| 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 | 34.3 | Very low | 45.5 | Very low | 244 Ų | 244 | 120 Ų | 120 | 100% | 1.202 | 68% | 0.675 | S | S | * | * | 0 | 93.4 | 0 | -88.6 | -176.7 | 150.4 | 0 | 0 | 109.4 | |||||
| 2 | C | 35.3 | Very low | 45.9 | Very low | 120 Ų | 120 | 120 Ų | 120 | 81% | 0.811 | 67% | 0.672 | S | S | * | * | trans | -135 | 125.6 | 137.3 | -79.2 | 0 | 0 | 0 | 0 | 102.9 | L4 | C2-L4 PolarHBondContact O-N 3.17Š| ||
| 3 | P | 41.3 | Very low | 46.2 | Very low | 129 Ų | 129 | 114.7 Ų | 114.7 | 84% | 0.838 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 124 | -177.8 | 24.5 | -29.2 | 0 | 0 | 0 | 109.4 | S5 | P3-S5 PolarHBondContact O-N 2.85Š|
| 4 | L | 42.5 | Very low | 46.2 | Very low | 152 Ų | 152 | 112.9 Ų | 112.9 | 80% | 0.796 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 120.4 | 172.2 | -77.7 | 158.8 | 0 | 0 | 0 | 108.1 | C2 D8 | C2-L4 PolarHBondContact O-N 3.17Å; L4-D8 WeakPolarHBondContact CD2-OD2 3.5Å |
| 5 | S | 45 | Very low | 46.6 | Very low | 62 Ų | 62 | 115.1 Ų | 115.1 | 43% | 0.434 | 64% | 0.639 | S | S | . | * | P | Polyproline II helix | trans | -68.5 | 145.7 | -176.5 | 79.2 | 0 | 0 | 0 | 0 | 109.5 | P3 N7 D8 | P3-S5 PolarHBondContact O-N 2.85Å; S5-N7 PolarHBondContact O-N 2.88Å; S5-D8 PolarHBondContact O-N 3.37Å |
| 6 | V | 50.7 | Low | 46.7 | Very low | 112 Ų | 112 | 112.3 Ų | 112.3 | 68% | 0.679 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -50.4 | -19.6 | -180 | -178.1 | 0 | 0 | 0 | 0 | 113 | D8 I10 | V6-D8 PolarHBondContact O-N 3.1Å; V6-I10 HydrophobicContact CG1-CD1 4.13Å; V6-I10 WeakPolarHBondContact O-CG1 3.45Å |
| 7 | N | 49.4 | Very low | 46.6 | Very low | 110 Ų | 110 | 112.9 Ų | 112.9 | 59% | 0.588 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.3 | -31.8 | 177.3 | -72.9 | -14.4 | 0 | 0 | 0 | 114.6 | S5 I10 Q11 | S5-N7 PolarHBondContact O-N 2.88Å; N7-I10 PolarHBondContact O-N 3.39Å; N7-Q11 WeakPolarHBondContact O-CG 3.48Å; N7-Q11 PolarHBondContact O-N 3.21Å |
| 8 | D | 50 | Low | 46.4 | Very low | 83 Ų | 83 | 112.6 Ų | 112.6 | 44% | 0.444 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -71.6 | -34.8 | -176.9 | -65.7 | -33 | 0 | 0 | 0 | 111.4 | L4 S5 V6 Q11 D12 | L4-D8 WeakPolarHBondContact CD2-OD2 3.5Å; S5-D8 PolarHBondContact O-N 3.37Å; V6-D8 PolarHBondContact O-N 3.1Å; D8-Q11 PolarHBondContact O-N 2.9Å; D8-D12 PolarHBondContact O-N 3.29Å |
| 9 | V | 52.2 | Low | 46.1 | Very low | 110 Ų | 110 | 117.7 Ų | 117.7 | 67% | 0.667 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -69.8 | -33.8 | 178.3 | -177.7 | 0 | 0 | 0 | 0 | 111.6 | A13 | V9-A13 PolarHBondContact O-N 3.15Å |
| 10 | I | 49.8 | Very low | 46 | Very low | 84 Ų | 84 | 118.1 Ų | 118.1 | 43% | 0.431 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -72.1 | -35.5 | -179.4 | -64 | 170.2 | 0 | 0 | 0 | 111 | V6 N7 A13 L14 | V6-I10 HydrophobicContact CG1-CD1 4.13Å; V6-I10 WeakPolarHBondContact O-CG1 3.45Å; N7-I10 PolarHBondContact O-N 3.39Å; I10-A13 PolarHBondContact O-N 3.36Å; I10-L14 HydrophobicContact CG2-CD1 4.08Å; I10-L14 WeakPolarHBondContact O-CG 3.36Å; I10-L14 PolarHBondContact O-N 3.23Å; I10-L14 VanDerWaalsContact O-N 3.17Å |
| 11 | Q | 50.3 | Low | 45.8 | Very low | 114 Ų | 114 | 117 Ų | 117 | 53% | 0.533 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -69.6 | -36.4 | 179.5 | -68.6 | -65.8 | -22.1 | 0 | 0 | 112.7 | N7 D8 K15 | N7-Q11 WeakPolarHBondContact O-CG 3.48Å; N7-Q11 PolarHBondContact O-N 3.21Å; D8-Q11 PolarHBondContact O-N 2.9Å; Q11-K15 PolarHBondContact O-N 3.4Å; Q11-K15 VanDerWaalsContact O-N 3.13Å |
| 12 | D | 50.3 | Low | 46.1 | Very low | 120 Ų | 120 | 112 Ų | 112 | 64% | 0.642 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -70.3 | -37.3 | 176.2 | -84.5 | -10 | 0 | 0 | 0 | 112.2 | D8 K15 S16 | D8-D12 PolarHBondContact O-N 3.29Å; D12-K15 PolarHBondContact O-N 3.48Å; D12-S16 PolarHBondContact O-N 2.99Å; D12-S16 VanDerWaalsContact O-N 3.1Å |
| 13 | A | 49.5 | Very low | 46.2 | Very low | 51 Ų | 51 | 114.9 Ų | 114.9 | 42% | 0.421 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -60.2 | -47.6 | 174 | 0 | 0 | 0 | 0 | 0 | 111.3 | V9 I10 K15 S16 E17 | V9-A13 PolarHBondContact O-N 3.15Å; I10-A13 PolarHBondContact O-N 3.36Å; A13-K15 PolarHBondContact O-N 3.33Å; A13-S16 PolarHBondContact O-N 3.15Å; A13-S16 PolarHBondContact O-OG 3.21Å; A13-E17 PolarHBondContact O-N 3.28Å; A13-E17 VanDerWaalsContact O-N 3.14Å |
| 14 | L | 46.5 | Very low | 46.1 | Very low | 89 Ų | 89 | 114.8 Ų | 114.8 | 47% | 0.466 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.6 | -36.3 | -180 | -75.2 | 167.5 | 0 | 0 | 0 | 113.2 | I10 L18 | I10-L14 HydrophobicContact CG2-CD1 4.08Å; I10-L14 WeakPolarHBondContact O-CG 3.36Å; I10-L14 PolarHBondContact O-N 3.23Å; I10-L14 VanDerWaalsContact O-N 3.17Å; L14-L18 PolarHBondContact O-N 3.33Å; L14-L18 VanDerWaalsContact O-N 3.15Å |
| 15 | K | 51.7 | Low | 45.7 | Very low | 146 Ų | 146 | 113.5 Ų | 113.5 | 64% | 0.635 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.2 | -36.4 | 175.3 | -85.9 | 178.7 | 178.2 | 173.1 | 0 | 113 | Q11 D12 A13 R19 | Q11-K15 PolarHBondContact O-N 3.4Å; Q11-K15 VanDerWaalsContact O-N 3.13Å; D12-K15 PolarHBondContact O-N 3.48Å; A13-K15 PolarHBondContact O-N 3.33Å; K15-R19 PolarHBondContact O-N 3.44Å |
| 16 | S | 48.3 | Very low | 45 | Very low | 71 Ų | 71 | 118.4 Ų | 118.4 | 50% | 0.497 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -69.2 | -35.4 | 178.4 | 73.1 | 0 | 0 | 0 | 0 | 112.3 | D12 A13 R19 | D12-S16 PolarHBondContact O-N 2.99Å; D12-S16 VanDerWaalsContact O-N 3.1Å; A13-S16 PolarHBondContact O-N 3.15Å; A13-S16 PolarHBondContact O-OG 3.21Å; S16-R19 PolarHBondContact O-N 3.13Å |
| 17 | E | 44.5 | Very low | 44.1 | Very low | 122 Ų | 122 | 119.6 Ų | 119.6 | 57% | 0.57 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -74.4 | -35 | 179.1 | -160 | 157.4 | -159.8 | 0 | 0 | 112 | A13 R19 N20 N21 | A13-E17 PolarHBondContact O-N 3.28Å; A13-E17 VanDerWaalsContact O-N 3.14Å; E17-R19 VanDerWaalsContact C-N 3.28Å; E17-R19 PolarHBondContact O-N 3Å; E17-N20 PolarHBondContact O-N 3.43Å; E17-N21 PolarHBondContact O-N 3.41Å; E17-N21 PolarHBondContact O-ND2 3.28Å |
| 18 | L | 43 | Very low | 43.1 | Very low | 107 Ų | 107 | 121.6 Ų | 121.6 | 56% | 0.56 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -63.5 | -30.1 | 171.8 | -93.7 | 158.2 | 0 | 0 | 0 | 113.4 | L14 | L14-L18 PolarHBondContact O-N 3.33Å; L14-L18 VanDerWaalsContact O-N 3.15Å |
| 19 | R | 40.6 | Very low | 42.3 | Very low | 210 Ų | 210 | 125.2 Ų | 125.2 | 79% | 0.792 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -74.4 | -30.1 | 179.2 | -150.4 | 176.9 | -174.7 | -158.6 | 0.1 | 112.4 | K15 S16 E17 | K15-R19 PolarHBondContact O-N 3.44Å; S16-R19 PolarHBondContact O-N 3.13Å; E17-R19 VanDerWaalsContact C-N 3.28Å; E17-R19 PolarHBondContact O-N 3Å |
| 20 | N | 45.2 | Very low | 41.2 | Very low | 126 Ų | 126 | 122.8 Ų | 122.8 | 67% | 0.674 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -80.9 | -21.7 | 179.5 | -72.6 | -13.5 | 0 | 0 | 0 | 113.4 | E17 | E17-N20 PolarHBondContact O-N 3.43Å |
| 21 | N | 41.3 | Very low | 40.5 | Very low | 96 Ų | 96 | 126.8 Ų | 126.8 | 51% | 0.513 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -89.2 | -11 | -177.4 | -67.5 | -18.8 | 0 | 0 | 0 | 114.3 | E17 E23 | E17-N21 PolarHBondContact O-N 3.41Å; E17-N21 PolarHBondContact O-ND2 3.28Å; N21-E23 VanDerWaalsContact C-N 3.29Å; N21-E23 PolarHBondContact O-N 3.16Å |
| 22 | N | 41.7 | Very low | 39.7 | Very low | 137 Ų | 137 | 128.8 Ų | 128.8 | 73% | 0.733 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -2.4 | 177.7 | -76 | -17.5 | 0 | 0 | 0 | 114.2 | ||
| 23 | E | 36.6 | Very low | 38.8 | Very low | 182 Ų | 182 | 129.7 Ų | 129.7 | 85% | 0.85 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | 5 | 173.7 | -86.3 | -170.1 | 167.9 | 0 | 0 | 114.1 | N21 L25 | N21-E23 VanDerWaalsContact C-N 3.29Å; N21-E23 PolarHBondContact O-N 3.16Å; E23-L25 PolarHBondContact O-N 3.02Å |
| 24 | I | 38.1 | Very low | 38.1 | Very low | 126 Ų | 126 | 134.2 Ų | 134.2 | 65% | 0.646 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -85.1 | 90.4 | 179.4 | -54.9 | -176.1 | 0 | 0 | 0 | 110.6 | ||
| 25 | L | 34.7 | Very low | 37.4 | Very low | 125 Ų | 125 | 138 Ų | 138 | 65% | 0.654 | 71% | 0.71 | S | S | * | * | trans | 60.2 | 98.9 | 140.4 | -70.3 | 162.3 | 0 | 0 | 0 | 116.8 | E23 L27 | E23-L25 PolarHBondContact O-N 3.02Å; L25-L27 HydrophobicContact CB-CD1 4.45Å; L25-L27 HydrophobicContact CB-CG 4.18Å; L25-L27 PolarHBondContact O-N 2.89Å | ||
| 26 | L | 30.5 | Very low | 36.6 | Very low | 166 Ų | 166 | 138.4 Ų | 138.4 | 87% | 0.869 | 72% | 0.718 | S | S | * | * | trans | -51.7 | 87.6 | 140.6 | -81.2 | 91.4 | 0 | 0 | 0 | 109.1 | ||||
| 27 | L | 32.8 | Very low | 35.7 | Very low | 137 Ų | 137 | 141.1 Ų | 141.1 | 72% | 0.717 | 73% | 0.727 | S | S | * | * | trans | -89.5 | 101.7 | 160 | -78.7 | 165.6 | 0 | 0 | 0 | 107.1 | L25 N29 | L25-L27 HydrophobicContact CB-CD1 4.45Å; L25-L27 HydrophobicContact CB-CG 4.18Å; L25-L27 PolarHBondContact O-N 2.89Å; L27-N29 PolarHBondContact O-N 2.8Å | ||
| 28 | N | 27.1 | Very low | 35.3 | Very low | 151 Ų | 151 | 141.3 Ų | 141.3 | 81% | 0.807 | 74% | 0.739 | S | S | * | * | trans | -48.6 | 95.7 | 167.9 | -73.1 | -36.1 | 0 | 0 | 0 | 110.2 | G30 | N28-G30 PolarHBondContact O-N 2.83Š| ||
| 29 | N | 34.7 | Very low | 34.8 | Very low | 160 Ų | 160 | 141.3 Ų | 141.3 | 86% | 0.856 | 74% | 0.744 | S | S | * | * | trans | -79.1 | 98.9 | 161.4 | -85.6 | -15.5 | 0 | 0 | 0 | 107.5 | L27 Q31 | L27-N29 PolarHBondContact O-N 2.8Å; N29-Q31 PolarHBondContact O-N 3.02Å | ||
| 30 | G | 27.8 | Very low | 34.6 | Very low | 59 Ų | 59 | 139.5 Ų | 139.5 | 61% | 0.608 | 74% | 0.744 | S | S | * | * | trans | -58.4 | 120.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | N28 N32 | N28-G30 PolarHBondContact O-N 2.83Å; G30-N32 PolarHBondContact O-N 3.22Å | ||
| 31 | Q | 34.9 | Very low | 34.2 | Very low | 167 Ų | 167 | 141.2 Ų | 141.2 | 78% | 0.78 | 75% | 0.753 | S | S | * | * | trans | 49 | 61.2 | 137.1 | -57.3 | -177.3 | -78 | 0 | 0 | 117.8 | N29 | N29-Q31 PolarHBondContact O-N 3.02Š| ||
| 32 | N | 33.7 | Very low | 34.3 | Very low | 156 Ų | 156 | 144.2 Ų | 144.2 | 83% | 0.834 | 76% | 0.764 | S | S | * | * | trans | -115 | 88.2 | 148.1 | -66.3 | -9.9 | 0 | 0 | 0 | 107.1 | G30 N34 | G30-N32 PolarHBondContact O-N 3.22Å; N32-N34 PolarHBondContact O-N 3.3Å | ||
| 33 | N | 30.9 | Very low | 34.3 | Very low | 139 Ų | 139 | 143.2 Ų | 143.2 | 74% | 0.743 | 76% | 0.763 | S | S | * | * | trans | -67.3 | 75.4 | 175.4 | -60.9 | -31.2 | 0 | 0 | 0 | 109.6 | E35 | N33-E35 PolarHBondContact O-N 3.35Š| ||
| 34 | N | 36.2 | Very low | 34.6 | Very low | 146 Ų | 146 | 145.4 Ų | 145.4 | 78% | 0.781 | 77% | 0.766 | S | S | * | * | trans | -83.6 | 83.7 | 148.8 | -76.8 | -4.4 | 0 | 0 | 0 | 105.4 | N32 L36 | N32-N34 PolarHBondContact O-N 3.3Å; N34-L36 PolarHBondContact O-N 3.1Å | ||
| 35 | E | 30.6 | Very low | 34.9 | Very low | 169 Ų | 169 | 144.6 Ų | 144.6 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | trans | -55.9 | 86.2 | 165.5 | -164.3 | 168.9 | -155.4 | 0 | 0 | 107 | N33 N37 | N33-E35 PolarHBondContact O-N 3.35Å; E35-N37 PolarHBondContact O-N 2.81Å | ||
| 36 | L | 34.9 | Very low | 35.9 | Very low | 154 Ų | 154 | 144.1 Ų | 144.1 | 81% | 0.806 | 77% | 0.77 | S | S | * | * | trans | -64.4 | 92.5 | 168.5 | -77.2 | 166.8 | 0 | 0 | 0 | 105.7 | N34 P38 | N34-L36 PolarHBondContact O-N 3.1Å; L36-P38 WeakPolarHBondContact O-CD 3.39Å | ||
| 37 | N | 29.2 | Very low | 37 | Very low | 129 Ų | 129 | 141.4 Ų | 141.4 | 69% | 0.69 | 76% | 0.756 | S | S | * | * | trans | -56 | 106.4 | 166.6 | -96.7 | -43 | 0 | 0 | 0 | 107.9 | E35 T39 | E35-N37 PolarHBondContact O-N 2.81Å; N37-T39 VanDerWaalsContact C-N 3.28Å; N37-T39 PolarHBondContact O-N 3.38Å; N37-T39 VanDerWaalsContact O-N 3.09Å | ||
| 38 | P | 37.7 | Very low | 38.4 | Very low | 125 Ų | 125 | 142 Ų | 142 | 81% | 0.812 | 76% | 0.76 | S | S | * | * | trans | -88.7 | 79.1 | 176.9 | 29.2 | -13.7 | 0 | 0 | 0 | 106.4 | L36 | L36-P38 WeakPolarHBondContact O-CD 3.39Š| ||
| 39 | T | 31.2 | Very low | 39.9 | Very low | 107 Ų | 107 | 139.2 Ų | 139.2 | 66% | 0.656 | 75% | 0.752 | S | S | * | * | trans | -135 | 102.1 | 163.6 | -28.3 | 0 | 0 | 0 | 0 | 102 | N37 | N37-T39 VanDerWaalsContact C-N 3.28Å; N37-T39 PolarHBondContact O-N 3.38Å; N37-T39 VanDerWaalsContact O-N 3.09Å | ||
| 40 | E | 36.9 | Very low | 41.6 | Very low | 173 Ų | 173 | 134.4 Ų | 134.4 | 81% | 0.808 | 73% | 0.727 | S | S | * | * | S | Bend | -160.8 | 124.7 | 76 | -78.3 | 161.3 | -161.8 | 0 | 0 | 109.5 | E42 | E40-E42 PolarHBondContact O-N 3.31Š| |
| 41 | N | 36.5 | Very low | 44 | Very low | 162 Ų | 162 | 134 Ų | 134 | 87% | 0.866 | 72% | 0.717 | S | S | * | * | trans | 45.9 | 63.5 | 153.4 | -65.8 | -14.9 | 0 | 0 | 0 | 118.2 | T43 | N41-T43 PolarHBondContact O-N 3.45Š| ||
| 42 | E | 44.2 | Very low | 46.2 | Very low | 158 Ų | 158 | 132.6 Ų | 132.6 | 74% | 0.738 | 71% | 0.706 | S | S | * | * | trans | -85 | 106.1 | 149.8 | -71.8 | -162.5 | -175.9 | 0 | 0 | 108.6 | E40 Y44 | E40-E42 PolarHBondContact O-N 3.31Å; E42-Y44 PolarHBondContact O-N 3.36Å; E42-Y44 VanDerWaalsContact O-N 3.13Å | ||
| 43 | T | 40.2 | Very low | 48.5 | Very low | 117 Ų | 117 | 129 Ų | 129 | 72% | 0.718 | 69% | 0.689 | S | S | * | * | trans | -45.6 | 117.4 | 167.4 | -38.9 | 0 | 0 | 0 | 0 | 108.6 | N41 D45 | N41-T43 PolarHBondContact O-N 3.45Å; T43-D45 PolarHBondContact O-N 3.14Å | ||
| 44 | Y | 43.5 | Very low | 51 | Low | 228 Ų | 228 | 127.6 Ų | 127.6 | 89% | 0.894 | 67% | 0.674 | S | S | * | * | trans | -66.7 | 82.4 | 176.3 | -86.1 | -100.9 | 0 | 0 | 0 | 109.5 | E42 S46 | E42-Y44 PolarHBondContact O-N 3.36Å; E42-Y44 VanDerWaalsContact O-N 3.13Å; Y44-S46 PolarHBondContact O-N 3.37Å | ||
| 45 | D | 44.5 | Very low | 53.5 | Low | 108 Ų | 108 | 127.6 Ų | 127.6 | 58% | 0.578 | 66% | 0.662 | S | S | * | * | trans | -77 | 106.3 | 163.4 | -79 | -18 | 0 | 0 | 0 | 107.8 | T43 D47 | T43-D45 PolarHBondContact O-N 3.14Å; D45-D47 PolarHBondContact O-N 3.08Å | ||
| 46 | S | 55.2 | Low | 56.4 | Low | 116 Ų | 116 | 123.5 Ų | 123.5 | 81% | 0.811 | 64% | 0.64 | S | S | * | * | trans | -69.4 | 41.8 | -172.4 | -176.8 | 0 | 0 | 0 | 0 | 114.2 | Y44 | Y44-S46 PolarHBondContact O-N 3.37Š| ||
| 47 | D | 54.2 | Low | 59.1 | Low | 109 Ų | 109 | 119.8 Ų | 119.8 | 58% | 0.583 | 62% | 0.623 | S | S | * | * | trans | -105 | 113.1 | 177.9 | -74.4 | -22.4 | 0 | 0 | 0 | 110.4 | D45 S49 N50 | D45-D47 PolarHBondContact O-N 3.08Å; D47-S49 PolarHBondContact O-N 3.48Å; D47-N50 WeakPolarHBondContact O-CA 3.49Å; D47-N50 VanDerWaalsContact O-CB 3.31Å; D47-N50 WeakPolarHBondContact O-CB 3.38Å; D47-N50 PolarHBondContact O-N 2.91Å | ||
| 48 | D | 62.2 | Low | 61.9 | Low | 150 Ų | 150 | 116.4 Ų | 116.4 | 80% | 0.802 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -50.2 | -27.5 | 169.9 | -74.8 | -31.4 | 0 | 0 | 0 | 112.3 | N50 A51 Y52 | D48-N50 VanDerWaalsContact C-N 3.29Å; D48-N50 PolarHBondContact O-N 3.37Å; D48-A51 WeakPolarHBondContact O-CB 3.44Å; D48-A51 PolarHBondContact O-N 3.34Å; D48-Y52 PolarHBondContact O-N 3.02Å |
| 49 | S | 59.1 | Low | 64.5 | Low | 92 Ų | 92 | 114.1 Ų | 114.1 | 64% | 0.643 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -59.4 | -36.6 | 171.8 | -65.1 | 0 | 0 | 0 | 0 | 112.9 | D47 Y52 V53 | D47-S49 PolarHBondContact O-N 3.48Å; S49-Y52 PolarHBondContact O-N 3.16Å; S49-V53 WeakPolarHBondContact O-CG2 3.44Å; S49-V53 PolarHBondContact O-N 3.24Å |
| 50 | N | 69.5 | Low | 67.4 | Low | 59 Ų | 59 | 112.8 Ų | 112.8 | 32% | 0.316 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -73.6 | -33 | 177.4 | -166.4 | -19.4 | 0 | 0 | 0 | 111 | D47 D48 Y52 V53 R54 | D47-N50 WeakPolarHBondContact O-CA 3.49Å; D47-N50 VanDerWaalsContact O-CB 3.31Å; D47-N50 WeakPolarHBondContact O-CB 3.38Å; D47-N50 PolarHBondContact O-N 2.91Å; D48-N50 VanDerWaalsContact C-N 3.29Å; D48-N50 PolarHBondContact O-N 3.37Å; N50-Y52 PolarHBondContact O-N 2.83Å; N50-V53 PolarHBondContact O-N 3.25Å; N50-R54 VanDerWaalsContact CG-NH1 3.26Å; N50-R54 PolarHBondContact ND2-NH1 3.47Å; N50-R54 WeakPolarHBondContact O-CB 3.42Å; N50-R54 WeakPolarHBondContact O-CG 3.29Å; N50-R54 PolarHBondContact O-N 3.27Å; N50-R54 PolarHBondContact O-NE 3.48Å; N50-R54 WeakPolarHBondContact OD1-CG 3.02Å; N50-R54 PolarHBondContact OD1-NE 3.24Å; N50-R54 PolarHBondContact OD1-NH1 3.38Å; N50-R54 VanDerWaalsContact OD1-NH1 3.14Å |
| 51 | A | 79.1 | Confident | 69.9 | Low | 49 Ų | 49 | 108.9 Ų | 108.9 | 41% | 0.405 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.8 | -41.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | D48 R55 | D48-A51 WeakPolarHBondContact O-CB 3.44Å; D48-A51 PolarHBondContact O-N 3.34Å; A51-R55 WeakPolarHBondContact O-CB 3.43Å; A51-R55 PolarHBondContact O-N 3.4Å |
| 52 | Y | 81.4 | Confident | 72.5 | Confident | 138 Ų | 138 | 106 Ų | 106 | 54% | 0.541 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.2 | -47.4 | 174.2 | 176.7 | -93.2 | 0 | 0 | 0 | 112.1 | D48 S49 N50 R55 R56 | D48-Y52 PolarHBondContact O-N 3.02Å; S49-Y52 PolarHBondContact O-N 3.16Å; N50-Y52 PolarHBondContact O-N 2.83Å; Y52-R55 PolarHBondContact O-N 3.37Å; Y52-R56 HydrophobicContact CE1-CB 4.47Å; Y52-R56 WeakPolarHBondContact O-CB 3.4Å; Y52-R56 PolarHBondContact O-N 3.03Å |
| 53 | V | 80.7 | Confident | 74.6 | Confident | 81 Ų | 81 | 103.3 Ų | 103.3 | 49% | 0.491 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | 180 | 173.8 | 0 | 0 | 0 | 0 | 110.5 | S49 N50 R55 R56 V57 | S49-V53 WeakPolarHBondContact O-CG2 3.44Å; S49-V53 PolarHBondContact O-N 3.24Å; N50-V53 PolarHBondContact O-N 3.25Å; V53-R55 VanDerWaalsContact C-N 3.33Å; V53-R55 PolarHBondContact O-N 3.41Å; V53-R56 PolarHBondContact O-N 3.4Å; V53-V57 HydrophobicContact CG1-CG2 4.35Å; V53-V57 VanDerWaalsContact O-CG2 3.3Å; V53-V57 WeakPolarHBondContact O-CG2 3.44Å; V53-V57 PolarHBondContact O-N 3.43Å |
| 54 | R | 83.2 | Confident | 76.7 | Confident | 110 Ų | 110 | 101.6 Ų | 101.6 | 42% | 0.415 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -57.9 | -44.7 | 176.1 | -75.3 | -177.8 | -75.4 | -123.9 | -1.6 | 112.1 | N50 V57 A58 | N50-R54 VanDerWaalsContact CG-NH1 3.26Å; N50-R54 PolarHBondContact ND2-NH1 3.47Å; N50-R54 WeakPolarHBondContact O-CB 3.42Å; N50-R54 WeakPolarHBondContact O-CG 3.29Å; N50-R54 PolarHBondContact O-N 3.27Å; N50-R54 PolarHBondContact O-NE 3.48Å; N50-R54 WeakPolarHBondContact OD1-CG 3.02Å; N50-R54 PolarHBondContact OD1-NE 3.24Å; N50-R54 PolarHBondContact OD1-NH1 3.38Å; N50-R54 VanDerWaalsContact OD1-NH1 3.14Å; R54-V57 PolarHBondContact O-N 3.33Å; R54-A58 WeakPolarHBondContact O-CB 3.32Å; R54-A58 PolarHBondContact O-N 3.19Å |
| 55 | R | 90 | Very high | 78.5 | Confident | 145 Ų | 145 | 94.2 Ų | 94.2 | 55% | 0.547 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 176 | -175 | 175 | 65.1 | -151.4 | -0.5 | 111.6 | A51 Y52 V53 V57 A58 E59 | A51-R55 WeakPolarHBondContact O-CB 3.43Å; A51-R55 PolarHBondContact O-N 3.4Å; Y52-R55 PolarHBondContact O-N 3.37Å; V53-R55 VanDerWaalsContact C-N 3.33Å; V53-R55 PolarHBondContact O-N 3.41Å; R55-V57 PolarHBondContact O-N 3.15Å; R55-A58 WeakPolarHBondContact O-CB 3.12Å; R55-A58 PolarHBondContact O-N 3.25Å; R55-E59 WeakPolarHBondContact O-CG 3.28Å; R55-E59 PolarHBondContact O-N 3.14Å |
| 56 | R | 91.6 | Very high | 80.2 | Confident | 84 Ų | 84 | 95.2 Ų | 95.2 | 32% | 0.317 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.6 | -37.3 | -178.7 | -174.2 | 59.2 | -173.3 | 143.1 | 5.4 | 112.4 | Y52 V53 A58 E59 L60 E63 | Y52-R56 HydrophobicContact CE1-CB 4.47Å; Y52-R56 WeakPolarHBondContact O-CB 3.4Å; Y52-R56 PolarHBondContact O-N 3.03Å; V53-R56 PolarHBondContact O-N 3.4Å; R56-A58 VanDerWaalsContact C-N 3.35Å; R56-E59 WeakPolarHBondContact CD-OE2 3.46Å; R56-E59 IonicContact CZ-OE2 3.03Å; R56-E59 IonicContact NH1-OE2 3.98Å; R56-E59 PolarHBondContact NH1-OE2 2.77Å; R56-E59 PolarHBondContact O-N 3.01Å; R56-L60 HydrophobicContact CG-CD1 4.29Å; R56-L60 VanDerWaalsContact NH2-CD2 3.31Å; R56-L60 WeakPolarHBondContact O-CB 3.26Å; R56-L60 WeakPolarHBondContact O-CG 3.28Å; R56-L60 PolarHBondContact O-N 3.42Å; R56-E63 IonicContact CZ-OE1 3.89Å; R56-E63 IonicContact NH1-OE1 2.75Å; R56-E63 PolarHBondContact NH1-OE1 3.15Å; R56-E63 VanDerWaalsContact NH1-OE1 3.12Å; R56-E63 IonicContact NH2-OE1 3.12Å |
| 57 | V | 90.1 | Very high | 81 | Confident | 75 Ų | 75 | 94.7 Ų | 94.7 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 173.3 | 170.5 | 0 | 0 | 0 | 0 | 110.7 | V53 R54 R55 L60 N61 | V53-V57 HydrophobicContact CG1-CG2 4.35Å; V53-V57 VanDerWaalsContact O-CG2 3.3Å; V53-V57 WeakPolarHBondContact O-CG2 3.44Å; V53-V57 PolarHBondContact O-N 3.43Å; R54-V57 PolarHBondContact O-N 3.33Å; R55-V57 PolarHBondContact O-N 3.15Å; V57-L60 PolarHBondContact O-N 2.91Å; V57-N61 WeakPolarHBondContact O-CB 3.49Å; V57-N61 VanDerWaalsContact O-CG 3.3Å; V57-N61 PolarHBondContact O-N 3.34Å; V57-N61 PolarHBondContact O-ND2 3.42Å |
| 58 | A | 89.3 | Confident | 81.9 | Confident | 59 Ų | 59 | 96.2 Ų | 96.2 | 49% | 0.488 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.2 | -41.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | R54 R55 R56 N61 L62 | R54-A58 WeakPolarHBondContact O-CB 3.32Å; R54-A58 PolarHBondContact O-N 3.19Å; R55-A58 WeakPolarHBondContact O-CB 3.12Å; R55-A58 PolarHBondContact O-N 3.25Å; R56-A58 VanDerWaalsContact C-N 3.35Å; A58-N61 PolarHBondContact O-N 3.26Å; A58-L62 PolarHBondContact O-N 3.42Å; A58-L62 VanDerWaalsContact O-N 3.07Å |
| 59 | E | 91.2 | Very high | 82.3 | Confident | 77 Ų | 77 | 95.3 Ų | 95.3 | 36% | 0.36 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61 | -48.4 | 174.5 | -72.8 | 169 | -168 | 0 | 0 | 112.1 | R55 R56 N61 L62 E63 | R55-E59 WeakPolarHBondContact O-CG 3.28Å; R55-E59 PolarHBondContact O-N 3.14Å; R56-E59 WeakPolarHBondContact CD-OE2 3.46Å; R56-E59 IonicContact CZ-OE2 3.03Å; R56-E59 IonicContact NH1-OE2 3.98Å; R56-E59 PolarHBondContact NH1-OE2 2.77Å; R56-E59 PolarHBondContact O-N 3.01Å; E59-N61 VanDerWaalsContact C-N 3.33Å; E59-N61 PolarHBondContact O-N 2.9Å; E59-L62 WeakPolarHBondContact O-CB 3.48Å; E59-L62 PolarHBondContact O-N 3.24Å; E59-L62 VanDerWaalsContact O-N 3.11Å; E59-E63 WeakPolarHBondContact O-CG 3.48Å; E59-E63 PolarHBondContact O-N 3.17Å |
| 60 | L | 92.3 | Very high | 82.2 | Confident | 79 Ų | 79 | 99.4 Ų | 99.4 | 41% | 0.414 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.9 | -40 | 178.9 | -76.2 | 171.7 | 0 | 0 | 0 | 112.2 | R56 V57 L62 E63 L64 | R56-L60 HydrophobicContact CG-CD1 4.29Å; R56-L60 VanDerWaalsContact NH2-CD2 3.31Å; R56-L60 WeakPolarHBondContact O-CB 3.26Å; R56-L60 WeakPolarHBondContact O-CG 3.28Å; R56-L60 PolarHBondContact O-N 3.42Å; V57-L60 PolarHBondContact O-N 2.91Å; L60-L62 VanDerWaalsContact C-N 3.3Å; L60-L62 PolarHBondContact O-N 3.1Å; L60-E63 PolarHBondContact O-N 3.14Å; L60-L64 WeakPolarHBondContact O-CB 3.37Å; L60-L64 PolarHBondContact O-N 3.15Å |
| 61 | N | 90.2 | Very high | 81.5 | Confident | 91 Ų | 91 | 101.6 Ų | 101.6 | 49% | 0.487 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.8 | -35.8 | 175.4 | -75 | -25.1 | 0 | 0 | 0 | 112 | V57 A58 E59 S65 | V57-N61 WeakPolarHBondContact O-CB 3.49Å; V57-N61 VanDerWaalsContact O-CG 3.3Å; V57-N61 PolarHBondContact O-N 3.34Å; V57-N61 PolarHBondContact O-ND2 3.42Å; A58-N61 PolarHBondContact O-N 3.26Å; E59-N61 VanDerWaalsContact C-N 3.33Å; E59-N61 PolarHBondContact O-N 2.9Å; N61-S65 PolarHBondContact O-N 3.13Å; N61-S65 VanDerWaalsContact O-N 3.07Å; N61-S65 PolarHBondContact O-OG 3.4Å; N61-S65 VanDerWaalsContact O-OG 3.11Å |
| 62 | L | 90.5 | Very high | 80.5 | Confident | 102 Ų | 102 | 102.2 Ų | 102.2 | 53% | 0.534 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.8 | -41.6 | 175.3 | -176.2 | 65.6 | 0 | 0 | 0 | 112 | A58 E59 L60 S65 K66 | A58-L62 PolarHBondContact O-N 3.42Å; A58-L62 VanDerWaalsContact O-N 3.07Å; E59-L62 WeakPolarHBondContact O-CB 3.48Å; E59-L62 PolarHBondContact O-N 3.24Å; E59-L62 VanDerWaalsContact O-N 3.11Å; L60-L62 VanDerWaalsContact C-N 3.3Å; L60-L62 PolarHBondContact O-N 3.1Å; L62-S65 PolarHBondContact O-N 3.46Å; L62-K66 WeakPolarHBondContact O-CG 3.48Å; L62-K66 PolarHBondContact O-N 3.01Å |
| 63 | E | 87.8 | Confident | 79.1 | Confident | 101 Ų | 101 | 100.9 Ų | 100.9 | 47% | 0.472 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.7 | -47.2 | 173.4 | -71.4 | 171.3 | -149.9 | 0 | 0 | 110.9 | R56 E59 L60 S65 K66 E67 | R56-E63 IonicContact CZ-OE1 3.89Å; R56-E63 IonicContact NH1-OE1 2.75Å; R56-E63 PolarHBondContact NH1-OE1 3.15Å; R56-E63 VanDerWaalsContact NH1-OE1 3.12Å; R56-E63 IonicContact NH2-OE1 3.12Å; E59-E63 WeakPolarHBondContact O-CG 3.48Å; E59-E63 PolarHBondContact O-N 3.17Å; L60-E63 PolarHBondContact O-N 3.14Å; E63-S65 PolarHBondContact O-N 3.25Å; E63-K66 PolarHBondContact O-N 3.35Å; E63-E67 PolarHBondContact O-N 3.48Å |
| 64 | L | 85.1 | Confident | 77.9 | Confident | 81 Ų | 81 | 98.8 Ų | 98.8 | 42% | 0.424 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64 | -38.9 | 179.8 | -173.3 | 67.7 | 0 | 0 | 0 | 112.7 | L60 E67 K68 | L60-L64 WeakPolarHBondContact O-CB 3.37Å; L60-L64 PolarHBondContact O-N 3.15Å; L64-E67 PolarHBondContact O-N 3.03Å; L64-K68 WeakPolarHBondContact O-CG 3.36Å; L64-K68 PolarHBondContact O-N 3.12Å; L64-K68 VanDerWaalsContact O-N 3.09Å |
| 65 | S | 80.4 | Confident | 76.2 | Confident | 73 Ų | 73 | 101.2 Ų | 101.2 | 51% | 0.51 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.3 | -41.7 | 175.9 | -70.1 | 0 | 0 | 0 | 0 | 112.3 | N61 L62 E63 K68 E69 | N61-S65 PolarHBondContact O-N 3.13Å; N61-S65 VanDerWaalsContact O-N 3.07Å; N61-S65 PolarHBondContact O-OG 3.4Å; N61-S65 VanDerWaalsContact O-OG 3.11Å; L62-S65 PolarHBondContact O-N 3.46Å; E63-S65 PolarHBondContact O-N 3.25Å; S65-K68 PolarHBondContact O-N 3.4Å; S65-E69 PolarHBondContact O-N 3.01Å; S65-E69 VanDerWaalsContact O-N 3.13Å |
| 66 | K | 80.8 | Confident | 74.4 | Confident | 129 Ų | 129 | 102.4 Ų | 102.4 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -66.1 | -37.9 | 176.3 | -71.8 | 175.6 | -179.8 | 176.9 | 0 | 112.3 | L62 E63 E69 Y70 | L62-K66 WeakPolarHBondContact O-CG 3.48Å; L62-K66 PolarHBondContact O-N 3.01Å; E63-K66 PolarHBondContact O-N 3.35Å; K66-E69 PolarHBondContact O-N 3.05Å; K66-Y70 PolarHBondContact O-N 3.07Å |
| 67 | E | 72.8 | Confident | 72.7 | Confident | 105 Ų | 105 | 107.1 Ų | 107.1 | 49% | 0.491 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.1 | -43 | 176.4 | -177 | 173.3 | -155.4 | 0 | 0 | 111.3 | E63 L64 E69 Y70 F71 | E63-E67 PolarHBondContact O-N 3.48Å; L64-E67 PolarHBondContact O-N 3.03Å; E67-E69 VanDerWaalsContact C-N 3.33Å; E67-E69 PolarHBondContact O-N 3.11Å; E67-Y70 PolarHBondContact O-N 3.41Å; E67-F71 HydrophobicContact CG-CD2 3.78Å; E67-F71 HydrophobicContact CG-CE2 3.41Å; E67-F71 VanDerWaalsContact CG-CE2 3.41Å; E67-F71 WeakPolarHBondContact O-CD2 3.45Å; E67-F71 PolarHBondContact O-N 3.21Å; E67-F71 VanDerWaalsContact O-N 3.08Å |
| 68 | K | 72.9 | Confident | 70.9 | Confident | 141 Ų | 141 | 112.3 Ų | 112.3 | 61% | 0.613 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -60.9 | -40.1 | 175.2 | -73.8 | 178.5 | 178.8 | 179.5 | 0 | 112.7 | L64 S65 F71 A72 | L64-K68 WeakPolarHBondContact O-CG 3.36Å; L64-K68 PolarHBondContact O-N 3.12Å; L64-K68 VanDerWaalsContact O-N 3.09Å; S65-K68 PolarHBondContact O-N 3.4Å; K68-F71 PolarHBondContact O-N 3.31Å; K68-A72 PolarHBondContact O-N 3.46Å; K68-A72 VanDerWaalsContact O-N 3.16Å |
| 69 | E | 70.6 | Confident | 69 | Low | 131 Ų | 131 | 113.7 Ų | 113.7 | 61% | 0.612 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -64.6 | -42.9 | 175.9 | -169.4 | 174.3 | -168.7 | 0 | 0 | 111.6 | S65 K66 E67 F71 A72 D73 | S65-E69 PolarHBondContact O-N 3.01Å; S65-E69 VanDerWaalsContact O-N 3.13Å; K66-E69 PolarHBondContact O-N 3.05Å; E67-E69 VanDerWaalsContact C-N 3.33Å; E67-E69 PolarHBondContact O-N 3.11Å; E69-F71 VanDerWaalsContact C-N 3.29Å; E69-F71 PolarHBondContact O-N 3.46Å; E69-A72 PolarHBondContact O-N 2.9Å; E69-D73 PolarHBondContact O-N 3.37Å |
| 70 | Y | 56.6 | Low | 66.9 | Low | 178 Ų | 178 | 112.8 Ų | 112.8 | 70% | 0.698 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.5 | -33.6 | 177.4 | -164.1 | -98.4 | 0 | 0 | 0 | 113.1 | K66 E67 S74 | K66-Y70 PolarHBondContact O-N 3.07Å; E67-Y70 PolarHBondContact O-N 3.41Å; Y70-S74 PolarHBondContact O-N 3.1Å; Y70-S74 PolarHBondContact O-OG 3.15Å |
| 71 | F | 55.9 | Low | 64.9 | Low | 104 Ų | 104 | 120 Ų | 120 | 46% | 0.456 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -72.7 | -35.1 | 175.2 | -77.2 | -63.8 | 0 | 0 | 0 | 113.2 | E67 K68 E69 Y75 | E67-F71 HydrophobicContact CG-CD2 3.78Å; E67-F71 HydrophobicContact CG-CE2 3.41Å; E67-F71 VanDerWaalsContact CG-CE2 3.41Å; E67-F71 WeakPolarHBondContact O-CD2 3.45Å; E67-F71 PolarHBondContact O-N 3.21Å; E67-F71 VanDerWaalsContact O-N 3.08Å; K68-F71 PolarHBondContact O-N 3.31Å; E69-F71 VanDerWaalsContact C-N 3.29Å; E69-F71 PolarHBondContact O-N 3.46Å; F71-Y75 PolarHBondContact O-N 2.89Å |
| 72 | A | 56.3 | Low | 63.2 | Low | 63 Ų | 63 | 120.4 Ų | 120.4 | 52% | 0.521 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -63.1 | -47.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | K68 E69 S74 | K68-A72 PolarHBondContact O-N 3.46Å; K68-A72 VanDerWaalsContact O-N 3.16Å; E69-A72 PolarHBondContact O-N 2.9Å; A72-S74 VanDerWaalsContact C-N 3.35Å; A72-S74 PolarHBondContact O-N 2.97Å |
| 73 | D | 53.4 | Low | 61.4 | Low | 109 Ų | 109 | 122 Ų | 122 | 58% | 0.583 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -69.6 | -29.9 | -177.1 | -79.6 | -8.1 | 0 | 0 | 0 | 113.7 | E69 | E69-D73 PolarHBondContact O-N 3.37Å |
| 74 | S | 54.9 | Low | 59.5 | Low | 37 Ų | 37 | 125.5 Ų | 125.5 | 26% | 0.259 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -85.7 | -27.1 | -176.5 | 84 | 0 | 0 | 0 | 0 | 113.8 | Y70 A72 K78 | Y70-S74 PolarHBondContact O-N 3.1Å; Y70-S74 PolarHBondContact O-OG 3.15Å; A72-S74 VanDerWaalsContact C-N 3.35Å; A72-S74 PolarHBondContact O-N 2.97Å; S74-K78 PolarHBondContact O-N 3.28Å |
| 75 | Y | 47.7 | Very low | 57.4 | Low | 161 Ų | 161 | 127.4 Ų | 127.4 | 63% | 0.631 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -70.8 | -44.5 | 179.4 | -107.2 | -89.9 | 0 | 0 | 0 | 111.6 | F71 K77 K78 T79 | F71-Y75 PolarHBondContact O-N 2.89Å; Y75-K77 PolarHBondContact O-N 3.07Å; Y75-K78 PolarHBondContact O-N 3.17Å; Y75-T79 PolarHBondContact O-N 2.78Å; Y75-T79 PolarHBondContact O-OG1 3.11Å |
| 76 | E | 52.1 | Low | 56.1 | Low | 170 Ų | 170 | 128.5 Ų | 128.5 | 79% | 0.794 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.5 | -33.9 | -176.3 | -151.5 | 179.9 | -161.2 | 0 | 0 | 112.6 | ||
| 77 | K | 55.1 | Low | 54.6 | Low | 184 Ų | 184 | 129.6 Ų | 129.6 | 80% | 0.8 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -76.1 | -28 | 178.9 | -77.3 | 179.1 | -179.9 | 167.4 | 0 | 114.4 | Y75 | Y75-K77 PolarHBondContact O-N 3.07Å |
| 78 | K | 53.3 | Low | 53.3 | Low | 183 Ų | 183 | 130.7 Ų | 130.7 | 80% | 0.796 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -92.4 | -30.5 | -175.4 | -78.8 | -177.3 | 179 | 174.5 | 0 | 113.7 | S74 Y75 G80 | S74-K78 PolarHBondContact O-N 3.28Å; Y75-K78 PolarHBondContact O-N 3.17Å; K78-G80 VanDerWaalsContact C-N 3.28Å; K78-G80 PolarHBondContact O-N 3.38Å; K78-G80 VanDerWaalsContact O-N 3.14Å |
| 79 | T | 50.1 | Low | 52.1 | Low | 88 Ų | 88 | 132.1 Ų | 132.1 | 54% | 0.54 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -88.8 | 74.2 | 172.1 | 62.2 | 0 | 0 | 0 | 0 | 108.7 | Y75 R81 | Y75-T79 PolarHBondContact O-N 2.78Å; Y75-T79 PolarHBondContact O-OG1 3.11Å; T79-R81 PolarHBondContact O-N 3.13Å |
| 80 | G | 45.9 | Very low | 50.9 | Low | 58 Ų | 58 | 135.5 Ų | 135.5 | 60% | 0.598 | 66% | 0.655 | S | S | * | * | trans | -47.9 | 120.8 | 162.9 | 0 | 0 | 0 | 0 | 0 | 107.4 | K78 V82 | K78-G80 VanDerWaalsContact C-N 3.28Å; K78-G80 PolarHBondContact O-N 3.38Å; K78-G80 VanDerWaalsContact O-N 3.14Å; G80-V82 WeakPolarHBondContact O-CG2 3.38Å; G80-V82 PolarHBondContact O-N 3.45Å | ||
| 81 | R | 49.8 | Very low | 50.4 | Low | 230 Ų | 230 | 131.7 Ų | 131.7 | 87% | 0.868 | 65% | 0.654 | S | S | * | * | trans | -28.6 | 96.3 | -176 | -116.4 | 177.5 | 174.2 | 165.9 | -2.5 | 110.6 | T79 N83 | T79-R81 PolarHBondContact O-N 3.13Å; R81-N83 PolarHBondContact O-N 3.45Å | ||
| 82 | V | 55.2 | Low | 49.7 | Very low | 100 Ų | 100 | 137.3 Ų | 137.3 | 61% | 0.606 | 67% | 0.672 | S | S | * | * | trans | -76 | 91.8 | 170.2 | -178.1 | 0 | 0 | 0 | 0 | 103.7 | G80 F84 | G80-V82 WeakPolarHBondContact O-CG2 3.38Å; G80-V82 PolarHBondContact O-N 3.45Å; V82-F84 HydrophobicContact CB-CE2 4.19Å; V82-F84 HydrophobicContact CG1-CD2 4.31Å; V82-F84 HydrophobicContact CG1-CE1 4.36Å; V82-F84 HydrophobicContact CG1-CE2 4.08Å; V82-F84 HydrophobicContact CG1-CZ 4.11Å; V82-F84 VanDerWaalsContact O-CD2 3.26Å; V82-F84 WeakPolarHBondContact O-CD2 3.36Å; V82-F84 PolarHBondContact O-N 3.09Å | ||
| 83 | N | 51.8 | Low | 49.2 | Very low | 137 Ų | 137 | 141.3 Ų | 141.3 | 73% | 0.733 | 68% | 0.683 | S | S | * | * | trans | -63.1 | 93.7 | 168.9 | -77.5 | -17.9 | 0 | 0 | 0 | 106.3 | R81 H85 | R81-N83 PolarHBondContact O-N 3.45Å; N83-H85 VanDerWaalsContact C-N 3.34Å; N83-H85 PolarHBondContact O-N 3.43Å | ||
| 84 | F | 48.9 | Very low | 48.8 | Very low | 174 Ų | 174 | 142 Ų | 142 | 76% | 0.763 | 69% | 0.686 | S | S | * | * | trans | -61.3 | 102 | 167.5 | -71.8 | -84.5 | 0 | 0 | 0 | 106.8 | V82 P86 | V82-F84 HydrophobicContact CB-CE2 4.19Å; V82-F84 HydrophobicContact CG1-CD2 4.31Å; V82-F84 HydrophobicContact CG1-CE1 4.36Å; V82-F84 HydrophobicContact CG1-CE2 4.08Å; V82-F84 HydrophobicContact CG1-CZ 4.11Å; V82-F84 VanDerWaalsContact O-CD2 3.26Å; V82-F84 WeakPolarHBondContact O-CD2 3.36Å; V82-F84 PolarHBondContact O-N 3.09Å; F84-P86 VanDerWaalsContact O-CD 3.28Å; F84-P86 WeakPolarHBondContact O-CD 3.33Å | ||
| 85 | H | 41.4 | Very low | 48 | Very low | 120 Ų | 120 | 143.9 Ų | 143.9 | 56% | 0.556 | 70% | 0.699 | S | S | * | * | trans | -69.2 | 116.4 | 171.4 | -165.4 | -83.7 | 0 | 0 | 0 | 106.5 | N83 Q87 L88 | N83-H85 VanDerWaalsContact C-N 3.34Å; N83-H85 PolarHBondContact O-N 3.43Å; H85-Q87 VanDerWaalsContact ND1-CB 3.28Å; H85-Q87 WeakPolarHBondContact ND1-CB 3.39Å; H85-Q87 PolarHBondContact O-N 3.03Å; H85-L88 PolarHBondContact O-N 3.41Å | ||
| 86 | P | 53 | Low | 48.1 | Very low | 97 Ų | 97 | 144.7 Ų | 144.7 | 63% | 0.63 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -58.5 | -17.4 | -172.3 | 19.2 | -30.5 | 0 | 0 | 0 | 113.6 | F84 L88 | F84-P86 VanDerWaalsContact O-CD 3.28Å; F84-P86 WeakPolarHBondContact O-CD 3.33Å; P86-L88 VanDerWaalsContact C-N 3.29Å; P86-L88 PolarHBondContact O-N 3.08Å |
| 87 | Q | 48 | Very low | 47.8 | Very low | 152 Ų | 152 | 143 Ų | 143 | 71% | 0.71 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -71.2 | -13.5 | 175 | -136.7 | 79.6 | 20.9 | 0 | 0 | 115.3 | H85 F89 | H85-Q87 VanDerWaalsContact ND1-CB 3.28Å; H85-Q87 WeakPolarHBondContact ND1-CB 3.39Å; H85-Q87 PolarHBondContact O-N 3.03Å; Q87-F89 VanDerWaalsContact C-N 3.33Å |
| 88 | L | 46.1 | Very low | 47.4 | Very low | 127 Ų | 127 | 138.2 Ų | 138.2 | 67% | 0.665 | 69% | 0.694 | S | S | * | * | G | 310 helix | trans | -90.9 | 11.1 | -179.7 | -68.2 | 178.4 | 0 | 0 | 0 | 113.9 | H85 P86 Y90 | H85-L88 PolarHBondContact O-N 3.41Å; P86-L88 VanDerWaalsContact C-N 3.29Å; P86-L88 PolarHBondContact O-N 3.08Å; L88-Y90 HydrophobicContact CD2-CE2 4.24Å; L88-Y90 PolarHBondContact O-N 3.42Å |
| 89 | F | 48.2 | Very low | 47.1 | Very low | 172 Ų | 172 | 133.2 Ų | 133.2 | 75% | 0.754 | 68% | 0.682 | S | S | * | * | trans | -67.8 | 73 | 160.4 | -84.2 | -90.4 | 0 | 0 | 0 | 109.6 | Q87 S91 | Q87-F89 VanDerWaalsContact C-N 3.33Å; F89-S91 PolarHBondContact O-N 2.99Å | ||
| 90 | Y | 44.4 | Very low | 47.2 | Very low | 202 Ų | 202 | 136.7 Ų | 136.7 | 79% | 0.792 | 69% | 0.692 | S | S | * | * | trans | -71.1 | 92.4 | 153.5 | -71.7 | -73.4 | 0 | 0 | 0 | 106.1 | L88 R92 | L88-Y90 HydrophobicContact CD2-CE2 4.24Å; L88-Y90 PolarHBondContact O-N 3.42Å; Y90-R92 PolarHBondContact O-N 3.16Å | ||
| 91 | S | 46 | Very low | 47.2 | Very low | 97 Ų | 97 | 140.6 Ų | 140.6 | 68% | 0.678 | 70% | 0.699 | S | S | * | * | trans | -56.4 | 92.5 | 160.5 | -58.4 | 0 | 0 | 0 | 0 | 106.9 | F89 I93 | F89-S91 PolarHBondContact O-N 2.99Å; S91-I93 PolarHBondContact O-N 2.91Å | ||
| 92 | R | 41 | Very low | 47.5 | Very low | 223 Ų | 223 | 136 Ų | 136 | 84% | 0.842 | 69% | 0.691 | S | S | * | * | trans | -66.2 | 92.7 | 158.7 | -175.8 | 177.5 | -68.7 | -161.5 | -1.3 | 104.1 | Y90 I94 | Y90-R92 PolarHBondContact O-N 3.16Å; R92-I94 VanDerWaalsContact C-N 3.26Å; R92-I94 PolarHBondContact O-N 2.83Å | ||
| 93 | I | 46.7 | Very low | 47.3 | Very low | 146 Ų | 146 | 137.8 Ų | 137.8 | 75% | 0.749 | 70% | 0.697 | S | S | * | * | trans | -59.2 | 102.4 | 168.3 | -41.4 | 172.7 | 0 | 0 | 0 | 103.5 | S91 S95 | S91-I93 PolarHBondContact O-N 2.91Å; I93-S95 VanDerWaalsContact C-N 3.26Å; I93-S95 PolarHBondContact O-N 2.91Å | ||
| 94 | I | 45 | Very low | 46.9 | Very low | 124 Ų | 124 | 138.5 Ų | 138.5 | 64% | 0.636 | 70% | 0.701 | S | S | * | * | trans | -68.8 | 99.6 | 169.5 | -56.7 | 171.5 | 0 | 0 | 0 | 102.9 | R92 Q96 | R92-I94 VanDerWaalsContact C-N 3.26Å; R92-I94 PolarHBondContact O-N 2.83Å; I94-Q96 PolarHBondContact O-N 2.98Å; I94-Q96 VanDerWaalsContact O-N 3.16Å | ||
| 95 | S | 38.8 | Very low | 47 | Very low | 76 Ų | 76 | 136.9 Ų | 136.9 | 53% | 0.531 | 69% | 0.694 | S | S | . | * | trans | -52.3 | 124.4 | 168.8 | -72.8 | 0 | 0 | 0 | 0 | 106.9 | I93 D97 S98 | I93-S95 VanDerWaalsContact C-N 3.26Å; I93-S95 PolarHBondContact O-N 2.91Å; S95-D97 PolarHBondContact O-N 3.43Å; S95-S98 PolarHBondContact O-N 3.43Å | ||
| 96 | Q | 49.7 | Very low | 47.5 | Very low | 179 Ų | 179 | 134.3 Ų | 134.3 | 84% | 0.836 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -56.3 | -21.1 | -178.8 | -72.4 | 178.6 | -21.7 | 0 | 0 | 112 | I94 S98 | I94-Q96 PolarHBondContact O-N 2.98Å; I94-Q96 VanDerWaalsContact O-N 3.16Å; Q96-S98 VanDerWaalsContact C-N 3.33Å; Q96-S98 PolarHBondContact O-N 3.3Å |
| 97 | D | 45.5 | Very low | 47.7 | Very low | 134 Ų | 134 | 137.5 Ų | 137.5 | 72% | 0.717 | 70% | 0.696 | S | S | * | * | G | 310 helix | trans | -82 | -0.7 | 178.7 | -50.2 | -27.6 | 0 | 0 | 0 | 114.2 | S95 | S95-D97 PolarHBondContact O-N 3.43Š|
| 98 | S | 45.5 | Very low | 48.3 | Very low | 83 Ų | 83 | 136 Ų | 136 | 58% | 0.58 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -95.5 | 3.6 | 179.4 | -176.6 | 0 | 0 | 0 | 0 | 113.8 | S95 Q96 E100 | S95-S98 PolarHBondContact O-N 3.43Å; Q96-S98 VanDerWaalsContact C-N 3.33Å; Q96-S98 PolarHBondContact O-N 3.3Å; S98-E100 PolarHBondContact O-N 3.49Å |
| 99 | C | 48.7 | Very low | 49 | Very low | 79 Ų | 79 | 135.2 Ų | 135.2 | 53% | 0.534 | 69% | 0.686 | S | S | . | * | G | 310 helix | trans | -81 | 3.4 | -178.8 | -67.7 | 0 | 0 | 0 | 0 | 114 | ||
| 100 | E | 50.5 | Low | 49.6 | Very low | 160 Ų | 160 | 132.3 Ų | 132.3 | 75% | 0.748 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -79 | -19.6 | -177.3 | -77.8 | 152.1 | -179.6 | 0 | 0 | 113.6 | S98 L102 | S98-E100 PolarHBondContact O-N 3.49Å; E100-L102 PolarHBondContact O-N 3.28Å |
| 101 | D | 47.9 | Very low | 50.4 | Low | 141 Ų | 141 | 126.7 Ų | 126.7 | 75% | 0.754 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -82.4 | -4.4 | -179 | -93.4 | 0.6 | 0 | 0 | 0 | 115 | ||
| 102 | L | 54.2 | Low | 51 | Low | 134 Ų | 134 | 128.4 Ų | 128.4 | 70% | 0.702 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -94.7 | 1 | -177 | -64.9 | -177.2 | 0 | 0 | 0 | 114.7 | E100 | E100-L102 PolarHBondContact O-N 3.28Š|
| 103 | N | 51 | Low | 51.8 | Low | 137 Ų | 137 | 122.6 Ų | 122.6 | 73% | 0.733 | 64% | 0.642 | S | S | * | * | trans | -99.1 | 4 | 177.2 | -78.9 | -27.6 | 0 | 0 | 0 | 114.3 | F105 | N103-F105 PolarHBondContact O-N 2.86Š| ||
| 104 | D | 44.7 | Very low | 52.4 | Low | 152 Ų | 152 | 119.4 Ų | 119.4 | 81% | 0.813 | 63% | 0.629 | S | S | * | * | trans | -78.4 | 56.1 | 168.8 | -88.2 | 0.2 | 0 | 0 | 0 | 111 | S106 | D104-S106 PolarHBondContact O-N 3.45Š| ||
| 105 | F | 50.9 | Low | 53 | Low | 140 Ų | 140 | 121 Ų | 121 | 61% | 0.614 | 63% | 0.631 | S | S | * | * | trans | -78.6 | 102.6 | 152.9 | -69.8 | -76.2 | 0 | 0 | 0 | 106 | N103 E107 | N103-F105 PolarHBondContact O-N 2.86Å; F105-E107 PolarHBondContact O-N 3.49Å | ||
| 106 | S | 51.8 | Low | 53.6 | Low | 66 Ų | 66 | 123.7 Ų | 123.7 | 46% | 0.462 | 64% | 0.639 | S | S | . | * | trans | -59.5 | 140.1 | 175.9 | 76.3 | 0 | 0 | 0 | 0 | 109.3 | D104 D108 E109 | D104-S106 PolarHBondContact O-N 3.45Å; S106-D108 PolarHBondContact O-N 3.4Å; S106-E109 PolarHBondContact O-N 3.03Å | ||
| 107 | E | 57.9 | Low | 53.7 | Low | 163 Ų | 163 | 119.5 Ų | 119.5 | 76% | 0.762 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -51.9 | -25.9 | 177.5 | -115.5 | 176 | 169.4 | 0 | 0 | 112.4 | F105 M110 N111 | F105-E107 PolarHBondContact O-N 3.49Å; E107-M110 PolarHBondContact O-N 3.4Å; E107-N111 WeakPolarHBondContact O-CB 3.4Å; E107-N111 VanDerWaalsContact O-CG 3.26Å; E107-N111 PolarHBondContact O-N 2.93Å; E107-N111 PolarHBondContact O-ND2 2.98Å; E107-N111 VanDerWaalsContact O-ND2 3.08Å |
| 108 | D | 59.1 | Low | 53.3 | Low | 121 Ų | 121 | 120.2 Ų | 120.2 | 65% | 0.647 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -64.3 | -38.9 | 177.1 | -67.1 | -26.5 | 0 | 0 | 0 | 112.9 | S106 N111 E112 | S106-D108 PolarHBondContact O-N 3.4Å; D108-N111 PolarHBondContact O-N 3.46Å; D108-E112 PolarHBondContact O-N 2.89Å |
| 109 | E | 61 | Low | 52.9 | Low | 111 Ų | 111 | 122.7 Ų | 122.7 | 52% | 0.519 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -71.3 | -36.3 | -179.4 | -157.5 | 174.2 | -158.8 | 0 | 0 | 111.1 | S106 E112 L113 | S106-E109 PolarHBondContact O-N 3.03Å; E109-E112 PolarHBondContact O-N 3.48Å; E109-L113 WeakPolarHBondContact O-CG 3.3Å; E109-L113 PolarHBondContact O-N 3.2Å |
| 110 | M | 62 | Low | 52.6 | Low | 111 Ų | 111 | 126.5 Ų | 126.5 | 55% | 0.547 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -70.6 | -32.3 | 173.7 | -68.3 | -63.9 | -75.9 | 0 | 0 | 112.6 | E107 L113 T114 | E107-M110 PolarHBondContact O-N 3.4Å; M110-L113 PolarHBondContact O-N 3.5Å; M110-L113 HydrophobicContact SD-CD1 3.93Å; M110-T114 PolarHBondContact O-N 3.31Å; M110-T114 PolarHBondContact O-OG1 3.42Å |
| 111 | N | 59.6 | Low | 51.7 | Low | 83 Ų | 83 | 122.5 Ų | 122.5 | 44% | 0.444 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -71.3 | -33.8 | 175 | -76.7 | -34.8 | 0 | 0 | 0 | 112.5 | E107 D108 T114 K115 | E107-N111 WeakPolarHBondContact O-CB 3.4Å; E107-N111 VanDerWaalsContact O-CG 3.26Å; E107-N111 PolarHBondContact O-N 2.93Å; E107-N111 PolarHBondContact O-ND2 2.98Å; E107-N111 VanDerWaalsContact O-ND2 3.08Å; D108-N111 PolarHBondContact O-N 3.46Å; N111-T114 PolarHBondContact O-N 2.99Å; N111-K115 WeakPolarHBondContact O-CG 3.43Å; N111-K115 PolarHBondContact O-N 2.93Å |
| 112 | E | 60.1 | Low | 51.1 | Low | 133 Ų | 133 | 123.5 Ų | 123.5 | 62% | 0.621 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -63.6 | -40.3 | 170.7 | -82.9 | -140.5 | 152.8 | 0 | 0 | 112.4 | D108 E109 T114 K115 L116 | D108-E112 PolarHBondContact O-N 2.89Å; E109-E112 PolarHBondContact O-N 3.48Å; E112-T114 VanDerWaalsContact C-N 3.26Å; E112-T114 PolarHBondContact O-N 2.97Å; E112-K115 PolarHBondContact O-N 3.2Å; E112-L116 PolarHBondContact O-N 3.15Å |
| 113 | L | 57.5 | Low | 50.1 | Low | 102 Ų | 102 | 122.9 Ų | 122.9 | 53% | 0.534 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -62.3 | -34.7 | 176 | -67.8 | 173.4 | 0 | 0 | 0 | 112.4 | E109 M110 S117 | E109-L113 WeakPolarHBondContact O-CG 3.3Å; E109-L113 PolarHBondContact O-N 3.2Å; M110-L113 PolarHBondContact O-N 3.5Å; M110-L113 HydrophobicContact SD-CD1 3.93Å; L113-S117 PolarHBondContact O-N 3.45Å |
| 114 | T | 59.4 | Low | 49.3 | Very low | 79 Ų | 79 | 122.7 Ų | 122.7 | 49% | 0.485 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -71 | -36.4 | 177.5 | -47.8 | 0 | 0 | 0 | 0 | 111.4 | M110 N111 E112 S117 | M110-T114 PolarHBondContact O-N 3.31Å; M110-T114 PolarHBondContact O-OG1 3.42Å; N111-T114 PolarHBondContact O-N 2.99Å; E112-T114 VanDerWaalsContact C-N 3.26Å; E112-T114 PolarHBondContact O-N 2.97Å; T114-S117 PolarHBondContact O-N 2.93Å |
| 115 | K | 56.7 | Low | 48.7 | Very low | 156 Ų | 156 | 120.9 Ų | 120.9 | 68% | 0.678 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -69.6 | -37.6 | 177.2 | -70.9 | 173.9 | -176.1 | 173.9 | 0 | 113 | N111 E112 S117 H118 | N111-K115 WeakPolarHBondContact O-CG 3.43Å; N111-K115 PolarHBondContact O-N 2.93Å; E112-K115 PolarHBondContact O-N 3.2Å; K115-S117 VanDerWaalsContact C-N 3.28Å; K115-S117 PolarHBondContact O-N 3.04Å; K115-H118 PolarHBondContact O-N 3.07Å |
| 116 | L | 52.7 | Low | 47.9 | Very low | 133 Ų | 133 | 123.4 Ų | 123.4 | 70% | 0.696 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -70.4 | -24.7 | 177.2 | -74.8 | 167.5 | 0 | 0 | 0 | 113.1 | E112 | E112-L116 PolarHBondContact O-N 3.15Å |
| 117 | S | 50.4 | Low | 47.1 | Very low | 91 Ų | 91 | 125.9 Ų | 125.9 | 64% | 0.636 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | -14.7 | 178.1 | -177 | 0 | 0 | 0 | 0 | 113.7 | L113 T114 K115 | L113-S117 PolarHBondContact O-N 3.45Å; T114-S117 PolarHBondContact O-N 2.93Å; K115-S117 VanDerWaalsContact C-N 3.28Å; K115-S117 PolarHBondContact O-N 3.04Å |
| 118 | H | 37 | Very low | 45.8 | Very low | 149 Ų | 149 | 124.7 Ų | 124.7 | 69% | 0.69 | 69% | 0.685 | S | S | * | * | trans | -107.1 | 35 | -172.2 | -88.3 | 45.1 | 0 | 0 | 0 | 114.4 | K115 | K115-H118 PolarHBondContact O-N 3.07Š| ||
| 119 | N | 38.8 | Very low | 44.5 | Very low | 136 Ų | 136 | 127.3 Ų | 127.3 | 73% | 0.727 | 70% | 0.695 | S | S | * | * | trans | -111.6 | 63.5 | 162.1 | -76 | -39.1 | 0 | 0 | 0 | 109.5 | ||||
| 120 | D | 40.8 | Very low | 43.2 | Very low | 159 Ų | 159 | 128.1 Ų | 128.1 | 85% | 0.85 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -160.3 | 112.4 | 146.1 | -88.4 | -34.8 | 0 | 0 | 0 | 106.4 | D122 | D120-D122 PolarHBondContact O-N 3.41Å; D120-D122 VanDerWaalsContact O-N 3.11Å |
| 121 | G | 31.9 | Very low | 41.8 | Very low | 76 Ų | 76 | 126.9 Ų | 126.9 | 78% | 0.784 | 71% | 0.711 | S | S | * | * | trans | -67.3 | 108.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 122 | D | 36.3 | Very low | 40.3 | Very low | 161 Ų | 161 | 130.2 Ų | 130.2 | 86% | 0.861 | 73% | 0.729 | S | S | * | * | trans | -154.7 | 140.8 | 137 | -105.4 | -25.6 | 0 | 0 | 0 | 111.7 | D120 | D120-D122 PolarHBondContact O-N 3.41Å; D120-D122 VanDerWaalsContact O-N 3.11Å | ||
| 123 | T | 33.5 | Very low | 39.1 | Very low | 122 Ų | 122 | 131.4 Ų | 131.4 | 75% | 0.748 | 74% | 0.738 | S | S | * | * | trans | -61.8 | 137.4 | -164.2 | 35.1 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 124 | V | 32.9 | Very low | 37.7 | Very low | 132 Ų | 132 | 137 Ų | 137 | 80% | 0.8 | 75% | 0.752 | S | S | * | * | trans | 70.3 | 96.2 | 145.2 | -172 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 125 | S | 32.1 | Very low | 36.4 | Very low | 115 Ų | 115 | 140.9 Ų | 140.9 | 80% | 0.804 | 77% | 0.765 | S | S | * | * | trans | -162.2 | 107.9 | 130.2 | -79.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 126 | K | 33.7 | Very low | 35.4 | Very low | 193 Ų | 193 | 139.4 Ų | 139.4 | 84% | 0.839 | 77% | 0.774 | S | S | * | * | trans | -60.7 | 130.3 | 172.3 | -65.2 | 176.3 | 178.1 | 179.9 | 0 | 108.8 | I128 | K126-I128 PolarHBondContact O-N 3.05Å; K126-I128 VanDerWaalsContact O-N 3.1Å | ||
| 127 | P | 35.3 | Very low | 34.3 | Very low | 118 Ų | 118 | 140.6 Ų | 140.6 | 77% | 0.766 | 78% | 0.776 | S | S | * | * | trans | -68.6 | 111.2 | 164.8 | 26.5 | -28.5 | 0 | 0 | 0 | 107.7 | M129 | P127-M129 PolarHBondContact O-N 2.89Š| ||
| 128 | I | 31.9 | Very low | 33.3 | Very low | 137 Ų | 137 | 144.5 Ų | 144.5 | 70% | 0.703 | 78% | 0.784 | S | S | * | * | trans | -65.4 | 100.2 | 170.4 | -65.6 | 173.5 | 0 | 0 | 0 | 106.5 | K126 N130 | K126-I128 PolarHBondContact O-N 3.05Å; K126-I128 VanDerWaalsContact O-N 3.1Å; I128-N130 VanDerWaalsContact C-N 3.27Å; I128-N130 WeakPolarHBondContact CG2-OD1 3.49Å; I128-N130 PolarHBondContact O-N 2.9Å | ||
| 129 | M | 31.6 | Very low | 33 | Very low | 177 Ų | 177 | 149.1 Ų | 149.1 | 87% | 0.872 | 80% | 0.795 | S | S | * | * | trans | -62.8 | 88.7 | 165.6 | -81.6 | -149.6 | -81.8 | 0 | 0 | 109 | P127 A131 | P127-M129 PolarHBondContact O-N 2.89Å; M129-A131 VanDerWaalsContact C-N 3.26Å; M129-A131 PolarHBondContact O-N 3.44Å | ||
| 130 | N | 32.6 | Very low | 32.6 | Very low | 127 Ų | 127 | 149.1 Ų | 149.1 | 68% | 0.679 | 80% | 0.8 | S | S | * | * | trans | -86.1 | 78.6 | 162.7 | -75.1 | -12.7 | 0 | 0 | 0 | 108.3 | I128 N132 | I128-N130 VanDerWaalsContact C-N 3.27Å; I128-N130 WeakPolarHBondContact CG2-OD1 3.49Å; I128-N130 PolarHBondContact O-N 2.9Å; N130-N132 PolarHBondContact O-N 2.79Å | ||
| 131 | A | 32.3 | Very low | 32.3 | Very low | 85 Ų | 85 | 146.5 Ų | 146.5 | 70% | 0.702 | 80% | 0.795 | S | S | * | * | trans | -65.4 | 82.6 | 160.6 | 0 | 0 | 0 | 0 | 0 | 109 | M129 L133 | M129-A131 VanDerWaalsContact C-N 3.26Å; M129-A131 PolarHBondContact O-N 3.44Å; A131-L133 PolarHBondContact O-N 2.96Å | ||
| 132 | N | 29.6 | Very low | 32.3 | Very low | 154 Ų | 154 | 148.6 Ų | 148.6 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | trans | -80.4 | 68.7 | 162 | -81 | -44 | 0 | 0 | 0 | 109 | N130 R134 | N130-N132 PolarHBondContact O-N 2.79Å; N132-R134 PolarHBondContact O-N 3.14Å; N132-R134 VanDerWaalsContact O-N 3.16Å | ||
| 133 | L | 33.7 | Very low | 32 | Very low | 157 Ų | 157 | 148.5 Ų | 148.5 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | trans | -82.9 | 65.3 | 169.9 | -162.8 | 86.2 | 0 | 0 | 0 | 109 | A131 | A131-L133 PolarHBondContact O-N 2.96Š| ||
| 134 | R | 28.9 | Very low | 31.9 | Very low | 219 Ų | 219 | 147.5 Ų | 147.5 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | trans | -142.8 | 93.5 | 168.9 | -75.2 | -155 | 178.6 | -153.1 | 0.7 | 113.7 | N132 | N132-R134 PolarHBondContact O-N 3.14Å; N132-R134 VanDerWaalsContact O-N 3.16Å | ||
| 135 | H | 32.1 | Very low | 31.7 | Very low | 162 Ų | 162 | 143.4 Ų | 143.4 | 75% | 0.75 | 77% | 0.77 | S | S | * | * | trans | 63.8 | 85.9 | 131.2 | -57.1 | 21.2 | 0 | 0 | 0 | 116.1 | ||||
| 136 | S | 34.9 | Very low | 31.8 | Very low | 124 Ų | 124 | 144.5 Ų | 144.5 | 87% | 0.867 | 77% | 0.774 | S | S | * | * | trans | -110.8 | 80.8 | 144.4 | -178.2 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 137 | Q | 29.9 | Very low | 31.7 | Very low | 159 Ų | 159 | 140.6 Ų | 140.6 | 74% | 0.743 | 77% | 0.767 | S | S | * | * | trans | -76.7 | 147.5 | 152.1 | -72 | 179.1 | -11.3 | 0 | 0 | 107.2 | ||||
| 138 | Q | 29.2 | Very low | 31.5 | Very low | 173 Ų | 173 | 142.2 Ų | 142.2 | 81% | 0.808 | 77% | 0.769 | S | S | * | * | trans | 87.8 | 91 | 166.1 | -48.6 | 179.7 | 1.6 | 0 | 0 | 116 | ||||
| 139 | R | 32.1 | Very low | 31.4 | Very low | 245 Ų | 245 | 142.6 Ų | 142.6 | 93% | 0.925 | 77% | 0.771 | S | S | * | * | -160.4 | 106.4 | 103.6 | -102.4 | 172.4 | 162.6 | -154.8 | -9.7 | 111.3 | |||||
| 140 | T | 29.8 | Very low | 31.4 | Very low | 136 Ų | 136 | 139.7 Ų | 139.7 | 83% | 0.834 | 76% | 0.763 | S | S | * | * | trans | -42.8 | 144 | 149.4 | 43.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 141 | S | 33.3 | Very low | 31.4 | Very low | 105 Ų | 105 | 142.9 Ų | 142.9 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | trans | 148 | 107.7 | 135 | 179.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 142 | V | 32 | Very low | 31.2 | Very low | 119 Ų | 119 | 144.7 Ų | 144.7 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | trans | 67.3 | 91.3 | 152.6 | -169.3 | 0 | 0 | 0 | 0 | 115.7 | P144 | V142-P144 VanDerWaalsContact O-CD 3.27Å; V142-P144 WeakPolarHBondContact O-CD 3.44Å | ||
| 143 | I | 31 | Very low | 31.3 | Very low | 159 Ų | 159 | 143.8 Ų | 143.8 | 82% | 0.815 | 77% | 0.767 | S | S | * | * | trans | -58.4 | 115.4 | 147.6 | -59.3 | 166.7 | 0 | 0 | 0 | 106.4 | G145 | I143-G145 PolarHBondContact O-N 3.09Š| ||
| 144 | P | 31 | Very low | 31.2 | Very low | 101 Ų | 101 | 144.8 Ų | 144.8 | 66% | 0.656 | 77% | 0.772 | S | S | * | * | trans | -66.1 | 121.6 | 160.5 | -6.8 | 24.3 | 0 | 0 | 0 | 105.9 | V142 | V142-P144 VanDerWaalsContact O-CD 3.27Å; V142-P144 WeakPolarHBondContact O-CD 3.44Å | ||
| 145 | G | 28.4 | Very low | 31.1 | Very low | 46 Ų | 46 | 137.5 Ų | 137.5 | 47% | 0.474 | 77% | 0.765 | S | S | . | * | trans | -53.4 | 165.1 | 168.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | I143 V147 | I143-G145 PolarHBondContact O-N 3.09Å; G145-V147 PolarHBondContact O-N 2.79Å | ||
| 146 | P | 34.8 | Very low | 31.1 | Very low | 138 Ų | 138 | 141 Ų | 141 | 90% | 0.896 | 77% | 0.772 | S | S | * | * | trans | -55.3 | 110.8 | -171.4 | 23.1 | -33 | 0 | 0 | 0 | 110.4 | N148 | P146-N148 PolarHBondContact O-N 3.38Å; P146-N148 VanDerWaalsContact O-N 3.09Å | ||
| 147 | V | 31.7 | Very low | 30.7 | Very low | 112 Ų | 112 | 144.1 Ų | 144.1 | 68% | 0.679 | 77% | 0.773 | S | S | * | * | trans | -70.5 | 107.4 | 168.5 | 177.8 | 0 | 0 | 0 | 0 | 105.8 | G145 I149 | G145-V147 PolarHBondContact O-N 2.79Å; V147-I149 HydrophobicContact CG1-CG1 4.38Å; V147-I149 PolarHBondContact O-N 3.32Å | ||
| 148 | N | 29.8 | Very low | 30.8 | Very low | 152 Ų | 152 | 140.6 Ų | 140.6 | 81% | 0.813 | 77% | 0.77 | S | S | * | * | trans | -59.3 | 90.9 | 163.6 | -116.1 | -15.5 | 0 | 0 | 0 | 107.4 | P146 T150 | P146-N148 PolarHBondContact O-N 3.38Å; P146-N148 VanDerWaalsContact O-N 3.09Å; N148-T150 PolarHBondContact O-N 3.02Å | ||
| 149 | I | 30.6 | Very low | 30.9 | Very low | 145 Ų | 145 | 137.9 Ų | 137.9 | 74% | 0.744 | 77% | 0.77 | S | S | * | * | trans | -79.3 | 87 | 163.8 | -15.7 | 177.5 | 0 | 0 | 0 | 105.3 | V147 E151 | V147-I149 HydrophobicContact CG1-CG1 4.38Å; V147-I149 PolarHBondContact O-N 3.32Å; I149-E151 PolarHBondContact O-N 2.84Å | ||
| 150 | T | 31.1 | Very low | 30.7 | Very low | 115 Ų | 115 | 133.6 Ų | 133.6 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | trans | -52.8 | 126 | 159.4 | 20.6 | 0 | 0 | 0 | 0 | 108.2 | N148 N152 | N148-T150 PolarHBondContact O-N 3.02Å; T150-N152 PolarHBondContact O-N 3.49Å | ||
| 151 | E | 33.2 | Very low | 30.7 | Very low | 194 Ų | 194 | 134 Ų | 134 | 91% | 0.907 | 76% | 0.76 | S | S | * | * | trans | -40.9 | 99.6 | 173.6 | -65.1 | 174 | 160.4 | 0 | 0 | 111.3 | I149 | I149-E151 PolarHBondContact O-N 2.84Š| ||
| 152 | N | 28.3 | Very low | 30.7 | Very low | 124 Ų | 124 | 136.3 Ų | 136.3 | 66% | 0.663 | 76% | 0.764 | S | S | * | * | trans | -112.1 | 90.5 | 165.6 | 81.3 | -30.1 | 0 | 0 | 0 | 110.4 | T150 L154 | T150-N152 PolarHBondContact O-N 3.49Å; N152-L154 PolarHBondContact O-N 3.32Å | ||
| 153 | N | 31.6 | Very low | 30.7 | Very low | 134 Ų | 134 | 139.3 Ų | 139.3 | 72% | 0.717 | 77% | 0.767 | S | S | * | * | trans | 43.3 | 74.3 | 130.3 | -62.7 | -64.5 | 0 | 0 | 0 | 117.4 | ||||
| 154 | L | 31.4 | Very low | 30.6 | Very low | 178 Ų | 178 | 140.4 Ų | 140.4 | 93% | 0.932 | 77% | 0.769 | S | S | * | * | trans | -151.3 | 119 | 142.6 | -85.1 | 119.6 | 0 | 0 | 0 | 106 | N152 | N152-L154 PolarHBondContact O-N 3.32Š| ||
| 155 | G | 27.7 | Very low | 30.6 | Very low | 66 Ų | 66 | 142.9 Ų | 142.9 | 68% | 0.68 | 78% | 0.777 | S | S | * | * | cis | -146.2 | 131.5 | 11.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | Q157 | G155-Q157 VanDerWaalsContact C-N 3.28Å; G155-Q157 PolarHBondContact O-N 2.87Å | ||
| 156 | R | 30.5 | Very low | 30.6 | Very low | 237 Ų | 237 | 148.3 Ų | 148.3 | 89% | 0.894 | 80% | 0.795 | S | S | * | * | trans | -62 | 87 | 157 | -67 | 175.9 | 172.6 | -138.9 | -0.8 | 109.4 | ||||
| 157 | Q | 28.1 | Very low | 30.6 | Very low | 189 Ų | 189 | 148.3 Ų | 148.3 | 88% | 0.883 | 79% | 0.792 | S | S | * | * | trans | -154.6 | 112.9 | 156.5 | -65.1 | -158.3 | 54.5 | 0 | 0 | 105 | G155 | G155-Q157 VanDerWaalsContact C-N 3.28Å; G155-Q157 PolarHBondContact O-N 2.87Å | ||
| 158 | A | 31.1 | Very low | 30.4 | Very low | 84 Ų | 84 | 151.5 Ų | 151.5 | 69% | 0.694 | 80% | 0.799 | S | S | * | * | cis | -152 | 112.1 | 19.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 159 | S | 30.7 | Very low | 30.5 | Very low | 116 Ų | 116 | 151.7 Ų | 151.7 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -102.5 | 73.7 | 157.8 | -67.2 | 0 | 0 | 0 | 0 | 107.3 | I161 | S159-I161 PolarHBondContact O-N 3.02Š| ||
| 160 | L | 28.5 | Very low | 30.4 | Very low | 155 Ų | 155 | 150.9 Ų | 150.9 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | trans | -70 | 83.9 | 153.3 | -81 | 165.9 | 0 | 0 | 0 | 106 | L162 | L160-L162 PolarHBondContact O-N 3.2Š| ||
| 161 | I | 29.9 | Very low | 30.2 | Very low | 144 Ų | 144 | 150 Ų | 150 | 74% | 0.738 | 79% | 0.79 | S | S | * | * | trans | -67.5 | 88.7 | 160.2 | -61.1 | 171.9 | 0 | 0 | 0 | 104.8 | S159 K163 | S159-I161 PolarHBondContact O-N 3.02Å; I161-K163 PolarHBondContact O-N 3.4Å; I161-K163 VanDerWaalsContact O-N 3.15Å | ||
| 162 | L | 33.4 | Very low | 29.9 | Very low | 154 Ų | 154 | 150.3 Ų | 150.3 | 81% | 0.806 | 78% | 0.783 | S | S | * | * | trans | -61.7 | 111.2 | 158.9 | -89.9 | 154.6 | 0 | 0 | 0 | 105.8 | L160 E164 | L160-L162 PolarHBondContact O-N 3.2Å; L162-E164 PolarHBondContact O-N 3.23Å; L162-E164 VanDerWaalsContact O-N 3.1Å | ||
| 163 | K | 30.8 | Very low | 30.1 | Very low | 182 Ų | 182 | 151.4 Ų | 151.4 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | trans | -49.7 | 113.8 | 174.2 | -73.1 | 172.8 | 173.1 | 178.3 | 0 | 109.2 | I161 N165 | I161-K163 PolarHBondContact O-N 3.4Å; I161-K163 VanDerWaalsContact O-N 3.15Å; K163-N165 PolarHBondContact O-N 2.79Å | ||
| 164 | E | 30.7 | Very low | 30 | Very low | 182 Ų | 182 | 149.8 Ų | 149.8 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 121.8 | 160.4 | -67.9 | -179 | 160 | 0 | 0 | 107.7 | L162 N166 | L162-E164 PolarHBondContact O-N 3.23Å; L162-E164 VanDerWaalsContact O-N 3.1Å; E164-N166 PolarHBondContact O-N 3.23Å |
| 165 | N | 29.6 | Very low | 29.6 | Very low | 154 Ų | 154 | 146.9 Ų | 146.9 | 82% | 0.824 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 117.5 | 172.6 | -76.6 | -46.1 | 0 | 0 | 0 | 108.3 | K163 V167 | K163-N165 PolarHBondContact O-N 2.79Å; N165-V167 PolarHBondContact O-N 3.32Å |
| 166 | N | 29.1 | Very low | 29.6 | Very low | 160 Ų | 160 | 150.3 Ų | 150.3 | 86% | 0.856 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 124.8 | 165 | -65.3 | -54.7 | 0 | 0 | 0 | 110.5 | E164 | E164-N166 PolarHBondContact O-N 3.23Š|
| 167 | V | 34.7 | Very low | 29.7 | Very low | 138 Ų | 138 | 146 Ų | 146 | 84% | 0.836 | 78% | 0.776 | S | S | * | * | trans | -123.2 | 86.1 | 152.2 | 179.5 | 0 | 0 | 0 | 0 | 107 | N165 | N165-V167 PolarHBondContact O-N 3.32Š| ||
| 168 | E | 28.3 | Very low | 29.7 | Very low | 178 Ų | 178 | 142.3 Ų | 142.3 | 83% | 0.832 | 77% | 0.766 | S | S | * | * | trans | 34.2 | 108.6 | 131.7 | -141.8 | 164.5 | -172.5 | 0 | 0 | 119.4 | ||||
| 169 | E | 30.5 | Very low | 29.9 | Very low | 157 Ų | 157 | 146 Ų | 146 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | trans | 3.1 | 150.7 | 135.8 | -109.1 | -173.1 | -163 | 0 | 0 | 120.3 | ||||
| 170 | P | 28.1 | Very low | 29.8 | Very low | 127 Ų | 127 | 147.1 Ų | 147.1 | 83% | 0.825 | 77% | 0.769 | S | S | * | * | -135.5 | 126.7 | 89.1 | 33.4 | -18.6 | 0 | 0 | 0 | 114.8 | |||||
| 171 | D | 26.9 | Very low | 30.1 | Very low | 96 Ų | 96 | 146.3 Ų | 146.3 | 51% | 0.513 | 77% | 0.771 | S | S | . | * | trans | -45.6 | 150.7 | 144.3 | 177.9 | 30.3 | 0 | 0 | 0 | 111.6 | ||||
| 172 | R | 28.6 | Very low | 29.9 | Very low | 201 Ų | 201 | 150 Ų | 150 | 76% | 0.758 | 78% | 0.776 | S | S | * | * | trans | 156.6 | 131.2 | 133 | -78.7 | -80.4 | 166.1 | 137.3 | 6.7 | 112.7 | ||||
| 173 | N | 31.9 | Very low | 29.6 | Very low | 147 Ų | 147 | 148.1 Ų | 148.1 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | trans | 97.5 | 133 | 154.1 | -59 | -9.7 | 0 | 0 | 0 | 116.1 | ||||
| 174 | S | 29 | Very low | 29.7 | Very low | 101 Ų | 101 | 146.1 Ų | 146.1 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | cis | -172.4 | 134.1 | -11.4 | -176.9 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 175 | T | 24.4 | Very low | 29.7 | Very low | 116 Ų | 116 | 145.4 Ų | 145.4 | 71% | 0.712 | 77% | 0.771 | S | S | * | * | trans | -43.2 | 138.9 | 153.7 | -22.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 176 | D | 27.2 | Very low | 30.1 | Very low | 139 Ų | 139 | 144.5 Ų | 144.5 | 74% | 0.743 | 77% | 0.771 | S | S | * | * | 164.5 | 151.9 | 118.1 | -83 | -21.4 | 0 | 0 | 0 | 114.7 | |||||
| 177 | N | 33 | Very low | 30.3 | Very low | 146 Ų | 146 | 142.2 Ų | 142.2 | 78% | 0.781 | 76% | 0.763 | S | S | * | * | trans | 88.4 | 81.5 | 162.4 | -72.4 | -19 | 0 | 0 | 0 | 119.9 | ||||
| 178 | V | 26.6 | Very low | 30.3 | Very low | 112 Ų | 112 | 144.7 Ų | 144.7 | 68% | 0.679 | 76% | 0.762 | S | S | * | * | 12.6 | 114.2 | 104.3 | -175.2 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 179 | N | 35.4 | Very low | 30.5 | Very low | 161 Ų | 161 | 145.6 Ų | 145.6 | 86% | 0.861 | 76% | 0.763 | S | S | * | * | -153.7 | 134.4 | 126.2 | -115 | -20.8 | 0 | 0 | 0 | 113.2 | |||||
| 180 | I | 28.4 | Very low | 30.7 | Very low | 139 Ų | 139 | 147.2 Ų | 147.2 | 71% | 0.713 | 77% | 0.768 | S | S | * | * | trans | -87.7 | 135.5 | -176.8 | -68.9 | 160.6 | 0 | 0 | 0 | 108.3 | ||||
| 181 | T | 34.8 | Very low | 31.2 | Very low | 139 Ų | 139 | 150.4 Ų | 150.4 | 85% | 0.853 | 77% | 0.769 | S | S | * | * | trans | -144.8 | 112.8 | 150.6 | -28.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 182 | R | 26.2 | Very low | 31.5 | Very low | 222 Ų | 222 | 153.5 Ų | 153.5 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | trans | -46.7 | 151 | 154.5 | -79.7 | 171.2 | 154.4 | 168.6 | -6.6 | 109.6 | ||||
| 183 | T | 27.1 | Very low | 31.6 | Very low | 114 Ų | 114 | 154.8 Ų | 154.8 | 70% | 0.699 | 79% | 0.785 | S | S | * | * | cis | -164.3 | 170.9 | 47.6 | 33.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 184 | D | 33.3 | Very low | 31.8 | Very low | 140 Ų | 140 | 154.1 Ų | 154.1 | 75% | 0.749 | 79% | 0.786 | S | S | * | * | trans | 103.2 | 97.7 | 154.7 | -55.8 | -32.1 | 0 | 0 | 0 | 118 | V186 | D184-V186 PolarHBondContact O-N 2.89Š| ||
| 185 | D | 30.6 | Very low | 32.2 | Very low | 166 Ų | 166 | 152.5 Ų | 152.5 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | trans | -47.6 | 105.5 | 161.7 | -73.2 | -55.4 | 0 | 0 | 0 | 112.1 | ||||
| 186 | V | 38.7 | Very low | 32.7 | Very low | 136 Ų | 136 | 152.5 Ų | 152.5 | 82% | 0.824 | 78% | 0.784 | S | S | * | * | trans | -120.8 | 106.5 | 153.1 | -176.1 | 0 | 0 | 0 | 0 | 108.5 | D184 | D184-V186 PolarHBondContact O-N 2.89Š| ||
| 187 | T | 32 | Very low | 33.2 | Very low | 112 Ų | 112 | 153.6 Ų | 153.6 | 69% | 0.687 | 79% | 0.788 | S | S | * | * | trans | -59 | 133.9 | 175.8 | 21.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 188 | K | 34.4 | Very low | 33.4 | Very low | 190 Ų | 190 | 152.2 Ų | 152.2 | 83% | 0.826 | 78% | 0.78 | S | S | * | * | trans | 64 | 103.2 | 141.7 | -58.2 | 176.5 | -177 | -179.3 | 0 | 117.3 | ||||
| 189 | K | 34.1 | Very low | 34.1 | Very low | 197 Ų | 197 | 154.9 Ų | 154.9 | 86% | 0.857 | 79% | 0.786 | S | S | * | * | -172.7 | 116.8 | 104.4 | -96.9 | 178.2 | -174.8 | -175.5 | 0 | 108.9 | K191 | K189-K191 VanDerWaalsContact C-N 3.3Å; K189-K191 PolarHBondContact O-N 3.34Å | |||
| 190 | K | 34.4 | Very low | 34.3 | Very low | 191 Ų | 191 | 154.3 Ų | 154.3 | 83% | 0.83 | 78% | 0.778 | S | S | * | * | trans | -63.2 | 88.2 | 172.8 | -169.7 | 177.4 | -176.9 | 178.5 | 0 | 108.1 | H192 | K190-H192 PolarHBondContact O-N 3.13Å; K190-H192 VanDerWaalsContact O-N 3.15Å | ||
| 191 | K | 38.3 | Very low | 34.8 | Very low | 193 Ų | 193 | 154.1 Ų | 154.1 | 84% | 0.839 | 78% | 0.778 | S | S | * | * | trans | -66.3 | 111 | 167 | -74.5 | -174.7 | 178.5 | 179.8 | 0 | 106.2 | K189 R193 | K189-K191 VanDerWaalsContact C-N 3.3Å; K189-K191 PolarHBondContact O-N 3.34Å; K191-R193 PolarHBondContact O-N 3.14Å | ||
| 192 | H | 32.3 | Very low | 35.1 | Very low | 162 Ų | 162 | 152.3 Ų | 152.3 | 75% | 0.75 | 76% | 0.763 | S | S | * | * | trans | -54.7 | 104.3 | 165.4 | -84.6 | -88 | 0 | 0 | 0 | 107.5 | K190 T194 | K190-H192 PolarHBondContact O-N 3.13Å; K190-H192 VanDerWaalsContact O-N 3.15Å; H192-T194 VanDerWaalsContact C-N 3.28Å; H192-T194 PolarHBondContact O-N 3.27Å; H192-T194 VanDerWaalsContact O-N 3.1Å | ||
| 193 | R | 32.2 | Very low | 35.9 | Very low | 228 Ų | 228 | 146.9 Ų | 146.9 | 86% | 0.86 | 75% | 0.751 | S | S | * | * | trans | -80.5 | 85.7 | 172.2 | -172.6 | 176.6 | 159.7 | 169.6 | -5.4 | 106.5 | K191 A195 | K191-R193 PolarHBondContact O-N 3.14Å; R193-A195 VanDerWaalsContact C-N 3.29Å; R193-A195 HydrophobicContact CG-CB 4.4Å; R193-A195 PolarHBondContact O-N 3.23Å | ||
| 194 | T | 35 | Very low | 36.6 | Very low | 132 Ų | 132 | 147.1 Ų | 147.1 | 81% | 0.81 | 75% | 0.752 | S | S | * | * | trans | -78.8 | 87.8 | 161.2 | -43.3 | 0 | 0 | 0 | 0 | 105.8 | H192 | H192-T194 VanDerWaalsContact C-N 3.28Å; H192-T194 PolarHBondContact O-N 3.27Å; H192-T194 VanDerWaalsContact O-N 3.1Å | ||
| 195 | A | 37.4 | Very low | 37 | Very low | 68 Ų | 68 | 145.5 Ų | 145.5 | 56% | 0.562 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 124.2 | 171 | 0 | 0 | 0 | 0 | 0 | 108.2 | R193 | R193-A195 VanDerWaalsContact C-N 3.29Å; R193-A195 HydrophobicContact CG-CB 4.4Å; R193-A195 PolarHBondContact O-N 3.23Å |
| 196 | S | 35 | Very low | 37.5 | Very low | 116 Ų | 116 | 144.3 Ų | 144.3 | 81% | 0.811 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -46.9 | 130.6 | -174.2 | -53.6 | 0 | 0 | 0 | 0 | 113.7 | N198 | S196-N198 PolarHBondContact O-N 2.99Š|
| 197 | I | 38.7 | Very low | 37.5 | Very low | 161 Ų | 161 | 143.7 Ų | 143.7 | 83% | 0.826 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 121.8 | 163.8 | -27.7 | 175.6 | 0 | 0 | 0 | 106.1 | ||
| 198 | N | 35.6 | Very low | 37.7 | Very low | 117 Ų | 117 | 145.6 Ų | 145.6 | 63% | 0.626 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 133.6 | -175.2 | -161.3 | 3.9 | 0 | 0 | 0 | 110.2 | S196 Q200 | S196-N198 PolarHBondContact O-N 2.99Å; N198-Q200 PolarHBondContact O-N 2.79Å |
| 199 | E | 42.5 | Very low | 38 | Very low | 169 Ų | 169 | 141.7 Ų | 141.7 | 79% | 0.79 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | 16.4 | -169.2 | -147.8 | 173.8 | -173.5 | 0 | 0 | 114 | ||
| 200 | Q | 38.5 | Very low | 38.2 | Very low | 149 Ų | 149 | 140.4 Ų | 140.4 | 70% | 0.696 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -24.1 | -178.8 | -92.2 | 175.8 | -39.2 | 0 | 0 | 114.2 | N198 N202 | N198-Q200 PolarHBondContact O-N 2.79Å; Q200-N202 VanDerWaalsContact C-N 3.28Å; Q200-N202 PolarHBondContact O-N 3.11Å |
| 201 | D | 38.7 | Very low | 38.3 | Very low | 135 Ų | 135 | 139.8 Ų | 139.8 | 72% | 0.722 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -82.3 | -5.3 | -177.8 | -66.6 | -24.4 | 0 | 0 | 0 | 113.7 | N203 | D201-N203 PolarHBondContact O-N 3.39Š|
| 202 | N | 42.4 | Very low | 38.3 | Very low | 100 Ų | 100 | 137.3 Ų | 137.3 | 54% | 0.535 | 72% | 0.717 | S | S | . | * | G | 310 helix | trans | -80.3 | 7.9 | 175.1 | -77.5 | -21.8 | 0 | 0 | 0 | 114.1 | Q200 | Q200-N202 VanDerWaalsContact C-N 3.28Å; Q200-N202 PolarHBondContact O-N 3.11Å |
| 203 | N | 43.4 | Very low | 38.8 | Very low | 109 Ų | 109 | 133.6 Ų | 133.6 | 58% | 0.583 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -81.1 | -23.2 | -179.6 | -154.6 | 13 | 0 | 0 | 0 | 113.5 | D201 K206 | D201-N203 PolarHBondContact O-N 3.39Å; N203-K206 PolarHBondContact O-N 3.38Å |
| 204 | V | 42 | Very low | 39.1 | Very low | 118 Ų | 118 | 130.3 Ų | 130.3 | 72% | 0.715 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -71.9 | -36.2 | 179.2 | -176.2 | 0 | 0 | 0 | 0 | 111.1 | K206 I207 | V204-K206 VanDerWaalsContact C-N 3.28Å; V204-K206 PolarHBondContact O-N 3.43Å; V204-I207 PolarHBondContact O-N 3.01Å |
| 205 | T | 41.2 | Very low | 39.5 | Very low | 107 Ų | 107 | 132.9 Ų | 132.9 | 66% | 0.656 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | -14.4 | 179.3 | -40.3 | 0 | 0 | 0 | 0 | 113.3 | ||
| 206 | K | 39.7 | Very low | 39.6 | Very low | 140 Ų | 140 | 136.3 Ų | 136.3 | 61% | 0.609 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -13.9 | 178 | -74.7 | -178.1 | -178.2 | 177 | 0 | 114.2 | N203 V204 | N203-K206 PolarHBondContact O-N 3.38Å; V204-K206 VanDerWaalsContact C-N 3.28Å; V204-K206 PolarHBondContact O-N 3.43Å |
| 207 | I | 40 | Very low | 39.8 | Very low | 124 Ų | 124 | 136.9 Ų | 136.9 | 64% | 0.636 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -77.9 | -26.8 | -176.6 | -62 | 178.2 | 0 | 0 | 0 | 111.6 | V204 | V204-I207 PolarHBondContact O-N 3.01Š|
| 208 | I | 36.6 | Very low | 39.7 | Very low | 151 Ų | 151 | 138.8 Ų | 138.8 | 77% | 0.774 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -82.2 | -20 | -178.5 | -59.2 | 179.7 | 0 | 0 | 0 | 112.8 | K210 | I208-K210 PolarHBondContact O-N 3.47Š|
| 209 | T | 40 | Very low | 39.9 | Very low | 109 Ų | 109 | 144.2 Ų | 144.2 | 67% | 0.669 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -88 | 7.4 | -179.5 | -29.5 | 0 | 0 | 0 | 0 | 114.7 | ||
| 210 | K | 39.1 | Very low | 39.6 | Very low | 169 Ų | 169 | 142.4 Ų | 142.4 | 74% | 0.735 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -88.3 | -10.5 | 179.8 | -76.4 | -165.7 | 177.1 | -177.4 | 0 | 115.8 | I208 | I208-K210 PolarHBondContact O-N 3.47Š|
| 211 | H | 34.8 | Very low | 39.4 | Very low | 179 Ų | 179 | 146.6 Ų | 146.6 | 83% | 0.829 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -99.8 | 1.4 | -175.8 | -87.5 | -71.4 | 0 | 0 | 0 | 116.8 | ||
| 212 | V | 39.9 | Very low | 39.2 | Very low | 141 Ų | 141 | 147.3 Ų | 147.3 | 86% | 0.855 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -121.7 | 8.2 | 176 | -164.5 | 0 | 0 | 0 | 0 | 113.3 | ||
| 213 | S | 41.8 | Very low | 38.9 | Very low | 83 Ų | 83 | 148 Ų | 148 | 58% | 0.58 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -101.9 | 10.8 | -177.2 | -169.1 | 0 | 0 | 0 | 0 | 115.5 | ||
| 214 | N | 38.5 | Very low | 38.3 | Very low | 160 Ų | 160 | 152.4 Ų | 152.4 | 86% | 0.856 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -111.5 | 16.1 | -173.6 | -118.7 | 17.2 | 0 | 0 | 0 | 116.3 | ||
| 215 | Q | 42.7 | Very low | 37.9 | Very low | 185 Ų | 185 | 151.1 Ų | 151.1 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -114.2 | -4 | 178.3 | -74.1 | -111.1 | -35.1 | 0 | 0 | 115.6 | ||
| 216 | N | 39.5 | Very low | 37.6 | Very low | 141 Ų | 141 | 154.4 Ų | 154.4 | 75% | 0.754 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -116.4 | -0.9 | -176.2 | -83.9 | -10.5 | 0 | 0 | 0 | 117 | ||
| 217 | N | 40 | Very low | 37.2 | Very low | 128 Ų | 128 | 159 Ų | 159 | 68% | 0.684 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -97.1 | -1.6 | -179.6 | -82.6 | -5.4 | 0 | 0 | 0 | 115.7 | ||
| 218 | E | 37.4 | Very low | 37 | Very low | 200 Ų | 200 | 157.6 Ų | 157.6 | 94% | 0.935 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -88.7 | -1.2 | 179.4 | -139 | 159 | -154.3 | 0 | 0 | 114 | ||
| 219 | R | 38.2 | Very low | 37 | Very low | 231 Ų | 231 | 157.6 Ų | 157.6 | 87% | 0.872 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -110.4 | 2.8 | -179.2 | -141.8 | 178.6 | -160.6 | 177.1 | 6 | 116.4 | R221 | R219-R221 VanDerWaalsContact C-N 3.31Å; R219-R221 PolarHBondContact O-N 2.86Å |
| 220 | I | 37.8 | Very low | 37.2 | Very low | 132 Ų | 132 | 160.4 Ų | 160.4 | 68% | 0.677 | 80% | 0.801 | S | S | * | * | trans | -86.4 | 5.3 | -175.4 | -48.2 | -176.2 | 0 | 0 | 0 | 113.2 | ||||
| 221 | R | 33.7 | Very low | 37.7 | Very low | 236 Ų | 236 | 161.3 Ų | 161.3 | 89% | 0.891 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -101.4 | 73.4 | 164.1 | -79.1 | -168.5 | -176.7 | 179.6 | 3 | 110.9 | R219 | R219-R221 VanDerWaalsContact C-N 3.31Å; R219-R221 PolarHBondContact O-N 2.86Å |
| 222 | N | 35.3 | Very low | 38.4 | Very low | 150 Ų | 150 | 158.1 Ų | 158.1 | 80% | 0.802 | 80% | 0.8 | S | S | * | * | S | Bend | trans | 163.5 | 80.5 | 145.3 | -85.2 | -12.3 | 0 | 0 | 0 | 109.4 | ||
| 223 | S | 35.8 | Very low | 38.8 | Very low | 114 Ų | 114 | 156.4 Ų | 156.4 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -171.7 | 58.9 | 152.7 | -78.2 | 0 | 0 | 0 | 0 | 109.6 | S225 | S223-S225 PolarHBondContact O-N 2.85Š| ||
| 224 | Q | 30.6 | Very low | 39.4 | Very low | 202 Ų | 202 | 156.4 Ų | 156.4 | 94% | 0.944 | 78% | 0.783 | S | S | * | * | trans | -84.7 | 73.2 | 157.4 | -172.7 | 168 | -8.9 | 0 | 0 | 107.1 | ||||
| 225 | S | 34.3 | Very low | 40.5 | Very low | 92 Ų | 92 | 156.4 Ų | 156.4 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | trans | -166.5 | 132.5 | 163.3 | 63.5 | 0 | 0 | 0 | 0 | 111.8 | S223 | S223-S225 PolarHBondContact O-N 2.85Š| ||
| 226 | Q | 33 | Very low | 41.4 | Very low | 175 Ų | 175 | 155.4 Ų | 155.4 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | trans | 87.8 | 77.8 | 163.2 | -49.9 | -157.9 | -17.1 | 0 | 0 | 117 | S228 | Q226-S228 PolarHBondContact O-N 3.23Š| ||
| 227 | Y | 32.1 | Very low | 42 | Very low | 237 Ų | 237 | 153.5 Ų | 153.5 | 93% | 0.929 | 76% | 0.757 | S | S | * | * | trans | -44.9 | 114.9 | 131.9 | -76.2 | -92.3 | 0 | 0 | 0 | 109 | ||||
| 228 | S | 35.2 | Very low | 43.2 | Very low | 95 Ų | 95 | 153.1 Ų | 153.1 | 66% | 0.664 | 75% | 0.749 | S | S | * | * | trans | -170.3 | 114.5 | 153.3 | -80.9 | 0 | 0 | 0 | 0 | 111.4 | Q226 | Q226-S228 PolarHBondContact O-N 3.23Š| ||
| 229 | N | 37.4 | Very low | 44.1 | Very low | 150 Ų | 150 | 148.7 Ų | 148.7 | 80% | 0.802 | 73% | 0.728 | S | S | * | * | trans | 78.4 | 48.4 | 154.8 | -54 | -32.6 | 0 | 0 | 0 | 119.6 | K231 | N229-K231 PolarHBondContact O-N 3.38Š| ||
| 230 | D | 45.1 | Very low | 45.1 | Very low | 168 Ų | 168 | 142 Ų | 142 | 90% | 0.898 | 71% | 0.71 | S | S | * | * | trans | -73.5 | 84.9 | 144.5 | -74 | -26.3 | 0 | 0 | 0 | 107.7 | ||||
| 231 | K | 48.7 | Very low | 45.8 | Very low | 189 Ų | 189 | 139.4 Ų | 139.4 | 82% | 0.822 | 70% | 0.703 | S | S | * | * | trans | -57.8 | 124.9 | 165.3 | -129.5 | 179.9 | -174 | -175.6 | 0 | 106 | N229 L233 | N229-K231 PolarHBondContact O-N 3.38Å; K231-L233 PolarHBondContact O-N 3.27Å; K231-L233 VanDerWaalsContact O-N 3.13Å | ||
| 232 | P | 49.9 | Very low | 47 | Very low | 111 Ų | 111 | 133.1 Ų | 133.1 | 72% | 0.721 | 69% | 0.687 | S | S | * | * | trans | -58 | 124.9 | 177.5 | 21.4 | -30.4 | 0 | 0 | 0 | 108.7 | T234 | P232-T234 PolarHBondContact O-N 2.96Å; P232-T234 VanDerWaalsContact O-N 3.15Å | ||
| 233 | L | 48.1 | Very low | 47.9 | Very low | 105 Ų | 105 | 131 Ų | 131 | 55% | 0.55 | 67% | 0.672 | S | S | . | * | trans | -45.3 | 122.1 | 174.6 | -76.4 | 156 | 0 | 0 | 0 | 108.7 | K231 E237 K238 | K231-L233 PolarHBondContact O-N 3.27Å; K231-L233 VanDerWaalsContact O-N 3.13Å; L233-E237 WeakPolarHBondContact CA-OE2 3.44Å; L233-E237 HydrophobicContact CB-CB 4.37Å; L233-E237 HydrophobicContact CD2-CB 3.73Å; L233-E237 HydrophobicContact CD2-CG 4.39Å; L233-K238 HydrophobicContact CB-CG 4.07Å | ||
| 234 | T | 53.9 | Low | 49 | Very low | 83 Ų | 83 | 129.7 Ų | 129.7 | 51% | 0.509 | 66% | 0.655 | S | S | . | * | trans | -62.5 | 150.7 | 177.4 | 53.9 | 0 | 0 | 0 | 0 | 109.2 | P232 K236 E237 K238 | P232-T234 PolarHBondContact O-N 2.96Å; P232-T234 VanDerWaalsContact O-N 3.15Å; T234-K236 PolarHBondContact O-N 2.86Å; T234-E237 PolarHBondContact N-OE2 2.8Å; T234-E237 PolarHBondContact O-N 2.99Å; T234-E237 PolarHBondContact OG1-OE2 3.47Å; T234-K238 PolarHBondContact O-N 2.78Å | ||
| 235 | E | 61.6 | Low | 50.4 | Low | 160 Ų | 160 | 122.8 Ų | 122.8 | 75% | 0.748 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -50.6 | -34.8 | -178.9 | -73.8 | -179.9 | 161.2 | 0 | 0 | 112.3 | E237 K238 E239 | E235-E237 PolarHBondContact O-N 3.19Å; E235-K238 PolarHBondContact O-N 3.04Å; E235-E239 WeakPolarHBondContact O-CG 3.43Å; E235-E239 PolarHBondContact O-N 3.4Å |
| 236 | K | 61.4 | Low | 51.6 | Low | 165 Ų | 165 | 123 Ų | 123 | 72% | 0.717 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -57.5 | -39.5 | 173.1 | -69.1 | -80.6 | -178.6 | -179.5 | 0 | 114.1 | T234 N240 | T234-K236 PolarHBondContact O-N 2.86Å; K236-N240 PolarHBondContact O-N 2.99Å; K236-N240 VanDerWaalsContact O-N 3.16Å |
| 237 | E | 53.6 | Low | 53.3 | Low | 100 Ų | 100 | 120.6 Ų | 120.6 | 47% | 0.467 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -77.3 | -34.2 | 179 | -69.4 | 167.7 | 142.9 | 0 | 0 | 111.6 | L233 T234 E235 N240 S241 | L233-E237 WeakPolarHBondContact CA-OE2 3.44Å; L233-E237 HydrophobicContact CB-CB 4.37Å; L233-E237 HydrophobicContact CD2-CB 3.73Å; L233-E237 HydrophobicContact CD2-CG 4.39Å; T234-E237 PolarHBondContact N-OE2 2.8Å; T234-E237 PolarHBondContact O-N 2.99Å; T234-E237 PolarHBondContact OG1-OE2 3.47Å; E235-E237 PolarHBondContact O-N 3.19Å; E237-N240 PolarHBondContact O-N 3.22Å; E237-S241 WeakPolarHBondContact O-CB 3.41Å; E237-S241 PolarHBondContact O-N 2.95Å |
| 238 | K | 64 | Low | 55.2 | Low | 120 Ų | 120 | 114.1 Ų | 114.1 | 52% | 0.522 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.5 | -43.6 | 172.7 | -66.5 | -178 | -177.8 | 175.4 | 0 | 111.4 | L233 T234 E235 S241 I242 | L233-K238 HydrophobicContact CB-CG 4.07Å; T234-K238 PolarHBondContact O-N 2.78Å; E235-K238 PolarHBondContact O-N 3.04Å; K238-S241 PolarHBondContact O-N 3.2Å; K238-I242 WeakPolarHBondContact O-CG1 3.31Å; K238-I242 PolarHBondContact O-N 2.88Å; K238-I242 VanDerWaalsContact O-N 3.08Å |
| 239 | E | 56 | Low | 57 | Low | 107 Ų | 107 | 117.3 Ų | 117.3 | 50% | 0.5 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -60.5 | -44.2 | 175.1 | -76.1 | 176.1 | 178.8 | 0 | 0 | 111.9 | E235 S241 I242 Q243 | E235-E239 WeakPolarHBondContact O-CG 3.43Å; E235-E239 PolarHBondContact O-N 3.4Å; E239-S241 PolarHBondContact O-N 3.42Å; E239-I242 PolarHBondContact O-N 2.97Å; E239-Q243 WeakPolarHBondContact O-CG 3.48Å; E239-Q243 PolarHBondContact O-N 3.46Å |
| 240 | N | 59.1 | Low | 58.7 | Low | 90 Ų | 90 | 112.7 Ų | 112.7 | 48% | 0.481 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.8 | -37.8 | 178.4 | -160.4 | 25.6 | 0 | 0 | 0 | 112 | K236 E237 Q243 I244 | K236-N240 PolarHBondContact O-N 2.99Å; K236-N240 VanDerWaalsContact O-N 3.16Å; E237-N240 PolarHBondContact O-N 3.22Å; N240-Q243 PolarHBondContact O-N 3.42Å; N240-I244 VanDerWaalsContact O-CG1 3.29Å; N240-I244 WeakPolarHBondContact O-CG1 3.47Å; N240-I244 PolarHBondContact O-N 3.43Å |
| 241 | S | 54.2 | Low | 60.4 | Low | 78 Ų | 78 | 109.5 Ų | 109.5 | 55% | 0.545 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67.3 | -36 | 177.2 | -165.8 | 0 | 0 | 0 | 0 | 113 | E237 K238 E239 A245 | E237-S241 WeakPolarHBondContact O-CB 3.41Å; E237-S241 PolarHBondContact O-N 2.95Å; K238-S241 PolarHBondContact O-N 3.2Å; E239-S241 PolarHBondContact O-N 3.42Å; S241-A245 WeakPolarHBondContact O-CB 3.39Å; S241-A245 PolarHBondContact O-N 3.48Å; S241-A245 VanDerWaalsContact O-N 3.14Å |
| 242 | I | 58.8 | Low | 62 | Low | 105 Ų | 105 | 105.3 Ų | 105.3 | 54% | 0.538 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.4 | -44 | 174.2 | -65.8 | 165.8 | 0 | 0 | 0 | 109.9 | K238 E239 I244 A245 D246 | K238-I242 WeakPolarHBondContact O-CG1 3.31Å; K238-I242 PolarHBondContact O-N 2.88Å; K238-I242 VanDerWaalsContact O-N 3.08Å; E239-I242 PolarHBondContact O-N 2.97Å; I242-I244 PolarHBondContact O-N 3Å; I242-A245 PolarHBondContact O-N 3.31Å; I242-D246 PolarHBondContact O-N 2.87Å |
| 243 | Q | 53.1 | Low | 63.8 | Low | 106 Ų | 106 | 105.9 Ų | 105.9 | 50% | 0.495 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.2 | -39.4 | 177.3 | -73.4 | -178 | 38.3 | 0 | 0 | 113.2 | E239 N240 K247 | E239-Q243 WeakPolarHBondContact O-CG 3.48Å; E239-Q243 PolarHBondContact O-N 3.46Å; N240-Q243 PolarHBondContact O-N 3.42Å; Q243-K247 WeakPolarHBondContact O-CG 3.34Å; Q243-K247 PolarHBondContact O-N 3.34Å; Q243-K247 VanDerWaalsContact O-N 3.15Å |
| 244 | I | 59.5 | Low | 65.6 | Low | 85 Ų | 85 | 105.2 Ų | 105.2 | 44% | 0.436 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.5 | -41.4 | 177 | -64.9 | 164.1 | 0 | 0 | 0 | 110.9 | N240 I242 K247 N248 | N240-I244 VanDerWaalsContact O-CG1 3.29Å; N240-I244 WeakPolarHBondContact O-CG1 3.47Å; N240-I244 PolarHBondContact O-N 3.43Å; I242-I244 PolarHBondContact O-N 3Å; I244-K247 PolarHBondContact O-N 2.9Å; I244-N248 PolarHBondContact O-N 2.87Å; I244-N248 PolarHBondContact O-ND2 2.9Å |
| 245 | A | 60.2 | Low | 67.2 | Low | 57 Ų | 57 | 103.3 Ų | 103.3 | 47% | 0.471 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.5 | -40 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | S241 I242 N248 R249 | S241-A245 WeakPolarHBondContact O-CB 3.39Å; S241-A245 PolarHBondContact O-N 3.48Å; S241-A245 VanDerWaalsContact O-N 3.14Å; I242-A245 PolarHBondContact O-N 3.31Å; A245-N248 PolarHBondContact O-N 2.88Å; A245-R249 PolarHBondContact O-N 3.33Å; A245-R249 VanDerWaalsContact O-N 3.1Å |
| 246 | D | 59.1 | Low | 68.5 | Low | 96 Ų | 96 | 99.5 Ų | 99.5 | 51% | 0.513 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.7 | -40 | 177.4 | -75.8 | -27.2 | 0 | 0 | 0 | 112.1 | I242 R249 S250 | I242-D246 PolarHBondContact O-N 2.87Å; D246-R249 PolarHBondContact O-N 3.06Å; D246-S250 PolarHBondContact O-N 3.43Å; D246-S250 PolarHBondContact O-OG 3.34Å |
| 247 | K | 68.5 | Low | 69.9 | Low | 125 Ų | 125 | 99.2 Ų | 99.2 | 54% | 0.543 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.8 | -47.3 | 173.8 | -73.6 | 176.3 | -179.2 | -179.3 | 0 | 112.4 | Q243 I244 R249 S250 D251 | Q243-K247 WeakPolarHBondContact O-CG 3.34Å; Q243-K247 PolarHBondContact O-N 3.34Å; Q243-K247 VanDerWaalsContact O-N 3.15Å; I244-K247 PolarHBondContact O-N 2.9Å; K247-R249 PolarHBondContact O-N 2.87Å; K247-S250 WeakPolarHBondContact CA-OG 3.41Å; K247-S250 PolarHBondContact O-N 3.46Å; K247-S250 VanDerWaalsContact O-N 3.14Å; K247-S250 PolarHBondContact O-OG 3.06Å; K247-D251 WeakPolarHBondContact O-CB 3.46Å; K247-D251 PolarHBondContact O-N 3.18Å |
| 248 | N | 71.9 | Confident | 71.7 | Confident | 101 Ų | 101 | 99.2 Ų | 99.2 | 54% | 0.54 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.4 | -34.5 | 177.4 | -72 | -20.7 | 0 | 0 | 0 | 112 | I244 A245 Q252 | I244-N248 PolarHBondContact O-N 2.87Å; I244-N248 PolarHBondContact O-ND2 2.9Å; A245-N248 PolarHBondContact O-N 2.88Å; N248-Q252 WeakPolarHBondContact O-CB 3.33Å; N248-Q252 PolarHBondContact O-N 3.34Å |
| 249 | R | 72.9 | Confident | 73 | Confident | 163 Ų | 163 | 99.4 Ų | 99.4 | 62% | 0.615 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -73.6 | -37.6 | 176.8 | -168 | 179.6 | -178.3 | -157.3 | 3 | 112.4 | A245 D246 K247 K253 | A245-R249 PolarHBondContact O-N 3.33Å; A245-R249 VanDerWaalsContact O-N 3.1Å; D246-R249 PolarHBondContact O-N 3.06Å; K247-R249 PolarHBondContact O-N 2.87Å; R249-K253 VanDerWaalsContact O-CG 3.3Å; R249-K253 WeakPolarHBondContact O-CG 3.3Å; R249-K253 PolarHBondContact O-N 3.44Å; R249-K253 VanDerWaalsContact O-N 3.15Å |
| 250 | S | 73 | Confident | 74.7 | Confident | 53 Ų | 53 | 97 Ų | 97 | 37% | 0.371 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65 | -44.8 | 173.2 | 56 | 0 | 0 | 0 | 0 | 111 | D246 K247 Q252 K253 V254 | D246-S250 PolarHBondContact O-N 3.43Å; D246-S250 PolarHBondContact O-OG 3.34Å; K247-S250 WeakPolarHBondContact CA-OG 3.41Å; K247-S250 PolarHBondContact O-N 3.46Å; K247-S250 VanDerWaalsContact O-N 3.14Å; K247-S250 PolarHBondContact O-OG 3.06Å; S250-Q252 VanDerWaalsContact C-N 3.34Å; S250-Q252 PolarHBondContact O-N 3.28Å; S250-K253 WeakPolarHBondContact O-CB 3.47Å; S250-K253 PolarHBondContact O-N 2.75Å; S250-K253 VanDerWaalsContact O-N 3.07Å; S250-V254 WeakPolarHBondContact O-CG2 3.28Å; S250-V254 PolarHBondContact O-N 3.45Å |
| 251 | D | 80.5 | Confident | 76.3 | Confident | 100 Ų | 100 | 97 Ų | 97 | 54% | 0.535 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65 | -40.4 | -177.7 | -63.5 | -7.8 | 0 | 0 | 0 | 110.9 | K247 K253 V254 S255 | K247-D251 WeakPolarHBondContact O-CB 3.46Å; K247-D251 PolarHBondContact O-N 3.18Å; D251-K253 VanDerWaalsContact C-N 3.34Å; D251-K253 PolarHBondContact O-N 3.12Å; D251-V254 PolarHBondContact O-N 3.18Å; D251-S255 VanDerWaalsContact O-CB 3.28Å; D251-S255 WeakPolarHBondContact O-CB 3.38Å; D251-S255 PolarHBondContact O-N 3.39Å |
| 252 | Q | 83.8 | Confident | 78.1 | Confident | 101 Ų | 101 | 97.6 Ų | 97.6 | 47% | 0.472 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.6 | -38.8 | 173.5 | -172.3 | 62.6 | 37.7 | 0 | 0 | 112.4 | N248 S250 N256 | N248-Q252 WeakPolarHBondContact O-CB 3.33Å; N248-Q252 PolarHBondContact O-N 3.34Å; S250-Q252 VanDerWaalsContact C-N 3.34Å; S250-Q252 PolarHBondContact O-N 3.28Å; Q252-N256 PolarHBondContact NE2-OD1 2.99Å; Q252-N256 WeakPolarHBondContact O-CB 3.5Å; Q252-N256 PolarHBondContact O-N 3.43Å |
| 253 | K | 86 | Confident | 79.7 | Confident | 124 Ų | 124 | 98.4 Ų | 98.4 | 54% | 0.539 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.5 | -44.9 | 176.4 | -77.5 | 174.7 | 178.4 | -177.6 | 0 | 111.4 | R249 S250 D251 N256 W257 | R249-K253 VanDerWaalsContact O-CG 3.3Å; R249-K253 WeakPolarHBondContact O-CG 3.3Å; R249-K253 PolarHBondContact O-N 3.44Å; R249-K253 VanDerWaalsContact O-N 3.15Å; S250-K253 WeakPolarHBondContact O-CB 3.47Å; S250-K253 PolarHBondContact O-N 2.75Å; S250-K253 VanDerWaalsContact O-N 3.07Å; D251-K253 VanDerWaalsContact C-N 3.34Å; D251-K253 PolarHBondContact O-N 3.12Å; K253-N256 PolarHBondContact O-N 3.2Å; K253-W257 WeakPolarHBondContact O-CB 3.33Å; K253-W257 PolarHBondContact O-N 3.26Å |
| 254 | V | 87 | Confident | 81.5 | Confident | 91 Ų | 91 | 97.7 Ų | 97.7 | 55% | 0.552 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.4 | -45.1 | 177.3 | 174.6 | 0 | 0 | 0 | 0 | 110.3 | S250 D251 N256 W257 L258 | S250-V254 WeakPolarHBondContact O-CG2 3.28Å; S250-V254 PolarHBondContact O-N 3.45Å; D251-V254 PolarHBondContact O-N 3.18Å; V254-N256 PolarHBondContact O-N 3.4Å; V254-W257 PolarHBondContact O-N 3.48Å; V254-L258 WeakPolarHBondContact O-CB 3.4Å; V254-L258 PolarHBondContact O-N 3.01Å |
| 255 | S | 86.2 | Confident | 83.1 | Confident | 43 Ų | 43 | 101.5 Ų | 101.5 | 30% | 0.301 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.5 | -43.2 | 176.4 | -173.4 | 0 | 0 | 0 | 0 | 112.4 | D251 L258 R259 | D251-S255 VanDerWaalsContact O-CB 3.28Å; D251-S255 WeakPolarHBondContact O-CB 3.38Å; D251-S255 PolarHBondContact O-N 3.39Å; S255-L258 PolarHBondContact O-N 2.92Å; S255-R259 PolarHBondContact O-N 3.44Å; S255-R259 VanDerWaalsContact OG-CZ 3.28Å; S255-R259 PolarHBondContact OG-NH1 3.09Å; S255-R259 VanDerWaalsContact OG-NH1 3.11Å; S255-R259 PolarHBondContact OG-NH2 2.92Å |
| 256 | N | 89 | Confident | 84.7 | Confident | 80 Ų | 80 | 105.2 Ų | 105.2 | 43% | 0.428 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.1 | -41.4 | 175.4 | -75 | -7.4 | 0 | 0 | 0 | 112.3 | Q252 K253 V254 R259 A260 | Q252-N256 PolarHBondContact NE2-OD1 2.99Å; Q252-N256 WeakPolarHBondContact O-CB 3.5Å; Q252-N256 PolarHBondContact O-N 3.43Å; K253-N256 PolarHBondContact O-N 3.2Å; V254-N256 PolarHBondContact O-N 3.4Å; N256-R259 PolarHBondContact O-N 2.97Å; N256-R259 PolarHBondContact OD1-NH2 3.11Å; N256-A260 WeakPolarHBondContact O-CB 3.41Å; N256-A260 PolarHBondContact O-N 2.97Å |
| 257 | W | 90.9 | Very high | 86.1 | Confident | 158 Ų | 158 | 102.3 Ų | 102.3 | 60% | 0.598 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.7 | -42.9 | 176.4 | 177.8 | 85.7 | 0 | 0 | 0 | 111.4 | K253 V254 A260 K261 | K253-W257 WeakPolarHBondContact O-CB 3.33Å; K253-W257 PolarHBondContact O-N 3.26Å; V254-W257 PolarHBondContact O-N 3.48Å; W257-A260 PolarHBondContact O-N 3.21Å; W257-K261 HydrophobicContact CD2-CG 4.12Å; W257-K261 HydrophobicContact CE3-CG 4.46Å; W257-K261 HydrophobicContact CH2-CG 4.3Å; W257-K261 HydrophobicContact CZ2-CD 4.33Å; W257-K261 HydrophobicContact CZ2-CG 3.92Å; W257-K261 WeakPolarHBondContact O-CG 3.43Å; W257-K261 PolarHBondContact O-N 3.35Å |
| 258 | L | 91.9 | Very high | 87.3 | Confident | 101 Ų | 101 | 101 Ų | 101 | 53% | 0.529 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.6 | -45.4 | 177.1 | -169.6 | 67.4 | 0 | 0 | 0 | 111.4 | V254 S255 A260 K261 V262 | V254-L258 WeakPolarHBondContact O-CB 3.4Å; V254-L258 PolarHBondContact O-N 3.01Å; S255-L258 PolarHBondContact O-N 2.92Å; L258-A260 VanDerWaalsContact C-N 3.33Å; L258-A260 PolarHBondContact O-N 3.39Å; L258-K261 PolarHBondContact O-N 2.95Å; L258-V262 WeakPolarHBondContact O-CG2 3.18Å; L258-V262 PolarHBondContact O-N 3.5Å |
| 259 | R | 91.8 | Very high | 88.2 | Confident | 123 Ų | 123 | 101.9 Ų | 101.9 | 46% | 0.464 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -56.7 | -46.1 | 173.3 | -82.7 | -171.5 | -79.1 | -90.4 | -5.5 | 112 | S255 N256 K261 V262 L263 | S255-R259 PolarHBondContact O-N 3.44Å; S255-R259 VanDerWaalsContact OG-CZ 3.28Å; S255-R259 PolarHBondContact OG-NH1 3.09Å; S255-R259 VanDerWaalsContact OG-NH1 3.11Å; S255-R259 PolarHBondContact OG-NH2 2.92Å; N256-R259 PolarHBondContact O-N 2.97Å; N256-R259 PolarHBondContact OD1-NH2 3.11Å; R259-K261 VanDerWaalsContact C-N 3.33Å; R259-K261 PolarHBondContact O-N 3.06Å; R259-V262 PolarHBondContact O-N 2.97Å; R259-L263 WeakPolarHBondContact O-CG 3.39Å; R259-L263 PolarHBondContact O-N 3.16Å |
| 260 | A | 91.4 | Very high | 89.2 | Confident | 57 Ų | 57 | 97.5 Ų | 97.5 | 47% | 0.471 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | N256 W257 L258 L263 Q264 | N256-A260 WeakPolarHBondContact O-CB 3.41Å; N256-A260 PolarHBondContact O-N 2.97Å; W257-A260 PolarHBondContact O-N 3.21Å; L258-A260 VanDerWaalsContact C-N 3.33Å; L258-A260 PolarHBondContact O-N 3.39Å; A260-L263 PolarHBondContact O-N 3.05Å; A260-Q264 WeakPolarHBondContact O-CB 3.32Å; A260-Q264 PolarHBondContact O-N 3.5Å |
| 261 | K | 93.3 | Very high | 90.1 | Very high | 89 Ų | 89 | 101.1 Ų | 101.1 | 39% | 0.387 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.1 | -39.1 | 177.9 | -76.6 | -72.3 | 168.6 | -163.1 | 0 | 113.4 | W257 L258 R259 Q264 R265 | W257-K261 HydrophobicContact CD2-CG 4.12Å; W257-K261 HydrophobicContact CE3-CG 4.46Å; W257-K261 HydrophobicContact CH2-CG 4.3Å; W257-K261 HydrophobicContact CZ2-CD 4.33Å; W257-K261 HydrophobicContact CZ2-CG 3.92Å; W257-K261 WeakPolarHBondContact O-CG 3.43Å; W257-K261 PolarHBondContact O-N 3.35Å; L258-K261 PolarHBondContact O-N 2.95Å; R259-K261 VanDerWaalsContact C-N 3.33Å; R259-K261 PolarHBondContact O-N 3.06Å; K261-Q264 PolarHBondContact O-N 3.08Å; K261-R265 WeakPolarHBondContact O-CB 3.48Å; K261-R265 PolarHBondContact O-N 3.18Å |
| 262 | V | 91.6 | Very high | 90.6 | Very high | 92 Ų | 92 | 103 Ų | 103 | 56% | 0.558 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.7 | -44.7 | 174.8 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | L258 R259 R265 K266 | L258-V262 WeakPolarHBondContact O-CG2 3.18Å; L258-V262 PolarHBondContact O-N 3.5Å; R259-V262 PolarHBondContact O-N 2.97Å; V262-R265 PolarHBondContact O-N 3.44Å; V262-K266 WeakPolarHBondContact O-CB 3.34Å; V262-K266 PolarHBondContact O-N 2.97Å |
| 263 | L | 91.3 | Very high | 91 | Very high | 121 Ų | 121 | 104.1 Ų | 104.1 | 63% | 0.634 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.7 | -41.2 | 176.7 | -71.8 | 172.5 | 0 | 0 | 0 | 112.3 | R259 A260 K266 G267 | R259-L263 WeakPolarHBondContact O-CG 3.39Å; R259-L263 PolarHBondContact O-N 3.16Å; A260-L263 PolarHBondContact O-N 3.05Å; L263-K266 PolarHBondContact O-N 3.34Å; L263-G267 PolarHBondContact O-N 3.04Å |
| 264 | Q | 92.7 | Very high | 91.3 | Very high | 91 Ų | 91 | 104 Ų | 104 | 43% | 0.425 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.6 | -50.9 | 174.6 | -179.1 | -177.7 | 5.3 | 0 | 0 | 110.8 | A260 K261 K266 G267 E268 | A260-Q264 WeakPolarHBondContact O-CB 3.32Å; A260-Q264 PolarHBondContact O-N 3.5Å; K261-Q264 PolarHBondContact O-N 3.08Å; Q264-K266 VanDerWaalsContact C-N 3.33Å; Q264-K266 PolarHBondContact O-N 3.46Å; Q264-G267 PolarHBondContact O-N 2.88Å; Q264-E268 VanDerWaalsContact CG-OE1 3.32Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.37Å; Q264-E268 PolarHBondContact NE2-OE1 3.04Å; Q264-E268 WeakPolarHBondContact O-CG 3.33Å; Q264-E268 PolarHBondContact O-N 3.4Å |
| 265 | R | 92.6 | Very high | 91.5 | Very high | 165 Ų | 165 | 105.3 Ų | 105.3 | 62% | 0.623 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.6 | -43.7 | 179 | -173.1 | -175.9 | -60.8 | -179.8 | 0.7 | 111.7 | K261 V262 G267 E268 E269 | K261-R265 WeakPolarHBondContact O-CB 3.48Å; K261-R265 PolarHBondContact O-N 3.18Å; V262-R265 PolarHBondContact O-N 3.44Å; R265-G267 VanDerWaalsContact C-N 3.33Å; R265-G267 PolarHBondContact O-N 3.42Å; R265-E268 PolarHBondContact O-N 2.97Å; R265-E269 HydrophobicContact CG-CG 4.47Å; R265-E269 WeakPolarHBondContact CG-OE1 3.39Å; R265-E269 WeakPolarHBondContact O-CB 3.49Å; R265-E269 WeakPolarHBondContact O-CG 3.43Å; R265-E269 PolarHBondContact O-N 3.45Å |
| 266 | K | 92.6 | Very high | 91.8 | Very high | 136 Ų | 136 | 107.9 Ų | 107.9 | 59% | 0.591 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.5 | -42.5 | 177.3 | -173.2 | 179.1 | 178.4 | -177.1 | 0 | 111.9 | V262 L263 Q264 E270 | V262-K266 WeakPolarHBondContact O-CB 3.34Å; V262-K266 PolarHBondContact O-N 2.97Å; L263-K266 PolarHBondContact O-N 3.34Å; Q264-K266 VanDerWaalsContact C-N 3.33Å; Q264-K266 PolarHBondContact O-N 3.46Å; K266-E270 WeakPolarHBondContact O-CB 3.45Å; K266-E270 PolarHBondContact O-N 2.96Å |
| 267 | G | 90.3 | Very high | 91.8 | Very high | 34 Ų | 34 | 107.9 Ų | 107.9 | 35% | 0.351 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | L263 Q264 R265 E270 M271 | L263-G267 PolarHBondContact O-N 3.04Å; Q264-G267 PolarHBondContact O-N 2.88Å; R265-G267 VanDerWaalsContact C-N 3.33Å; R265-G267 PolarHBondContact O-N 3.42Å; G267-E270 PolarHBondContact O-N 3.38Å; G267-M271 WeakPolarHBondContact O-CG 3.47Å; G267-M271 PolarHBondContact O-N 3.35Å |
| 268 | E | 91.8 | Very high | 91.8 | Very high | 99 Ų | 99 | 106.9 Ų | 106.9 | 46% | 0.463 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.7 | -40.8 | 176.8 | -71.6 | 171.6 | -168.6 | 0 | 0 | 112.5 | Q264 R265 M271 K272 | Q264-E268 VanDerWaalsContact CG-OE1 3.32Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.37Å; Q264-E268 PolarHBondContact NE2-OE1 3.04Å; Q264-E268 WeakPolarHBondContact O-CG 3.33Å; Q264-E268 PolarHBondContact O-N 3.4Å; R265-E268 PolarHBondContact O-N 2.97Å; E268-M271 PolarHBondContact O-N 3.43Å; E268-K272 WeakPolarHBondContact O-CG 3.41Å; E268-K272 PolarHBondContact O-N 3.25Å |
| 269 | E | 92 | Very high | 91.6 | Very high | 119 Ų | 119 | 106.3 Ų | 106.3 | 56% | 0.556 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -66.1 | -39.5 | 175.7 | -74.3 | 171.9 | -172.5 | 0 | 0 | 112.1 | R265 K272 R273 | R265-E269 HydrophobicContact CG-CG 4.47Å; R265-E269 WeakPolarHBondContact CG-OE1 3.39Å; R265-E269 WeakPolarHBondContact O-CB 3.49Å; R265-E269 WeakPolarHBondContact O-CG 3.43Å; R265-E269 PolarHBondContact O-N 3.45Å; E269-K272 PolarHBondContact O-N 2.95Å; E269-R273 PolarHBondContact O-N 3.26Å |
| 270 | E | 92.8 | Very high | 91.3 | Very high | 71 Ų | 71 | 106.2 Ų | 106.2 | 33% | 0.332 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.3 | -43.1 | 175.5 | 173.9 | 150.8 | -123.6 | 0 | 0 | 112.3 | K266 G267 K272 R273 Y274 | K266-E270 WeakPolarHBondContact O-CB 3.45Å; K266-E270 PolarHBondContact O-N 2.96Å; G267-E270 PolarHBondContact O-N 3.38Å; E270-K272 PolarHBondContact O-N 2.98Å; E270-R273 WeakPolarHBondContact O-CB 3.43Å; E270-R273 PolarHBondContact O-N 3.37Å; E270-R273 IonicContact OE1-CZ 3.76Å; E270-R273 IonicContact OE1-NH1 3.9Å; E270-R273 IonicContact OE1-NH2 3.94Å; E270-R273 PolarHBondContact OE1-NH2 3.25Å; E270-Y274 HydrophobicContact CG-CD2 3.96Å; E270-Y274 HydrophobicContact CG-CE2 3.46Å; E270-Y274 VanDerWaalsContact CG-CE2 3.46Å; E270-Y274 WeakPolarHBondContact O-CD2 3.3Å; E270-Y274 PolarHBondContact O-N 2.91Å; E270-Y274 VanDerWaalsContact O-N 3.12Å |
| 271 | M | 91.9 | Very high | 91 | Very high | 129 Ų | 129 | 110.6 Ų | 110.6 | 64% | 0.635 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.3 | -43.1 | 174.4 | -73 | -60.3 | -60.3 | 0 | 0 | 112.1 | G267 E268 R273 Y274 E275 | G267-M271 WeakPolarHBondContact O-CG 3.47Å; G267-M271 PolarHBondContact O-N 3.35Å; E268-M271 PolarHBondContact O-N 3.43Å; M271-R273 VanDerWaalsContact C-N 3.27Å; M271-R273 PolarHBondContact O-N 3.35Å; M271-Y274 PolarHBondContact O-N 3.26Å; M271-E275 PolarHBondContact O-N 3.4Å |
| 272 | K | 92.3 | Very high | 90.7 | Very high | 139 Ų | 139 | 109.9 Ų | 109.9 | 60% | 0.604 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.8 | -35.3 | 175.2 | -77.3 | 177.9 | -179.9 | 176.5 | 0 | 112.7 | E268 E269 E270 N276 | E268-K272 WeakPolarHBondContact O-CG 3.41Å; E268-K272 PolarHBondContact O-N 3.25Å; E269-K272 PolarHBondContact O-N 2.95Å; E270-K272 PolarHBondContact O-N 2.98Å; K272-N276 VanDerWaalsContact O-CB 3.3Å; K272-N276 WeakPolarHBondContact O-CB 3.43Å; K272-N276 PolarHBondContact O-N 3.44Å |
| 273 | R | 92.4 | Very high | 90.4 | Very high | 124 Ų | 124 | 110.2 Ų | 110.2 | 47% | 0.468 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.9 | -47.8 | 176.2 | -174.7 | -176.3 | 67.2 | -122.2 | 1.7 | 110.8 | E269 E270 M271 N276 E277 | E269-R273 PolarHBondContact O-N 3.26Å; E270-R273 WeakPolarHBondContact O-CB 3.43Å; E270-R273 PolarHBondContact O-N 3.37Å; E270-R273 IonicContact OE1-CZ 3.76Å; E270-R273 IonicContact OE1-NH1 3.9Å; E270-R273 IonicContact OE1-NH2 3.94Å; E270-R273 PolarHBondContact OE1-NH2 3.25Å; M271-R273 VanDerWaalsContact C-N 3.27Å; M271-R273 PolarHBondContact O-N 3.35Å; R273-N276 PolarHBondContact O-N 3Å; R273-E277 WeakPolarHBondContact O-CB 3.16Å; R273-E277 PolarHBondContact O-N 2.97Å |
| 274 | Y | 90.9 | Very high | 90.2 | Very high | 123 Ų | 123 | 109.1 Ų | 109.1 | 48% | 0.482 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.1 | -43.5 | 177.4 | -71.6 | -58.7 | 0 | 0 | 0 | 112.3 | E270 M271 N276 E277 E278 | E270-Y274 HydrophobicContact CG-CD2 3.96Å; E270-Y274 HydrophobicContact CG-CE2 3.46Å; E270-Y274 VanDerWaalsContact CG-CE2 3.46Å; E270-Y274 WeakPolarHBondContact O-CD2 3.3Å; E270-Y274 PolarHBondContact O-N 2.91Å; E270-Y274 VanDerWaalsContact O-N 3.12Å; M271-Y274 PolarHBondContact O-N 3.26Å; Y274-N276 VanDerWaalsContact C-N 3.34Å; Y274-N276 PolarHBondContact O-N 2.98Å; Y274-E277 PolarHBondContact O-N 3.15Å; Y274-E278 WeakPolarHBondContact O-CB 3.44Å; Y274-E278 PolarHBondContact O-N 3.47Å |
| 275 | E | 91.4 | Very high | 89.7 | Confident | 118 Ų | 118 | 108.2 Ų | 108.2 | 55% | 0.551 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.3 | -43 | 176.9 | -174.7 | 177.9 | -166 | 0 | 0 | 111.5 | M271 E278 Q279 | M271-E275 PolarHBondContact O-N 3.4Å; E275-E278 PolarHBondContact O-N 2.91Å; E275-Q279 WeakPolarHBondContact O-CB 3.39Å; E275-Q279 VanDerWaalsContact O-CG 3.25Å; E275-Q279 WeakPolarHBondContact O-CG 3.44Å; E275-Q279 PolarHBondContact O-N 2.99Å |
| 276 | N | 93 | Very high | 89.4 | Confident | 97 Ų | 97 | 105 Ų | 105 | 52% | 0.519 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.1 | -38.5 | 176.8 | -178.7 | 59.6 | 0 | 0 | 0 | 112.4 | K272 R273 Y274 Q279 Q280 | K272-N276 VanDerWaalsContact O-CB 3.3Å; K272-N276 WeakPolarHBondContact O-CB 3.43Å; K272-N276 PolarHBondContact O-N 3.44Å; R273-N276 PolarHBondContact O-N 3Å; Y274-N276 VanDerWaalsContact C-N 3.34Å; Y274-N276 PolarHBondContact O-N 2.98Å; N276-Q279 PolarHBondContact O-N 3.02Å; N276-Q280 WeakPolarHBondContact O-CG 3.27Å; N276-Q280 PolarHBondContact O-N 3.1Å |
| 277 | E | 90 | Very high | 89 | Confident | 79 Ų | 79 | 101.9 Ų | 101.9 | 37% | 0.369 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.3 | -44.1 | 175.4 | -179.8 | 172 | -165.9 | 0 | 0 | 111.6 | R273 Y274 Q279 Q280 Y281 | R273-E277 WeakPolarHBondContact O-CB 3.16Å; R273-E277 PolarHBondContact O-N 2.97Å; Y274-E277 PolarHBondContact O-N 3.15Å; E277-Q279 PolarHBondContact O-N 3.45Å; E277-Q280 WeakPolarHBondContact O-CB 3.4Å; E277-Q280 PolarHBondContact O-N 2.97Å; E277-Q280 VanDerWaalsContact O-N 3.15Å; E277-Y281 HydrophobicContact CG-CD2 3.85Å; E277-Y281 HydrophobicContact CG-CE2 3.4Å; E277-Y281 VanDerWaalsContact CG-CE2 3.4Å; E277-Y281 WeakPolarHBondContact O-CD2 3.49Å; E277-Y281 PolarHBondContact O-N 3.03Å; E277-Y281 WeakPolarHBondContact OE1-CE2 3.48Å; E277-Y281 PolarHBondContact OE1-OH 3.48Å |
| 278 | E | 89.2 | Confident | 88.8 | Confident | 137 Ų | 137 | 108.3 Ų | 108.3 | 64% | 0.64 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.4 | -44.7 | 174.4 | -174.9 | 177.3 | -163.4 | 0 | 0 | 111.8 | Y274 E275 Q280 Y281 L282 | Y274-E278 WeakPolarHBondContact O-CB 3.44Å; Y274-E278 PolarHBondContact O-N 3.47Å; E275-E278 PolarHBondContact O-N 2.91Å; E278-Q280 VanDerWaalsContact C-N 3.31Å; E278-Q280 PolarHBondContact O-N 2.96Å; E278-Y281 PolarHBondContact O-N 3.29Å; E278-L282 WeakPolarHBondContact O-CB 3.25Å; E278-L282 PolarHBondContact O-N 2.9Å |
| 279 | Q | 87.8 | Confident | 88.4 | Confident | 90 Ų | 90 | 108.2 Ų | 108.2 | 42% | 0.421 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62 | -37.4 | 175.2 | -71.6 | -66.1 | -17.6 | 0 | 0 | 112.3 | E275 N276 E277 L282 N283 | E275-Q279 WeakPolarHBondContact O-CB 3.39Å; E275-Q279 VanDerWaalsContact O-CG 3.25Å; E275-Q279 WeakPolarHBondContact O-CG 3.44Å; E275-Q279 PolarHBondContact O-N 2.99Å; N276-Q279 PolarHBondContact O-N 3.02Å; E277-Q279 PolarHBondContact O-N 3.45Å; Q279-L282 PolarHBondContact O-N 3.45Å; Q279-N283 WeakPolarHBondContact O-CB 3.4Å; Q279-N283 PolarHBondContact O-N 3.21Å; Q279-N283 PolarHBondContact O-ND2 3.44Å; Q279-N283 VanDerWaalsContact O-ND2 3.1Å |
| 280 | Q | 86.8 | Confident | 87.9 | Confident | 120 Ų | 120 | 105.3 Ų | 105.3 | 56% | 0.561 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65 | -45.8 | 174.4 | -75 | -169.6 | 15.2 | 0 | 0 | 111.9 | N276 E277 E278 L282 N283 V284 | N276-Q280 WeakPolarHBondContact O-CG 3.27Å; N276-Q280 PolarHBondContact O-N 3.1Å; E277-Q280 WeakPolarHBondContact O-CB 3.4Å; E277-Q280 PolarHBondContact O-N 2.97Å; E277-Q280 VanDerWaalsContact O-N 3.15Å; E278-Q280 VanDerWaalsContact C-N 3.31Å; E278-Q280 PolarHBondContact O-N 2.96Å; Q280-L282 VanDerWaalsContact C-N 3.32Å; Q280-L282 PolarHBondContact O-N 3.1Å; Q280-N283 PolarHBondContact O-N 2.95Å; Q280-V284 WeakPolarHBondContact O-CG2 3.46Å; Q280-V284 PolarHBondContact O-N 2.9Å |
| 281 | Y | 85.2 | Confident | 87.5 | Confident | 149 Ų | 149 | 105 Ų | 105 | 58% | 0.584 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.2 | -44.5 | 175.5 | -76.7 | -64.3 | 0 | 0 | 0 | 111.6 | E277 E278 N283 V284 V285 | E277-Y281 HydrophobicContact CG-CD2 3.85Å; E277-Y281 HydrophobicContact CG-CE2 3.4Å; E277-Y281 VanDerWaalsContact CG-CE2 3.4Å; E277-Y281 WeakPolarHBondContact O-CD2 3.49Å; E277-Y281 PolarHBondContact O-N 3.03Å; E277-Y281 WeakPolarHBondContact OE1-CE2 3.48Å; E277-Y281 PolarHBondContact OE1-OH 3.48Å; E278-Y281 PolarHBondContact O-N 3.29Å; Y281-N283 VanDerWaalsContact C-N 3.34Å; Y281-N283 PolarHBondContact O-N 3.43Å; Y281-V284 PolarHBondContact O-N 3.49Å; Y281-V285 WeakPolarHBondContact O-CG2 3.49Å; Y281-V285 PolarHBondContact O-N 2.94Å |
| 282 | L | 86.4 | Confident | 87.3 | Confident | 75 Ų | 75 | 102.9 Ų | 102.9 | 39% | 0.393 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.6 | -41.5 | 179 | -171.6 | 63.1 | 0 | 0 | 0 | 111.9 | E278 Q279 Q280 V284 V285 H286 | E278-L282 WeakPolarHBondContact O-CB 3.25Å; E278-L282 PolarHBondContact O-N 2.9Å; Q279-L282 PolarHBondContact O-N 3.45Å; Q280-L282 VanDerWaalsContact C-N 3.32Å; Q280-L282 PolarHBondContact O-N 3.1Å; L282-V284 VanDerWaalsContact C-N 3.34Å; L282-V284 PolarHBondContact O-N 3.35Å; L282-V285 PolarHBondContact O-N 2.95Å; L282-H286 VanDerWaalsContact CG-CE1 3.47Å; L282-H286 WeakPolarHBondContact CG-CE1 3.47Å; L282-H286 PolarHBondContact O-N 3.46Å; L282-H286 PolarHBondContact O-ND1 3.11Å |
| 283 | N | 86 | Confident | 86.9 | Confident | 98 Ų | 98 | 102.4 Ų | 102.4 | 52% | 0.524 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.7 | -38.9 | 175.3 | -74.1 | -29.5 | 0 | 0 | 0 | 112.7 | Q279 Q280 Y281 S287 | Q279-N283 WeakPolarHBondContact O-CB 3.4Å; Q279-N283 PolarHBondContact O-N 3.21Å; Q279-N283 PolarHBondContact O-ND2 3.44Å; Q279-N283 VanDerWaalsContact O-ND2 3.1Å; Q280-N283 PolarHBondContact O-N 2.95Å; Y281-N283 VanDerWaalsContact C-N 3.34Å; Y281-N283 PolarHBondContact O-N 3.43Å; N283-S287 WeakPolarHBondContact O-CB 3.39Å; N283-S287 PolarHBondContact O-N 3.42Å |
| 284 | V | 86.6 | Confident | 86.5 | Confident | 99 Ų | 99 | 99.6 Ų | 99.6 | 60% | 0.6 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.3 | -42.9 | 175.5 | 172.6 | 0 | 0 | 0 | 0 | 111 | Q280 Y281 L282 S287 R288 | Q280-V284 WeakPolarHBondContact O-CG2 3.46Å; Q280-V284 PolarHBondContact O-N 2.9Å; Y281-V284 PolarHBondContact O-N 3.49Å; L282-V284 VanDerWaalsContact C-N 3.34Å; L282-V284 PolarHBondContact O-N 3.35Å; V284-S287 PolarHBondContact O-N 2.92Å; V284-R288 WeakPolarHBondContact O-CB 3.35Å; V284-R288 PolarHBondContact O-N 3.37Å |
| 285 | V | 82.6 | Confident | 86 | Confident | 72 Ų | 72 | 102.4 Ų | 102.4 | 44% | 0.436 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62 | -50.3 | 176.9 | 173 | 0 | 0 | 0 | 0 | 110.8 | Y281 L282 S287 R288 E289 | Y281-V285 WeakPolarHBondContact O-CG2 3.49Å; Y281-V285 PolarHBondContact O-N 2.94Å; L282-V285 PolarHBondContact O-N 2.95Å; V285-S287 VanDerWaalsContact C-N 3.3Å; V285-S287 PolarHBondContact O-N 2.93Å; V285-R288 WeakPolarHBondContact O-CB 3.17Å; V285-R288 PolarHBondContact O-N 3.29Å; V285-R288 VanDerWaalsContact O-N 3.11Å; V285-E289 WeakPolarHBondContact O-CG 3.45Å; V285-E289 PolarHBondContact O-N 3.46Å |
| 286 | H | 86 | Confident | 85.6 | Confident | 96 Ų | 96 | 105.1 Ų | 105.1 | 44% | 0.444 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.3 | -39.4 | 177.5 | -68.1 | 154.6 | 0 | 0 | 0 | 112.4 | L282 E289 A290 | L282-H286 VanDerWaalsContact CG-CE1 3.47Å; L282-H286 WeakPolarHBondContact CG-CE1 3.47Å; L282-H286 PolarHBondContact O-N 3.46Å; L282-H286 PolarHBondContact O-ND1 3.11Å; H286-E289 PolarHBondContact O-N 3.3Å; H286-A290 WeakPolarHBondContact O-CB 3.39Å; H286-A290 PolarHBondContact O-N 3.46Å |
| 287 | S | 83.9 | Confident | 84.5 | Confident | 71 Ų | 71 | 111 Ų | 111 | 50% | 0.497 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.7 | -40.1 | 175.5 | -173.6 | 0 | 0 | 0 | 0 | 111.8 | N283 V284 V285 A290 C291 | N283-S287 WeakPolarHBondContact O-CB 3.39Å; N283-S287 PolarHBondContact O-N 3.42Å; V284-S287 PolarHBondContact O-N 2.92Å; V285-S287 VanDerWaalsContact C-N 3.3Å; V285-S287 PolarHBondContact O-N 2.93Å; S287-A290 PolarHBondContact O-N 3.19Å; S287-C291 PolarHBondContact O-N 2.93Å; S287-C291 PolarHBondContact O-SG 3.01Å |
| 288 | R | 85.8 | Confident | 84.2 | Confident | 169 Ų | 169 | 112.6 Ų | 112.6 | 64% | 0.638 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -64.4 | -46.4 | 176.3 | 178.6 | 179.7 | 172.4 | 174.2 | 1.4 | 111.3 | V284 V285 A290 C291 E292 | V284-R288 WeakPolarHBondContact O-CB 3.35Å; V284-R288 PolarHBondContact O-N 3.37Å; V285-R288 WeakPolarHBondContact O-CB 3.17Å; V285-R288 PolarHBondContact O-N 3.29Å; V285-R288 VanDerWaalsContact O-N 3.11Å; R288-A290 VanDerWaalsContact C-N 3.32Å; R288-A290 PolarHBondContact O-N 3.16Å; R288-C291 PolarHBondContact O-N 2.88Å; R288-E292 IonicContact CZ-OE1 3.65Å; R288-E292 IonicContact NE-OE1 2.94Å; R288-E292 PolarHBondContact NE-OE1 3.44Å; R288-E292 IonicContact NH2-OE1 3.49Å; R288-E292 PolarHBondContact NH2-OE1 3.29Å; R288-E292 WeakPolarHBondContact O-CG 3.5Å; R288-E292 PolarHBondContact O-N 3.23Å |
| 289 | E | 82.6 | Confident | 84 | Confident | 97 Ų | 97 | 111.3 Ų | 111.3 | 45% | 0.453 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -60.2 | -42.6 | 176.5 | -72.9 | -179.2 | 175.2 | 0 | 0 | 111.6 | V285 H286 C291 E292 Q293 | V285-E289 WeakPolarHBondContact O-CG 3.45Å; V285-E289 PolarHBondContact O-N 3.46Å; H286-E289 PolarHBondContact O-N 3.3Å; E289-C291 PolarHBondContact O-N 3Å; E289-E292 PolarHBondContact O-N 3.37Å; E289-Q293 WeakPolarHBondContact O-CG 3.46Å; E289-Q293 PolarHBondContact O-N 3.48Å |
| 290 | A | 82.8 | Confident | 83.7 | Confident | 58 Ų | 58 | 112.5 Ų | 112.5 | 48% | 0.479 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.8 | -42.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | H286 S287 R288 Q293 A294 | H286-A290 WeakPolarHBondContact O-CB 3.39Å; H286-A290 PolarHBondContact O-N 3.46Å; S287-A290 PolarHBondContact O-N 3.19Å; R288-A290 VanDerWaalsContact C-N 3.32Å; R288-A290 PolarHBondContact O-N 3.16Å; A290-Q293 PolarHBondContact O-N 3.01Å; A290-A294 WeakPolarHBondContact O-CB 3.37Å; A290-A294 PolarHBondContact O-N 2.91Å |
| 291 | C | 84.9 | Confident | 83.6 | Confident | 65 Ų | 65 | 112.1 Ų | 112.1 | 44% | 0.439 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.5 | -46 | 173.8 | -71 | 0 | 0 | 0 | 0 | 111.8 | S287 R288 E289 Q293 A294 F295 | S287-C291 PolarHBondContact O-N 2.93Å; S287-C291 PolarHBondContact O-SG 3.01Å; R288-C291 PolarHBondContact O-N 2.88Å; E289-C291 PolarHBondContact O-N 3Å; C291-Q293 VanDerWaalsContact C-N 3.28Å; C291-Q293 PolarHBondContact O-N 2.93Å; C291-A294 PolarHBondContact O-N 3.25Å; C291-A294 VanDerWaalsContact O-N 3.16Å; C291-F295 WeakPolarHBondContact O-CD2 3.35Å; C291-F295 PolarHBondContact O-N 3.45Å |
| 292 | E | 85.9 | Confident | 83.5 | Confident | 84 Ų | 84 | 109.8 Ų | 109.8 | 39% | 0.393 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.7 | -35.4 | 178.1 | -74.7 | -178.3 | -164.8 | 0 | 0 | 112.2 | R288 E289 K296 | R288-E292 IonicContact CZ-OE1 3.65Å; R288-E292 IonicContact NE-OE1 2.94Å; R288-E292 PolarHBondContact NE-OE1 3.44Å; R288-E292 IonicContact NH2-OE1 3.49Å; R288-E292 PolarHBondContact NH2-OE1 3.29Å; R288-E292 WeakPolarHBondContact O-CG 3.5Å; R288-E292 PolarHBondContact O-N 3.23Å; E289-E292 PolarHBondContact O-N 3.37Å; E292-K296 WeakPolarHBondContact O-CG 3.22Å; E292-K296 PolarHBondContact O-N 3.43Å |
| 293 | Q | 85.7 | Confident | 83.3 | Confident | 130 Ų | 130 | 112.1 Ų | 112.1 | 61% | 0.607 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -68.7 | -40.8 | 173 | -72.5 | -176.5 | 16.6 | 0 | 0 | 112.4 | E289 A290 C291 F295 K296 | E289-Q293 WeakPolarHBondContact O-CG 3.46Å; E289-Q293 PolarHBondContact O-N 3.48Å; A290-Q293 PolarHBondContact O-N 3.01Å; C291-Q293 VanDerWaalsContact C-N 3.28Å; C291-Q293 PolarHBondContact O-N 2.93Å; Q293-F295 VanDerWaalsContact C-N 3.34Å; Q293-F295 PolarHBondContact O-N 2.99Å; Q293-K296 PolarHBondContact O-N 3.48Å |
| 294 | A | 83.2 | Confident | 83.1 | Confident | 64 Ų | 64 | 113.1 Ų | 113.1 | 53% | 0.529 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65 | -35.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | A290 C291 K296 | A290-A294 WeakPolarHBondContact O-CB 3.37Å; A290-A294 PolarHBondContact O-N 2.91Å; C291-A294 PolarHBondContact O-N 3.25Å; C291-A294 VanDerWaalsContact O-N 3.16Å; A294-K296 VanDerWaalsContact C-N 3.29Å; A294-K296 PolarHBondContact O-N 3.16Å |
| 295 | F | 79.9 | Confident | 82.8 | Confident | 183 Ų | 183 | 114.2 Ų | 114.2 | 80% | 0.803 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -71.8 | -19.2 | 175.8 | -85 | -69.4 | 0 | 0 | 0 | 114.3 | C291 Q293 | C291-F295 WeakPolarHBondContact O-CD2 3.35Å; C291-F295 PolarHBondContact O-N 3.45Å; Q293-F295 VanDerWaalsContact C-N 3.34Å; Q293-F295 PolarHBondContact O-N 2.99Å |
| 296 | K | 83.9 | Confident | 82.8 | Confident | 174 Ų | 174 | 117.7 Ų | 117.7 | 76% | 0.757 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | -8.5 | 178.9 | -74.9 | 175.4 | -177.9 | 173.3 | 0 | 113.5 | E292 Q293 A294 | E292-K296 WeakPolarHBondContact O-CG 3.22Å; E292-K296 PolarHBondContact O-N 3.43Å; Q293-K296 PolarHBondContact O-N 3.48Å; A294-K296 VanDerWaalsContact C-N 3.29Å; A294-K296 PolarHBondContact O-N 3.16Å |
| 297 | Q | 69.2 | Low | 82.5 | Confident | 221 Ų | 221 | 119.6 Ų | 119.6 | 100% | 1.033 | 60% | 0.602 | S | S | * | * | trans | -92.5 | 0 | 174.7 | -65.1 | -176.2 | 13.2 | 0 | 0 | 110.5 |
Retrieved 297 of 297 residues in 97.8 ms
(Link to these results)