| 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 | 53.2 | Low | 56.4 | Low | 231 Ų | 231 | 171.4 Ų | 171.4 | 100% | 1.138 | 83% | 0.831 | S | S | * | * | 0 | 128.3 | 0 | -84.1 | -154 | 178.9 | 0 | 0 | 107.9 | |||||
| 2 | Y | 63.1 | Low | 56.3 | Low | 240 Ų | 240 | 171.3 Ų | 171.3 | 94% | 0.941 | 83% | 0.827 | S | S | * | * | trans | 67.4 | 100.4 | -147.2 | -65.2 | -76.5 | 0 | 0 | 0 | 113.3 | ||||
| 3 | D | 58.2 | Low | 55.8 | Low | 153 Ų | 153 | 166.2 Ų | 166.2 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -86.6 | 131 | 174 | -65 | -43.8 | 0 | 0 | 0 | 109.7 | Q5 | D3-Q5 PolarHBondContact O-N 3.32Š| ||
| 4 | E | 55.5 | Low | 55.8 | Low | 198 Ų | 198 | 165.9 Ų | 165.9 | 93% | 0.925 | 82% | 0.816 | S | S | * | * | trans | -64.4 | 116 | 163.1 | -85.1 | 174.4 | 108 | 0 | 0 | 109 | ||||
| 5 | Q | 59.5 | Low | 55.9 | Low | 184 Ų | 184 | 167.5 Ų | 167.5 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | -125.9 | 88.7 | 169.9 | -134.1 | 172.8 | 17 | 0 | 0 | 111.8 | D3 | D3-Q5 PolarHBondContact O-N 3.32Š| ||
| 6 | T | 58.9 | Low | 55.9 | Low | 115 Ų | 115 | 167.9 Ų | 167.9 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | 58.3 | 107.9 | 125.5 | -28 | 0 | 0 | 0 | 0 | 118.4 | N8 | T6-N8 PolarHBondContact O-N 2.8Å; T6-N8 VanDerWaalsContact O-N 3.15Å | |||
| 7 | H | 53.6 | Low | 56 | Low | 159 Ų | 159 | 170.1 Ų | 170.1 | 74% | 0.736 | 82% | 0.821 | S | S | * | * | trans | -16.4 | 106 | 147.5 | -107.2 | -103.5 | 0 | 0 | 0 | 113.8 | H9 | H7-H9 AromaticContact CE1-NE2 3.45Å; H7-H9 PolarHBondContact CE1-NE2 3.07Å; H7-H9 AromaticContact ND1-CD2 3.26Å; H7-H9 PolarHBondContact ND1-CD2 3.16Å; H7-H9 VanDerWaalsContact ND1-CD2 3.26Å; H7-H9 AromaticContact ND1-NE2 3.07Å; H7-H9 PolarHBondContact ND1-NE2 2.89Å | ||
| 8 | N | 49.1 | Very low | 55.6 | Low | 155 Ų | 155 | 166.9 Ų | 166.9 | 83% | 0.829 | 81% | 0.813 | S | S | * | * | trans | -102.8 | 88.2 | 164.2 | -119.5 | -16.3 | 0 | 0 | 0 | 108.4 | T6 N10 | T6-N8 PolarHBondContact O-N 2.8Å; T6-N8 VanDerWaalsContact O-N 3.15Å; N8-N10 PolarHBondContact O-N 2.95Å; N8-N10 VanDerWaalsContact O-N 3.08Å | ||
| 9 | H | 62.6 | Low | 55.7 | Low | 137 Ų | 137 | 164.1 Ų | 164.1 | 63% | 0.634 | 81% | 0.812 | S | S | * | * | trans | -67.4 | 98 | 162.2 | -84.8 | -81.5 | 0 | 0 | 0 | 108.1 | H7 H11 | H7-H9 AromaticContact CE1-NE2 3.45Å; H7-H9 PolarHBondContact CE1-NE2 3.07Å; H7-H9 AromaticContact ND1-CD2 3.26Å; H7-H9 PolarHBondContact ND1-CD2 3.16Å; H7-H9 VanDerWaalsContact ND1-CD2 3.26Å; H7-H9 AromaticContact ND1-NE2 3.07Å; H7-H9 PolarHBondContact ND1-NE2 2.89Å; H9-H11 PolarHBondContact O-N 2.88Å | ||
| 10 | N | 54.7 | Low | 55.4 | Low | 144 Ų | 144 | 164.5 Ų | 164.5 | 77% | 0.77 | 81% | 0.811 | S | S | * | * | trans | -69.1 | 81.2 | 165.6 | -107.7 | -13 | 0 | 0 | 0 | 109.2 | N8 H12 | N8-N10 PolarHBondContact O-N 2.95Å; N8-N10 VanDerWaalsContact O-N 3.08Å; N10-H12 PolarHBondContact O-N 3.41Å; N10-H12 VanDerWaalsContact O-N 3.08Å | ||
| 11 | H | 52.4 | Low | 55.5 | Low | 169 Ų | 169 | 161.9 Ų | 161.9 | 78% | 0.782 | 81% | 0.809 | S | S | * | * | trans | -74.7 | 79 | 161.1 | -113.4 | -89.9 | 0 | 0 | 0 | 107.6 | H9 T13 | H9-H11 PolarHBondContact O-N 2.88Å; H11-T13 PolarHBondContact O-N 3.2Å; H11-T13 VanDerWaalsContact O-N 3.16Å | ||
| 12 | H | 55.1 | Low | 55.8 | Low | 170 Ų | 170 | 157 Ų | 157 | 79% | 0.787 | 79% | 0.788 | S | S | * | * | trans | -79.3 | 101 | 171.5 | -134.3 | -75 | 0 | 0 | 0 | 109.1 | N10 L14 | N10-H12 PolarHBondContact O-N 3.41Å; N10-H12 VanDerWaalsContact O-N 3.08Å; H12-L14 PolarHBondContact O-N 2.87Å | ||
| 13 | T | 49.2 | Very low | 55.3 | Low | 106 Ų | 106 | 151.8 Ų | 151.8 | 65% | 0.65 | 78% | 0.783 | S | S | * | * | trans | -51.6 | 118.2 | 175.1 | -46.3 | 0 | 0 | 0 | 0 | 112.4 | H11 K15 | H11-T13 PolarHBondContact O-N 3.2Å; H11-T13 VanDerWaalsContact O-N 3.16Å; T13-K15 HydrophobicContact CG2-CG 4.31Å; T13-K15 PolarHBondContact O-N 3.43Å | ||
| 14 | L | 56.1 | Low | 55.5 | Low | 161 Ų | 161 | 151.1 Ų | 151.1 | 84% | 0.843 | 78% | 0.775 | S | S | * | * | trans | -90.8 | 91 | 166.1 | -100.3 | 143.8 | 0 | 0 | 0 | 109.2 | H12 Q16 | H12-L14 PolarHBondContact O-N 2.87Å; L14-Q16 PolarHBondContact O-N 2.94Å; L14-Q16 VanDerWaalsContact O-N 3.14Å | ||
| 15 | K | 57.2 | Low | 55.3 | Low | 190 Ų | 190 | 149.8 Ų | 149.8 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | trans | -69.2 | 101.1 | 159.8 | -75.3 | -175.8 | 176.5 | 179.7 | 0 | 107.5 | T13 K17 | T13-K15 HydrophobicContact CG2-CG 4.31Å; T13-K15 PolarHBondContact O-N 3.43Å; K15-K17 PolarHBondContact O-N 3.16Å | ||
| 16 | Q | 56.8 | Low | 55.3 | Low | 175 Ų | 175 | 148.4 Ų | 148.4 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | trans | -62.7 | 113 | 169.3 | -76.3 | 176.8 | -51.5 | 0 | 0 | 109.3 | L14 | L14-Q16 PolarHBondContact O-N 2.94Å; L14-Q16 VanDerWaalsContact O-N 3.14Å | ||
| 17 | K | 56.6 | Low | 55.6 | Low | 204 Ų | 204 | 148.5 Ų | 148.5 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | trans | -97.7 | 103.3 | 157 | -79 | -173.5 | 175.8 | -176.4 | 0 | 106.9 | K15 S19 | K15-K17 PolarHBondContact O-N 3.16Å; K17-S19 PolarHBondContact O-N 3.31Å | ||
| 18 | V | 48.3 | Very low | 56.2 | Low | 114 Ų | 114 | 146.4 Ų | 146.4 | 69% | 0.691 | 77% | 0.768 | S | S | * | * | trans | -70.2 | 118.8 | 168.7 | 176.2 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 19 | S | 59.2 | Low | 57.2 | Low | 113 Ų | 113 | 148 Ų | 148 | 79% | 0.79 | 76% | 0.764 | S | S | * | * | trans | -122.7 | 115.9 | 166.7 | -144.5 | 0 | 0 | 0 | 0 | 107.1 | K17 | K17-S19 PolarHBondContact O-N 3.31Š| ||
| 20 | H | 49.4 | Very low | 57.7 | Low | 172 Ų | 172 | 151 Ų | 151 | 80% | 0.796 | 77% | 0.77 | S | S | * | * | trans | -84 | 117 | 178.3 | -83 | -86.2 | 0 | 0 | 0 | 109.5 | ||||
| 21 | S | 57.7 | Low | 58.3 | Low | 109 Ų | 109 | 151.4 Ų | 151.4 | 76% | 0.762 | 77% | 0.767 | S | S | * | * | trans | -162.7 | 141.5 | 156.1 | -18.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 22 | D | 59.6 | Low | 58.6 | Low | 130 Ų | 130 | 152.9 Ų | 152.9 | 70% | 0.695 | 77% | 0.767 | S | S | * | * | trans | 76.2 | 102.7 | 173.6 | -85.4 | -51.4 | 0 | 0 | 0 | 119.9 | Q24 | D22-Q24 PolarHBondContact O-N 3.08Š| ||
| 23 | P | 52.3 | Low | 59 | Low | 129 Ų | 129 | 149 Ų | 149 | 84% | 0.838 | 76% | 0.759 | S | S | * | * | trans | -89 | 72.9 | 161.2 | 36.4 | -26.9 | 0 | 0 | 0 | 109.3 | ||||
| 24 | Q | 61.9 | Low | 59.9 | Low | 140 Ų | 140 | 149.9 Ų | 149.9 | 65% | 0.654 | 77% | 0.765 | S | S | * | * | trans | -111.1 | 89.5 | 165.1 | -75.7 | -170.7 | 28 | 0 | 0 | 109.8 | D22 H26 | D22-Q24 PolarHBondContact O-N 3.08Å; Q24-H26 VanDerWaalsContact C-N 3.32Å; Q24-H26 PolarHBondContact O-CD2 3.21Å; Q24-H26 PolarHBondContact O-N 3.37Å | ||
| 25 | N | 51.9 | Low | 60 | Low | 170 Ų | 170 | 150.1 Ų | 150.1 | 91% | 0.909 | 76% | 0.761 | S | S | * | * | trans | 13 | 58.1 | 143.2 | -113.7 | 3.3 | 0 | 0 | 0 | 119.2 | ||||
| 26 | H | 59.3 | Low | 60 | Low | 154 Ų | 154 | 146.5 Ų | 146.5 | 71% | 0.713 | 76% | 0.755 | S | S | * | * | trans | -105.6 | 124 | 164.8 | -73.3 | -70.6 | 0 | 0 | 0 | 109.8 | Q24 V28 | Q24-H26 VanDerWaalsContact C-N 3.32Å; Q24-H26 PolarHBondContact O-CD2 3.21Å; Q24-H26 PolarHBondContact O-N 3.37Å; H26-V28 PolarHBondContact O-N 2.98Å; H26-V28 VanDerWaalsContact O-N 3.07Å | ||
| 27 | P | 65 | Low | 60 | Low | 117 Ų | 117 | 143.2 Ų | 143.2 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | trans | -58.8 | 117.8 | 174.7 | 21.9 | -29.6 | 0 | 0 | 0 | 109.1 | Y29 | P27-Y29 VanDerWaalsContact C-N 3.33Å; P27-Y29 PolarHBondContact O-N 2.98Å | ||
| 28 | V | 65.9 | Low | 59.9 | Low | 116 Ų | 116 | 139.5 Ų | 139.5 | 70% | 0.703 | 75% | 0.745 | S | S | * | * | trans | -66 | 94.9 | 174.6 | 178.2 | 0 | 0 | 0 | 0 | 107.6 | H26 W30 | H26-V28 PolarHBondContact O-N 2.98Å; H26-V28 VanDerWaalsContact O-N 3.07Å; V28-W30 PolarHBondContact O-N 3.14Å | ||
| 29 | Y | 69.8 | Low | 60.1 | Low | 189 Ų | 189 | 137.5 Ų | 137.5 | 74% | 0.741 | 74% | 0.737 | S | S | * | * | trans | -74.4 | 105.6 | 170.9 | -139.2 | -94 | 0 | 0 | 0 | 107.7 | P27 H31 | P27-Y29 VanDerWaalsContact C-N 3.33Å; P27-Y29 PolarHBondContact O-N 2.98Å; Y29-H31 PolarHBondContact O-N 3.03Å | ||
| 30 | W | 73.4 | Confident | 59.9 | Low | 198 Ų | 198 | 143 Ų | 143 | 75% | 0.75 | 74% | 0.74 | S | S | * | * | trans | -67.5 | 97.5 | 171.9 | -68.3 | 85.8 | 0 | 0 | 0 | 108.5 | V28 Y32 | V28-W30 PolarHBondContact O-N 3.14Å; W30-Y32 HydrophobicContact CB-CD2 4.41Å; W30-Y32 HydrophobicContact CB-CE2 4.1Å; W30-Y32 PolarHBondContact O-N 3.43Å | ||
| 31 | H | 67 | Low | 60.3 | Low | 154 Ų | 154 | 140.5 Ų | 140.5 | 71% | 0.713 | 73% | 0.733 | S | S | * | * | trans | -70.6 | 93.1 | 169.3 | -83.2 | -91.5 | 0 | 0 | 0 | 109.1 | Y29 S33 | Y29-H31 PolarHBondContact O-N 3.03Å; H31-S33 PolarHBondContact O-N 2.95Å | ||
| 32 | Y | 59.9 | Low | 60.3 | Low | 199 Ų | 199 | 141.1 Ų | 141.1 | 78% | 0.78 | 73% | 0.728 | S | S | * | * | trans | -68.8 | 84.2 | 163.2 | -72.6 | -80.4 | 0 | 0 | 0 | 108.8 | W30 T34 | W30-Y32 HydrophobicContact CB-CD2 4.41Å; W30-Y32 HydrophobicContact CB-CE2 4.1Å; W30-Y32 PolarHBondContact O-N 3.43Å; Y32-T34 VanDerWaalsContact C-N 3.33Å; Y32-T34 PolarHBondContact O-N 3.5Å | ||
| 33 | S | 62.4 | Low | 60.2 | Low | 89 Ų | 89 | 140.9 Ų | 140.9 | 62% | 0.622 | 72% | 0.722 | S | S | * | * | trans | -72.4 | 91.8 | 169 | -62 | 0 | 0 | 0 | 0 | 108.2 | H31 H35 | H31-S33 PolarHBondContact O-N 2.95Å; S33-H35 PolarHBondContact O-N 2.89Å | ||
| 34 | T | 67.5 | Low | 60.8 | Low | 125 Ų | 125 | 138.5 Ų | 138.5 | 77% | 0.767 | 71% | 0.705 | S | S | * | * | trans | -74.2 | 92 | 171.9 | -0.4 | 0 | 0 | 0 | 0 | 107.8 | Y32 V36 | Y32-T34 VanDerWaalsContact C-N 3.33Å; Y32-T34 PolarHBondContact O-N 3.5Å; T34-V36 VanDerWaalsContact C-N 3.26Å; T34-V36 PolarHBondContact O-N 3.03Å | ||
| 35 | H | 58.4 | Low | 60.8 | Low | 165 Ų | 165 | 134.8 Ų | 134.8 | 76% | 0.764 | 69% | 0.692 | S | S | * | * | trans | -67.2 | 89.8 | 166.8 | -82.3 | -85.8 | 0 | 0 | 0 | 108.7 | S33 S37 | S33-H35 PolarHBondContact O-N 2.89Å; H35-S37 PolarHBondContact O-N 3.02Å | ||
| 36 | V | 57.1 | Low | 61.4 | Low | 114 Ų | 114 | 133.4 Ų | 133.4 | 69% | 0.691 | 68% | 0.678 | S | S | * | * | trans | -74.4 | 82.6 | 166.8 | -176.8 | 0 | 0 | 0 | 0 | 107.2 | T34 T38 | T34-V36 VanDerWaalsContact C-N 3.26Å; T34-V36 PolarHBondContact O-N 3.03Å; V36-T38 VanDerWaalsContact C-N 3.29Å; V36-T38 HydrophobicContact CG1-CG2 4.13Å; V36-T38 PolarHBondContact O-N 2.84Å | ||
| 37 | S | 57.4 | Low | 61.6 | Low | 106 Ų | 106 | 134.2 Ų | 134.2 | 74% | 0.741 | 68% | 0.675 | S | S | * | * | trans | -71.9 | 86.6 | 171 | -64.9 | 0 | 0 | 0 | 0 | 109 | H35 S39 | H35-S37 PolarHBondContact O-N 3.02Å; S37-S39 PolarHBondContact O-N 3.37Å | ||
| 38 | T | 55.4 | Low | 61.6 | Low | 126 Ų | 126 | 132.3 Ų | 132.3 | 77% | 0.773 | 66% | 0.664 | S | S | * | * | trans | -70.4 | 78.1 | 168.9 | 32.1 | 0 | 0 | 0 | 0 | 110 | V36 R40 | V36-T38 VanDerWaalsContact C-N 3.29Å; V36-T38 HydrophobicContact CG1-CG2 4.13Å; V36-T38 PolarHBondContact O-N 2.84Å; T38-R40 PolarHBondContact O-N 2.77Å | ||
| 39 | S | 51.4 | Low | 61.4 | Low | 72 Ų | 72 | 131.8 Ų | 131.8 | 50% | 0.503 | 65% | 0.654 | S | S | . | * | trans | -69.9 | 118.6 | 169.1 | 179.1 | 0 | 0 | 0 | 0 | 109.8 | S37 N41 N42 | S37-S39 PolarHBondContact O-N 3.37Å; S39-N41 PolarHBondContact O-N 3.08Å; S39-N41 PolarHBondContact OG-N 3.5Å; S39-N42 PolarHBondContact O-N 3.02Å | ||
| 40 | R | 54.8 | Low | 61.1 | Low | 228 Ų | 228 | 127.7 Ų | 127.7 | 86% | 0.86 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -52.1 | -23.2 | 171.6 | -83.1 | -179.1 | 173 | 173.6 | -1.6 | 112.8 | T38 N42 Q43 | T38-R40 PolarHBondContact O-N 2.77Å; R40-N42 VanDerWaalsContact C-N 3.34Å; R40-N42 PolarHBondContact O-N 2.89Å; R40-Q43 PolarHBondContact O-N 3.31Å |
| 41 | N | 58.4 | Low | 60.8 | Low | 121 Ų | 121 | 125 Ų | 125 | 65% | 0.647 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -72.7 | -25.1 | -179.9 | -137.8 | 21.3 | 0 | 0 | 0 | 113 | S39 T44 T45 | S39-N41 PolarHBondContact O-N 3.08Å; S39-N41 PolarHBondContact OG-N 3.5Å; N41-T44 PolarHBondContact O-OG1 3.08Å; N41-T45 PolarHBondContact O-OG1 3.15Å |
| 42 | N | 57.6 | Low | 60.5 | Low | 122 Ų | 122 | 123.7 Ų | 123.7 | 65% | 0.652 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -80.7 | -24.3 | 179.2 | -140.5 | 15.2 | 0 | 0 | 0 | 112.3 | S39 R40 F46 | S39-N42 PolarHBondContact O-N 3.02Å; R40-N42 VanDerWaalsContact C-N 3.34Å; R40-N42 PolarHBondContact O-N 2.89Å; N42-F46 WeakPolarHBondContact O-CB 3.29Å; N42-F46 PolarHBondContact O-N 3.48Å |
| 43 | Q | 58.6 | Low | 60.6 | Low | 124 Ų | 124 | 123.1 Ų | 123.1 | 58% | 0.579 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -75.7 | -33 | -179.2 | -158.9 | 177.8 | 66.2 | 0 | 0 | 112.1 | R40 R47 | R40-Q43 PolarHBondContact O-N 3.31Å; Q43-R47 WeakPolarHBondContact O-CB 3.4Å; Q43-R47 VanDerWaalsContact O-CG 3.29Å; Q43-R47 WeakPolarHBondContact O-CG 3.42Å; Q43-R47 PolarHBondContact O-N 3.18Å; Q43-R47 VanDerWaalsContact O-N 3.08Å |
| 44 | T | 63.5 | Low | 60.9 | Low | 79 Ų | 79 | 124 Ų | 124 | 49% | 0.485 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -72 | -42.7 | 174.5 | 48.4 | 0 | 0 | 0 | 0 | 111.4 | N41 R47 S48 | N41-T44 PolarHBondContact O-OG1 3.08Å; T44-R47 PolarHBondContact O-N 3.05Å; T44-S48 WeakPolarHBondContact O-CB 3.36Å; T44-S48 PolarHBondContact O-N 3.07Å; T44-S48 PolarHBondContact O-OG 3.31Å |
| 45 | T | 61.6 | Low | 61 | Low | 62 Ų | 62 | 124.9 Ų | 124.9 | 38% | 0.38 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -63.5 | -43.3 | 175.6 | -19.4 | 0 | 0 | 0 | 0 | 111.5 | N41 R47 S48 H49 | N41-T45 PolarHBondContact O-OG1 3.15Å; T45-R47 PolarHBondContact O-N 3.45Å; T45-S48 PolarHBondContact O-N 3.26Å; T45-H49 WeakPolarHBondContact O-CB 3.2Å; T45-H49 PolarHBondContact O-CD2 2.94Å; T45-H49 PolarHBondContact O-N 3.27Å |
| 46 | F | 64.8 | Low | 61.6 | Low | 141 Ų | 141 | 119.9 Ų | 119.9 | 62% | 0.618 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -61.5 | -44.1 | 175.3 | -174.8 | -96.9 | 0 | 0 | 0 | 111.9 | N42 H49 F50 | N42-F46 WeakPolarHBondContact O-CB 3.29Å; N42-F46 PolarHBondContact O-N 3.48Å; F46-H49 PolarHBondContact O-N 2.89Å; F46-F50 WeakPolarHBondContact O-CB 3.47Å; F46-F50 PolarHBondContact O-N 3.45Å |
| 47 | R | 64.5 | Low | 62.3 | Low | 172 Ų | 172 | 118.5 Ų | 118.5 | 65% | 0.649 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.5 | -41 | 176.3 | -78.7 | 179 | 175.2 | -158.8 | 0.6 | 112.3 | Q43 T44 T45 F50 K51 | Q43-R47 WeakPolarHBondContact O-CB 3.4Å; Q43-R47 VanDerWaalsContact O-CG 3.29Å; Q43-R47 WeakPolarHBondContact O-CG 3.42Å; Q43-R47 PolarHBondContact O-N 3.18Å; Q43-R47 VanDerWaalsContact O-N 3.08Å; T44-R47 PolarHBondContact O-N 3.05Å; T45-R47 PolarHBondContact O-N 3.45Å; R47-F50 PolarHBondContact O-N 2.87Å; R47-K51 VanDerWaalsContact O-CB 3.28Å; R47-K51 WeakPolarHBondContact O-CB 3.49Å; R47-K51 PolarHBondContact O-N 2.9Å |
| 48 | S | 64.7 | Low | 63.1 | Low | 76 Ų | 76 | 119.4 Ų | 119.4 | 53% | 0.531 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.3 | -49.7 | 176.7 | -68.7 | 0 | 0 | 0 | 0 | 111.6 | T44 T45 F50 K51 E52 | T44-S48 WeakPolarHBondContact O-CB 3.36Å; T44-S48 PolarHBondContact O-N 3.07Å; T44-S48 PolarHBondContact O-OG 3.31Å; T45-S48 PolarHBondContact O-N 3.26Å; S48-F50 VanDerWaalsContact C-N 3.31Å; S48-F50 PolarHBondContact O-N 3.36Å; S48-K51 PolarHBondContact O-N 3.18Å; S48-E52 WeakPolarHBondContact O-CB 3.38Å; S48-E52 PolarHBondContact O-N 3.07Å |
| 49 | H | 60.6 | Low | 63.9 | Low | 106 Ų | 106 | 119.4 Ų | 119.4 | 49% | 0.491 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61.5 | -37.7 | 175.9 | -78.4 | -61.2 | 0 | 0 | 0 | 112.6 | T45 F46 R53 | T45-H49 WeakPolarHBondContact O-CB 3.2Å; T45-H49 PolarHBondContact O-CD2 2.94Å; T45-H49 PolarHBondContact O-N 3.27Å; F46-H49 PolarHBondContact O-N 2.89Å; H49-R53 WeakPolarHBondContact O-CB 3.36Å; H49-R53 VanDerWaalsContact O-CG 3.31Å; H49-R53 WeakPolarHBondContact O-CG 3.39Å; H49-R53 PolarHBondContact O-N 3.27Å |
| 50 | F | 64.9 | Low | 65 | Low | 103 Ų | 103 | 124.3 Ų | 124.3 | 45% | 0.452 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70.5 | -39.2 | 177.8 | -168.3 | -109.6 | 0 | 0 | 0 | 112.3 | F46 R47 S48 K54 | F46-F50 WeakPolarHBondContact O-CB 3.47Å; F46-F50 PolarHBondContact O-N 3.45Å; R47-F50 PolarHBondContact O-N 2.87Å; S48-F50 VanDerWaalsContact C-N 3.31Å; S48-F50 PolarHBondContact O-N 3.36Å; F50-K54 HydrophobicContact CD1-CD 4.09Å; F50-K54 HydrophobicContact CE1-CD 3.8Å; F50-K54 HydrophobicContact CE1-CG 4.42Å; F50-K54 HydrophobicContact CZ-CD 4.36Å; F50-K54 VanDerWaalsContact CZ-CE 3.48Å; F50-K54 WeakPolarHBondContact O-CB 3.28Å; F50-K54 WeakPolarHBondContact O-CG 3.43Å; F50-K54 PolarHBondContact O-N 3.5Å |
| 51 | K | 66.7 | Low | 65.8 | Low | 140 Ų | 140 | 117.6 Ų | 117.6 | 61% | 0.609 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.9 | -40.6 | 175.5 | -170.8 | 176.3 | -176.6 | 179.4 | 0 | 111.2 | R47 S48 K54 K55 | R47-K51 VanDerWaalsContact O-CB 3.28Å; R47-K51 WeakPolarHBondContact O-CB 3.49Å; R47-K51 PolarHBondContact O-N 2.9Å; S48-K51 PolarHBondContact O-N 3.18Å; K51-K54 PolarHBondContact O-N 2.98Å; K51-K55 WeakPolarHBondContact O-CG 3.38Å; K51-K55 PolarHBondContact O-N 2.92Å |
| 52 | E | 60.5 | Low | 66.6 | Low | 127 Ų | 127 | 114.2 Ų | 114.2 | 59% | 0.593 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.7 | -48.5 | 177.2 | -171.1 | 165.6 | -159.6 | 0 | 0 | 111.6 | S48 K54 K55 T56 | S48-E52 WeakPolarHBondContact O-CB 3.38Å; S48-E52 PolarHBondContact O-N 3.07Å; E52-K54 VanDerWaalsContact C-N 3.32Å; E52-K54 PolarHBondContact O-N 3.33Å; E52-K55 PolarHBondContact O-N 3.14Å; E52-K55 VanDerWaalsContact O-N 3.15Å; E52-T56 PolarHBondContact O-N 2.74Å; E52-T56 PolarHBondContact O-OG1 2.96Å |
| 53 | R | 62.9 | Low | 67.2 | Low | 187 Ų | 187 | 113.1 Ų | 113.1 | 71% | 0.706 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59.2 | -41.4 | 174.8 | -74 | -176.6 | -178.5 | -160.2 | 2 | 112.2 | H49 K55 T56 V57 | H49-R53 WeakPolarHBondContact O-CB 3.36Å; H49-R53 VanDerWaalsContact O-CG 3.31Å; H49-R53 WeakPolarHBondContact O-CG 3.39Å; H49-R53 PolarHBondContact O-N 3.27Å; R53-K55 PolarHBondContact O-N 3.42Å; R53-T56 PolarHBondContact O-N 3.35Å; R53-V57 WeakPolarHBondContact O-CG2 3.31Å; R53-V57 PolarHBondContact O-N 3.5Å |
| 54 | K | 67.6 | Low | 67.7 | Low | 107 Ų | 107 | 111.2 Ų | 111.2 | 47% | 0.465 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -59.2 | -46.9 | 175 | -85.5 | -174.8 | 167.3 | -177.7 | 0 | 111.8 | F50 K51 E52 T56 V57 H58 | F50-K54 HydrophobicContact CD1-CD 4.09Å; F50-K54 HydrophobicContact CE1-CD 3.8Å; F50-K54 HydrophobicContact CE1-CG 4.42Å; F50-K54 HydrophobicContact CZ-CD 4.36Å; F50-K54 VanDerWaalsContact CZ-CE 3.48Å; F50-K54 WeakPolarHBondContact O-CB 3.28Å; F50-K54 WeakPolarHBondContact O-CG 3.43Å; F50-K54 PolarHBondContact O-N 3.5Å; K51-K54 PolarHBondContact O-N 2.98Å; E52-K54 VanDerWaalsContact C-N 3.32Å; E52-K54 PolarHBondContact O-N 3.33Å; K54-T56 VanDerWaalsContact C-N 3.32Å; K54-T56 PolarHBondContact O-N 3.5Å; K54-V57 PolarHBondContact O-N 2.95Å; K54-H58 PolarHBondContact O-N 3.15Å; K54-H58 PolarHBondContact O-ND1 3.4Å |
| 55 | K | 69.4 | Low | 67.9 | Low | 144 Ų | 144 | 112.4 Ų | 112.4 | 63% | 0.626 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -59.4 | -43.6 | 178.3 | -74.7 | -179.7 | 176.4 | -171.1 | 0 | 111.6 | K51 E52 R53 V57 H58 L59 | K51-K55 WeakPolarHBondContact O-CG 3.38Å; K51-K55 PolarHBondContact O-N 2.92Å; E52-K55 PolarHBondContact O-N 3.14Å; E52-K55 VanDerWaalsContact O-N 3.15Å; R53-K55 PolarHBondContact O-N 3.42Å; K55-V57 PolarHBondContact O-N 3.07Å; K55-H58 PolarHBondContact O-N 3.5Å; K55-L59 VanDerWaalsContact O-CB 3.26Å; K55-L59 WeakPolarHBondContact O-CB 3.31Å; K55-L59 PolarHBondContact O-N 3.49Å |
| 56 | T | 71.5 | Confident | 68 | Low | 60 Ų | 60 | 116.1 Ų | 116.1 | 37% | 0.368 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65 | -39.4 | 178.5 | -50.4 | 0 | 0 | 0 | 0 | 112.2 | E52 R53 K54 L59 R60 | E52-T56 PolarHBondContact O-N 2.74Å; E52-T56 PolarHBondContact O-OG1 2.96Å; R53-T56 PolarHBondContact O-N 3.35Å; K54-T56 VanDerWaalsContact C-N 3.32Å; K54-T56 PolarHBondContact O-N 3.5Å; T56-L59 PolarHBondContact O-N 2.92Å; T56-R60 WeakPolarHBondContact O-CB 3.3Å; T56-R60 VanDerWaalsContact O-CG 3.31Å; T56-R60 WeakPolarHBondContact O-CG 3.21Å; T56-R60 PolarHBondContact O-N 2.84Å |
| 57 | V | 71.6 | Confident | 68 | Low | 86 Ų | 86 | 115.4 Ų | 115.4 | 52% | 0.521 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.4 | -47.7 | 175.7 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | R53 K54 K55 L59 R60 V61 | R53-V57 WeakPolarHBondContact O-CG2 3.31Å; R53-V57 PolarHBondContact O-N 3.5Å; K54-V57 PolarHBondContact O-N 2.95Å; K55-V57 PolarHBondContact O-N 3.07Å; V57-L59 VanDerWaalsContact C-N 3.3Å; V57-L59 PolarHBondContact O-N 3.22Å; V57-R60 PolarHBondContact O-N 3.41Å; V57-V61 HydrophobicContact CG1-CG2 4.27Å; V57-V61 VanDerWaalsContact O-CG2 3.3Å; V57-V61 WeakPolarHBondContact O-CG2 3.26Å; V57-V61 PolarHBondContact O-N 2.86Å |
| 58 | H | 73.9 | Confident | 67.7 | Low | 125 Ų | 125 | 108.8 Ų | 108.8 | 58% | 0.579 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.3 | -39.2 | 178.3 | -71.2 | 77.3 | 0 | 0 | 0 | 111.4 | K54 K55 V61 A62 | K54-H58 PolarHBondContact O-N 3.15Å; K54-H58 PolarHBondContact O-ND1 3.4Å; K55-H58 PolarHBondContact O-N 3.5Å; H58-V61 PolarHBondContact O-N 3.42Å; H58-A62 WeakPolarHBondContact O-CB 3.34Å; H58-A62 PolarHBondContact O-N 2.82Å |
| 59 | L | 73.3 | Confident | 67.4 | Low | 125 Ų | 125 | 108.6 Ų | 108.6 | 65% | 0.654 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64 | -42.9 | 175.9 | -173.2 | 67.5 | 0 | 0 | 0 | 111.4 | K55 T56 V57 L63 | K55-L59 VanDerWaalsContact O-CB 3.26Å; K55-L59 WeakPolarHBondContact O-CB 3.31Å; K55-L59 PolarHBondContact O-N 3.49Å; T56-L59 PolarHBondContact O-N 2.92Å; V57-L59 VanDerWaalsContact C-N 3.3Å; V57-L59 PolarHBondContact O-N 3.22Å; L59-L63 WeakPolarHBondContact O-CB 3.43Å; L59-L63 PolarHBondContact O-N 3.37Å |
| 60 | R | 73.1 | Confident | 67.2 | Low | 175 Ų | 175 | 112.8 Ų | 112.8 | 66% | 0.66 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65.9 | -43.6 | 175.7 | -75 | 179.5 | -174.2 | -173.9 | 1.9 | 111.9 | T56 V57 L63 S64 | T56-R60 WeakPolarHBondContact O-CB 3.3Å; T56-R60 VanDerWaalsContact O-CG 3.31Å; T56-R60 WeakPolarHBondContact O-CG 3.21Å; T56-R60 PolarHBondContact O-N 2.84Å; V57-R60 PolarHBondContact O-N 3.41Å; R60-L63 PolarHBondContact O-N 2.82Å; R60-S64 VanDerWaalsContact O-CB 3.28Å; R60-S64 WeakPolarHBondContact O-CB 3.48Å; R60-S64 PolarHBondContact O-N 2.82Å; R60-S64 PolarHBondContact O-OG 2.82Å; R60-S64 VanDerWaalsContact O-OG 3.04Å |
| 61 | V | 71.9 | Confident | 66.7 | Low | 88 Ų | 88 | 110.3 Ų | 110.3 | 53% | 0.533 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.5 | -47.3 | 176.7 | 172.2 | 0 | 0 | 0 | 0 | 110.3 | V57 H58 L63 S64 L65 | V57-V61 HydrophobicContact CG1-CG2 4.27Å; V57-V61 VanDerWaalsContact O-CG2 3.3Å; V57-V61 WeakPolarHBondContact O-CG2 3.26Å; V57-V61 PolarHBondContact O-N 2.86Å; H58-V61 PolarHBondContact O-N 3.42Å; V61-L63 PolarHBondContact O-N 3.37Å; V61-S64 PolarHBondContact O-N 2.82Å; V61-L65 WeakPolarHBondContact O-CB 2.96Å; V61-L65 PolarHBondContact O-N 3.37Å |
| 62 | A | 75.4 | Confident | 66.3 | Low | 50 Ų | 50 | 106.7 Ų | 106.7 | 41% | 0.413 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.7 | -40.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | H58 L65 M66 | H58-A62 WeakPolarHBondContact O-CB 3.34Å; H58-A62 PolarHBondContact O-N 2.82Å; A62-L65 WeakPolarHBondContact O-CB 3.11Å; A62-L65 PolarHBondContact O-N 3.49Å; A62-M66 WeakPolarHBondContact O-CB 3.15Å; A62-M66 WeakPolarHBondContact O-CG 3.34Å; A62-M66 PolarHBondContact O-N 2.78Å |
| 63 | L | 70.6 | Confident | 66.3 | Low | 98 Ų | 98 | 106.2 Ų | 106.2 | 51% | 0.513 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -67.7 | -42.3 | 176.7 | -171.6 | 71 | 0 | 0 | 0 | 111.4 | L59 R60 V61 L65 M66 L67 | L59-L63 WeakPolarHBondContact O-CB 3.43Å; L59-L63 PolarHBondContact O-N 3.37Å; R60-L63 PolarHBondContact O-N 2.82Å; V61-L63 PolarHBondContact O-N 3.37Å; L63-L65 VanDerWaalsContact C-N 3.32Å; L63-L65 PolarHBondContact O-N 3.39Å; L63-M66 PolarHBondContact O-N 3.3Å; L63-L67 HydrophobicContact CD1-CD1 4.11Å; L63-L67 HydrophobicContact CD1-CG 4.19Å; L63-L67 HydrophobicContact CD2-CD1 4.21Å; L63-L67 HydrophobicContact CG-CD1 3.73Å; L63-L67 HydrophobicContact CG-CG 4.16Å; L63-L67 VanDerWaalsContact O-CB 3.24Å; L63-L67 WeakPolarHBondContact O-CB 3.28Å; L63-L67 WeakPolarHBondContact O-CG 3.13Å; L63-L67 PolarHBondContact O-N 3.04Å |
| 64 | S | 69.3 | Low | 66.3 | Low | 84 Ų | 84 | 103.9 Ų | 103.9 | 59% | 0.587 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.4 | -38.5 | 173.4 | -68.9 | 0 | 0 | 0 | 0 | 111.6 | R60 V61 G68 | R60-S64 VanDerWaalsContact O-CB 3.28Å; R60-S64 WeakPolarHBondContact O-CB 3.48Å; R60-S64 PolarHBondContact O-N 2.82Å; R60-S64 PolarHBondContact O-OG 2.82Å; R60-S64 VanDerWaalsContact O-OG 3.04Å; V61-S64 PolarHBondContact O-N 2.82Å; S64-G68 WeakPolarHBondContact O-CA 3.24Å; S64-G68 PolarHBondContact O-N 3.47Å |
| 65 | L | 66.4 | Low | 66.3 | Low | 105 Ų | 105 | 106.7 Ų | 106.7 | 55% | 0.55 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.8 | -51.1 | 172.9 | -142.2 | 98.8 | 0 | 0 | 0 | 109.6 | V61 A62 L63 L67 G68 I69 | V61-L65 WeakPolarHBondContact O-CB 2.96Å; V61-L65 PolarHBondContact O-N 3.37Å; A62-L65 WeakPolarHBondContact O-CB 3.11Å; A62-L65 PolarHBondContact O-N 3.49Å; L63-L65 VanDerWaalsContact C-N 3.32Å; L63-L65 PolarHBondContact O-N 3.39Å; L65-L67 PolarHBondContact O-N 2.87Å; L65-G68 PolarHBondContact O-N 3.5Å; L65-I69 HydrophobicContact CB-CD1 4.18Å; L65-I69 HydrophobicContact CD2-CD1 3.45Å; L65-I69 VanDerWaalsContact CD2-CD1 3.45Å; L65-I69 HydrophobicContact CG-CD1 3.47Å; L65-I69 VanDerWaalsContact CG-CD1 3.47Å; L65-I69 HydrophobicContact CG-CG1 4.4Å; L65-I69 WeakPolarHBondContact O-CB 3.49Å; L65-I69 VanDerWaalsContact O-CD1 3.24Å; L65-I69 WeakPolarHBondContact O-CD1 3.22Å; L65-I69 WeakPolarHBondContact O-CG1 3.24Å; L65-I69 PolarHBondContact O-N 3.3Å |
| 66 | M | 65.2 | Low | 65.9 | Low | 139 Ų | 139 | 103.4 Ų | 103.4 | 69% | 0.685 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.9 | -40.9 | -178.4 | -71.6 | -71.3 | -73.7 | 0 | 0 | 113.3 | A62 L63 | A62-M66 WeakPolarHBondContact O-CB 3.15Å; A62-M66 WeakPolarHBondContact O-CG 3.34Å; A62-M66 PolarHBondContact O-N 2.78Å; L63-M66 PolarHBondContact O-N 3.3Å |
| 67 | L | 64.7 | Low | 65.5 | Low | 127 Ų | 127 | 102 Ų | 102 | 67% | 0.665 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -75.1 | -33.8 | 178.5 | -67.7 | 176.9 | 0 | 0 | 0 | 111.9 | L63 L65 | L63-L67 HydrophobicContact CD1-CD1 4.11Å; L63-L67 HydrophobicContact CD1-CG 4.19Å; L63-L67 HydrophobicContact CD2-CD1 4.21Å; L63-L67 HydrophobicContact CG-CD1 3.73Å; L63-L67 HydrophobicContact CG-CG 4.16Å; L63-L67 VanDerWaalsContact O-CB 3.24Å; L63-L67 WeakPolarHBondContact O-CB 3.28Å; L63-L67 WeakPolarHBondContact O-CG 3.13Å; L63-L67 PolarHBondContact O-N 3.04Å; L65-L67 PolarHBondContact O-N 2.87Å |
| 68 | G | 58.1 | Low | 65.2 | Low | 32 Ų | 32 | 103.6 Ų | 103.6 | 33% | 0.33 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -73.7 | -37.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | S64 L65 K70 G71 S72 | S64-G68 WeakPolarHBondContact O-CA 3.24Å; S64-G68 PolarHBondContact O-N 3.47Å; L65-G68 PolarHBondContact O-N 3.5Å; G68-K70 PolarHBondContact O-N 2.78Å; G68-G71 PolarHBondContact O-N 3.12Å; G68-S72 WeakPolarHBondContact O-CB 3.46Å; G68-S72 PolarHBondContact O-N 3.4Å; G68-S72 PolarHBondContact O-OG 2.92Å |
| 69 | I | 57.8 | Low | 64.8 | Low | 72 Ų | 72 | 99.8 Ų | 99.8 | 37% | 0.369 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -72.4 | -25.1 | -172.5 | -73.2 | 168.6 | 0 | 0 | 0 | 112.8 | L65 G71 S72 F73 | L65-I69 HydrophobicContact CB-CD1 4.18Å; L65-I69 HydrophobicContact CD2-CD1 3.45Å; L65-I69 VanDerWaalsContact CD2-CD1 3.45Å; L65-I69 HydrophobicContact CG-CD1 3.47Å; L65-I69 VanDerWaalsContact CG-CD1 3.47Å; L65-I69 HydrophobicContact CG-CG1 4.4Å; L65-I69 WeakPolarHBondContact O-CB 3.49Å; L65-I69 VanDerWaalsContact O-CD1 3.24Å; L65-I69 WeakPolarHBondContact O-CD1 3.22Å; L65-I69 WeakPolarHBondContact O-CG1 3.24Å; L65-I69 PolarHBondContact O-N 3.3Å; I69-G71 VanDerWaalsContact C-N 3.27Å; I69-G71 PolarHBondContact O-N 2.81Å; I69-S72 PolarHBondContact O-N 3.25Å; I69-F73 HydrophobicContact CG2-CB 3.91Å; I69-F73 WeakPolarHBondContact O-CB 3.44Å; I69-F73 PolarHBondContact O-N 3.4Å |
| 70 | K | 57 | Low | 64.6 | Low | 194 Ų | 194 | 100.6 Ų | 100.6 | 84% | 0.843 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.3 | -27 | -179 | -143 | 174.9 | -175.8 | 179.8 | 0 | 113.3 | G68 | G68-K70 PolarHBondContact O-N 2.78Å |
| 71 | G | 54.6 | Low | 64.7 | Low | 51 Ų | 51 | 94.1 Ų | 94.1 | 53% | 0.526 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -98.2 | -36.5 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | G68 I69 Y75 | G68-G71 PolarHBondContact O-N 3.12Å; I69-G71 VanDerWaalsContact C-N 3.27Å; I69-G71 PolarHBondContact O-N 2.81Å; G71-Y75 PolarHBondContact O-N 3.27Å |
| 72 | S | 56.8 | Low | 64.8 | Low | 64 Ų | 64 | 97.4 Ų | 97.4 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -78.7 | -27.9 | -176.4 | -57.3 | 0 | 0 | 0 | 0 | 114 | G68 I69 Y75 V76 | G68-S72 WeakPolarHBondContact O-CB 3.46Å; G68-S72 PolarHBondContact O-N 3.4Å; G68-S72 PolarHBondContact O-OG 2.92Å; I69-S72 PolarHBondContact O-N 3.25Å; S72-Y75 PolarHBondContact O-N 3.45Å; S72-V76 WeakPolarHBondContact O-CB 3.19Å; S72-V76 WeakPolarHBondContact O-CG2 3.4Å; S72-V76 PolarHBondContact O-N 3.49Å |
| 73 | F | 61.4 | Low | 64.9 | Low | 117 Ų | 117 | 101.7 Ų | 101.7 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 175.4 | -166.4 | -99.4 | 0 | 0 | 0 | 110.6 | I69 Y75 V76 V77 V90 | I69-F73 HydrophobicContact CG2-CB 3.91Å; I69-F73 WeakPolarHBondContact O-CB 3.44Å; I69-F73 PolarHBondContact O-N 3.4Å; F73-Y75 VanDerWaalsContact C-N 3.3Å; F73-Y75 PolarHBondContact O-N 2.85Å; F73-V76 PolarHBondContact O-N 2.91Å; F73-V77 HydrophobicContact CD1-CG2 3.97Å; F73-V77 HydrophobicContact CE1-CG2 3.76Å; F73-V77 HydrophobicContact CZ-CG2 4.24Å; F73-V77 WeakPolarHBondContact O-CB 3.2Å; F73-V77 WeakPolarHBondContact O-CG2 3.46Å; F73-V77 PolarHBondContact O-N 3.47Å; F73-V90 HydrophobicContact CZ-CG1 4.19Å |
| 74 | K | 63.4 | Low | 64.6 | Low | 138 Ų | 138 | 100.5 Ų | 100.5 | 60% | 0.6 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -59 | -43.7 | 172.9 | -168.3 | 173.5 | -178.8 | 179.7 | 0 | 110.6 | V77 F78 | K74-V77 PolarHBondContact O-N 3.36Å; K74-F78 HydrophobicContact CD-CE2 4.3Å; K74-F78 HydrophobicContact CG-CD2 3.77Å; K74-F78 HydrophobicContact CG-CE2 3.78Å; K74-F78 WeakPolarHBondContact O-CB 3.13Å; K74-F78 WeakPolarHBondContact O-CD2 3.44Å; K74-F78 PolarHBondContact O-N 2.85Å |
| 75 | Y | 66.6 | Low | 64.8 | Low | 166 Ų | 166 | 103 Ų | 103 | 65% | 0.651 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.3 | -42.2 | 178 | -165.4 | -101.5 | 0 | 0 | 0 | 113.2 | G71 S72 F73 F78 V79 | G71-Y75 PolarHBondContact O-N 3.27Å; S72-Y75 PolarHBondContact O-N 3.45Å; F73-Y75 VanDerWaalsContact C-N 3.3Å; F73-Y75 PolarHBondContact O-N 2.85Å; Y75-F78 PolarHBondContact O-N 2.89Å; Y75-V79 HydrophobicContact CD1-CG2 3.87Å; Y75-V79 HydrophobicContact CE1-CG2 3.57Å; Y75-V79 HydrophobicContact CE2-CG2 4.41Å; Y75-V79 HydrophobicContact CG-CG2 4.43Å; Y75-V79 WeakPolarHBondContact O-CB 3.44Å; Y75-V79 VanDerWaalsContact O-CG2 3.25Å; Y75-V79 WeakPolarHBondContact O-CG2 3.25Å; Y75-V79 PolarHBondContact O-N 3.3Å |
| 76 | V | 60.6 | Low | 65 | Low | 75 Ų | 75 | 103.3 Ų | 103.3 | 46% | 0.455 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66 | -38.9 | 178 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | S72 F73 R80 | S72-V76 WeakPolarHBondContact O-CB 3.19Å; S72-V76 WeakPolarHBondContact O-CG2 3.4Å; S72-V76 PolarHBondContact O-N 3.49Å; F73-V76 PolarHBondContact O-N 2.91Å; V76-R80 PolarHBondContact O-N 3.29Å; V76-R80 VanDerWaalsContact O-N 3.12Å |
| 77 | V | 63.7 | Low | 65.3 | Low | 31 Ų | 31 | 99.9 Ų | 99.9 | 19% | 0.188 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -63.8 | -49 | 172.4 | 174.5 | 0 | 0 | 0 | 0 | 110.3 | F73 K74 V79 R80 C81 V90 | F73-V77 HydrophobicContact CD1-CG2 3.97Å; F73-V77 HydrophobicContact CE1-CG2 3.76Å; F73-V77 HydrophobicContact CZ-CG2 4.24Å; F73-V77 WeakPolarHBondContact O-CB 3.2Å; F73-V77 WeakPolarHBondContact O-CG2 3.46Å; F73-V77 PolarHBondContact O-N 3.47Å; K74-V77 PolarHBondContact O-N 3.36Å; V77-V79 PolarHBondContact O-N 3.22Å; V77-R80 PolarHBondContact O-N 3.3Å; V77-C81 WeakPolarHBondContact O-CB 2.97Å; V77-C81 PolarHBondContact O-N 3.36Å; V77-C81 PolarHBondContact O-SG 3.25Å; V77-V90 HydrophobicContact CG2-CG1 3.84Å |
| 78 | F | 65.8 | Low | 65.8 | Low | 119 Ų | 119 | 101 Ų | 101 | 52% | 0.522 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.7 | -45.3 | 177.6 | -95.7 | -98.2 | 0 | 0 | 0 | 112.6 | K74 Y75 C81 E82 | K74-F78 HydrophobicContact CD-CE2 4.3Å; K74-F78 HydrophobicContact CG-CD2 3.77Å; K74-F78 HydrophobicContact CG-CE2 3.78Å; K74-F78 WeakPolarHBondContact O-CB 3.13Å; K74-F78 WeakPolarHBondContact O-CD2 3.44Å; K74-F78 PolarHBondContact O-N 2.85Å; Y75-F78 PolarHBondContact O-N 2.89Å; F78-C81 WeakPolarHBondContact O-CB 3.14Å; F78-C81 PolarHBondContact O-N 3.28Å; F78-E82 PolarHBondContact O-N 3.44Å |
| 79 | V | 65.9 | Low | 66 | Low | 46 Ų | 46 | 106.2 Ų | 106.2 | 28% | 0.279 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.7 | -38.1 | -179.6 | 171 | 0 | 0 | 0 | 0 | 112 | Y75 V77 E82 H83 | Y75-V79 HydrophobicContact CD1-CG2 3.87Å; Y75-V79 HydrophobicContact CE1-CG2 3.57Å; Y75-V79 HydrophobicContact CE2-CG2 4.41Å; Y75-V79 HydrophobicContact CG-CG2 4.43Å; Y75-V79 WeakPolarHBondContact O-CB 3.44Å; Y75-V79 VanDerWaalsContact O-CG2 3.25Å; Y75-V79 WeakPolarHBondContact O-CG2 3.25Å; Y75-V79 PolarHBondContact O-N 3.3Å; V77-V79 PolarHBondContact O-N 3.22Å; V79-E82 PolarHBondContact O-N 3.01Å; V79-H83 PolarHBondContact O-N 3.32Å; V79-H83 PolarHBondContact O-ND1 2.85Å |
| 80 | R | 68 | Low | 65.9 | Low | 142 Ų | 142 | 108.1 Ų | 108.1 | 54% | 0.536 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.7 | -37.7 | 175.2 | -77 | -165.7 | 168.8 | 162.9 | -1.2 | 112.2 | V76 V77 H83 F85 | V76-R80 PolarHBondContact O-N 3.29Å; V76-R80 VanDerWaalsContact O-N 3.12Å; V77-R80 PolarHBondContact O-N 3.3Å; R80-H83 PolarHBondContact O-N 3.34Å; R80-F85 HydrophobicContact CB-CB 4.41Å; R80-F85 HydrophobicContact CB-CD2 4.44Å; R80-F85 WeakPolarHBondContact O-CB 3.05Å; R80-F85 WeakPolarHBondContact O-CD2 3.48Å; R80-F85 PolarHBondContact O-N 2.03Å |
| 81 | C | 74.8 | Confident | 66.3 | Low | 39 Ų | 39 | 103.9 Ų | 103.9 | 26% | 0.264 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -60.7 | -43 | 172.5 | -72.4 | 0 | 0 | 0 | 0 | 112.3 | V77 F78 H83 G84 C87 | V77-C81 WeakPolarHBondContact O-CB 2.97Å; V77-C81 PolarHBondContact O-N 3.36Å; V77-C81 PolarHBondContact O-SG 3.25Å; F78-C81 WeakPolarHBondContact O-CB 3.14Å; F78-C81 PolarHBondContact O-N 3.28Å; C81-H83 VanDerWaalsContact C-N 3.28Å; C81-H83 PolarHBondContact O-N 3.43Å; C81-G84 PolarHBondContact O-N 3.32Å; C81-C87 WeakPolarHBondContact CB-SG 3.39Å; C81-C87 WeakPolarHBondContact SG-CB 3.22Å; C81-C87 CovalentContact SG-SG 2.03Å; C81-C87 PolarHBondContact SG-SG 2.89Å |
| 82 | E | 74.6 | Confident | 66.9 | Low | 156 Ų | 156 | 106.6 Ų | 106.6 | 73% | 0.729 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.2 | -27.4 | 177.6 | -75.4 | -172 | 153.6 | 0 | 0 | 113.5 | F78 V79 G84 | F78-E82 PolarHBondContact O-N 3.44Å; V79-E82 PolarHBondContact O-N 3.01Å; E82-G84 VanDerWaalsContact C-N 3.3Å; E82-G84 PolarHBondContact O-N 3Å |
| 83 | H | 78 | Confident | 67.5 | Low | 141 Ų | 141 | 109 Ų | 109 | 65% | 0.653 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.2 | 14.3 | 178.7 | -72.9 | 82.5 | 0 | 0 | 0 | 114 | V79 R80 C81 F85 | V79-H83 PolarHBondContact O-N 3.32Å; V79-H83 PolarHBondContact O-ND1 2.85Å; R80-H83 PolarHBondContact O-N 3.34Å; C81-H83 VanDerWaalsContact C-N 3.28Å; C81-H83 PolarHBondContact O-N 3.43Å; H83-F85 HydrophobicContact CB-CD2 4.38Å; H83-F85 HydrophobicContact CB-CE2 4.46Å |
| 84 | G | 64.1 | Low | 67.8 | Low | 72 Ų | 72 | 108.5 Ų | 108.5 | 74% | 0.742 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 86.4 | 15.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | C81 E82 | C81-G84 PolarHBondContact O-N 3.32Å; E82-G84 VanDerWaalsContact C-N 3.3Å; E82-G84 PolarHBondContact O-N 3Å |
| 85 | F | 73.2 | Confident | 68.1 | Low | 136 Ų | 136 | 106.7 Ų | 106.7 | 60% | 0.596 | 56% | 0.557 | S | S | * | * | trans | -84.6 | 141.1 | 168 | -65.5 | -91.9 | 0 | 0 | 0 | 110.1 | R80 H83 C87 | R80-F85 HydrophobicContact CB-CB 4.41Å; R80-F85 HydrophobicContact CB-CD2 4.44Å; R80-F85 WeakPolarHBondContact O-CB 3.05Å; R80-F85 WeakPolarHBondContact O-CD2 3.48Å; R80-F85 PolarHBondContact O-N 2.03Å; H83-F85 HydrophobicContact CB-CD2 4.38Å; H83-F85 HydrophobicContact CB-CE2 4.46Å; F85-C87 PolarHBondContact O-N 3.25Å | ||
| 86 | N | 71.8 | Confident | 68.2 | Low | 113 Ų | 113 | 102.7 Ų | 102.7 | 60% | 0.604 | 55% | 0.551 | S | S | * | * | trans | -64.1 | 125 | 176.9 | -128.6 | -2 | 0 | 0 | 0 | 109.5 | D88 D89 | N86-D88 PolarHBondContact O-N 3.23Å; N86-D89 PolarHBondContact O-N 3.46Å | ||
| 87 | C | 70.3 | Confident | 68.8 | Low | 66 Ų | 66 | 104.7 Ų | 104.7 | 45% | 0.446 | 56% | 0.557 | S | S | . | * | G | 310 helix | trans | -70.3 | -14.4 | -178 | -57 | 0 | 0 | 0 | 0 | 113.2 | C81 F85 D89 | C81-C87 WeakPolarHBondContact CB-SG 3.39Å; C81-C87 WeakPolarHBondContact SG-CB 3.22Å; C81-C87 CovalentContact SG-SG 2.03Å; C81-C87 PolarHBondContact SG-SG 2.89Å; F85-C87 PolarHBondContact O-N 3.25Å; C87-D89 VanDerWaalsContact C-N 3.31Å |
| 88 | D | 76.4 | Confident | 69.1 | Low | 152 Ų | 152 | 110.4 Ų | 110.4 | 81% | 0.813 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -79.2 | -9.1 | 179.5 | -74.1 | -39.5 | 0 | 0 | 0 | 113.6 | N86 | N86-D88 PolarHBondContact O-N 3.23Š|
| 89 | D | 62.3 | Low | 69.4 | Low | 141 Ų | 141 | 109.7 Ų | 109.7 | 75% | 0.754 | 59% | 0.591 | S | S | * | * | G | 310 helix | trans | -98.8 | 9.3 | -177.5 | -81.1 | -37.6 | 0 | 0 | 0 | 114.6 | N86 C87 | N86-D89 PolarHBondContact O-N 3.46Å; C87-D89 VanDerWaalsContact C-N 3.31Å |
| 90 | V | 53.9 | Low | 69.8 | Low | 112 Ų | 112 | 115.5 Ų | 115.5 | 68% | 0.679 | 62% | 0.62 | S | S | * | * | trans | -120.5 | 0 | -179.6 | -170 | 0 | 0 | 0 | 0 | 111.9 | F73 V77 | F73-V90 HydrophobicContact CZ-CG1 4.19Å; V77-V90 HydrophobicContact CG2-CG1 3.84Å |
Retrieved 90 of 90 residues in 23.8 ms
(Link to these results)