3.44Å |
| 218 | L | 91.6 | Very high | 89.4 | Confident | 110 Ų | 110 | 108 Ų | 108 | 58% | 0.576 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.3 | -45.1 | 175.4 | -71.9 | 175.2 | 0 | 0 | 0 | 111.1 | V214 T215 K220 R221 Y222 | V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.2Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 VanDerWaalsContact O-CG 3.27Å; V214-L218 WeakPolarHBondContact O-CG 2.98Å; V214-L218 PolarHBondContact O-N 2.84Å; T215-L218 PolarHBondContact O-N 3.45Å; L218-K220 VanDerWaalsContact C-N 3.33Å; L218-K220 PolarHBondContact O-N 3.14Å; L218-R221 PolarHBondContact O-N 2.86Å; L218-Y222 VanDerWaalsContact O-CB 3.25Å; L218-Y222 WeakPolarHBondContact O-CB 3.48Å; L218-Y222 PolarHBondContact O-N 2.85Å |
| 219 | R | 90.2 | Very high | 88.6 | Confident | 196 Ų | 196 | 107.9 Ų | 107.9 | 74% | 0.74 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.8 | -43.3 | 174.1 | -75.6 | 179.8 | -178.5 | -166.3 | 1.9 | 111.6 | T215 V216 Y222 F223 | T215-R219 WeakPolarHBondContact O-CB 3.38Å; T215-R219 VanDerWaalsContact O-CG 3.28Å; T215-R219 WeakPolarHBondContact O-CG 3.12Å; T215-R219 PolarHBondContact O-N 3.07Å; V216-R219 PolarHBondContact O-N 3.45Å; R219-Y222 PolarHBondContact O-N 3.01Å; R219-F223 VanDerWaalsContact O-CB 3.24Å; R219-F223 WeakPolarHBondContact O-CB 3.08Å; R219-F223 PolarHBondContact O-N 2.82Å |
| 220 | K | 88.4 | Confident | 87.9 | Confident | 163 Ų | 163 | 107.2 Ų | 107.2 | 71% | 0.709 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.2 | -40.9 | 178.6 | -170 | 175.8 | -178.5 | 177.3 | 0 | 112.2 | V216 Q217 L218 K224 | V216-K220 WeakPolarHBondContact O-CB 3.46Å; V216-K220 PolarHBondContact O-N 3Å; Q217-K220 PolarHBondContact O-N 3.34Å; L218-K220 VanDerWaalsContact C-N 3.33Å; L218-K220 PolarHBondContact O-N 3.14Å; K220-K224 WeakPolarHBondContact O-CB 3.28Å; K220-K224 PolarHBondContact O-N 2.95Å; K220-K224 VanDerWaalsContact O-N 3.11Å |
| 221 | R | 88.1 | Confident | 87.3 | Confident | 167 Ų | 167 | 108.4 Ų | 108.4 | 63% | 0.63 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66.4 | -47.9 | 175 | -75.3 | -168.7 | -175.4 | -162.3 | 2.5 | 111.6 | Q217 L218 F223 K224 E225 | Q217-R221 WeakPolarHBondContact O-CG 3.01Å; Q217-R221 PolarHBondContact O-N 3.44Å; L218-R221 PolarHBondContact O-N 2.86Å; R221-F223 VanDerWaalsContact C-N 3.34Å; R221-F223 PolarHBondContact O-N 2.89Å; R221-K224 PolarHBondContact O-N 2.86Å; R221-E225 PolarHBondContact O-N 2.05Å |
| 222 | Y | 85.6 | Confident | 86.7 | Confident | 167 Ų | 167 | 112 Ų | 112 | 66% | 0.655 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60.9 | -43.2 | 179.3 | -171.7 | -94.9 | 0 | 0 | 0 | 111.9 | L218 R219 K224 E225 Y226 | L218-Y222 VanDerWaalsContact O-CB 3.25Å; L218-Y222 WeakPolarHBondContact O-CB 3.48Å; L218-Y222 PolarHBondContact O-N 2.85Å; R219-Y222 PolarHBondContact O-N 3.01Å; Y222-K224 PolarHBondContact O-N 2.95Å; Y222-E225 PolarHBondContact O-N 2.02Å; Y222-Y226 WeakPolarHBondContact O-CB 3.01Å; Y222-Y226 PolarHBondContact O-N 3.13Å |
| 223 | F | 83.6 | Confident | 86.1 | Confident | 123 Ų | 123 | 114.8 Ų | 114.8 | 54% | 0.539 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.5 | -39.3 | 177.4 | -164 | -96.2 | 0 | 0 | 0 | 112.1 | R219 R221 Y226 E227 | R219-F223 VanDerWaalsContact O-CB 3.24Å; R219-F223 WeakPolarHBondContact O-CB 3.08Å; R219-F223 PolarHBondContact O-N 2.82Å; R221-F223 VanDerWaalsContact C-N 3.34Å; R221-F223 PolarHBondContact O-N 2.89Å; F223-Y226 PolarHBondContact O-N 3.47Å; F223-E227 HydrophobicContact CD1-CG 4.17Å; F223-E227 VanDerWaalsContact CE1-CD 3.41Å; F223-E227 HydrophobicContact CE1-CG 3.83Å; F223-E227 VanDerWaalsContact CE1-OE1 3.24Å; F223-E227 WeakPolarHBondContact CE1-OE1 3.41Å; F223-E227 HydrophobicContact CZ-CG 4.35Å; F223-E227 PolarHBondContact O-N 3.5Å |
| 224 | K | 84.3 | Confident | 85.5 | Confident | 165 Ų | 165 | 119 Ų | 119 | 72% | 0.717 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.1 | -41.8 | 175.7 | -175.7 | -177.9 | 174.2 | -179.8 | 0 | 112.3 | K220 R221 Y222 G228 | K220-K224 WeakPolarHBondContact O-CB 3.28Å; K220-K224 PolarHBondContact O-N 2.95Å; K220-K224 VanDerWaalsContact O-N 3.11Å; R221-K224 PolarHBondContact O-N 2.86Å; Y222-K224 PolarHBondContact O-N 2.95Å; K224-G228 PolarHBondContact O-N 3.11Å |
| 225 | E | 82.1 | Confident | 85 | Confident | 136 Ų | 136 | 120.3 Ų | 120.3 | 64% | 0.636 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.1 | -42.8 | 175.3 | -77.4 | 169.2 | -168.7 | 0 | 0 | 111.3 | R221 Y222 G228 E229 | R221-E225 PolarHBondContact O-N 2.05Å; Y222-E225 PolarHBondContact O-N 2.02Å; E225-G228 PolarHBondContact O-N 2.03Å; E225-E229 PolarHBondContact O-N 3.07Å |
| 226 | Y | 78.9 | Confident | 84.4 | Confident | 142 Ų | 142 | 122 Ų | 122 | 56% | 0.557 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -63.1 | -43.3 | 177.1 | -177 | -98.8 | 0 | 0 | 0 | 113 | Y222 F223 E229 A230 | Y222-Y226 WeakPolarHBondContact O-CB 3.01Å; Y222-Y226 PolarHBondContact O-N 3.13Å; F223-Y226 PolarHBondContact O-N 3.47Å; Y226-E229 PolarHBondContact O-N 2.79Å; Y226-A230 WeakPolarHBondContact O-CB 3.35Å; Y226-A230 PolarHBondContact O-N 3.24Å |
| 227 | E | 80.9 | Confident | 83.6 | Confident | 113 Ų | 113 | 127.9 Ų | 127.9 | 53% | 0.528 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.3 | -40.1 | 174.4 | -79.5 | -168.7 | 151.6 | 0 | 0 | 112.4 | F223 A230 E231 | F223-E227 HydrophobicContact CD1-CG 4.17Å; F223-E227 VanDerWaalsContact CE1-CD 3.41Å; F223-E227 HydrophobicContact CE1-CG 3.83Å; F223-E227 VanDerWaalsContact CE1-OE1 3.24Å; F223-E227 WeakPolarHBondContact CE1-OE1 3.41Å; F223-E227 HydrophobicContact CZ-CG 4.35Å; F223-E227 PolarHBondContact O-N 3.5Å; E227-A230 PolarHBondContact O-N 3.24Å; E227-E231 PolarHBondContact O-N 2.96Å |
| 228 | G | 82.2 | Confident | 83 | Confident | 31 Ų | 31 | 129 Ų | 129 | 32% | 0.32 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -60.6 | -46.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | K224 E225 A230 E231 E232 | K224-G228 PolarHBondContact O-N 3.11Å; E225-G228 PolarHBondContact O-N 2.03Å; G228-A230 VanDerWaalsContact C-N 3.32Å; G228-A230 PolarHBondContact O-N 3.48Å; G228-E231 PolarHBondContact O-N 3.14Å; G228-E232 WeakPolarHBondContact O-CG 3.48Å; G228-E232 PolarHBondContact O-N 3.31Å |
| 229 | E | 81.4 | Confident | 82.2 | Confident | 99 Ų | 99 | 130.6 Ų | 130.6 | 46% | 0.463 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.2 | -38.4 | 176.6 | -162.6 | -169.8 | 153.6 | 0 | 0 | 111.9 | E225 Y226 E232 R233 | E225-E229 PolarHBondContact O-N 3.07Å; Y226-E229 PolarHBondContact O-N 2.79Å; E229-E232 PolarHBondContact O-N 3.2Å; E229-R233 WeakPolarHBondContact O-CB 3.4Å; E229-R233 VanDerWaalsContact O-CG 3.24Å; E229-R233 WeakPolarHBondContact O-CG 3.47Å; E229-R233 PolarHBondContact O-N 3.21Å; E229-R233 IonicContact OE1-CZ 2.9Å; E229-R233 IonicContact OE1-NE 3.99Å; E229-R233 PolarHBondContact OE1-NE 3.04Å; E229-R233 IonicContact OE1-NH2 2.79Å; E229-R233 PolarHBondContact OE1-NH2 3.19Å |
| 230 | A | 78.4 | Confident | 81.4 | Confident | 36 Ų | 36 | 126.2 Ų | 126.2 | 30% | 0.298 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.4 | -35.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y226 E227 G228 K234 | Y226-A230 WeakPolarHBondContact O-CB 3.35Å; Y226-A230 PolarHBondContact O-N 3.24Å; E227-A230 PolarHBondContact O-N 3.24Å; G228-A230 VanDerWaalsContact C-N 3.32Å; G228-A230 PolarHBondContact O-N 3.48Å; A230-K234 VanDerWaalsContact O-CG 3.3Å; A230-K234 WeakPolarHBondContact O-CG 3.34Å; A230-K234 PolarHBondContact O-N 2.97Å |
| 231 | E | 83.4 | Confident | 80.3 | Confident | 104 Ų | 104 | 121.5 Ų | 121.5 | 49% | 0.486 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -69.5 | -45.1 | 175 | -164.6 | -170.3 | 144 | 0 | 0 | 111.6 | E227 G228 R233 K234 K235 | E227-E231 PolarHBondContact O-N 2.96Å; G228-E231 PolarHBondContact O-N 3.14Å; E231-R233 VanDerWaalsContact C-N 3.34Å; E231-R233 PolarHBondContact O-N 3.44Å; E231-K234 WeakPolarHBondContact O-CB 3.48Å; E231-K234 PolarHBondContact O-N 3.36Å; E231-K234 VanDerWaalsContact O-N 3.09Å; E231-K235 PolarHBondContact O-N 2.97Å; E231-K235 VanDerWaalsContact OE1-CE 3.28Å; E231-K235 WeakPolarHBondContact OE1-CE 3.39Å; E231-K235 IonicContact OE1-NZ 2.82Å; E231-K235 PolarHBondContact OE1-NZ 3.1Å |
| 232 | E | 83.1 | Confident | 79.1 | Confident | 108 Ų | 108 | 119 Ų | 119 | 51% | 0.505 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.5 | -43.9 | 176 | -71.4 | -67.2 | 122.8 | 0 | 0 | 111.3 | G228 E229 K234 K235 L236 | G228-E232 WeakPolarHBondContact O-CG 3.48Å; G228-E232 PolarHBondContact O-N 3.31Å; E229-E232 PolarHBondContact O-N 3.2Å; E232-K234 VanDerWaalsContact C-N 3.28Å; E232-K234 PolarHBondContact O-N 2.99Å; E232-K235 PolarHBondContact O-N 3.37Å; E232-K235 IonicContact OE1-NZ 3.21Å; E232-L236 WeakPolarHBondContact O-CG 3.44Å; E232-L236 PolarHBondContact O-N 3Å |
| 233 | R | 81.1 | Confident | 78.1 | Confident | 155 Ų | 155 | 115.8 Ų | 115.8 | 59% | 0.585 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.4 | -32.7 | 175.2 | -73.9 | 175.3 | 179.5 | -132 | 4.8 | 112.9 | E229 E231 R237 | E229-R233 WeakPolarHBondContact O-CB 3.4Å; E229-R233 VanDerWaalsContact O-CG 3.24Å; E229-R233 WeakPolarHBondContact O-CG 3.47Å; E229-R233 PolarHBondContact O-N 3.21Å; E229-R233 IonicContact OE1-CZ 2.9Å; E229-R233 IonicContact OE1-NE 3.99Å; E229-R233 PolarHBondContact OE1-NE 3.04Å; E229-R233 IonicContact OE1-NH2 2.79Å; E229-R233 PolarHBondContact OE1-NH2 3.19Å; E231-R233 VanDerWaalsContact C-N 3.34Å; E231-R233 PolarHBondContact O-N 3.44Å; R233-R237 PolarHBondContact O-N 3.47Å |
| 234 | K | 82.6 | Confident | 77 | Confident | 153 Ų | 153 | 114.7 Ų | 114.7 | 67% | 0.665 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -69.9 | -42.9 | 174.3 | -74.2 | 171 | -176.4 | 178 | 0 | 111.3 | A230 E231 E232 R237 Q238 | A230-K234 VanDerWaalsContact O-CG 3.3Å; A230-K234 WeakPolarHBondContact O-CG 3.34Å; A230-K234 PolarHBondContact O-N 2.97Å; E231-K234 WeakPolarHBondContact O-CB 3.48Å; E231-K234 PolarHBondContact O-N 3.36Å; E231-K234 VanDerWaalsContact O-N 3.09Å; E232-K234 VanDerWaalsContact C-N 3.28Å; E232-K234 PolarHBondContact O-N 2.99Å; K234-R237 PolarHBondContact O-N 3.26Å; K234-Q238 PolarHBondContact O-N 3.26Å |
| 235 | K | 82.4 | Confident | 75.8 | Confident | 97 Ų | 97 | 113.3 Ų | 113.3 | 42% | 0.422 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -60.7 | -47.3 | 176.1 | -73.1 | 177.4 | -174.5 | 156.2 | 0 | 111.7 | E231 E232 R237 Q238 E239 | E231-K235 PolarHBondContact O-N 2.97Å; E231-K235 VanDerWaalsContact OE1-CE 3.28Å; E231-K235 WeakPolarHBondContact OE1-CE 3.39Å; E231-K235 IonicContact OE1-NZ 2.82Å; E231-K235 PolarHBondContact OE1-NZ 3.1Å; E232-K235 PolarHBondContact O-N 3.37Å; E232-K235 IonicContact OE1-NZ 3.21Å; K235-R237 VanDerWaalsContact C-N 3.34Å; K235-R237 PolarHBondContact O-N 3.19Å; K235-Q238 PolarHBondContact O-N 3.14Å; K235-Q238 VanDerWaalsContact O-N 3.15Å; K235-E239 PolarHBondContact O-N 2.96Å |
| 236 | L | 79.9 | Confident | 74.7 | Confident | 107 Ų | 107 | 114.8 Ų | 114.8 | 56% | 0.56 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -58.5 | -43.3 | 176.6 | -71.3 | 172.1 | 0 | 0 | 0 | 112.4 | E232 Q238 E239 T240 | E232-L236 WeakPolarHBondContact O-CG 3.44Å; E232-L236 PolarHBondContact O-N 3Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 2.85Å; L236-E239 PolarHBondContact O-N 3.16Å; L236-T240 PolarHBondContact O-N 3.09Å; L236-T240 PolarHBondContact O-OG1 3.26Å |
| 237 | R | 76.7 | Confident | 73.4 | Confident | 206 Ų | 206 | 115.4 Ų | 115.4 | 78% | 0.777 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -63.3 | -39.4 | 176.5 | -83.3 | -176.3 | 175.5 | -117.9 | 0.3 | 112.9 | R233 K234 K235 G241 | R233-R237 PolarHBondContact O-N 3.47Å; K234-R237 PolarHBondContact O-N 3.26Å; K235-R237 VanDerWaalsContact C-N 3.34Å; K235-R237 PolarHBondContact O-N 3.19Å; R237-G241 PolarHBondContact O-N 3.26Å |
| 238 | Q | 78.9 | Confident | 73 | Confident | 132 Ų | 132 | 115.6 Ų | 115.6 | 62% | 0.617 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -67.6 | -42.1 | 178.1 | -166.3 | 175.3 | 8.9 | 0 | 0 | 111.2 | K234 K235 L236 G241 N242 | K234-Q238 PolarHBondContact O-N 3.26Å; K235-Q238 PolarHBondContact O-N 3.14Å; K235-Q238 VanDerWaalsContact O-N 3.15Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 2.85Å; Q238-G241 PolarHBondContact O-N 3.15Å; Q238-N242 PolarHBondContact O-N 3.14Å; Q238-N242 PolarHBondContact O-ND2 3.31Å; Q238-N242 VanDerWaalsContact O-ND2 3.13Å; Q238-N242 PolarHBondContact O-OD1 3.34Å |
| 239 | E | 74.5 | Confident | 72.5 | Confident | 142 Ų | 142 | 120 Ų | 120 | 66% | 0.664 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -65.5 | -39.8 | 177 | -168.1 | 158 | -178.1 | 0 | 0 | 112.1 | K235 L236 G241 N242 | K235-E239 PolarHBondContact O-N 2.96Å; L236-E239 PolarHBondContact O-N 3.16Å; E239-G241 VanDerWaalsContact C-N 3.32Å; E239-G241 PolarHBondContact O-N 3.18Å; E239-N242 PolarHBondContact O-N 2.86Å |
| 240 | T | 72.4 | Confident | 72.1 | Confident | 105 Ų | 105 | 121.2 Ų | 121.2 | 64% | 0.644 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -67 | -31.8 | 175.8 | -37.8 | 0 | 0 | 0 | 0 | 112.4 | L236 N242 | L236-T240 PolarHBondContact O-N 3.09Å; L236-T240 PolarHBondContact O-OG1 3.26Å; T240-N242 VanDerWaalsContact C-N 3.32Å |
| 241 | G | 66.1 | Low | 71.7 | Confident | 63 Ų | 63 | 126.2 Ų | 126.2 | 65% | 0.649 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -76 | -17.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | R237 Q238 E239 | R237-G241 PolarHBondContact O-N 3.26Å; Q238-G241 PolarHBondContact O-N 3.15Å; E239-G241 VanDerWaalsContact C-N 3.32Å; E239-G241 PolarHBondContact O-N 3.18Å |
| 242 | N | 62.7 | Low | 71 | Confident | 116 Ų | 116 | 127.6 Ų | 127.6 | 62% | 0.62 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | -1.1 | -177.7 | -63.2 | -17.9 | 0 | 0 | 0 | 113.4 | Q238 E239 T240 P244 | Q238-N242 PolarHBondContact O-N 3.14Å; Q238-N242 PolarHBondContact O-ND2 3.31Å; Q238-N242 VanDerWaalsContact O-ND2 3.13Å; Q238-N242 PolarHBondContact O-OD1 3.34Å; E239-N242 PolarHBondContact O-N 2.86Å; T240-N242 VanDerWaalsContact C-N 3.32Å; N242-P244 VanDerWaalsContact O-CD 3.23Å; N242-P244 WeakPolarHBondContact O-CD 3.49Å |
| 243 | V | 64.6 | Low | 70.1 | Confident | 99 Ų | 99 | 128.9 Ų | 128.9 | 60% | 0.6 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -74.7 | 113.3 | 174.7 | -177.6 | 0 | 0 | 0 | 0 | 108.2 | V245 | V243-V245 PolarHBondContact O-N 2.81Š|
| 244 | P | 60.6 | Low | 69.4 | Low | 99 Ų | 99 | 127 Ų | 127 | 64% | 0.643 | 70% | 0.702 | S | S | * | * | trans | -65.1 | 123.7 | 175.8 | 26.5 | -30.5 | 0 | 0 | 0 | 108.4 | N242 I246 | N242-P244 VanDerWaalsContact O-CD 3.23Å; N242-P244 WeakPolarHBondContact O-CD 3.49Å; P244-I246 VanDerWaalsContact C-N 3.34Å; P244-I246 PolarHBondContact O-N 3.12Å | ||
| 245 | V | 59.3 | Low | 68.3 | Low | 137 Ų | 137 | 125 Ų | 125 | 83% | 0.83 | 71% | 0.705 | S | S | * | * | trans | -64.5 | 99.6 | 167.8 | 177.4 | 0 | 0 | 0 | 0 | 106.3 | V243 A247 | V243-V245 PolarHBondContact O-N 2.81Å; V245-A247 PolarHBondContact O-N 3.29Å; V245-A247 VanDerWaalsContact O-N 3.1Å | ||
| 246 | I | 57.8 | Low | 67.2 | Low | 166 Ų | 166 | 127.3 Ų | 127.3 | 85% | 0.851 | 73% | 0.729 | S | S | * | * | trans | -73.4 | 99.7 | 169.1 | -57 | 172.8 | 0 | 0 | 0 | 105.3 | P244 | P244-I246 VanDerWaalsContact C-N 3.34Å; P244-I246 PolarHBondContact O-N 3.12Å | ||
| 247 | A | 52.6 | Low | 66 | Low | 156 Ų | 156 | 129.2 Ų | 129.2 | 100% | 1.289 | 74% | 0.744 | S | S | * | * | trans | -100.1 | 0 | 169 | 0 | 0 | 0 | 0 | 0 | 109.6 | V245 | V245-A247 PolarHBondContact O-N 3.29Å; V245-A247 VanDerWaalsContact O-N 3.1Å |
Retrieved 247 of 247 residues in 35.1 ms
(Link to these results)