| 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 | 35.9 | Very low | 27.8 | Very low | 239 Ų | 239 | 158.1 Ų | 158.1 | 100% | 1.177 | 83% | 0.827 | S | S | * | * | 0 | 93.8 | 0 | -95 | 175.4 | 172.1 | 0 | 0 | 106.5 | |||||
| 2 | E | 29.2 | Very low | 27.6 | Very low | 195 Ų | 195 | 150.9 Ų | 150.9 | 91% | 0.911 | 82% | 0.82 | S | S | * | * | trans | -72.6 | 124.9 | 174.3 | -70.1 | 176.1 | 164.1 | 0 | 0 | 108 | P4 | E2-P4 WeakPolarHBondContact O-CD 3.37Š| ||
| 3 | I | 30.4 | Very low | 27.5 | Very low | 154 Ų | 154 | 150.8 Ų | 150.8 | 79% | 0.79 | 82% | 0.818 | S | S | * | * | trans | -82.3 | 115.5 | -179.1 | -59.6 | 170.2 | 0 | 0 | 0 | 106.7 | ||||
| 4 | P | 27.1 | Very low | 27.5 | Very low | 102 Ų | 102 | 153.8 Ų | 153.8 | 66% | 0.662 | 82% | 0.819 | S | S | * | * | trans | -78.6 | 135.3 | -176.5 | 30.4 | -31.2 | 0 | 0 | 0 | 110.8 | E2 T6 | E2-P4 WeakPolarHBondContact O-CD 3.37Å; P4-T6 PolarHBondContact O-N 3.24Å | ||
| 5 | Y | 27.5 | Very low | 27.3 | Very low | 232 Ų | 232 | 151.7 Ų | 151.7 | 91% | 0.91 | 82% | 0.815 | S | S | * | * | trans | -65.2 | 95.1 | 170.4 | -71.6 | -90.5 | 0 | 0 | 0 | 109.9 | N7 | Y5-N7 PolarHBondContact O-N 2.76Š| ||
| 6 | T | 27.4 | Very low | 27.1 | Very low | 122 Ų | 122 | 153 Ų | 153 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | trans | -82.1 | 109 | 164.7 | 39.3 | 0 | 0 | 0 | 0 | 108.8 | P4 L8 | P4-T6 PolarHBondContact O-N 3.24Å; T6-L8 PolarHBondContact O-N 3.38Å | ||
| 7 | N | 25.7 | Very low | 26.8 | Very low | 146 Ų | 146 | 150.6 Ų | 150.6 | 78% | 0.781 | 81% | 0.808 | S | S | * | * | trans | -44.7 | 107.9 | 163.7 | -76.3 | -31.8 | 0 | 0 | 0 | 109.5 | Y5 T9 | Y5-N7 PolarHBondContact O-N 2.76Å; N7-T9 PolarHBondContact O-N 3.17Å | ||
| 8 | L | 25 | Very low | 26.6 | Very low | 162 Ų | 162 | 150.5 Ų | 150.5 | 85% | 0.848 | 81% | 0.806 | S | S | * | * | trans | -70.5 | 82.2 | 167.7 | -85.9 | 149.3 | 0 | 0 | 0 | 108 | T6 I10 | T6-L8 PolarHBondContact O-N 3.38Å; L8-I10 VanDerWaalsContact C-N 3.3Å; L8-I10 PolarHBondContact O-N 3.06Å | ||
| 9 | T | 24.7 | Very low | 26.4 | Very low | 126 Ų | 126 | 149.3 Ų | 149.3 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -64.2 | 94.5 | 156.9 | 42.5 | 0 | 0 | 0 | 0 | 107.6 | N7 P11 | N7-T9 PolarHBondContact O-N 3.17Å; T9-P11 WeakPolarHBondContact O-CD 3.46Å | ||
| 10 | I | 27.8 | Very low | 26.2 | Very low | 149 Ų | 149 | 146.6 Ų | 146.6 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | trans | -65.6 | 119.7 | 167.7 | -62.3 | 172.3 | 0 | 0 | 0 | 106.6 | L8 G12 | L8-I10 VanDerWaalsContact C-N 3.3Å; L8-I10 PolarHBondContact O-N 3.06Å; I10-G12 PolarHBondContact O-N 3.24Å | ||
| 11 | P | 25.3 | Very low | 26.1 | Very low | 112 Ų | 112 | 144.4 Ų | 144.4 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -65 | 136.6 | -174.8 | 24.1 | -29.9 | 0 | 0 | 0 | 110.1 | T9 N13 | T9-P11 WeakPolarHBondContact O-CD 3.46Å; P11-N13 PolarHBondContact O-N 2.96Å | ||
| 12 | G | 25.3 | Very low | 25.7 | Very low | 72 Ų | 72 | 140.4 Ų | 140.4 | 74% | 0.742 | 77% | 0.765 | S | S | * | * | trans | -61.7 | 100.5 | -172.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | I10 K14 | I10-G12 PolarHBondContact O-N 3.24Å; G12-K14 VanDerWaalsContact C-N 3.32Å; G12-K14 PolarHBondContact O-N 3.34Å | ||
| 13 | N | 26.2 | Very low | 25.4 | Very low | 150 Ų | 150 | 137 Ų | 137 | 80% | 0.802 | 76% | 0.757 | S | S | * | * | trans | -71.2 | 102.4 | 141.7 | -89.5 | -12.7 | 0 | 0 | 0 | 105.8 | P11 T15 | P11-N13 PolarHBondContact O-N 2.96Å; N13-T15 PolarHBondContact O-N 2.98Å | ||
| 14 | K | 27.6 | Very low | 25.3 | Very low | 192 Ų | 192 | 133.8 Ų | 133.8 | 84% | 0.835 | 75% | 0.749 | S | S | * | * | trans | -56.5 | 83.8 | 162.7 | -71 | 176.5 | 177.9 | 176.6 | 0 | 107.4 | G12 K16 | G12-K14 VanDerWaalsContact C-N 3.32Å; G12-K14 PolarHBondContact O-N 3.34Å; K14-K16 PolarHBondContact O-N 2.91Å | ||
| 15 | T | 24.6 | Very low | 25.7 | Very low | 122 Ų | 122 | 138.6 Ų | 138.6 | 75% | 0.748 | 76% | 0.759 | S | S | * | * | trans | -63.7 | 88.6 | 155.2 | 31.2 | 0 | 0 | 0 | 0 | 105.1 | N13 C17 | N13-T15 PolarHBondContact O-N 2.98Å; T15-C17 PolarHBondContact O-N 2.73Å | ||
| 16 | K | 23.5 | Very low | 25.7 | Very low | 173 Ų | 173 | 135.7 Ų | 135.7 | 75% | 0.752 | 75% | 0.753 | S | S | * | * | trans | -59.8 | 91.3 | 160.6 | -78.3 | -179.8 | 175.3 | 179.6 | 0 | 105.4 | K14 L18 | K14-K16 PolarHBondContact O-N 2.91Å; K16-L18 PolarHBondContact O-N 2.77Å | ||
| 17 | C | 22.7 | Very low | 25.6 | Very low | 112 Ų | 112 | 136.1 Ų | 136.1 | 76% | 0.757 | 75% | 0.751 | S | S | * | * | trans | -63.2 | 94.1 | 155.2 | -76 | 0 | 0 | 0 | 0 | 105.4 | T15 V19 | T15-C17 PolarHBondContact O-N 2.73Å; C17-V19 PolarHBondContact O-N 2.72Å | ||
| 18 | L | 22.4 | Very low | 25.9 | Very low | 149 Ų | 149 | 134.5 Ų | 134.5 | 78% | 0.78 | 75% | 0.752 | S | S | * | * | trans | -62.6 | 91.3 | 161.8 | -81.1 | 154.8 | 0 | 0 | 0 | 105.8 | K16 C20 | K16-L18 PolarHBondContact O-N 2.77Å; L18-C20 VanDerWaalsContact C-N 3.3Å; L18-C20 PolarHBondContact O-N 2.52Å | ||
| 19 | V | 24.3 | Very low | 26.1 | Very low | 128 Ų | 128 | 135.5 Ų | 135.5 | 78% | 0.776 | 75% | 0.752 | S | S | * | * | trans | -63.3 | 104.4 | 155.4 | 178.8 | 0 | 0 | 0 | 0 | 104.2 | C17 S21 | C17-V19 PolarHBondContact O-N 2.72Å; V19-S21 VanDerWaalsContact C-N 3.28Å; V19-S21 PolarHBondContact O-N 2.79Å | ||
| 20 | C | 21.7 | Very low | 26.1 | Very low | 94 Ų | 94 | 138.9 Ų | 138.9 | 64% | 0.635 | 76% | 0.756 | S | S | * | * | trans | -61.1 | 91.9 | 176.2 | -80.7 | 0 | 0 | 0 | 0 | 109.1 | L18 Y22 | L18-C20 VanDerWaalsContact C-N 3.3Å; L18-C20 PolarHBondContact O-N 2.52Å; C20-Y22 VanDerWaalsContact C-N 3.33Å; C20-Y22 HydrophobicContact CB-CD2 4.17Å; C20-Y22 HydrophobicContact CB-CE2 4.08Å; C20-Y22 PolarHBondContact O-N 3.03Å | ||
| 21 | S | 24.6 | Very low | 26 | Very low | 102 Ų | 102 | 139 Ų | 139 | 71% | 0.713 | 76% | 0.758 | S | S | * | * | trans | -68.2 | 95.3 | 160.2 | 54.4 | 0 | 0 | 0 | 0 | 107.4 | V19 T23 | V19-S21 VanDerWaalsContact C-N 3.28Å; V19-S21 PolarHBondContact O-N 2.79Å; S21-T23 VanDerWaalsContact C-N 3.33Å; S21-T23 PolarHBondContact O-N 3.34Å | ||
| 22 | Y | 25.9 | Very low | 26.2 | Very low | 155 Ų | 155 | 142.7 Ų | 142.7 | 61% | 0.608 | 77% | 0.766 | S | S | * | * | trans | -68.7 | 91.3 | 169.3 | -86.2 | -85.6 | 0 | 0 | 0 | 109.4 | C20 R217 | C20-Y22 VanDerWaalsContact C-N 3.33Å; C20-Y22 HydrophobicContact CB-CD2 4.17Å; C20-Y22 HydrophobicContact CB-CE2 4.08Å; C20-Y22 PolarHBondContact O-N 3.03Å; Y22-R217 PolarHBondContact OH-NH1 3.3Å | ||
| 23 | T | 24.2 | Very low | 26.3 | Very low | 123 Ų | 123 | 146 Ų | 146 | 76% | 0.755 | 77% | 0.766 | S | S | * | * | trans | -88.8 | 92 | 151.8 | 54.4 | 0 | 0 | 0 | 0 | 107.3 | S21 K25 | S21-T23 VanDerWaalsContact C-N 3.33Å; S21-T23 PolarHBondContact O-N 3.34Å; T23-K25 PolarHBondContact O-N 3.36Å | ||
| 24 | S | 28.2 | Very low | 26.2 | Very low | 86 Ų | 86 | 147.2 Ų | 147.2 | 60% | 0.601 | 77% | 0.767 | S | S | * | * | trans | -61.4 | 119.1 | 166.1 | 164.1 | 0 | 0 | 0 | 0 | 108.7 | H26 | S24-H26 PolarHBondContact O-N 2.98Š| ||
| 25 | K | 34.1 | Very low | 26.1 | Very low | 204 Ų | 204 | 147.8 Ų | 147.8 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | 14.2 | -179.9 | -88.5 | -175.9 | 175 | 179.7 | 0 | 114.9 | T23 | T23-K25 PolarHBondContact O-N 3.36Š|
| 26 | H | 28.9 | Very low | 26.3 | Very low | 170 Ų | 170 | 146.6 Ų | 146.6 | 79% | 0.787 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.8 | 5.1 | 178.3 | -85 | -62 | 0 | 0 | 0 | 116.7 | S24 | S24-H26 PolarHBondContact O-N 2.98Š|
| 27 | N | 25.8 | Very low | 26.6 | Very low | 131 Ų | 131 | 146.9 Ų | 146.9 | 70% | 0.701 | 77% | 0.77 | S | S | * | * | trans | -110.6 | 74.4 | 167.5 | -79 | -12 | 0 | 0 | 0 | 110.8 | Q29 | N27-Q29 PolarHBondContact O-N 3.29Š| ||
| 28 | S | 31.4 | Very low | 26.9 | Very low | 113 Ų | 113 | 149.6 Ų | 149.6 | 79% | 0.79 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | 73 | 167.8 | 57.1 | 0 | 0 | 0 | 0 | 110.1 | ||
| 29 | Q | 28.4 | Very low | 27.2 | Very low | 182 Ų | 182 | 152.3 Ų | 152.3 | 85% | 0.85 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -170.7 | 11.5 | 161.9 | -110.1 | 166.7 | 21.8 | 0 | 0 | 115.9 | N27 N31 | N27-Q29 PolarHBondContact O-N 3.29Å; Q29-N31 PolarHBondContact O-N 3.12Å |
| 30 | F | 25.3 | Very low | 27.5 | Very low | 197 Ų | 197 | 152.6 Ų | 152.6 | 86% | 0.864 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -92.5 | 99.8 | 166.8 | -97.2 | -86.4 | 0 | 0 | 0 | 110.3 | E32 | F30-E32 PolarHBondContact O-N 2.98Š|
| 31 | N | 25.1 | Very low | 27.6 | Very low | 152 Ų | 152 | 154.2 Ų | 154.2 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | trans | -50 | 126.4 | 178.3 | -77.4 | -30.7 | 0 | 0 | 0 | 112.6 | Q29 N33 | Q29-N31 PolarHBondContact O-N 3.12Å; N31-N33 PolarHBondContact O-N 3.05Å | ||
| 32 | E | 30.3 | Very low | 27.9 | Very low | 189 Ų | 189 | 154.5 Ų | 154.5 | 88% | 0.883 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -67 | 18.2 | -176.3 | -73.8 | -173.2 | 139.4 | 0 | 0 | 116.5 | F30 | F30-E32 PolarHBondContact O-N 2.98Š|
| 33 | N | 26.6 | Very low | 28.3 | Very low | 141 Ų | 141 | 151.7 Ų | 151.7 | 75% | 0.754 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -104 | 14.3 | -166.3 | -74.6 | -4.2 | 0 | 0 | 0 | 117.2 | N31 | N31-N33 PolarHBondContact O-N 3.05Š|
| 34 | H | 25.4 | Very low | 28.9 | Very low | 176 Ų | 176 | 153.5 Ų | 153.5 | 82% | 0.815 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -134 | 8.7 | 176.6 | -82.9 | -61.3 | 0 | 0 | 0 | 117.6 | ||
| 35 | F | 25.6 | Very low | 29.4 | Very low | 204 Ų | 204 | 155.8 Ų | 155.8 | 90% | 0.895 | 77% | 0.774 | S | S | * | * | trans | -104 | 69.4 | 168.2 | -80.8 | -81.6 | 0 | 0 | 0 | 110.8 | Q37 | F35-Q37 PolarHBondContact O-N 3.42Š| ||
| 36 | S | 28.3 | Very low | 30 | Very low | 97 Ų | 97 | 149.8 Ų | 149.8 | 68% | 0.678 | 75% | 0.748 | S | S | * | * | trans | -60 | 128.9 | 155.9 | 30.6 | 0 | 0 | 0 | 0 | 108.4 | E38 | S36-E38 PolarHBondContact O-N 3.44Š| ||
| 37 | Q | 29.9 | Very low | 30.4 | Very low | 179 Ų | 179 | 149.1 Ų | 149.1 | 84% | 0.836 | 75% | 0.745 | S | S | * | * | trans | -62.2 | 61.9 | -175.8 | -64.9 | 168 | -22.8 | 0 | 0 | 113.4 | F35 Y39 | F35-Q37 PolarHBondContact O-N 3.42Å; Q37-Y39 PolarHBondContact O-N 3.1Å | ||
| 38 | E | 28.8 | Very low | 31.1 | Very low | 169 Ų | 169 | 143.6 Ų | 143.6 | 79% | 0.79 | 72% | 0.715 | S | S | * | * | trans | -80.3 | 98.7 | 164.4 | -71.9 | -174.1 | 177.9 | 0 | 0 | 107.7 | S36 T40 | S36-E38 PolarHBondContact O-N 3.44Å; E38-T40 PolarHBondContact O-N 3.34Å | ||
| 39 | Y | 28.9 | Very low | 31.5 | Very low | 206 Ų | 206 | 142.8 Ų | 142.8 | 81% | 0.808 | 71% | 0.706 | S | S | * | * | trans | -43.9 | 113.6 | 158.1 | -66.4 | -88.8 | 0 | 0 | 0 | 108 | Q37 T41 | Q37-Y39 PolarHBondContact O-N 3.1Å; Y39-T41 PolarHBondContact O-N 3.28Å | ||
| 40 | T | 30.1 | Very low | 32 | Very low | 134 Ų | 134 | 139.3 Ų | 139.3 | 82% | 0.822 | 69% | 0.69 | S | S | * | * | trans | -64.8 | 93.9 | 167.2 | 39.7 | 0 | 0 | 0 | 0 | 107 | E38 I42 | E38-T40 PolarHBondContact O-N 3.34Å; T40-I42 PolarHBondContact O-N 3.44Å | ||
| 41 | T | 24.7 | Very low | 32.5 | Very low | 129 Ų | 129 | 134.8 Ų | 134.8 | 79% | 0.791 | 68% | 0.682 | S | S | * | * | trans | -66.7 | 112.9 | 169.3 | 29.2 | 0 | 0 | 0 | 0 | 106.5 | Y39 D43 | Y39-T41 PolarHBondContact O-N 3.28Å; T41-D43 VanDerWaalsContact C-N 3.34Å; T41-D43 PolarHBondContact O-N 2.88Å | ||
| 42 | I | 30.5 | Very low | 33.1 | Very low | 107 Ų | 107 | 133.4 Ų | 133.4 | 55% | 0.549 | 67% | 0.669 | S | S | . | * | trans | -70.7 | 95.6 | 173 | -59.4 | 169.3 | 0 | 0 | 0 | 106.1 | T40 F44 P105 | T40-I42 PolarHBondContact O-N 3.44Å; I42-F44 HydrophobicContact CB-CE2 4.4Å; I42-F44 HydrophobicContact CG2-CD1 4.49Å; I42-F44 HydrophobicContact CG2-CD2 4.17Å; I42-F44 HydrophobicContact CG2-CE1 4.26Å; I42-F44 HydrophobicContact CG2-CE2 3.92Å; I42-F44 HydrophobicContact CG2-CG 4.46Å; I42-F44 HydrophobicContact CG2-CZ 3.97Å; I42-F44 PolarHBondContact O-N 3.49Å; I42-F44 VanDerWaalsContact O-N 3.17Å; I42-P105 HydrophobicContact CG2-CG 4.09Å | ||
| 43 | D | 33.5 | Very low | 33.4 | Very low | 97 Ų | 97 | 126.3 Ų | 126.3 | 52% | 0.519 | 64% | 0.64 | S | S | . | * | trans | -76.9 | 97.6 | 171.1 | -171.7 | 1.5 | 0 | 0 | 0 | 108.9 | T41 N45 F46 | T41-D43 VanDerWaalsContact C-N 3.34Å; T41-D43 PolarHBondContact O-N 2.88Å; D43-N45 PolarHBondContact O-N 3.24Å; D43-N45 PolarHBondContact OD1-N 3.3Å; D43-F46 HydrophobicContact CB-CB 4.49Å; D43-F46 PolarHBondContact O-N 2.96Å | ||
| 44 | F | 37.2 | Very low | 34.2 | Very low | 161 Ų | 161 | 128.7 Ų | 128.7 | 71% | 0.706 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -18.4 | 175.1 | -73.9 | -82.4 | 0 | 0 | 0 | 112.8 | I42 | I42-F44 HydrophobicContact CB-CE2 4.4Å; I42-F44 HydrophobicContact CG2-CD1 4.49Å; I42-F44 HydrophobicContact CG2-CD2 4.17Å; I42-F44 HydrophobicContact CG2-CE1 4.26Å; I42-F44 HydrophobicContact CG2-CE2 3.92Å; I42-F44 HydrophobicContact CG2-CG 4.46Å; I42-F44 HydrophobicContact CG2-CZ 3.97Å; I42-F44 PolarHBondContact O-N 3.49Å; I42-F44 VanDerWaalsContact O-N 3.17Å |
| 45 | N | 39 | Very low | 35 | Very low | 134 Ų | 134 | 123.8 Ų | 123.8 | 72% | 0.717 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | 22.4 | -176.3 | -70.6 | -16.1 | 0 | 0 | 0 | 112.9 | D43 Q47 | D43-N45 PolarHBondContact O-N 3.24Å; D43-N45 PolarHBondContact OD1-N 3.3Å; N45-Q47 PolarHBondContact O-N 3.47Å |
| 46 | F | 45.6 | Very low | 36 | Very low | 78 Ų | 78 | 124.1 Ų | 124.1 | 34% | 0.342 | 63% | 0.63 | S | S | . | * | trans | -59.1 | 97.9 | 179.2 | -172.8 | -99.1 | 0 | 0 | 0 | 112.1 | D43 L48 R104 | D43-F46 HydrophobicContact CB-CB 4.49Å; D43-F46 PolarHBondContact O-N 2.96Å; F46-L48 HydrophobicContact CD1-CG 4.45Å; F46-L48 HydrophobicContact CE1-CD2 3.74Å; F46-L48 HydrophobicContact CE1-CG 3.86Å; F46-L48 HydrophobicContact CZ-CD2 4.34Å; F46-R104 PolarHBondContact O-NE 3.04Å; F46-R104 PolarHBondContact O-NH2 3.01Å | ||
| 47 | Q | 38.9 | Very low | 37.1 | Very low | 155 Ų | 155 | 124.3 Ų | 124.3 | 72% | 0.724 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 121.7 | 171 | -70.3 | 179.9 | -6.9 | 0 | 0 | 108.7 | N45 T49 | N45-Q47 PolarHBondContact O-N 3.47Å; Q47-T49 PolarHBondContact O-N 2.99Å |
| 48 | L | 40.7 | Very low | 38.5 | Very low | 15 Ų | 15 | 116.5 Ų | 116.5 | 8% | 0.079 | 60% | 0.596 | C | S | . | * | P | Polyproline II helix | trans | -66.7 | 116.8 | 172.6 | -83.1 | 157.9 | 0 | 0 | 0 | 108.9 | F46 K52 Y99 F100 | F46-L48 HydrophobicContact CD1-CG 4.45Å; F46-L48 HydrophobicContact CE1-CD2 3.74Å; F46-L48 HydrophobicContact CE1-CG 3.86Å; F46-L48 HydrophobicContact CZ-CD2 4.34Å; L48-K52 HydrophobicContact CD2-CB 4.36Å; L48-Y99 HydrophobicContact CD2-CE1 4.1Å; L48-F100 HydrophobicContact CD1-CD2 3.33Å; L48-F100 HydrophobicContact CD1-CE2 3.83Å; L48-F100 HydrophobicContact CD1-CG 4.3Å |
| 49 | T | 37.8 | Very low | 40.3 | Very low | 96 Ų | 96 | 110.6 Ų | 110.6 | 59% | 0.589 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 147.1 | 162.9 | 59.6 | 0 | 0 | 0 | 0 | 109 | Q47 S51 K52 | Q47-T49 PolarHBondContact O-N 2.99Å; T49-S51 PolarHBondContact O-N 3.34Å; T49-S51 PolarHBondContact OG1-OG 3.29Å; T49-K52 PolarHBondContact O-N 3.37Å |
| 50 | H | 39 | Very low | 42.3 | Very low | 110 Ų | 110 | 107.7 Ų | 107.7 | 51% | 0.509 | 57% | 0.565 | S | S | . | * | G | 310 helix | trans | -42.8 | -28.3 | -179.4 | -88.1 | -75.9 | 0 | 0 | 0 | 114.7 | K52 C53 | H50-K52 PolarHBondContact O-N 3.39Å; H50-C53 PolarHBondContact O-N 3.26Å |
| 51 | S | 35.9 | Very low | 44.4 | Very low | 102 Ų | 102 | 105 Ų | 105 | 71% | 0.713 | 55% | 0.552 | S | S | * | * | G | 310 helix | trans | -59.5 | -11.5 | -176.9 | 68.3 | 0 | 0 | 0 | 0 | 116.5 | T49 | T49-S51 PolarHBondContact O-N 3.34Å; T49-S51 PolarHBondContact OG1-OG 3.29Å |
| 52 | K | 38.3 | Very low | 46.7 | Very low | 123 Ų | 123 | 101.7 Ų | 101.7 | 54% | 0.535 | 53% | 0.529 | S | S | . | . | G | 310 helix | trans | -119.5 | 3.6 | 177.6 | -70.8 | -177.3 | -179.9 | 175.5 | 0 | 115.1 | L48 T49 H50 H54 | L48-K52 HydrophobicContact CD2-CB 4.36Å; T49-K52 PolarHBondContact O-N 3.37Å; H50-K52 PolarHBondContact O-N 3.39Å; K52-H54 PolarHBondContact O-N 3.3Å |
| 53 | C | 37.8 | Very low | 48.9 | Very low | 40 Ų | 40 | 97 Ų | 97 | 27% | 0.27 | 51% | 0.505 | S | S | . | . | trans | -79.5 | 114.5 | 164.7 | -85.8 | 0 | 0 | 0 | 0 | 108.2 | H50 N55 | H50-C53 PolarHBondContact O-N 3.26Å; C53-N55 PolarHBondContact O-N 3.45Å; C53-N55 VanDerWaalsContact O-N 3.09Å | ||
| 54 | H | 42.7 | Very low | 51.2 | Low | 191 Ų | 191 | 96.2 Ų | 96.2 | 88% | 0.884 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -68.8 | 0.2 | 173.5 | -92.3 | -61.1 | 0 | 0 | 0 | 113.8 | K52 | K52-H54 PolarHBondContact O-N 3.3Š|
| 55 | N | 43 | Very low | 53.4 | Low | 73 Ų | 73 | 93 Ų | 93 | 39% | 0.39 | 49% | 0.488 | S | S | . | . | trans | -110.1 | 102.1 | 174 | -67.7 | -4.4 | 0 | 0 | 0 | 109.1 | C53 S57 V58 T94 | C53-N55 PolarHBondContact O-N 3.45Å; C53-N55 VanDerWaalsContact O-N 3.09Å; N55-S57 PolarHBondContact O-N 2.97Å; N55-V58 HydrophobicContact CB-CG2 3.85Å; N55-T94 PolarHBondContact ND2-O 3.21Å | ||
| 56 | E | 45.3 | Very low | 55.4 | Low | 210 Ų | 210 | 87 Ų | 87 | 98% | 0.981 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | -2.5 | 170.4 | -69.7 | -178 | 161 | 0 | 0 | 112.9 | ||
| 57 | S | 52.1 | Low | 57.2 | Low | 101 Ų | 101 | 84.7 Ų | 84.7 | 71% | 0.706 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.7 | 14.2 | -177.1 | 64.5 | 0 | 0 | 0 | 0 | 115.2 | N55 | N55-S57 PolarHBondContact O-N 2.97Š|
| 58 | V | 58.3 | Low | 59.5 | Low | 16 Ų | 16 | 82.9 Ų | 82.9 | 10% | 0.097 | 44% | 0.439 | C | S | . | . | trans | -79.5 | 125 | 176 | 174.4 | 0 | 0 | 0 | 0 | 109.8 | N55 L63 L95 | N55-V58 HydrophobicContact CB-CG2 3.85Å; V58-L63 HydrophobicContact CG1-CB 4.38Å; V58-L95 HydrophobicContact CB-CD2 4.37Å; V58-L95 HydrophobicContact CG1-CD1 4.07Å; V58-L95 HydrophobicContact CG1-CD2 3.42Å; V58-L95 VanDerWaalsContact CG1-CD2 3.42Å; V58-L95 HydrophobicContact CG1-CG 3.77Å; V58-L95 HydrophobicContact CG2-CD2 4Å; V58-L95 HydrophobicContact CG2-CG 3.97Å | ||
| 59 | S | 66.8 | Low | 61.7 | Low | 45 Ų | 45 | 82.4 Ų | 82.4 | 32% | 0.315 | 44% | 0.436 | S | S | . | . | trans | -67.3 | 139.2 | 175.7 | 86.4 | 0 | 0 | 0 | 0 | 110.2 | S61 D62 L63 | S59-S61 PolarHBondContact O-N 3.22Å; S59-S61 PolarHBondContact OG-OG 3.27Å; S59-D62 WeakPolarHBondContact CB-OD2 3.34Å; S59-D62 PolarHBondContact O-N 2.71Å; S59-D62 PolarHBondContact OG-N 2.87Å; S59-D62 PolarHBondContact OG-OD1 3.13Å; S59-D62 PolarHBondContact OG-OD2 3.46Å; S59-L63 PolarHBondContact O-N 3.23Å | ||
| 60 | K | 70.8 | Confident | 63.8 | Low | 144 Ų | 144 | 78 Ų | 78 | 63% | 0.626 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -58 | -33.7 | -179.9 | -159.8 | 176.4 | -176.2 | -179.6 | 0 | 111.8 | L63 D64 | K60-L63 PolarHBondContact O-N 2.87Å; K60-D64 WeakPolarHBondContact O-CB 3.33Å; K60-D64 VanDerWaalsContact O-CG 3.22Å; K60-D64 PolarHBondContact O-N 2.83Å |
| 61 | S | 74.6 | Confident | 66.1 | Low | 77 Ų | 77 | 77.9 Ų | 77.9 | 54% | 0.538 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 175.1 | 41.2 | 0 | 0 | 0 | 0 | 113.4 | S59 D64 H65 | S59-S61 PolarHBondContact O-N 3.22Å; S59-S61 PolarHBondContact OG-OG 3.27Å; S61-D64 PolarHBondContact O-N 3.45Å; S61-H65 WeakPolarHBondContact O-CB 3.5Å; S61-H65 PolarHBondContact O-N 3.02Å |
| 62 | D | 73.4 | Confident | 68.6 | Low | 60 Ų | 60 | 76.4 Ų | 76.4 | 32% | 0.321 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -70.2 | -39.4 | -179.2 | -57.4 | -28.4 | 0 | 0 | 0 | 110.7 | S59 H65 I66 L95 | S59-D62 WeakPolarHBondContact CB-OD2 3.34Å; S59-D62 PolarHBondContact O-N 2.71Å; S59-D62 PolarHBondContact OG-N 2.87Å; S59-D62 PolarHBondContact OG-OD1 3.13Å; S59-D62 PolarHBondContact OG-OD2 3.46Å; D62-H65 PolarHBondContact O-N 2.88Å; D62-I66 WeakPolarHBondContact O-CG1 3.32Å; D62-I66 PolarHBondContact O-N 3.29Å; D62-L95 HydrophobicContact CB-CD1 3.58Å |
| 63 | L | 76.6 | Confident | 71.1 | Confident | 10 Ų | 10 | 70.6 Ų | 70.6 | 5% | 0.052 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 175.7 | -176.2 | 63.6 | 0 | 0 | 0 | 111.6 | V58 S59 K60 H65 I66 N67 | V58-L63 HydrophobicContact CG1-CB 4.38Å; S59-L63 PolarHBondContact O-N 3.23Å; K60-L63 PolarHBondContact O-N 2.87Å; L63-H65 VanDerWaalsContact C-N 3.34Å; L63-I66 PolarHBondContact O-N 3.47Å; L63-N67 WeakPolarHBondContact O-CB 3.49Å; L63-N67 PolarHBondContact O-N 2.92Å; L63-N67 PolarHBondContact O-ND2 2.78Å |
| 64 | D | 81.4 | Confident | 73.5 | Confident | 80 Ų | 80 | 73.2 Ų | 73.2 | 43% | 0.428 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 176.4 | -70.5 | -20.9 | 0 | 0 | 0 | 111 | K60 S61 N67 Q68 | K60-D64 WeakPolarHBondContact O-CB 3.33Å; K60-D64 VanDerWaalsContact O-CG 3.22Å; K60-D64 PolarHBondContact O-N 2.83Å; S61-D64 PolarHBondContact O-N 3.45Å; D64-N67 PolarHBondContact O-N 2.91Å; D64-Q68 WeakPolarHBondContact O-CG 3.28Å; D64-Q68 PolarHBondContact O-N 3.03Å |
| 65 | H | 83.4 | Confident | 75.7 | Confident | 93 Ų | 93 | 67 Ų | 67 | 43% | 0.431 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63.2 | -46.3 | 176.2 | -178 | -103.9 | 0 | 0 | 0 | 112.4 | S61 D62 L63 N67 Q68 L69 | S61-H65 WeakPolarHBondContact O-CB 3.5Å; S61-H65 PolarHBondContact O-N 3.02Å; D62-H65 PolarHBondContact O-N 2.88Å; L63-H65 VanDerWaalsContact C-N 3.34Å; H65-N67 VanDerWaalsContact C-N 3.33Å; H65-N67 PolarHBondContact O-N 3Å; H65-Q68 WeakPolarHBondContact O-CB 3.48Å; H65-Q68 PolarHBondContact O-N 3.11Å; H65-L69 WeakPolarHBondContact O-CG 3.02Å; H65-L69 PolarHBondContact O-N 2.88Å |
| 66 | I | 80.8 | Confident | 77.9 | Confident | 7 Ų | 7 | 67.7 Ų | 67.7 | 4% | 0.036 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -65.2 | -37.1 | 177.5 | -69.3 | -179.2 | 0 | 0 | 0 | 111.4 | D62 L63 L69 S70 L95 I97 F100 | D62-I66 WeakPolarHBondContact O-CG1 3.32Å; D62-I66 PolarHBondContact O-N 3.29Å; L63-I66 PolarHBondContact O-N 3.47Å; I66-L69 PolarHBondContact O-N 3.45Å; I66-S70 WeakPolarHBondContact O-CB 3.27Å; I66-S70 PolarHBondContact O-N 2.92Å; I66-L95 HydrophobicContact CD1-CB 4.15Å; I66-L95 HydrophobicContact CD1-CD1 3.53Å; I66-L95 HydrophobicContact CD1-CD2 4.07Å; I66-L95 HydrophobicContact CD1-CG 4.1Å; I66-I97 HydrophobicContact CD1-CD1 4.49Å; I66-I97 HydrophobicContact CD1-CG1 4.11Å; I66-F100 HydrophobicContact CG2-CD1 3.66Å; I66-F100 HydrophobicContact CG2-CD2 4.12Å; I66-F100 HydrophobicContact CG2-CE1 3.36Å; I66-F100 HydrophobicContact CG2-CE2 3.87Å; I66-F100 HydrophobicContact CG2-CG 4.04Å; I66-F100 HydrophobicContact CG2-CZ 3.47Å; I66-F100 VanDerWaalsContact CG2-CZ 3.47Å |
| 67 | N | 84.1 | Confident | 80 | Confident | 30 Ų | 30 | 65.2 Ų | 65.2 | 16% | 0.16 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 173.7 | -78.6 | -46 | 0 | 0 | 0 | 111.7 | L63 D64 H65 L69 S70 D71 R104 | L63-N67 WeakPolarHBondContact O-CB 3.49Å; L63-N67 PolarHBondContact O-N 2.92Å; L63-N67 PolarHBondContact O-ND2 2.78Å; D64-N67 PolarHBondContact O-N 2.91Å; H65-N67 VanDerWaalsContact C-N 3.33Å; H65-N67 PolarHBondContact O-N 3Å; N67-L69 VanDerWaalsContact C-N 3.34Å; N67-L69 PolarHBondContact O-N 3.34Å; N67-S70 WeakPolarHBondContact O-CB 3.47Å; N67-S70 PolarHBondContact O-N 3.42Å; N67-D71 PolarHBondContact O-N 3.45Å; N67-R104 PolarHBondContact OD1-NH1 3.32Å; N67-R104 PolarHBondContact OD1-NH2 3.08Å |
| 68 | Q | 87 | Confident | 81.9 | Confident | 118 Ų | 118 | 65 Ų | 65 | 55% | 0.551 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -60.6 | -42.7 | 174.5 | -71.7 | 173.9 | 10.7 | 0 | 0 | 112 | D64 H65 S70 D71 Q72 | D64-Q68 WeakPolarHBondContact O-CG 3.28Å; D64-Q68 PolarHBondContact O-N 3.03Å; H65-Q68 WeakPolarHBondContact O-CB 3.48Å; H65-Q68 PolarHBondContact O-N 3.11Å; Q68-S70 VanDerWaalsContact C-N 3.33Å; Q68-S70 PolarHBondContact O-N 2.94Å; Q68-D71 PolarHBondContact O-N 3.41Å; Q68-Q72 WeakPolarHBondContact O-CG 3.48Å; Q68-Q72 PolarHBondContact O-N 3.15Å |
| 69 | L | 86 | Confident | 83.5 | Confident | 5 Ų | 5 | 65.3 Ų | 65.3 | 3% | 0.026 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.8 | -39.2 | 175.3 | -70.8 | 178 | 0 | 0 | 0 | 111.9 | H65 I66 N67 D71 Q72 I73 N85 I86 | H65-L69 WeakPolarHBondContact O-CG 3.02Å; H65-L69 PolarHBondContact O-N 2.88Å; I66-L69 PolarHBondContact O-N 3.45Å; N67-L69 VanDerWaalsContact C-N 3.34Å; N67-L69 PolarHBondContact O-N 3.34Å; L69-D71 VanDerWaalsContact C-N 3.33Å; L69-D71 PolarHBondContact O-N 2.92Å; L69-Q72 PolarHBondContact O-N 3.36Å; L69-I73 WeakPolarHBondContact O-CG1 3.5Å; L69-I73 PolarHBondContact O-N 3.37Å; L69-N85 HydrophobicContact CD1-CB 4.1Å; L69-N85 HydrophobicContact CD2-CB 3.76Å; L69-I86 HydrophobicContact CB-CD1 4.06Å; L69-I86 HydrophobicContact CB-CG1 3.77Å; L69-I86 HydrophobicContact CD1-CG1 3.83Å; L69-I86 HydrophobicContact CG-CG1 4.4Å |
| 70 | S | 83.6 | Confident | 84.8 | Confident | 3 Ų | 3 | 65.5 Ų | 65.5 | 2% | 0.021 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -59.7 | -43.4 | 174.4 | 178.4 | 0 | 0 | 0 | 0 | 112.1 | I66 N67 Q68 Q72 I73 R104 I107 | I66-S70 WeakPolarHBondContact O-CB 3.27Å; I66-S70 PolarHBondContact O-N 2.92Å; N67-S70 WeakPolarHBondContact O-CB 3.47Å; N67-S70 PolarHBondContact O-N 3.42Å; Q68-S70 VanDerWaalsContact C-N 3.33Å; Q68-S70 PolarHBondContact O-N 2.94Å; S70-Q72 VanDerWaalsContact C-N 3.29Å; S70-Q72 PolarHBondContact O-N 3.03Å; S70-I73 PolarHBondContact O-N 3.39Å; S70-R104 PolarHBondContact OG-NH1 2.82Å; S70-I107 WeakPolarHBondContact OG-CD1 3.45Å |
| 71 | D | 86.1 | Confident | 85.8 | Confident | 107 Ų | 107 | 63.2 Ų | 63.2 | 57% | 0.572 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -66.8 | -36.1 | 178.8 | -65.5 | -20.4 | 0 | 0 | 0 | 110.8 | N67 Q68 L69 I74 | N67-D71 PolarHBondContact O-N 3.45Å; Q68-D71 PolarHBondContact O-N 3.41Å; L69-D71 VanDerWaalsContact C-N 3.33Å; L69-D71 PolarHBondContact O-N 2.92Å; D71-I74 PolarHBondContact O-N 3Å |
| 72 | Q | 89.4 | Confident | 86.6 | Confident | 72 Ų | 72 | 59.5 Ų | 59.5 | 34% | 0.336 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -67.7 | -34.1 | 175.4 | -72 | 176.1 | 8.7 | 0 | 0 | 113.3 | Q68 L69 S70 I74 N75 F78 A82 | Q68-Q72 WeakPolarHBondContact O-CG 3.48Å; Q68-Q72 PolarHBondContact O-N 3.15Å; L69-Q72 PolarHBondContact O-N 3.36Å; S70-Q72 VanDerWaalsContact C-N 3.29Å; S70-Q72 PolarHBondContact O-N 3.03Å; Q72-I74 VanDerWaalsContact C-N 3.26Å; Q72-I74 PolarHBondContact O-N 3.02Å; Q72-N75 PolarHBondContact O-N 3.4Å; Q72-N75 VanDerWaalsContact O-O 3.1Å; Q72-F78 HydrophobicContact CB-CB 3.95Å; Q72-F78 HydrophobicContact CG-CB 4.3Å; Q72-A82 HydrophobicContact CB-CB 3.71Å |
| 73 | I | 90.6 | Very high | 87.5 | Confident | 1 Ų | 1 | 56.7 Ų | 56.7 | 1% | 0.005 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.9 | -37 | 176.4 | -77.7 | -170.9 | 0 | 0 | 0 | 111.9 | L69 S70 N75 R79 A82 I83 I86 I107 A110 | L69-I73 WeakPolarHBondContact O-CG1 3.5Å; L69-I73 PolarHBondContact O-N 3.37Å; S70-I73 PolarHBondContact O-N 3.39Å; I73-N75 PolarHBondContact O-N 3.23Å; I73-R79 HydrophobicContact CG2-CG 4.37Å; I73-R79 WeakPolarHBondContact O-CG 3.1Å; I73-R79 PolarHBondContact O-NE 3.3Å; I73-A82 HydrophobicContact CB-CB 4.45Å; I73-A82 HydrophobicContact CD1-CB 4.5Å; I73-A82 HydrophobicContact CG1-CB 3.47Å; I73-A82 VanDerWaalsContact CG1-CB 3.47Å; I73-I83 HydrophobicContact CD1-CG1 3.95Å; I73-I83 HydrophobicContact CG1-CG1 4.24Å; I73-I86 HydrophobicContact CD1-CD1 3.24Å; I73-I86 HydrophobicContact CD1-CG1 4.23Å; I73-I86 HydrophobicContact CG1-CD1 4.18Å; I73-I107 HydrophobicContact CD1-CG2 4.23Å; I73-I107 HydrophobicContact CG2-CG2 4.29Å; I73-A110 HydrophobicContact CG2-CB 3.38Å |
| 74 | I | 87.4 | Confident | 88.2 | Confident | 95 Ų | 95 | 56.8 Ų | 56.8 | 49% | 0.487 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -66.1 | -33.5 | -179 | -61.4 | 170.4 | 0 | 0 | 0 | 110.3 | D71 Q72 P76 | D71-I74 PolarHBondContact O-N 3Å; Q72-I74 VanDerWaalsContact C-N 3.26Å; Q72-I74 PolarHBondContact O-N 3.02Å; I74-P76 WeakPolarHBondContact O-CD 3.16Å |
| 75 | N | 89.5 | Confident | 88.7 | Confident | 60 Ų | 60 | 56.1 Ų | 56.1 | 32% | 0.321 | 28% | 0.281 | S | S | . | . | S | Bend | trans | -79.1 | 118.6 | 178.2 | -172.7 | -19.8 | 0 | 0 | 0 | 111.8 | Q72 I73 Q77 F78 R79 | Q72-N75 PolarHBondContact O-N 3.4Å; Q72-N75 VanDerWaalsContact O-O 3.1Å; I73-N75 PolarHBondContact O-N 3.23Å; N75-Q77 PolarHBondContact O-N 3.36Å; N75-Q77 PolarHBondContact OD1-N 3.5Å; N75-F78 HydrophobicContact CB-CD2 4.06Å; N75-F78 WeakPolarHBondContact ND2-CD2 3.4Å; N75-F78 WeakPolarHBondContact ND2-CE2 3.05Å; N75-F78 PolarHBondContact O-N 3.07Å; N75-F78 VanDerWaalsContact O-N 3.08Å; N75-R79 WeakPolarHBondContact O-CB 3.32Å; N75-R79 PolarHBondContact O-N 2.84Å |
| 76 | P | 88.5 | Confident | 88.9 | Confident | 88 Ų | 88 | 51.9 Ų | 51.9 | 57% | 0.571 | 26% | 0.262 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -31.2 | 179.4 | -23.6 | 30.8 | 0 | 0 | 0 | 115 | I74 | I74-P76 WeakPolarHBondContact O-CD 3.16Š|
| 77 | Q | 89.3 | Confident | 89.2 | Confident | 157 Ų | 157 | 52.8 Ų | 52.8 | 73% | 0.734 | 27% | 0.268 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72 | -30.5 | -177.8 | -66.1 | -177.8 | -22.4 | 0 | 0 | 113.2 | N75 | N75-Q77 PolarHBondContact O-N 3.36Å; N75-Q77 PolarHBondContact OD1-N 3.5Å |
| 78 | F | 91.7 | Very high | 89.4 | Confident | 98 Ų | 98 | 56.9 Ų | 56.9 | 43% | 0.43 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.5 | -8.4 | -176.7 | -57 | -64.1 | 0 | 0 | 0 | 112.9 | Q72 N75 K80 N81 A82 | Q72-F78 HydrophobicContact CB-CB 3.95Å; Q72-F78 HydrophobicContact CG-CB 4.3Å; N75-F78 HydrophobicContact CB-CD2 4.06Å; N75-F78 WeakPolarHBondContact ND2-CD2 3.4Å; N75-F78 WeakPolarHBondContact ND2-CE2 3.05Å; N75-F78 PolarHBondContact O-N 3.07Å; N75-F78 VanDerWaalsContact O-N 3.08Å; F78-K80 PolarHBondContact O-N 3.44Å; F78-N81 PolarHBondContact O-N 3.05Å; F78-A82 WeakPolarHBondContact O-CB 3.27Å; F78-A82 PolarHBondContact O-N 3.25Å |
| 79 | R | 93.2 | Very high | 89.1 | Confident | 22 Ų | 22 | 52.1 Ų | 52.1 | 8% | 0.083 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -53.6 | -50.8 | -171 | -171.5 | -176.5 | -51 | 149.4 | -4.1 | 114.1 | I73 N75 N81 A82 I83 A110 E114 | I73-R79 HydrophobicContact CG2-CG 4.37Å; I73-R79 WeakPolarHBondContact O-CG 3.1Å; I73-R79 PolarHBondContact O-NE 3.3Å; N75-R79 WeakPolarHBondContact O-CB 3.32Å; N75-R79 PolarHBondContact O-N 2.84Å; R79-N81 PolarHBondContact O-N 3.01Å; R79-A82 PolarHBondContact O-N 3.38Å; R79-I83 HydrophobicContact CG-CD1 3.85Å; R79-I83 HydrophobicContact CG-CG1 4.41Å; R79-I83 VanDerWaalsContact O-CG1 3.3Å; R79-I83 WeakPolarHBondContact O-CG1 3.44Å; R79-I83 PolarHBondContact O-N 3.43Å; R79-A110 HydrophobicContact CG-CB 4.48Å; R79-E114 VanDerWaalsContact CD-OE1 3.23Å; R79-E114 WeakPolarHBondContact CD-OE1 3.47Å; R79-E114 HydrophobicContact CG-CG 4.1Å; R79-E114 IonicContact CZ-OE1 3.69Å; R79-E114 IonicContact NE-OE1 3.86Å; R79-E114 IonicContact NH1-OE1 2.8Å; R79-E114 PolarHBondContact NH1-OE1 3.37Å |
| 80 | K | 92.7 | Very high | 88.7 | Confident | 48 Ų | 48 | 52.4 Ų | 52.4 | 21% | 0.209 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -56.2 | -52.1 | -178.7 | -65 | 178.6 | 161.5 | -172 | 0 | 112.1 | F78 A82 I83 I84 E130 I134 | F78-K80 PolarHBondContact O-N 3.44Å; K80-A82 VanDerWaalsContact C-N 3.33Å; K80-A82 PolarHBondContact O-N 3.11Å; K80-I83 PolarHBondContact O-N 3.31Å; K80-I84 WeakPolarHBondContact O-CG1 3.36Å; K80-I84 PolarHBondContact O-N 2.95Å; K80-E130 WeakPolarHBondContact CD-OE1 3.48Å; K80-E130 IonicContact NZ-OE1 2.86Å; K80-E130 IonicContact NZ-OE2 2.77Å; K80-E130 PolarHBondContact NZ-OE2 3.47Å; K80-I134 HydrophobicContact CB-CD1 3.88Å; K80-I134 HydrophobicContact CB-CG1 4.22Å; K80-I134 HydrophobicContact CD-CD1 3.65Å; K80-I134 HydrophobicContact CG-CD1 3.59Å; K80-I134 HydrophobicContact CG-CG1 4.38Å |
| 81 | N | 93 | Very high | 88 | Confident | 96 Ų | 96 | 58.2 Ų | 58.2 | 51% | 0.513 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64.3 | -39.7 | 179.1 | -69 | -16.1 | 0 | 0 | 0 | 111.5 | F78 R79 I84 N85 | F78-N81 PolarHBondContact O-N 3.05Å; R79-N81 PolarHBondContact O-N 3.01Å; N81-I84 PolarHBondContact O-N 2.98Å; N81-N85 WeakPolarHBondContact O-CB 3.35Å; N81-N85 PolarHBondContact O-N 3.43Å; N81-N85 PolarHBondContact O-ND2 2.87Å |
| 82 | A | 91.9 | Very high | 86.8 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -65.7 | -40.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | Q72 I73 F78 R79 K80 I84 N85 I86 | Q72-A82 HydrophobicContact CB-CB 3.71Å; I73-A82 HydrophobicContact CB-CB 4.45Å; I73-A82 HydrophobicContact CD1-CB 4.5Å; I73-A82 HydrophobicContact CG1-CB 3.47Å; I73-A82 VanDerWaalsContact CG1-CB 3.47Å; F78-A82 WeakPolarHBondContact O-CB 3.27Å; F78-A82 PolarHBondContact O-N 3.25Å; R79-A82 PolarHBondContact O-N 3.38Å; K80-A82 VanDerWaalsContact C-N 3.33Å; K80-A82 PolarHBondContact O-N 3.11Å; A82-I84 PolarHBondContact O-N 2.94Å; A82-N85 PolarHBondContact O-N 2.9Å; A82-I86 WeakPolarHBondContact O-CG1 3.4Å; A82-I86 PolarHBondContact O-N 2.95Å |
| 83 | I | 92.4 | Very high | 85.4 | Confident | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.1 | -47.7 | 174 | -71.7 | 168.6 | 0 | 0 | 0 | 111.1 | I73 R79 K80 N85 I86 C87 L111 E114 I138 I141 | I73-I83 HydrophobicContact CD1-CG1 3.95Å; I73-I83 HydrophobicContact CG1-CG1 4.24Å; R79-I83 HydrophobicContact CG-CD1 3.85Å; R79-I83 HydrophobicContact CG-CG1 4.41Å; R79-I83 VanDerWaalsContact O-CG1 3.3Å; R79-I83 WeakPolarHBondContact O-CG1 3.44Å; R79-I83 PolarHBondContact O-N 3.43Å; K80-I83 PolarHBondContact O-N 3.31Å; I83-N85 PolarHBondContact O-N 2.93Å; I83-I86 PolarHBondContact O-N 2.72Å; I83-C87 PolarHBondContact O-N 3.47Å; I83-L111 HydrophobicContact CD1-CD2 3.87Å; I83-L111 HydrophobicContact CG1-CD2 3.79Å; I83-L111 HydrophobicContact CG2-CD2 4.32Å; I83-E114 HydrophobicContact CD1-CB 4.24Å; I83-E114 HydrophobicContact CD1-CG 3.64Å; I83-I138 HydrophobicContact CD1-CD1 4.46Å; I83-I138 HydrophobicContact CD1-CG1 4.48Å; I83-I138 HydrophobicContact CG2-CG1 3.76Å; I83-I141 HydrophobicContact CG2-CD1 4.11Å |
| 84 | I | 91.4 | Very high | 83.9 | Confident | 12 Ų | 12 | 64.9 Ų | 64.9 | 6% | 0.062 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 179 | -67.4 | 167.6 | 0 | 0 | 0 | 110.7 | K80 N81 A82 C87 K88 E133 I134 | K80-I84 WeakPolarHBondContact O-CG1 3.36Å; K80-I84 PolarHBondContact O-N 2.95Å; N81-I84 PolarHBondContact O-N 2.98Å; A82-I84 PolarHBondContact O-N 2.94Å; I84-C87 PolarHBondContact O-N 3.07Å; I84-K88 HydrophobicContact CG2-CD 4.03Å; I84-K88 WeakPolarHBondContact O-CG 3.25Å; I84-K88 PolarHBondContact O-N 3.38Å; I84-E133 HydrophobicContact CD1-CB 4.35Å; I84-E133 HydrophobicContact CD1-CG 3.92Å; I84-E133 HydrophobicContact CG1-CG 4.09Å; I84-E133 HydrophobicContact CG2-CG 4.4Å; I84-E133 VanDerWaalsContact CG2-OE1 3.3Å; I84-E133 WeakPolarHBondContact CG2-OE1 2.96Å; I84-I134 HydrophobicContact CD1-CG1 4.23Å |
| 85 | N | 90 | Very high | 82.8 | Confident | 67 Ų | 67 | 61.5 Ų | 61.5 | 36% | 0.358 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -67.3 | -37.8 | 179.9 | -71.3 | -17.8 | 0 | 0 | 0 | 112.6 | L69 N81 A82 I83 K88 S89 | L69-N85 HydrophobicContact CD1-CB 4.1Å; L69-N85 HydrophobicContact CD2-CB 3.76Å; N81-N85 WeakPolarHBondContact O-CB 3.35Å; N81-N85 PolarHBondContact O-N 3.43Å; N81-N85 PolarHBondContact O-ND2 2.87Å; A82-N85 PolarHBondContact O-N 2.9Å; I83-N85 PolarHBondContact O-N 2.93Å; N85-K88 PolarHBondContact O-N 2.91Å; N85-S89 PolarHBondContact O-N 3.35Å |
| 86 | I | 88.6 | Confident | 82.1 | Confident | 3 Ų | 3 | 62.6 Ų | 62.6 | 2% | 0.015 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.7 | -47.6 | 172.4 | -71.6 | -172.2 | 0 | 0 | 0 | 109.8 | L69 I73 A82 I83 K88 S89 I90 I97 I101 I141 | L69-I86 HydrophobicContact CB-CD1 4.06Å; L69-I86 HydrophobicContact CB-CG1 3.77Å; L69-I86 HydrophobicContact CD1-CG1 3.83Å; L69-I86 HydrophobicContact CG-CG1 4.4Å; I73-I86 HydrophobicContact CD1-CD1 3.24Å; I73-I86 HydrophobicContact CD1-CG1 4.23Å; I73-I86 HydrophobicContact CG1-CD1 4.18Å; A82-I86 WeakPolarHBondContact O-CG1 3.4Å; A82-I86 PolarHBondContact O-N 2.95Å; I83-I86 PolarHBondContact O-N 2.72Å; I86-K88 VanDerWaalsContact C-N 3.26Å; I86-K88 PolarHBondContact O-N 2.88Å; I86-S89 WeakPolarHBondContact CA-OG 3.27Å; I86-S89 PolarHBondContact O-N 3.32Å; I86-S89 VanDerWaalsContact O-N 3.11Å; I86-S89 PolarHBondContact O-OG 2.91Å; I86-I90 WeakPolarHBondContact O-CG1 3.48Å; I86-I90 PolarHBondContact O-N 3.27Å; I86-I97 HydrophobicContact CG2-CG2 4.28Å; I86-I101 HydrophobicContact CG2-CD1 3.68Å; I86-I141 HydrophobicContact CB-CD1 4.41Å; I86-I141 HydrophobicContact CG2-CD1 4Å; I86-I141 HydrophobicContact CG2-CG1 4.18Å |
| 87 | C | 88 | Confident | 81.6 | Confident | 26 Ų | 26 | 58.9 Ų | 58.9 | 18% | 0.176 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.8 | -35.4 | 178.2 | -168 | 0 | 0 | 0 | 0 | 112.7 | I83 I84 I90 I141 | I83-C87 PolarHBondContact O-N 3.47Å; I84-C87 PolarHBondContact O-N 3.07Å; C87-I90 WeakPolarHBondContact O-CB 3.38Å; C87-I90 PolarHBondContact O-N 3.11Å; C87-I141 HydrophobicContact CB-CG1 4.36Å |
| 88 | K | 86.6 | Confident | 81 | Confident | 116 Ų | 116 | 51.5 Ų | 51.5 | 50% | 0.504 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -68 | -37.2 | 174.7 | -74.8 | 167.6 | 177.9 | 156.7 | 0 | 112.6 | I84 N85 I86 I90 D91 E133 | I84-K88 HydrophobicContact CG2-CD 4.03Å; I84-K88 WeakPolarHBondContact O-CG 3.25Å; I84-K88 PolarHBondContact O-N 3.38Å; N85-K88 PolarHBondContact O-N 2.91Å; I86-K88 VanDerWaalsContact C-N 3.26Å; I86-K88 PolarHBondContact O-N 2.88Å; K88-I90 PolarHBondContact O-N 3.01Å; K88-D91 PolarHBondContact O-N 3.31Å; K88-E133 IonicContact NZ-OE1 2.71Å; K88-E133 PolarHBondContact NZ-OE1 3.44Å |
| 89 | S | 82 | Confident | 80.5 | Confident | 18 Ų | 18 | 48.4 Ų | 48.4 | 13% | 0.126 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -69.2 | -13 | 176.3 | 67.2 | 0 | 0 | 0 | 0 | 114.6 | N85 I86 D91 D92 I97 | N85-S89 PolarHBondContact O-N 3.35Å; I86-S89 WeakPolarHBondContact CA-OG 3.27Å; I86-S89 PolarHBondContact O-N 3.32Å; I86-S89 VanDerWaalsContact O-N 3.11Å; I86-S89 PolarHBondContact O-OG 2.91Å; S89-D91 VanDerWaalsContact C-N 3.32Å; S89-D92 PolarHBondContact O-N 2.83Å; S89-I97 WeakPolarHBondContact O-CD1 3.33Å |
| 90 | I | 77.9 | Confident | 79.8 | Confident | 11 Ų | 11 | 47.9 Ų | 47.9 | 6% | 0.056 | 25% | 0.251 | C | S | . | . | G | 310 helix | trans | -67 | -34.4 | 177.6 | -74.4 | 165.4 | 0 | 0 | 0 | 111.9 | I86 C87 K88 D92 N93 I97 I141 Q144 | I86-I90 WeakPolarHBondContact O-CG1 3.48Å; I86-I90 PolarHBondContact O-N 3.27Å; C87-I90 WeakPolarHBondContact O-CB 3.38Å; C87-I90 PolarHBondContact O-N 3.11Å; K88-I90 PolarHBondContact O-N 3.01Å; I90-D92 PolarHBondContact O-N 2.77Å; I90-D92 VanDerWaalsContact O-N 3.15Å; I90-N93 PolarHBondContact O-N 3.21Å; I90-I97 HydrophobicContact CB-CD1 4.3Å; I90-I97 HydrophobicContact CD1-CG2 4.27Å; I90-I97 HydrophobicContact CG1-CB 4.29Å; I90-I97 HydrophobicContact CG1-CD1 3.81Å; I90-I97 HydrophobicContact CG1-CG2 3.8Å; I90-I141 HydrophobicContact CD1-CG1 3.88Å; I90-Q144 HydrophobicContact CB-CG 4.27Å; I90-Q144 HydrophobicContact CD1-CB 4.41Å; I90-Q144 HydrophobicContact CD1-CG 3.69Å; I90-Q144 HydrophobicContact CG1-CG 4.01Å; I90-Q144 HydrophobicContact CG2-CG 3.3Å |
| 91 | D | 68 | Low | 79.4 | Confident | 125 Ų | 125 | 45.6 Ų | 45.6 | 67% | 0.668 | 24% | 0.241 | S | C | * | . | G | 310 helix | trans | -65 | -20 | -176.9 | -68.2 | -26.2 | 0 | 0 | 0 | 112.4 | K88 S89 N93 | K88-D91 PolarHBondContact O-N 3.31Å; S89-D91 VanDerWaalsContact C-N 3.32Å; D91-N93 VanDerWaalsContact C-N 3.27Å; D91-N93 PolarHBondContact O-N 3.45Å |
| 92 | D | 60.8 | Low | 79 | Confident | 115 Ų | 115 | 43.3 Ų | 43.3 | 62% | 0.615 | 23% | 0.226 | S | C | * | . | G | 310 helix | trans | -78.3 | -1.8 | -176.3 | -66.4 | -29.9 | 0 | 0 | 0 | 114.1 | S89 I90 T94 | S89-D92 PolarHBondContact O-N 2.83Å; I90-D92 PolarHBondContact O-N 2.77Å; I90-D92 VanDerWaalsContact O-N 3.15Å; D92-T94 WeakPolarHBondContact O-CG2 3.44Å; D92-T94 PolarHBondContact O-N 2.95Å |
| 93 | N | 60 | Low | 78.6 | Confident | 147 Ų | 147 | 44.9 Ų | 44.9 | 79% | 0.786 | 24% | 0.237 | S | C | * | . | trans | 53.6 | 5.3 | 167.9 | -75.9 | -43.4 | 0 | 0 | 0 | 118.2 | I90 D91 | I90-N93 PolarHBondContact O-N 3.21Å; D91-N93 VanDerWaalsContact C-N 3.27Å; D91-N93 PolarHBondContact O-N 3.45Å | ||
| 94 | T | 58.3 | Low | 78.4 | Confident | 58 Ų | 58 | 46.2 Ų | 46.2 | 36% | 0.356 | 24% | 0.242 | S | C | . | . | S | Bend | trans | -86.4 | -27.4 | -172.3 | 50.6 | 0 | 0 | 0 | 0 | 113.4 | N55 D92 | N55-T94 PolarHBondContact ND2-O 3.21Å; D92-T94 WeakPolarHBondContact O-CG2 3.44Å; D92-T94 PolarHBondContact O-N 2.95Å |
| 95 | L | 65.7 | Low | 78.2 | Confident | 25 Ų | 25 | 49.2 Ų | 49.2 | 13% | 0.131 | 26% | 0.262 | C | S | . | . | S | Bend | trans | -117.9 | 143.8 | -173.5 | -76.3 | 123.5 | 0 | 0 | 0 | 112.5 | V58 D62 I66 I97 | V58-L95 HydrophobicContact CB-CD2 4.37Å; V58-L95 HydrophobicContact CG1-CD1 4.07Å; V58-L95 HydrophobicContact CG1-CD2 3.42Å; V58-L95 VanDerWaalsContact CG1-CD2 3.42Å; V58-L95 HydrophobicContact CG1-CG 3.77Å; V58-L95 HydrophobicContact CG2-CD2 4Å; V58-L95 HydrophobicContact CG2-CG 3.97Å; D62-L95 HydrophobicContact CB-CD1 3.58Å; I66-L95 HydrophobicContact CD1-CB 4.15Å; I66-L95 HydrophobicContact CD1-CD1 3.53Å; I66-L95 HydrophobicContact CD1-CD2 4.07Å; I66-L95 HydrophobicContact CD1-CG 4.1Å; L95-I97 HydrophobicContact CB-CD1 4.41Å; L95-I97 HydrophobicContact CB-CG1 3.85Å; L95-I97 PolarHBondContact O-N 2.72Å |
| 96 | D | 74.5 | Confident | 78.1 | Confident | 82 Ų | 82 | 47.3 Ų | 47.3 | 44% | 0.439 | 26% | 0.258 | S | S | . | . | trans | -74.8 | 70.8 | 166.6 | -169.9 | -7.8 | 0 | 0 | 0 | 110 | G98 Y99 F100 N148 | D96-G98 PolarHBondContact O-N 3.03Å; D96-Y99 WeakPolarHBondContact O-CB 3.36Å; D96-Y99 PolarHBondContact O-N 3.34Å; D96-Y99 WeakPolarHBondContact OD1-CB 3.3Å; D96-Y99 PolarHBondContact OD1-N 2.95Å; D96-Y99 VanDerWaalsContact OD1-N 3.08Å; D96-Y99 WeakPolarHBondContact OD2-CB 3.38Å; D96-F100 PolarHBondContact O-N 3.5Å; D96-F100 VanDerWaalsContact O-N 3.07Å; D96-N148 PolarHBondContact OD1-ND2 3.37Å; D96-N148 PolarHBondContact OD2-ND2 2.83Å | ||
| 97 | I | 77.1 | Confident | 78.2 | Confident | 10 Ų | 10 | 47.2 Ų | 47.2 | 5% | 0.051 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.5 | -34.7 | -176.9 | -68.8 | 161.6 | 0 | 0 | 0 | 110.6 | I66 I86 S89 I90 L95 Y99 F100 I101 | I66-I97 HydrophobicContact CD1-CD1 4.49Å; I66-I97 HydrophobicContact CD1-CG1 4.11Å; I86-I97 HydrophobicContact CG2-CG2 4.28Å; S89-I97 WeakPolarHBondContact O-CD1 3.33Å; I90-I97 HydrophobicContact CB-CD1 4.3Å; I90-I97 HydrophobicContact CD1-CG2 4.27Å; I90-I97 HydrophobicContact CG1-CB 4.29Å; I90-I97 HydrophobicContact CG1-CD1 3.81Å; I90-I97 HydrophobicContact CG1-CG2 3.8Å; L95-I97 HydrophobicContact CB-CD1 4.41Å; L95-I97 HydrophobicContact CB-CG1 3.85Å; L95-I97 PolarHBondContact O-N 2.72Å; I97-Y99 PolarHBondContact O-N 3.14Å; I97-F100 PolarHBondContact O-N 3.25Å; I97-I101 HydrophobicContact CG2-CD1 3.42Å; I97-I101 VanDerWaalsContact CG2-CD1 3.42Å; I97-I101 HydrophobicContact CG2-CG1 4.02Å; I97-I101 WeakPolarHBondContact O-CB 3.32Å; I97-I101 VanDerWaalsContact O-CG1 3.27Å; I97-I101 WeakPolarHBondContact O-CG1 3.21Å; I97-I101 PolarHBondContact O-N 3.36Å |
| 98 | G | 77.9 | Confident | 78.4 | Confident | 3 Ų | 3 | 47.1 Ų | 47.1 | 3% | 0.031 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59 | -44.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | D96 Y102 | D96-G98 PolarHBondContact O-N 3.03Å; G98-Y102 WeakPolarHBondContact O-CB 3.27Å; G98-Y102 PolarHBondContact O-N 3.35Å; G98-Y102 VanDerWaalsContact O-N 3.12Å |
| 99 | Y | 80 | Confident | 78.7 | Confident | 33 Ų | 33 | 44 Ų | 44 | 13% | 0.129 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.3 | -48.8 | 173.5 | -179.1 | -94.7 | 0 | 0 | 0 | 111.7 | L48 D96 I97 I101 Y102 S103 N148 K150 F151 | L48-Y99 HydrophobicContact CD2-CE1 4.1Å; D96-Y99 WeakPolarHBondContact O-CB 3.36Å; D96-Y99 PolarHBondContact O-N 3.34Å; D96-Y99 WeakPolarHBondContact OD1-CB 3.3Å; D96-Y99 PolarHBondContact OD1-N 2.95Å; D96-Y99 VanDerWaalsContact OD1-N 3.08Å; D96-Y99 WeakPolarHBondContact OD2-CB 3.38Å; I97-Y99 PolarHBondContact O-N 3.14Å; Y99-I101 VanDerWaalsContact C-N 3.33Å; Y99-I101 PolarHBondContact O-N 2.85Å; Y99-Y102 PolarHBondContact O-N 3.39Å; Y99-S103 VanDerWaalsContact O-CB 3.22Å; Y99-S103 WeakPolarHBondContact O-CB 3.35Å; Y99-S103 PolarHBondContact O-N 3.41Å; Y99-S103 PolarHBondContact O-OG 2.88Å; Y99-S103 VanDerWaalsContact O-OG 3.08Å; Y99-N148 WeakPolarHBondContact CB-ND2 3.18Å; Y99-N148 PolarHBondContact N-ND2 3.12Å; Y99-K150 HydrophobicContact CD2-CD 3.93Å; Y99-K150 HydrophobicContact CE2-CD 3.73Å; Y99-K150 VanDerWaalsContact CE2-NZ 3.31Å; Y99-F151 AromaticContact CD2-CD2 3.87Å; Y99-F151 HydrophobicContact CD2-CD2 3.87Å; Y99-F151 AromaticContact CD2-CE2 3.08Å; Y99-F151 HydrophobicContact CD2-CE2 3.08Å; Y99-F151 AromaticContact CD2-CZ 3.79Å; Y99-F151 HydrophobicContact CD2-CZ 3.79Å; Y99-F151 HydrophobicContact CE2-CD2 4.38Å; Y99-F151 AromaticContact CE2-CE2 3.26Å; Y99-F151 HydrophobicContact CE2-CE2 3.26Å; Y99-F151 AromaticContact CE2-CZ 3.43Å; Y99-F151 HydrophobicContact CE2-CZ 3.43Å; Y99-F151 VanDerWaalsContact CE2-CZ 3.43Å; Y99-F151 AromaticContact CG-CE2 3.97Å; Y99-F151 HydrophobicContact CG-CE2 3.97Å |
| 100 | F | 79.8 | Confident | 79.2 | Confident | 10 Ų | 10 | 43.3 Ų | 43.3 | 4% | 0.044 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -55.9 | -48.6 | -178.5 | -179.8 | -86.2 | 0 | 0 | 0 | 111.5 | L48 I66 D96 I97 S103 I107 | L48-F100 HydrophobicContact CD1-CD2 3.33Å; L48-F100 HydrophobicContact CD1-CE2 3.83Å; L48-F100 HydrophobicContact CD1-CG 4.3Å; I66-F100 HydrophobicContact CG2-CD1 3.66Å; I66-F100 HydrophobicContact CG2-CD2 4.12Å; I66-F100 HydrophobicContact CG2-CE1 3.36Å; I66-F100 HydrophobicContact CG2-CE2 3.87Å; I66-F100 HydrophobicContact CG2-CG 4.04Å; I66-F100 HydrophobicContact CG2-CZ 3.47Å; I66-F100 VanDerWaalsContact CG2-CZ 3.47Å; D96-F100 PolarHBondContact O-N 3.5Å; D96-F100 VanDerWaalsContact O-N 3.07Å; I97-F100 PolarHBondContact O-N 3.25Å; F100-S103 PolarHBondContact O-OG 3.18Å; F100-I107 HydrophobicContact CD1-CD1 4.43Å; F100-I107 HydrophobicContact CE1-CD1 4.05Å |
| 101 | I | 82.7 | Confident | 80 | Confident | 1 Ų | 1 | 42.8 Ų | 42.8 | 1% | 0.005 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.5 | -51.1 | -177.2 | -68.9 | 173.4 | 0 | 0 | 0 | 111.3 | I86 I97 Y99 S103 R104 I107 I108 L111 I141 I145 | I86-I101 HydrophobicContact CG2-CD1 3.68Å; I97-I101 HydrophobicContact CG2-CD1 3.42Å; I97-I101 VanDerWaalsContact CG2-CD1 3.42Å; I97-I101 HydrophobicContact CG2-CG1 4.02Å; I97-I101 WeakPolarHBondContact O-CB 3.32Å; I97-I101 VanDerWaalsContact O-CG1 3.27Å; I97-I101 WeakPolarHBondContact O-CG1 3.21Å; I97-I101 PolarHBondContact O-N 3.36Å; Y99-I101 VanDerWaalsContact C-N 3.33Å; Y99-I101 PolarHBondContact O-N 2.85Å; I101-S103 VanDerWaalsContact C-N 3.31Å; I101-S103 PolarHBondContact O-N 2.85Å; I101-R104 PolarHBondContact O-N 3.31Å; I101-I107 HydrophobicContact CG2-CG2 3.8Å; I101-I108 HydrophobicContact CG2-CD1 3.99Å; I101-L111 HydrophobicContact CG2-CD1 4.16Å; I101-I141 HydrophobicContact CD1-CB 4.4Å; I101-I141 HydrophobicContact CD1-CG1 4.17Å; I101-I141 HydrophobicContact CD1-CG2 3.51Å; I101-I141 HydrophobicContact CG2-CG2 3.93Å; I101-I145 HydrophobicContact CG2-CD1 3.83Å; I101-I145 HydrophobicContact CG2-CG1 4.43Å |
| 102 | Y | 85.3 | Confident | 81.3 | Confident | 48 Ų | 48 | 39.1 Ų | 39.1 | 19% | 0.188 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -68.8 | -30.6 | -175.4 | -172.1 | -100.6 | 0 | 0 | 0 | 112.9 | G98 Y99 R104 I108 I145 F151 D154 F155 | G98-Y102 WeakPolarHBondContact O-CB 3.27Å; G98-Y102 PolarHBondContact O-N 3.35Å; G98-Y102 VanDerWaalsContact O-N 3.12Å; Y99-Y102 PolarHBondContact O-N 3.39Å; Y102-R104 PolarHBondContact O-N 3.27Å; Y102-R104 VanDerWaalsContact O-N 3.16Å; Y102-I108 HydrophobicContact CD2-CD1 4.14Å; Y102-I108 HydrophobicContact CD2-CG1 4.34Å; Y102-I145 HydrophobicContact CD2-CG2 4.08Å; Y102-I145 HydrophobicContact CG-CG2 4.19Å; Y102-F151 HydrophobicContact CD1-CB 3.42Å; Y102-F151 VanDerWaalsContact CD1-CB 3.42Å; Y102-F151 AromaticContact CD1-CD1 3.6Å; Y102-F151 HydrophobicContact CD1-CD1 3.6Å; Y102-F151 AromaticContact CD1-CD2 3.57Å; Y102-F151 HydrophobicContact CD1-CD2 3.57Å; Y102-F151 HydrophobicContact CD1-CE1 4.15Å; Y102-F151 HydrophobicContact CD1-CE2 4.06Å; Y102-F151 AromaticContact CD1-CG 3.27Å; Y102-F151 HydrophobicContact CD1-CG 3.27Å; Y102-F151 HydrophobicContact CD1-CZ 4.36Å; Y102-F151 HydrophobicContact CE1-CB 3.72Å; Y102-F151 AromaticContact CE1-CD1 3.67Å; Y102-F151 HydrophobicContact CE1-CD1 3.67Å; Y102-F151 HydrophobicContact CE1-CD2 4.45Å; Y102-F151 HydrophobicContact CE1-CE1 4.34Å; Y102-F151 AromaticContact CE1-CG 3.74Å; Y102-F151 HydrophobicContact CE1-CG 3.74Å; Y102-F151 HydrophobicContact CG-CB 4.03Å; Y102-F151 HydrophobicContact CG-CD2 4.23Å; Y102-F151 HydrophobicContact CG-CG 4.18Å; Y102-D154 HydrophobicContact CE1-CB 4.22Å; Y102-D154 WeakPolarHBondContact OH-CB 3.41Å; Y102-F155 HydrophobicContact CD2-CB 4.08Å; Y102-F155 AromaticContact CD2-CD2 3.71Å; Y102-F155 HydrophobicContact CD2-CD2 3.71Å; Y102-F155 HydrophobicContact CD2-CG 4.3Å; Y102-F155 HydrophobicContact CE2-CB 3.74Å; Y102-F155 AromaticContact CE2-CD2 3.66Å; Y102-F155 HydrophobicContact CE2-CD2 3.66Å; Y102-F155 HydrophobicContact CE2-CG 4.19Å; Y102-F155 PolarHBondContact OH-N 3.42Å |
| 103 | S | 84.4 | Confident | 82.9 | Confident | 33 Ų | 33 | 38 Ų | 38 | 23% | 0.231 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | -13.6 | 176.9 | 70.8 | 0 | 0 | 0 | 0 | 114.3 | Y99 F100 I101 | Y99-S103 VanDerWaalsContact O-CB 3.22Å; Y99-S103 WeakPolarHBondContact O-CB 3.35Å; Y99-S103 PolarHBondContact O-N 3.41Å; Y99-S103 PolarHBondContact O-OG 2.88Å; Y99-S103 VanDerWaalsContact O-OG 3.08Å; F100-S103 PolarHBondContact O-OG 3.18Å; I101-S103 VanDerWaalsContact C-N 3.31Å; I101-S103 PolarHBondContact O-N 2.85Å |
| 104 | R | 86.8 | Confident | 84.6 | Confident | 27 Ų | 27 | 31.2 Ų | 31.2 | 10% | 0.102 | 18% | 0.181 | C | C | . | . | trans | -112.1 | 99.8 | -178.6 | -70.1 | -178 | 171.4 | -174 | 6.1 | 110.6 | F46 N67 S70 I101 Y102 G106 I107 I108 | F46-R104 PolarHBondContact O-NE 3.04Å; F46-R104 PolarHBondContact O-NH2 3.01Å; N67-R104 PolarHBondContact OD1-NH1 3.32Å; N67-R104 PolarHBondContact OD1-NH2 3.08Å; S70-R104 PolarHBondContact OG-NH1 2.82Å; I101-R104 PolarHBondContact O-N 3.31Å; Y102-R104 PolarHBondContact O-N 3.27Å; Y102-R104 VanDerWaalsContact O-N 3.16Å; R104-G106 PolarHBondContact O-N 3.17Å; R104-G106 VanDerWaalsContact O-N 3.14Å; R104-I107 HydrophobicContact CB-CB 4.34Å; R104-I107 HydrophobicContact CB-CD1 3.71Å; R104-I107 HydrophobicContact CB-CG1 3.79Å; R104-I107 HydrophobicContact CG-CD1 4.27Å; R104-I107 WeakPolarHBondContact O-CB 3.27Å; R104-I107 PolarHBondContact O-N 3.16Å; R104-I108 PolarHBondContact O-N 3.5Å | ||
| 105 | P | 87.5 | Confident | 86.3 | Confident | 76 Ų | 76 | 28.4 Ų | 28.4 | 49% | 0.494 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -61.5 | -28.7 | -176.3 | 23.9 | -33.7 | 0 | 0 | 0 | 113.1 | I42 I107 I108 A109 | I42-P105 HydrophobicContact CG2-CG 4.09Å; P105-I107 VanDerWaalsContact C-N 3.29Å; P105-I107 PolarHBondContact O-N 3.24Å; P105-I108 PolarHBondContact O-N 3.12Å; P105-A109 WeakPolarHBondContact O-CB 3.24Å; P105-A109 PolarHBondContact O-N 3.41Å |
| 106 | G | 89.1 | Confident | 87.6 | Confident | 26 Ų | 26 | 31 Ų | 31 | 27% | 0.268 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -61.2 | -34.8 | 174 | 0 | 0 | 0 | 0 | 0 | 113.5 | R104 A110 | R104-G106 PolarHBondContact O-N 3.17Å; R104-G106 VanDerWaalsContact O-N 3.14Å; G106-A110 WeakPolarHBondContact O-CB 3.3Å; G106-A110 PolarHBondContact O-N 2.88Å |
| 107 | I | 90 | Very high | 88.3 | Confident | 2 Ų | 2 | 32.7 Ų | 32.7 | 1% | 0.01 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -70.5 | -48.6 | 175.9 | -58.2 | 179.3 | 0 | 0 | 0 | 109.6 | S70 I73 F100 I101 R104 P105 A109 A110 L111 | S70-I107 WeakPolarHBondContact OG-CD1 3.45Å; I73-I107 HydrophobicContact CD1-CG2 4.23Å; I73-I107 HydrophobicContact CG2-CG2 4.29Å; F100-I107 HydrophobicContact CD1-CD1 4.43Å; F100-I107 HydrophobicContact CE1-CD1 4.05Å; I101-I107 HydrophobicContact CG2-CG2 3.8Å; R104-I107 HydrophobicContact CB-CB 4.34Å; R104-I107 HydrophobicContact CB-CD1 3.71Å; R104-I107 HydrophobicContact CB-CG1 3.79Å; R104-I107 HydrophobicContact CG-CD1 4.27Å; R104-I107 WeakPolarHBondContact O-CB 3.27Å; R104-I107 PolarHBondContact O-N 3.16Å; P105-I107 VanDerWaalsContact C-N 3.29Å; P105-I107 PolarHBondContact O-N 3.24Å; I107-A109 VanDerWaalsContact C-N 3.28Å; I107-A109 PolarHBondContact O-N 3.43Å; I107-A110 WeakPolarHBondContact O-CB 2.87Å; I107-A110 PolarHBondContact O-N 3.01Å; I107-A110 VanDerWaalsContact O-N 3.08Å; I107-L111 HydrophobicContact CG2-CD1 4.21Å; I107-L111 HydrophobicContact CG2-CG 4.33Å; I107-L111 WeakPolarHBondContact O-CG 3.35Å; I107-L111 PolarHBondContact O-N 3.2Å |
| 108 | I | 92.4 | Very high | 88.9 | Confident | 23 Ų | 23 | 33.2 Ų | 33.2 | 12% | 0.118 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.2 | -42.2 | 178.1 | -60.9 | -59.1 | 0 | 0 | 0 | 111.4 | I101 Y102 R104 P105 L111 L112 I145 L160 | I101-I108 HydrophobicContact CG2-CD1 3.99Å; Y102-I108 HydrophobicContact CD2-CD1 4.14Å; Y102-I108 HydrophobicContact CD2-CG1 4.34Å; R104-I108 PolarHBondContact O-N 3.5Å; P105-I108 PolarHBondContact O-N 3.12Å; I108-L111 HydrophobicContact CD1-CD1 4.36Å; I108-L111 PolarHBondContact O-N 3.27Å; I108-L112 PolarHBondContact O-N 3.25Å; I108-I145 HydrophobicContact CD1-CD1 4.01Å; I108-L160 HydrophobicContact CG2-CD1 3.52Å |
| 109 | A | 92.7 | Very high | 89.5 | Confident | 50 Ų | 50 | 36.9 Ų | 36.9 | 41% | 0.413 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62.6 | -42.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | P105 I107 L112 L113 | P105-A109 WeakPolarHBondContact O-CB 3.24Å; P105-A109 PolarHBondContact O-N 3.41Å; I107-A109 VanDerWaalsContact C-N 3.28Å; I107-A109 PolarHBondContact O-N 3.43Å; A109-L112 PolarHBondContact O-N 2.83Å; A109-L113 WeakPolarHBondContact O-CG 3.27Å; A109-L113 PolarHBondContact O-N 3.11Å |
| 110 | A | 92.8 | Very high | 89.7 | Confident | 4 Ų | 4 | 37.1 Ų | 37.1 | 3% | 0.033 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.9 | -39.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | I73 R79 G106 I107 L113 E114 | I73-A110 HydrophobicContact CG2-CB 3.38Å; R79-A110 HydrophobicContact CG-CB 4.48Å; G106-A110 WeakPolarHBondContact O-CB 3.3Å; G106-A110 PolarHBondContact O-N 2.88Å; I107-A110 WeakPolarHBondContact O-CB 2.87Å; I107-A110 PolarHBondContact O-N 3.01Å; I107-A110 VanDerWaalsContact O-N 3.08Å; A110-L113 PolarHBondContact O-N 3.04Å; A110-E114 PolarHBondContact O-N 3.19Å |
| 111 | L | 94.8 | Very high | 89.5 | Confident | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.2 | -44.9 | 173.8 | -63.9 | 173.5 | 0 | 0 | 0 | 110.9 | I83 I101 I107 I108 L113 E114 I115 I138 I141 F142 | I83-L111 HydrophobicContact CD1-CD2 3.87Å; I83-L111 HydrophobicContact CG1-CD2 3.79Å; I83-L111 HydrophobicContact CG2-CD2 4.32Å; I101-L111 HydrophobicContact CG2-CD1 4.16Å; I107-L111 HydrophobicContact CG2-CD1 4.21Å; I107-L111 HydrophobicContact CG2-CG 4.33Å; I107-L111 WeakPolarHBondContact O-CG 3.35Å; I107-L111 PolarHBondContact O-N 3.2Å; I108-L111 HydrophobicContact CD1-CD1 4.36Å; I108-L111 PolarHBondContact O-N 3.27Å; L111-L113 VanDerWaalsContact C-N 3.32Å; L111-L113 PolarHBondContact O-N 3.43Å; L111-E114 PolarHBondContact O-N 3.46Å; L111-I115 WeakPolarHBondContact O-CG1 3.3Å; L111-I115 PolarHBondContact O-N 2.78Å; L111-I138 HydrophobicContact CB-CG2 4.48Å; L111-I138 HydrophobicContact CD2-CG1 4Å; L111-I141 HydrophobicContact CD1-CG2 3.88Å; L111-I141 HydrophobicContact CD2-CD1 4.12Å; L111-F142 HydrophobicContact CB-CE1 4.38Å; L111-F142 HydrophobicContact CD1-CD1 4.5Å; L111-F142 HydrophobicContact CD1-CE1 3.91Å |
| 112 | L | 95.2 | Very high | 88.9 | Confident | 48 Ų | 48 | 45.9 Ų | 45.9 | 25% | 0.251 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -60.8 | -41 | 176 | 178.6 | 61 | 0 | 0 | 0 | 112 | I108 A109 E114 I115 V116 L160 Y163 | I108-L112 PolarHBondContact O-N 3.25Å; A109-L112 PolarHBondContact O-N 2.83Å; L112-E114 VanDerWaalsContact C-N 3.31Å; L112-E114 PolarHBondContact O-N 2.93Å; L112-I115 PolarHBondContact O-N 3.13Å; L112-V116 HydrophobicContact CD1-CG2 4.14Å; L112-V116 HydrophobicContact CG-CG2 4.45Å; L112-V116 WeakPolarHBondContact O-CG2 3.42Å; L112-V116 PolarHBondContact O-N 3.31Å; L112-L160 HydrophobicContact CB-CD2 4.33Å; L112-L160 HydrophobicContact CD1-CD2 3.85Å; L112-L160 HydrophobicContact CD2-CD2 4.03Å; L112-L160 HydrophobicContact CG-CD2 4.29Å; L112-Y163 HydrophobicContact CD1-CD2 4.26Å; L112-Y163 HydrophobicContact CD1-CE2 4.44Å; L112-Y163 HydrophobicContact CD1-CG 4.29Å |
| 113 | L | 94.8 | Very high | 87.9 | Confident | 93 Ų | 93 | 53.1 Ų | 53.1 | 49% | 0.487 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -59.5 | -40.7 | 176.7 | -73.5 | 172.3 | 0 | 0 | 0 | 112.1 | A109 A110 L111 V116 Q117 | A109-L113 WeakPolarHBondContact O-CG 3.27Å; A109-L113 PolarHBondContact O-N 3.11Å; A110-L113 PolarHBondContact O-N 3.04Å; L111-L113 VanDerWaalsContact C-N 3.32Å; L111-L113 PolarHBondContact O-N 3.43Å; L113-V116 PolarHBondContact O-N 2.94Å; L113-Q117 VanDerWaalsContact O-CB 3.25Å; L113-Q117 WeakPolarHBondContact O-CB 3.35Å; L113-Q117 PolarHBondContact O-N 3.21Å |
| 114 | E | 94.2 | Very high | 86.7 | Confident | 3 Ų | 3 | 56.7 Ų | 56.7 | 1% | 0.014 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -70.4 | -38.4 | 176.1 | -66.2 | -56.7 | 125.5 | 0 | 0 | 112.5 | R79 I83 A110 L111 L112 V116 Q117 H118 I134 I138 | R79-E114 VanDerWaalsContact CD-OE1 3.23Å; R79-E114 WeakPolarHBondContact CD-OE1 3.47Å; R79-E114 HydrophobicContact CG-CG 4.1Å; R79-E114 IonicContact CZ-OE1 3.69Å; R79-E114 IonicContact NE-OE1 3.86Å; R79-E114 IonicContact NH1-OE1 2.8Å; R79-E114 PolarHBondContact NH1-OE1 3.37Å; I83-E114 HydrophobicContact CD1-CB 4.24Å; I83-E114 HydrophobicContact CD1-CG 3.64Å; A110-E114 PolarHBondContact O-N 3.19Å; L111-E114 PolarHBondContact O-N 3.46Å; L112-E114 VanDerWaalsContact C-N 3.31Å; L112-E114 PolarHBondContact O-N 2.93Å; E114-V116 VanDerWaalsContact C-N 3.27Å; E114-V116 PolarHBondContact O-N 2.95Å; E114-Q117 PolarHBondContact O-N 2.98Å; E114-Q117 PolarHBondContact OE1-OE1 3.27Å; E114-H118 PolarHBondContact O-CD2 3.03Å; E114-H118 VanDerWaalsContact O-CD2 3.27Å; E114-H118 PolarHBondContact O-N 3.4Å; E114-H118 IonicContact OE2-CD2 3.93Å; E114-H118 IonicContact OE2-NE2 3.67Å; E114-I134 HydrophobicContact CB-CG2 4.2Å; E114-I138 HydrophobicContact CB-CD1 3.79Å |
| 115 | I | 94.2 | Very high | 85.6 | Confident | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.5 | -41.8 | 172.1 | -65.3 | 169.4 | 0 | 0 | 0 | 110.6 | L111 L112 Y119 I135 I138 F142 L164 Y167 | L111-I115 WeakPolarHBondContact O-CG1 3.3Å; L111-I115 PolarHBondContact O-N 2.78Å; L112-I115 PolarHBondContact O-N 3.13Å; I115-Y119 PolarHBondContact O-N 2.83Å; I115-I135 HydrophobicContact CG1-CD1 4.49Å; I115-I138 HydrophobicContact CD1-CG2 3.87Å; I115-I138 HydrophobicContact CG1-CD1 3.96Å; I115-I138 HydrophobicContact CG1-CG2 4.02Å; I115-F142 HydrophobicContact CD1-CE2 3.83Å; I115-F142 HydrophobicContact CD1-CZ 3.79Å; I115-L164 HydrophobicContact CD1-CD2 4.01Å; I115-L164 HydrophobicContact CG1-CD2 4.14Å; I115-L164 HydrophobicContact CG2-CD2 4.25Å; I115-Y167 HydrophobicContact CG2-CE2 3.97Å; I115-Y167 PolarHBondContact O-OH 2.84Å |
| 116 | V | 92.9 | Very high | 84.7 | Confident | 79 Ų | 79 | 62.1 Ų | 62.1 | 48% | 0.479 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -73.2 | -37.6 | 179.6 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | L112 L113 E114 H118 Y119 | L112-V116 HydrophobicContact CD1-CG2 4.14Å; L112-V116 HydrophobicContact CG-CG2 4.45Å; L112-V116 WeakPolarHBondContact O-CG2 3.42Å; L112-V116 PolarHBondContact O-N 3.31Å; L113-V116 PolarHBondContact O-N 2.94Å; E114-V116 VanDerWaalsContact C-N 3.27Å; E114-V116 PolarHBondContact O-N 2.95Å; V116-H118 VanDerWaalsContact C-N 3.3Å; V116-H118 PolarHBondContact O-N 2.65Å; V116-Y119 VanDerWaalsContact O-CB 3.25Å; V116-Y119 WeakPolarHBondContact O-CB 3.46Å; V116-Y119 PolarHBondContact O-N 3.27Å |
| 117 | Q | 90.9 | Very high | 84.1 | Confident | 117 Ų | 117 | 62.4 Ų | 62.4 | 55% | 0.547 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.9 | -35.5 | 179 | 177.2 | 168.9 | -22.4 | 0 | 0 | 112.7 | L113 E114 | L113-Q117 VanDerWaalsContact O-CB 3.25Å; L113-Q117 WeakPolarHBondContact O-CB 3.35Å; L113-Q117 PolarHBondContact O-N 3.21Å; E114-Q117 PolarHBondContact O-N 2.98Å; E114-Q117 PolarHBondContact OE1-OE1 3.27Å |
| 118 | H | 89.6 | Confident | 83.8 | Confident | 21 Ų | 21 | 64.8 Ų | 64.8 | 10% | 0.097 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.3 | 12 | 178.8 | -66.6 | -74.3 | 0 | 0 | 0 | 113.2 | E114 V116 F127 S131 I135 Y167 | E114-H118 PolarHBondContact O-CD2 3.03Å; E114-H118 VanDerWaalsContact O-CD2 3.27Å; E114-H118 PolarHBondContact O-N 3.4Å; E114-H118 IonicContact OE2-CD2 3.93Å; E114-H118 IonicContact OE2-NE2 3.67Å; V116-H118 VanDerWaalsContact C-N 3.3Å; V116-H118 PolarHBondContact O-N 2.65Å; H118-F127 HydrophobicContact CB-CE2 4.39Å; H118-F127 HydrophobicContact CB-CZ 4.32Å; H118-F127 WeakPolarHBondContact O-CE2 3.49Å; H118-S131 PolarHBondContact CE1-OG 3.36Å; H118-S131 VanDerWaalsContact ND1-CB 3.3Å; H118-S131 WeakPolarHBondContact ND1-CB 3.07Å; H118-S131 PolarHBondContact ND1-OG 3.41Å; H118-I135 HydrophobicContact CB-CD1 4.11Å; H118-I135 HydrophobicContact CB-CG1 4.25Å; H118-Y167 PolarHBondContact O-OH 3.35Å |
| 119 | Y | 90.3 | Very high | 83.6 | Confident | 80 Ų | 80 | 67.4 Ų | 67.4 | 31% | 0.314 | 38% | 0.38 | S | S | . | . | trans | -62.4 | 134 | -172.8 | -161.2 | -97.4 | 0 | 0 | 0 | 111.8 | I115 V116 T121 Y163 P166 Y167 | I115-Y119 PolarHBondContact O-N 2.83Å; V116-Y119 VanDerWaalsContact O-CB 3.25Å; V116-Y119 WeakPolarHBondContact O-CB 3.46Å; V116-Y119 PolarHBondContact O-N 3.27Å; Y119-T121 VanDerWaalsContact C-N 3.31Å; Y119-T121 HydrophobicContact CD1-CG2 4.03Å; Y119-T121 PolarHBondContact O-N 3.48Å; Y119-Y163 HydrophobicContact CE2-CD1 4.43Å; Y119-P166 HydrophobicContact CE1-CG 4.5Å; Y119-P166 HydrophobicContact CE2-CG 4.17Å; Y119-P166 WeakPolarHBondContact OH-CG 3.39Å; Y119-Y167 HydrophobicContact CD2-CE2 4.27Å; Y119-Y167 PolarHBondContact N-OH 3.36Å | ||
| 120 | P | 84.1 | Confident | 83.3 | Confident | 38 Ų | 38 | 69.1 Ų | 69.1 | 25% | 0.247 | 38% | 0.38 | C | S | . | . | trans | -76.8 | 79.4 | -177.5 | 31.4 | -35 | 0 | 0 | 0 | 110.8 | P166 I170 | P120-P166 HydrophobicContact CG-CB 3.82Å; P120-I170 HydrophobicContact CB-CD1 4.18Å; P120-I170 HydrophobicContact CB-CG1 3.96Å; P120-I170 HydrophobicContact CG-CD1 4.43Å; P120-I170 HydrophobicContact CG-CG1 4.39Å | ||
| 121 | T | 75.5 | Confident | 83.1 | Confident | 101 Ų | 101 | 69.4 Ų | 69.4 | 62% | 0.62 | 38% | 0.382 | S | S | * | . | trans | -76.1 | -41.8 | 177.1 | 55.2 | 0 | 0 | 0 | 0 | 112.2 | Y119 | Y119-T121 VanDerWaalsContact C-N 3.31Å; Y119-T121 HydrophobicContact CD1-CG2 4.03Å; Y119-T121 PolarHBondContact O-N 3.48Å | ||
| 122 | D | 69.3 | Low | 82.9 | Confident | 94 Ų | 94 | 69.8 Ų | 69.8 | 50% | 0.503 | 38% | 0.384 | S | S | . | . | trans | -121.7 | 126 | -175.6 | -66.3 | -44.2 | 0 | 0 | 0 | 111.1 | S124 I125 | D122-S124 PolarHBondContact O-N 3.25Å; D122-I125 HydrophobicContact CB-CD1 3.99Å; D122-I125 HydrophobicContact CB-CG1 4.07Å; D122-I125 PolarHBondContact O-N 3.15Å | ||
| 123 | K | 64.9 | Low | 82.7 | Confident | 200 Ų | 200 | 71.4 Ų | 71.4 | 87% | 0.87 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -16.8 | 174.8 | -64.8 | -174.1 | 178.7 | -172.3 | 0 | 113.6 | ||
| 124 | S | 58.6 | Low | 82.6 | Confident | 108 Ų | 108 | 67 Ų | 67 | 76% | 0.755 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | -16.4 | -176.2 | 56.4 | 0 | 0 | 0 | 0 | 114.1 | D122 S126 | D122-S124 PolarHBondContact O-N 3.25Å; S124-S126 PolarHBondContact O-N 2.94Å |
| 125 | I | 64 | Low | 82.7 | Confident | 111 Ų | 111 | 66.9 Ų | 66.9 | 57% | 0.569 | 37% | 0.366 | S | S | * | . | S | Bend | trans | -85.5 | 114.6 | -176.8 | -59.8 | 172.8 | 0 | 0 | 0 | 108.6 | D122 F127 | D122-I125 HydrophobicContact CB-CD1 3.99Å; D122-I125 HydrophobicContact CB-CG1 4.07Å; D122-I125 PolarHBondContact O-N 3.15Å; I125-F127 PolarHBondContact O-N 3.22Å |
| 126 | S | 69.1 | Low | 82.6 | Confident | 106 Ų | 106 | 68.2 Ų | 68.2 | 74% | 0.741 | 38% | 0.375 | S | S | * | . | P | Polyproline II helix | trans | -61 | 121.8 | 173.1 | 57.2 | 0 | 0 | 0 | 0 | 110.2 | S124 S128 | S124-S126 PolarHBondContact O-N 2.94Å; S126-S128 PolarHBondContact O-N 3.15Å |
| 127 | F | 76.4 | Confident | 82.7 | Confident | 33 Ų | 33 | 65 Ų | 65 | 15% | 0.145 | 36% | 0.356 | C | S | . | . | P | Polyproline II helix | trans | -70.2 | 124.9 | 176.9 | -151.5 | -99.6 | 0 | 0 | 0 | 110 | H118 I125 F132 I135 Y167 I170 | H118-F127 HydrophobicContact CB-CE2 4.39Å; H118-F127 HydrophobicContact CB-CZ 4.32Å; H118-F127 WeakPolarHBondContact O-CE2 3.49Å; I125-F127 PolarHBondContact O-N 3.22Å; F127-F132 HydrophobicContact CB-CD2 4.46Å; F127-F132 HydrophobicContact CB-CE1 4.34Å; F127-F132 HydrophobicContact CB-CE2 3.68Å; F127-F132 HydrophobicContact CB-CZ 3.59Å; F127-F132 HydrophobicContact CD1-CB 4.33Å; F127-F132 AromaticContact CD1-CD1 3.45Å; F127-F132 HydrophobicContact CD1-CD1 3.45Å; F127-F132 VanDerWaalsContact CD1-CD1 3.45Å; F127-F132 AromaticContact CD1-CD2 3.51Å; F127-F132 HydrophobicContact CD1-CD2 3.51Å; F127-F132 AromaticContact CD1-CE1 3.43Å; F127-F132 HydrophobicContact CD1-CE1 3.43Å; F127-F132 VanDerWaalsContact CD1-CE1 3.43Å; F127-F132 AromaticContact CD1-CE2 3.5Å; F127-F132 HydrophobicContact CD1-CE2 3.5Å; F127-F132 VanDerWaalsContact CD1-CE2 3.5Å; F127-F132 AromaticContact CD1-CG 3.47Å; F127-F132 HydrophobicContact CD1-CG 3.47Å; F127-F132 VanDerWaalsContact CD1-CG 3.47Å; F127-F132 AromaticContact CD1-CZ 3.44Å; F127-F132 HydrophobicContact CD1-CZ 3.44Å; F127-F132 VanDerWaalsContact CD1-CZ 3.44Å; F127-F132 HydrophobicContact CE1-CB 4.29Å; F127-F132 AromaticContact CE1-CD1 3.64Å; F127-F132 HydrophobicContact CE1-CD1 3.64Å; F127-F132 HydrophobicContact CE1-CD2 4.29Å; F127-F132 AromaticContact CE1-CE1 3.95Å; F127-F132 HydrophobicContact CE1-CE1 3.95Å; F127-F132 AromaticContact CE1-CG 3.8Å; F127-F132 HydrophobicContact CE1-CG 3.8Å; F127-F132 HydrophobicContact CE1-CZ 4.4Å; F127-F132 VanDerWaalsContact CE1-N 3.29Å; F127-F132 HydrophobicContact CG-CD2 4.45Å; F127-F132 HydrophobicContact CG-CE1 4.13Å; F127-F132 HydrophobicContact CG-CE2 4.05Å; F127-F132 AromaticContact CG-CZ 3.86Å; F127-F132 HydrophobicContact CG-CZ 3.86Å; F127-F132 WeakPolarHBondContact O-CE2 2.71Å; F127-I135 HydrophobicContact CZ-CG1 3.99Å; F127-Y167 HydrophobicContact CE2-CD1 4.31Å; F127-Y167 AromaticContact CE2-CE1 3.9Å; F127-Y167 HydrophobicContact CE2-CE1 3.9Å; F127-Y167 HydrophobicContact CZ-CD1 4.14Å; F127-Y167 AromaticContact CZ-CE1 3.76Å; F127-Y167 HydrophobicContact CZ-CE1 3.76Å; F127-I170 HydrophobicContact CB-CG2 4.33Å; F127-I170 HydrophobicContact CD2-CD1 3.77Å; F127-I170 HydrophobicContact CE2-CD1 3.73Å; F127-I170 HydrophobicContact CG-CD1 4.31Å; F127-I170 HydrophobicContact CZ-CD1 4.22Å |
| 128 | S | 84.3 | Confident | 82.9 | Confident | 51 Ų | 51 | 59.4 Ų | 59.4 | 36% | 0.357 | 33% | 0.33 | S | S | . | . | P | Polyproline II helix | trans | -75.7 | 154.3 | -176.6 | 76.7 | 0 | 0 | 0 | 0 | 111.7 | S126 E130 S131 F132 | S126-S128 PolarHBondContact O-N 3.15Å; S128-E130 PolarHBondContact O-N 3.43Å; S128-S131 WeakPolarHBondContact O-CB 3.41Å; S128-S131 PolarHBondContact O-N 3.14Å; S128-S131 VanDerWaalsContact O-N 3.07Å; S128-S131 PolarHBondContact OG-N 2.92Å; S128-S131 VanDerWaalsContact OG-N 3.16Å; S128-S131 PolarHBondContact OG-OG 3.03Å; S128-F132 VanDerWaalsContact O-CD2 3.26Å; S128-F132 WeakPolarHBondContact O-CD2 3.47Å; S128-F132 PolarHBondContact O-N 3.33Å; S128-F132 VanDerWaalsContact O-N 3.1Å |
| 129 | S | 86.2 | Confident | 83.2 | Confident | 78 Ų | 78 | 58.4 Ų | 58.4 | 55% | 0.545 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -57.3 | -36.9 | 175.4 | -165.1 | 0 | 0 | 0 | 0 | 112.6 | F132 E133 N176 | S129-F132 PolarHBondContact O-N 2.84Å; S129-E133 PolarHBondContact O-N 3.11Å; S129-N176 PolarHBondContact OG-ND2 3.05Å |
| 130 | E | 87.6 | Confident | 83.3 | Confident | 86 Ų | 86 | 55.2 Ų | 55.2 | 40% | 0.402 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 175.6 | -169.7 | -165 | -153.9 | 0 | 0 | 111.2 | K80 S128 F132 E133 I134 | K80-E130 WeakPolarHBondContact CD-OE1 3.48Å; K80-E130 IonicContact NZ-OE1 2.86Å; K80-E130 IonicContact NZ-OE2 2.77Å; K80-E130 PolarHBondContact NZ-OE2 3.47Å; S128-E130 PolarHBondContact O-N 3.43Å; E130-F132 VanDerWaalsContact C-N 3.29Å; E130-F132 PolarHBondContact O-N 3.14Å; E130-E133 PolarHBondContact O-N 3.29Å; E130-I134 HydrophobicContact CG-CD1 3.95Å; E130-I134 WeakPolarHBondContact O-CD1 3.34Å; E130-I134 VanDerWaalsContact O-CG1 3.28Å; E130-I134 WeakPolarHBondContact O-CG1 3.43Å; E130-I134 PolarHBondContact O-N 3.33Å |
| 131 | S | 89.1 | Confident | 83.7 | Confident | 11 Ų | 11 | 53.5 Ų | 53.5 | 8% | 0.077 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.7 | -39.3 | 178.3 | -52.8 | 0 | 0 | 0 | 0 | 111.3 | H118 S128 I134 I135 | H118-S131 PolarHBondContact CE1-OG 3.36Å; H118-S131 VanDerWaalsContact ND1-CB 3.3Å; H118-S131 WeakPolarHBondContact ND1-CB 3.07Å; H118-S131 PolarHBondContact ND1-OG 3.41Å; S128-S131 WeakPolarHBondContact O-CB 3.41Å; S128-S131 PolarHBondContact O-N 3.14Å; S128-S131 VanDerWaalsContact O-N 3.07Å; S128-S131 PolarHBondContact OG-N 2.92Å; S128-S131 VanDerWaalsContact OG-N 3.16Å; S128-S131 PolarHBondContact OG-OG 3.03Å; S131-I134 PolarHBondContact O-N 3.17Å; S131-I135 WeakPolarHBondContact O-CG1 3.41Å; S131-I135 PolarHBondContact O-N 2.87Å |
| 132 | F | 89.3 | Confident | 84.6 | Confident | 8 Ų | 8 | 48.7 Ų | 48.7 | 4% | 0.035 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.3 | -48.3 | 175.7 | -77.6 | -65.8 | 0 | 0 | 0 | 111.5 | F127 S128 S129 E130 I134 I135 C136 I170 N176 I177 L180 | F127-F132 HydrophobicContact CB-CD2 4.46Å; F127-F132 HydrophobicContact CB-CE1 4.34Å; F127-F132 HydrophobicContact CB-CE2 3.68Å; F127-F132 HydrophobicContact CB-CZ 3.59Å; F127-F132 HydrophobicContact CD1-CB 4.33Å; F127-F132 AromaticContact CD1-CD1 3.45Å; F127-F132 HydrophobicContact CD1-CD1 3.45Å; F127-F132 VanDerWaalsContact CD1-CD1 3.45Å; F127-F132 AromaticContact CD1-CD2 3.51Å; F127-F132 HydrophobicContact CD1-CD2 3.51Å; F127-F132 AromaticContact CD1-CE1 3.43Å; F127-F132 HydrophobicContact CD1-CE1 3.43Å; F127-F132 VanDerWaalsContact CD1-CE1 3.43Å; F127-F132 AromaticContact CD1-CE2 3.5Å; F127-F132 HydrophobicContact CD1-CE2 3.5Å; F127-F132 VanDerWaalsContact CD1-CE2 3.5Å; F127-F132 AromaticContact CD1-CG 3.47Å; F127-F132 HydrophobicContact CD1-CG 3.47Å; F127-F132 VanDerWaalsContact CD1-CG 3.47Å; F127-F132 AromaticContact CD1-CZ 3.44Å; F127-F132 HydrophobicContact CD1-CZ 3.44Å; F127-F132 VanDerWaalsContact CD1-CZ 3.44Å; F127-F132 HydrophobicContact CE1-CB 4.29Å; F127-F132 AromaticContact CE1-CD1 3.64Å; F127-F132 HydrophobicContact CE1-CD1 3.64Å; F127-F132 HydrophobicContact CE1-CD2 4.29Å; F127-F132 AromaticContact CE1-CE1 3.95Å; F127-F132 HydrophobicContact CE1-CE1 3.95Å; F127-F132 AromaticContact CE1-CG 3.8Å; F127-F132 HydrophobicContact CE1-CG 3.8Å; F127-F132 HydrophobicContact CE1-CZ 4.4Å; F127-F132 VanDerWaalsContact CE1-N 3.29Å; F127-F132 HydrophobicContact CG-CD2 4.45Å; F127-F132 HydrophobicContact CG-CE1 4.13Å; F127-F132 HydrophobicContact CG-CE2 4.05Å; F127-F132 AromaticContact CG-CZ 3.86Å; F127-F132 HydrophobicContact CG-CZ 3.86Å; F127-F132 WeakPolarHBondContact O-CE2 2.71Å; S128-F132 VanDerWaalsContact O-CD2 3.26Å; S128-F132 WeakPolarHBondContact O-CD2 3.47Å; S128-F132 PolarHBondContact O-N 3.33Å; S128-F132 VanDerWaalsContact O-N 3.1Å; S129-F132 PolarHBondContact O-N 2.84Å; E130-F132 VanDerWaalsContact C-N 3.29Å; E130-F132 PolarHBondContact O-N 3.14Å; F132-I134 VanDerWaalsContact C-N 3.33Å; F132-I134 PolarHBondContact O-N 3.39Å; F132-I135 PolarHBondContact O-N 3.09Å; F132-C136 VanDerWaalsContact O-CB 3.3Å; F132-C136 WeakPolarHBondContact O-CB 3.32Å; F132-C136 PolarHBondContact O-N 3.26Å; F132-C136 PolarHBondContact O-SG 3.36Å; F132-I170 HydrophobicContact CZ-CG2 4.4Å; F132-N176 HydrophobicContact CB-CB 4.26Å; F132-N176 HydrophobicContact CD1-CB 4.23Å; F132-N176 HydrophobicContact CD2-CB 3.59Å; F132-N176 HydrophobicContact CE2-CB 3.92Å; F132-N176 HydrophobicContact CG-CB 3.78Å; F132-N176 HydrophobicContact CZ-CB 4.39Å; F132-I177 HydrophobicContact CE1-CG1 3.6Å; F132-I177 HydrophobicContact CZ-CD1 4.19Å; F132-I177 HydrophobicContact CZ-CG1 3.46Å; F132-I177 VanDerWaalsContact CZ-CG1 3.46Å; F132-L180 HydrophobicContact CD1-CB 4.07Å; F132-L180 HydrophobicContact CD1-CD2 3.96Å; F132-L180 HydrophobicContact CE1-CB 4.27Å; F132-L180 HydrophobicContact CE1-CD2 3.76Å |
| 133 | E | 91 | Very high | 85.7 | Confident | 82 Ų | 82 | 45.7 Ų | 45.7 | 38% | 0.383 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.2 | -41.4 | 180 | -166.3 | 178.1 | -179.6 | 0 | 0 | 111.5 | I84 K88 S129 E130 S137 | I84-E133 HydrophobicContact CD1-CB 4.35Å; I84-E133 HydrophobicContact CD1-CG 3.92Å; I84-E133 HydrophobicContact CG1-CG 4.09Å; I84-E133 HydrophobicContact CG2-CG 4.4Å; I84-E133 VanDerWaalsContact CG2-OE1 3.3Å; I84-E133 WeakPolarHBondContact CG2-OE1 2.96Å; K88-E133 IonicContact NZ-OE1 2.71Å; K88-E133 PolarHBondContact NZ-OE1 3.44Å; S129-E133 PolarHBondContact O-N 3.11Å; E130-E133 PolarHBondContact O-N 3.29Å; E133-S137 VanDerWaalsContact O-CB 3.27Å; E133-S137 WeakPolarHBondContact O-CB 3.44Å; E133-S137 PolarHBondContact O-N 3.36Å; E133-S137 PolarHBondContact O-OG 3.2Å |
| 134 | I | 93.7 | Very high | 86.9 | Confident | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62 | -54.1 | 177.7 | -65.9 | 159.6 | 0 | 0 | 0 | 110.7 | K80 I84 E114 E130 S131 F132 C136 S137 I138 | K80-I134 HydrophobicContact CB-CD1 3.88Å; K80-I134 HydrophobicContact CB-CG1 4.22Å; K80-I134 HydrophobicContact CD-CD1 3.65Å; K80-I134 HydrophobicContact CG-CD1 3.59Å; K80-I134 HydrophobicContact CG-CG1 4.38Å; I84-I134 HydrophobicContact CD1-CG1 4.23Å; E114-I134 HydrophobicContact CB-CG2 4.2Å; E130-I134 HydrophobicContact CG-CD1 3.95Å; E130-I134 WeakPolarHBondContact O-CD1 3.34Å; E130-I134 VanDerWaalsContact O-CG1 3.28Å; E130-I134 WeakPolarHBondContact O-CG1 3.43Å; E130-I134 PolarHBondContact O-N 3.33Å; S131-I134 PolarHBondContact O-N 3.17Å; F132-I134 VanDerWaalsContact C-N 3.33Å; F132-I134 PolarHBondContact O-N 3.39Å; I134-C136 PolarHBondContact O-N 2.79Å; I134-S137 WeakPolarHBondContact O-CB 3.48Å; I134-S137 PolarHBondContact O-N 3.45Å; I134-S137 VanDerWaalsContact O-N 3.1Å; I134-I138 HydrophobicContact CG2-CD1 3.94Å; I134-I138 HydrophobicContact CG2-CG1 4.43Å; I134-I138 WeakPolarHBondContact O-CG1 3.3Å; I134-I138 PolarHBondContact O-N 2.96Å |
| 135 | I | 94.9 | Very high | 88.5 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.9 | -41.3 | -176.4 | -64.4 | -56.6 | 0 | 0 | 0 | 111.5 | I115 H118 F127 S131 F132 S137 I138 I139 Y167 L180 | I115-I135 HydrophobicContact CG1-CD1 4.49Å; H118-I135 HydrophobicContact CB-CD1 4.11Å; H118-I135 HydrophobicContact CB-CG1 4.25Å; F127-I135 HydrophobicContact CZ-CG1 3.99Å; S131-I135 WeakPolarHBondContact O-CG1 3.41Å; S131-I135 PolarHBondContact O-N 2.87Å; F132-I135 PolarHBondContact O-N 3.09Å; I135-S137 VanDerWaalsContact C-N 3.28Å; I135-S137 PolarHBondContact O-N 2.91Å; I135-I138 HydrophobicContact CD1-CD1 4.19Å; I135-I138 PolarHBondContact O-N 3.01Å; I135-I139 HydrophobicContact CG2-CD1 3.88Å; I135-I139 HydrophobicContact CG2-CG1 4.45Å; I135-I139 WeakPolarHBondContact O-CB 3.49Å; I135-I139 WeakPolarHBondContact O-CD1 3.38Å; I135-I139 VanDerWaalsContact O-CG1 3.25Å; I135-I139 WeakPolarHBondContact O-CG1 3.14Å; I135-I139 PolarHBondContact O-N 3.33Å; I135-Y167 HydrophobicContact CB-CE1 4.42Å; I135-Y167 HydrophobicContact CD1-CE1 3.94Å; I135-Y167 WeakPolarHBondContact CD1-OH 3.41Å; I135-Y167 HydrophobicContact CG1-CD1 4.33Å; I135-Y167 HydrophobicContact CG1-CE1 3.65Å; I135-Y167 HydrophobicContact CG2-CD1 3.96Å; I135-Y167 HydrophobicContact CG2-CE1 4.05Å; I135-Y167 HydrophobicContact CG2-CG 4.38Å; I135-L180 HydrophobicContact CB-CD1 4.45Å; I135-L180 HydrophobicContact CG2-CD1 3.76Å |
| 136 | C | 93.9 | Very high | 89.7 | Confident | 29 Ų | 29 | 28.7 Ų | 28.7 | 20% | 0.196 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60 | -38.9 | 173 | -71.2 | 0 | 0 | 0 | 0 | 112 | F132 I134 I139 G140 | F132-C136 VanDerWaalsContact O-CB 3.3Å; F132-C136 WeakPolarHBondContact O-CB 3.32Å; F132-C136 PolarHBondContact O-N 3.26Å; F132-C136 PolarHBondContact O-SG 3.36Å; I134-C136 PolarHBondContact O-N 2.79Å; C136-I139 WeakPolarHBondContact O-CB 3.31Å; C136-I139 PolarHBondContact O-N 3.09Å; C136-G140 PolarHBondContact O-N 3.35Å |
| 137 | S | 93.5 | Very high | 90.7 | Very high | 11 Ų | 11 | 27 Ų | 27 | 8% | 0.077 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -65.9 | -41.7 | 176 | -60.9 | 0 | 0 | 0 | 0 | 112.1 | E133 I134 I135 I139 G140 I141 | E133-S137 VanDerWaalsContact O-CB 3.27Å; E133-S137 WeakPolarHBondContact O-CB 3.44Å; E133-S137 PolarHBondContact O-N 3.36Å; E133-S137 PolarHBondContact O-OG 3.2Å; I134-S137 WeakPolarHBondContact O-CB 3.48Å; I134-S137 PolarHBondContact O-N 3.45Å; I134-S137 VanDerWaalsContact O-N 3.1Å; I135-S137 VanDerWaalsContact C-N 3.28Å; I135-S137 PolarHBondContact O-N 2.91Å; S137-I139 VanDerWaalsContact C-N 3.33Å; S137-I139 PolarHBondContact O-N 3.47Å; S137-G140 PolarHBondContact O-N 3.31Å; S137-I141 WeakPolarHBondContact O-CG1 3.39Å; S137-I141 PolarHBondContact O-N 3.45Å |
| 138 | I | 95.9 | Very high | 91.1 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.8 | -42.2 | 174.8 | -64 | 174.9 | 0 | 0 | 0 | 110.6 | I83 L111 E114 I115 I134 I135 G140 I141 F142 | I83-I138 HydrophobicContact CD1-CD1 4.46Å; I83-I138 HydrophobicContact CD1-CG1 4.48Å; I83-I138 HydrophobicContact CG2-CG1 3.76Å; L111-I138 HydrophobicContact CB-CG2 4.48Å; L111-I138 HydrophobicContact CD2-CG1 4Å; E114-I138 HydrophobicContact CB-CD1 3.79Å; I115-I138 HydrophobicContact CD1-CG2 3.87Å; I115-I138 HydrophobicContact CG1-CD1 3.96Å; I115-I138 HydrophobicContact CG1-CG2 4.02Å; I134-I138 HydrophobicContact CG2-CD1 3.94Å; I134-I138 HydrophobicContact CG2-CG1 4.43Å; I134-I138 WeakPolarHBondContact O-CG1 3.3Å; I134-I138 PolarHBondContact O-N 2.96Å; I135-I138 HydrophobicContact CD1-CD1 4.19Å; I135-I138 PolarHBondContact O-N 3.01Å; I138-G140 VanDerWaalsContact C-N 3.34Å; I138-G140 PolarHBondContact O-N 3.38Å; I138-I141 WeakPolarHBondContact O-CB 3.47Å; I138-I141 PolarHBondContact O-N 3.34Å; I138-F142 HydrophobicContact CG2-CD1 4.24Å; I138-F142 HydrophobicContact CG2-CD2 4.46Å; I138-F142 HydrophobicContact CG2-CE1 3.97Å; I138-F142 HydrophobicContact CG2-CE2 4.2Å; I138-F142 HydrophobicContact CG2-CG 4.49Å; I138-F142 HydrophobicContact CG2-CZ 3.95Å; I138-F142 WeakPolarHBondContact O-CG 3.41Å; I138-F142 PolarHBondContact O-N 3.35Å |
| 139 | I | 95.8 | Very high | 91.1 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.3 | -45.5 | 175.1 | -71.8 | 163.1 | 0 | 0 | 0 | 110.8 | I135 C136 S137 I141 F142 Q143 L164 L180 S183 L184 L187 | I135-I139 HydrophobicContact CG2-CD1 3.88Å; I135-I139 HydrophobicContact CG2-CG1 4.45Å; I135-I139 WeakPolarHBondContact O-CB 3.49Å; I135-I139 WeakPolarHBondContact O-CD1 3.38Å; I135-I139 VanDerWaalsContact O-CG1 3.25Å; I135-I139 WeakPolarHBondContact O-CG1 3.14Å; I135-I139 PolarHBondContact O-N 3.33Å; C136-I139 WeakPolarHBondContact O-CB 3.31Å; C136-I139 PolarHBondContact O-N 3.09Å; S137-I139 VanDerWaalsContact C-N 3.33Å; S137-I139 PolarHBondContact O-N 3.47Å; I139-I141 VanDerWaalsContact C-N 3.35Å; I139-I141 PolarHBondContact O-N 3.33Å; I139-F142 PolarHBondContact O-N 3Å; I139-Q143 WeakPolarHBondContact O-CG 3.4Å; I139-Q143 PolarHBondContact O-N 3.4Å; I139-L164 HydrophobicContact CG1-CD1 4.11Å; I139-L164 HydrophobicContact CG1-CD2 4.48Å; I139-L180 HydrophobicContact CD1-CD1 3.91Å; I139-S183 VanDerWaalsContact CG2-O 3.27Å; I139-S183 WeakPolarHBondContact CG2-O 3.46Å; I139-L184 HydrophobicContact CD1-CD2 3.52Å; I139-L184 HydrophobicContact CD1-CG 3.74Å; I139-L184 HydrophobicContact CG1-CD2 4.19Å; I139-L187 HydrophobicContact CG1-CD2 4.43Å; I139-L187 HydrophobicContact CG2-CB 3.87Å; I139-L187 HydrophobicContact CG2-CD2 4.14Å; I139-L187 HydrophobicContact CG2-CG 4.5Å |
| 140 | G | 92.7 | Very high | 91 | Very high | 13 Ų | 13 | 32.4 Ų | 32.4 | 13% | 0.134 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59.7 | -43.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | C136 S137 I138 Q143 Q144 | C136-G140 PolarHBondContact O-N 3.35Å; S137-G140 PolarHBondContact O-N 3.31Å; I138-G140 VanDerWaalsContact C-N 3.34Å; I138-G140 PolarHBondContact O-N 3.38Å; G140-Q143 WeakPolarHBondContact O-CB 3.37Å; G140-Q143 PolarHBondContact O-N 3.21Å; G140-Q144 PolarHBondContact O-N 3.49Å; G140-Q144 VanDerWaalsContact O-N 3.13Å |
| 141 | I | 92.7 | Very high | 90.9 | Very high | 1 Ų | 1 | 29.9 Ų | 29.9 | 1% | 0.005 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60.5 | -47.4 | 174.1 | -72.1 | 165.8 | 0 | 0 | 0 | 111.3 | I83 I86 C87 I90 I101 L111 S137 I138 I139 Q143 Q144 I145 | I83-I141 HydrophobicContact CG2-CD1 4.11Å; I86-I141 HydrophobicContact CB-CD1 4.41Å; I86-I141 HydrophobicContact CG2-CD1 4Å; I86-I141 HydrophobicContact CG2-CG1 4.18Å; C87-I141 HydrophobicContact CB-CG1 4.36Å; I90-I141 HydrophobicContact CD1-CG1 3.88Å; I101-I141 HydrophobicContact CD1-CB 4.4Å; I101-I141 HydrophobicContact CD1-CG1 4.17Å; I101-I141 HydrophobicContact CD1-CG2 3.51Å; I101-I141 HydrophobicContact CG2-CG2 3.93Å; L111-I141 HydrophobicContact CD1-CG2 3.88Å; L111-I141 HydrophobicContact CD2-CD1 4.12Å; S137-I141 WeakPolarHBondContact O-CG1 3.39Å; S137-I141 PolarHBondContact O-N 3.45Å; I138-I141 WeakPolarHBondContact O-CB 3.47Å; I138-I141 PolarHBondContact O-N 3.34Å; I139-I141 VanDerWaalsContact C-N 3.35Å; I139-I141 PolarHBondContact O-N 3.33Å; I141-Q143 VanDerWaalsContact C-N 3.31Å; I141-Q143 PolarHBondContact O-N 3.35Å; I141-Q144 PolarHBondContact O-N 3.24Å; I141-Q144 VanDerWaalsContact O-N 3.11Å; I141-I145 HydrophobicContact CG2-CD1 4.16Å; I141-I145 WeakPolarHBondContact O-CG1 3.48Å; I141-I145 PolarHBondContact O-N 3.3Å |
| 142 | F | 94.5 | Very high | 90.9 | Very high | 1 Ų | 1 | 30.6 Ų | 30.6 | 0% | 0.004 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.8 | -40.1 | 178.6 | -76.7 | 6.2 | 0 | 0 | 0 | 111.8 | L111 I115 I138 I139 Q144 I145 I146 F155 L160 L161 L164 L187 | L111-F142 HydrophobicContact CB-CE1 4.38Å; L111-F142 HydrophobicContact CD1-CD1 4.5Å; L111-F142 HydrophobicContact CD1-CE1 3.91Å; I115-F142 HydrophobicContact CD1-CE2 3.83Å; I115-F142 HydrophobicContact CD1-CZ 3.79Å; I138-F142 HydrophobicContact CG2-CD1 4.24Å; I138-F142 HydrophobicContact CG2-CD2 4.46Å; I138-F142 HydrophobicContact CG2-CE1 3.97Å; I138-F142 HydrophobicContact CG2-CE2 4.2Å; I138-F142 HydrophobicContact CG2-CG 4.49Å; I138-F142 HydrophobicContact CG2-CZ 3.95Å; I138-F142 WeakPolarHBondContact O-CG 3.41Å; I138-F142 PolarHBondContact O-N 3.35Å; I139-F142 PolarHBondContact O-N 3Å; F142-Q144 VanDerWaalsContact C-N 3.29Å; F142-Q144 PolarHBondContact O-N 2.92Å; F142-I145 HydrophobicContact CD1-CD1 4.24Å; F142-I145 PolarHBondContact O-N 2.88Å; F142-I146 WeakPolarHBondContact O-CD1 3.28Å; F142-I146 WeakPolarHBondContact O-CG1 3.36Å; F142-I146 PolarHBondContact O-N 3.49Å; F142-F155 HydrophobicContact CB-CE1 4.17Å; F142-F155 HydrophobicContact CB-CZ 4.01Å; F142-F155 HydrophobicContact CD1-CE2 4.15Å; F142-F155 AromaticContact CD1-CZ 3.57Å; F142-F155 HydrophobicContact CD1-CZ 3.57Å; F142-F155 HydrophobicContact CD2-CE1 4.44Å; F142-F155 AromaticContact CD2-CZ 3.76Å; F142-F155 HydrophobicContact CD2-CZ 3.76Å; F142-F155 HydrophobicContact CE1-CE2 4.1Å; F142-F155 AromaticContact CE1-CZ 3.85Å; F142-F155 HydrophobicContact CE1-CZ 3.85Å; F142-F155 HydrophobicContact CE2-CZ 4.04Å; F142-F155 HydrophobicContact CG-CE1 4.16Å; F142-F155 AromaticContact CG-CZ 3.52Å; F142-F155 HydrophobicContact CG-CZ 3.52Å; F142-F155 HydrophobicContact CZ-CE2 4.41Å; F142-F155 HydrophobicContact CZ-CZ 4.08Å; F142-L160 HydrophobicContact CE2-CB 4.42Å; F142-L160 HydrophobicContact CZ-CB 4.46Å; F142-L161 HydrophobicContact CD2-CD2 3.84Å; F142-L164 HydrophobicContact CD2-CD1 3.65Å; F142-L164 HydrophobicContact CE2-CD1 3.91Å; F142-L187 HydrophobicContact CB-CD1 3.92Å |
| 143 | Q | 92.2 | Very high | 90.8 | Very high | 31 Ų | 31 | 32.4 Ų | 32.4 | 15% | 0.145 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -56.2 | -44.3 | 173.1 | -74.8 | 173.6 | 14.7 | 0 | 0 | 111.2 | I139 G140 I141 I146 L147 S183 S186 L187 | I139-Q143 WeakPolarHBondContact O-CG 3.4Å; I139-Q143 PolarHBondContact O-N 3.4Å; G140-Q143 WeakPolarHBondContact O-CB 3.37Å; G140-Q143 PolarHBondContact O-N 3.21Å; I141-Q143 VanDerWaalsContact C-N 3.31Å; I141-Q143 PolarHBondContact O-N 3.35Å; Q143-I146 PolarHBondContact O-N 2.96Å; Q143-L147 VanDerWaalsContact O-CG 3.28Å; Q143-L147 WeakPolarHBondContact O-CG 3.37Å; Q143-L147 PolarHBondContact O-N 2.61Å; Q143-S183 PolarHBondContact NE2-O 3.48Å; Q143-S183 VanDerWaalsContact NE2-O 3.12Å; Q143-S186 PolarHBondContact NE2-OG 3.49Å; Q143-L187 HydrophobicContact CB-CD1 4.44Å; Q143-L187 HydrophobicContact CG-CB 3.97Å; Q143-L187 HydrophobicContact CG-CD1 3.6Å; Q143-L187 HydrophobicContact CG-CG 4.4Å |
| 144 | Q | 90.1 | Very high | 90.6 | Very high | 61 Ų | 61 | 32.3 Ų | 32.3 | 29% | 0.285 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -65.9 | -38.7 | 177.9 | -66.2 | -54.5 | -31.1 | 0 | 0 | 113.7 | I90 G140 I141 F142 I146 L147 N148 | I90-Q144 HydrophobicContact CB-CG 4.27Å; I90-Q144 HydrophobicContact CD1-CB 4.41Å; I90-Q144 HydrophobicContact CD1-CG 3.69Å; I90-Q144 HydrophobicContact CG1-CG 4.01Å; I90-Q144 HydrophobicContact CG2-CG 3.3Å; G140-Q144 PolarHBondContact O-N 3.49Å; G140-Q144 VanDerWaalsContact O-N 3.13Å; I141-Q144 PolarHBondContact O-N 3.24Å; I141-Q144 VanDerWaalsContact O-N 3.11Å; F142-Q144 VanDerWaalsContact C-N 3.29Å; F142-Q144 PolarHBondContact O-N 2.92Å; Q144-I146 VanDerWaalsContact C-N 3.29Å; Q144-I146 PolarHBondContact O-N 3.43Å; Q144-L147 PolarHBondContact O-N 2.66Å; Q144-N148 PolarHBondContact O-N 3.06Å |
| 145 | I | 91 | Very high | 90.4 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.8 | -42.3 | 174.4 | -61.2 | 168.3 | 0 | 0 | 0 | 110.2 | I101 Y102 I108 I141 F142 N148 F155 | I101-I145 HydrophobicContact CG2-CD1 3.83Å; I101-I145 HydrophobicContact CG2-CG1 4.43Å; Y102-I145 HydrophobicContact CD2-CG2 4.08Å; Y102-I145 HydrophobicContact CG-CG2 4.19Å; I108-I145 HydrophobicContact CD1-CD1 4.01Å; I141-I145 HydrophobicContact CG2-CD1 4.16Å; I141-I145 WeakPolarHBondContact O-CG1 3.48Å; I141-I145 PolarHBondContact O-N 3.3Å; F142-I145 HydrophobicContact CD1-CD1 4.24Å; F142-I145 PolarHBondContact O-N 2.88Å; I145-N148 WeakPolarHBondContact O-CB 3.5Å; I145-N148 PolarHBondContact O-N 3.41Å; I145-F155 HydrophobicContact CB-CD1 4.39Å; I145-F155 HydrophobicContact CB-CG 4.45Å; I145-F155 HydrophobicContact CD1-CD2 4.38Å; I145-F155 HydrophobicContact CD1-CE2 4.1Å; I145-F155 HydrophobicContact CD1-CZ 4.4Å; I145-F155 HydrophobicContact CG2-CB 3.77Å; I145-F155 HydrophobicContact CG2-CD1 3.89Å; I145-F155 HydrophobicContact CG2-CD2 3.9Å; I145-F155 HydrophobicContact CG2-CE1 4.49Å; I145-F155 HydrophobicContact CG2-CG 3.56Å |
| 146 | I | 90.2 | Very high | 90.1 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -68.5 | -36.5 | 178.2 | -66.2 | 156 | 0 | 0 | 0 | 111.6 | F142 Q143 Q144 N148 R152 F155 L161 L187 T190 V191 | F142-I146 WeakPolarHBondContact O-CD1 3.28Å; F142-I146 WeakPolarHBondContact O-CG1 3.36Å; F142-I146 PolarHBondContact O-N 3.49Å; Q143-I146 PolarHBondContact O-N 2.96Å; Q144-I146 VanDerWaalsContact C-N 3.29Å; Q144-I146 PolarHBondContact O-N 3.43Å; I146-N148 PolarHBondContact O-N 2.94Å; I146-R152 HydrophobicContact CG2-CG 4.37Å; I146-R152 VanDerWaalsContact O-CZ 3.3Å; I146-R152 PolarHBondContact O-NE 3.45Å; I146-R152 PolarHBondContact O-NH2 3.41Å; I146-F155 HydrophobicContact CD1-CD1 4.45Å; I146-F155 HydrophobicContact CD1-CE1 4.14Å; I146-F155 HydrophobicContact CG1-CD1 3.83Å; I146-F155 HydrophobicContact CG1-CE1 3.98Å; I146-L161 HydrophobicContact CD1-CD1 4.31Å; I146-L161 HydrophobicContact CD1-CD2 4.31Å; I146-L187 HydrophobicContact CD1-CD1 3.48Å; I146-L187 VanDerWaalsContact CD1-CD1 3.48Å; I146-T190 HydrophobicContact CG2-CG2 4.07Å; I146-V191 HydrophobicContact CD1-CG2 3.47Å; I146-V191 VanDerWaalsContact CD1-CG2 3.47Å; I146-V191 HydrophobicContact CG1-CG2 4.4Å; I146-V191 HydrophobicContact CG2-CG2 4.44Å |
| 147 | L | 89.5 | Confident | 89.6 | Confident | 72 Ų | 72 | 41.4 Ų | 41.4 | 38% | 0.377 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -64.6 | -27.3 | 176.6 | -72.1 | 173.7 | 0 | 0 | 0 | 111.8 | Q143 Q144 N149 R152 T190 | Q143-L147 VanDerWaalsContact O-CG 3.28Å; Q143-L147 WeakPolarHBondContact O-CG 3.37Å; Q143-L147 PolarHBondContact O-N 2.61Å; Q144-L147 PolarHBondContact O-N 2.66Å; L147-N149 PolarHBondContact O-N 3.34Å; L147-R152 PolarHBondContact O-NH2 3.14Å; L147-T190 HydrophobicContact CD2-CG2 3.73Å; L147-T190 HydrophobicContact CG-CG2 4.02Å |
| 148 | N | 85.8 | Confident | 89.4 | Confident | 21 Ų | 21 | 44 Ų | 44 | 11% | 0.112 | 22% | 0.215 | C | C | . | . | S | Bend | trans | -73.5 | 119.5 | 171.8 | -168.9 | -33.5 | 0 | 0 | 0 | 112.4 | D96 Y99 Q144 I145 I146 K150 R152 | D96-N148 PolarHBondContact OD1-ND2 3.37Å; D96-N148 PolarHBondContact OD2-ND2 2.83Å; Y99-N148 WeakPolarHBondContact CB-ND2 3.18Å; Y99-N148 PolarHBondContact N-ND2 3.12Å; Q144-N148 PolarHBondContact O-N 3.06Å; I145-N148 WeakPolarHBondContact O-CB 3.5Å; I145-N148 PolarHBondContact O-N 3.41Å; I146-N148 PolarHBondContact O-N 2.94Å; N148-K150 VanDerWaalsContact C-N 3.27Å; N148-K150 PolarHBondContact O-N 3.27Å; N148-K150 WeakPolarHBondContact OD1-CB 3.44Å; N148-K150 PolarHBondContact OD1-N 3.27Å; N148-R152 WeakPolarHBondContact O-CB 3.16Å; N148-R152 PolarHBondContact O-N 2.88Å |
| 149 | N | 83.6 | Confident | 88.9 | Confident | 125 Ų | 125 | 45.2 Ų | 45.2 | 67% | 0.668 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -28.2 | -179.3 | -69.1 | -13.1 | 0 | 0 | 0 | 114.2 | L147 R152 | L147-N149 PolarHBondContact O-N 3.34Å; N149-R152 VanDerWaalsContact OD1-CZ 3.23Å; N149-R152 PolarHBondContact OD1-NH1 2.81Å; N149-R152 PolarHBondContact OD1-NH2 3.28Å |
| 150 | K | 84.9 | Confident | 88.6 | Confident | 128 Ų | 128 | 45.9 Ų | 45.9 | 56% | 0.557 | 23% | 0.231 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -35.7 | -169.6 | -174.9 | 170.9 | 175.7 | 177.8 | 0 | 113.3 | Y99 N148 | Y99-K150 HydrophobicContact CD2-CD 3.93Å; Y99-K150 HydrophobicContact CE2-CD 3.73Å; Y99-K150 VanDerWaalsContact CE2-NZ 3.31Å; N148-K150 VanDerWaalsContact C-N 3.27Å; N148-K150 PolarHBondContact O-N 3.27Å; N148-K150 WeakPolarHBondContact OD1-CB 3.44Å; N148-K150 PolarHBondContact OD1-N 3.27Å |
| 151 | F | 84.4 | Confident | 88.6 | Confident | 33 Ų | 33 | 45.3 Ų | 45.3 | 15% | 0.145 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -120.7 | -0.9 | -173.8 | -63.2 | -53.9 | 0 | 0 | 0 | 114.1 | Y99 Y102 C153 D154 F155 | Y99-F151 AromaticContact CD2-CD2 3.87Å; Y99-F151 HydrophobicContact CD2-CD2 3.87Å; Y99-F151 AromaticContact CD2-CE2 3.08Å; Y99-F151 HydrophobicContact CD2-CE2 3.08Å; Y99-F151 AromaticContact CD2-CZ 3.79Å; Y99-F151 HydrophobicContact CD2-CZ 3.79Å; Y99-F151 HydrophobicContact CE2-CD2 4.38Å; Y99-F151 AromaticContact CE2-CE2 3.26Å; Y99-F151 HydrophobicContact CE2-CE2 3.26Å; Y99-F151 AromaticContact CE2-CZ 3.43Å; Y99-F151 HydrophobicContact CE2-CZ 3.43Å; Y99-F151 VanDerWaalsContact CE2-CZ 3.43Å; Y99-F151 AromaticContact CG-CE2 3.97Å; Y99-F151 HydrophobicContact CG-CE2 3.97Å; Y102-F151 HydrophobicContact CD1-CB 3.42Å; Y102-F151 VanDerWaalsContact CD1-CB 3.42Å; Y102-F151 AromaticContact CD1-CD1 3.6Å; Y102-F151 HydrophobicContact CD1-CD1 3.6Å; Y102-F151 AromaticContact CD1-CD2 3.57Å; Y102-F151 HydrophobicContact CD1-CD2 3.57Å; Y102-F151 HydrophobicContact CD1-CE1 4.15Å; Y102-F151 HydrophobicContact CD1-CE2 4.06Å; Y102-F151 AromaticContact CD1-CG 3.27Å; Y102-F151 HydrophobicContact CD1-CG 3.27Å; Y102-F151 HydrophobicContact CD1-CZ 4.36Å; Y102-F151 HydrophobicContact CE1-CB 3.72Å; Y102-F151 AromaticContact CE1-CD1 3.67Å; Y102-F151 HydrophobicContact CE1-CD1 3.67Å; Y102-F151 HydrophobicContact CE1-CD2 4.45Å; Y102-F151 HydrophobicContact CE1-CE1 4.34Å; Y102-F151 AromaticContact CE1-CG 3.74Å; Y102-F151 HydrophobicContact CE1-CG 3.74Å; Y102-F151 HydrophobicContact CG-CB 4.03Å; Y102-F151 HydrophobicContact CG-CD2 4.23Å; Y102-F151 HydrophobicContact CG-CG 4.18Å; F151-C153 PolarHBondContact O-N 3.2Å; F151-D154 PolarHBondContact O-N 2.86Å; F151-F155 WeakPolarHBondContact O-CB 3.26Å; F151-F155 PolarHBondContact O-N 3.3Å |
| 152 | R | 88.9 | Confident | 88.4 | Confident | 27 Ų | 27 | 46.2 Ų | 46.2 | 10% | 0.102 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -45.1 | -58.5 | -179.7 | 173.7 | -178.1 | -57.1 | 126.5 | 11 | 112.7 | I146 L147 N148 N149 D154 F155 I156 L195 | I146-R152 HydrophobicContact CG2-CG 4.37Å; I146-R152 VanDerWaalsContact O-CZ 3.3Å; I146-R152 PolarHBondContact O-NE 3.45Å; I146-R152 PolarHBondContact O-NH2 3.41Å; L147-R152 PolarHBondContact O-NH2 3.14Å; N148-R152 WeakPolarHBondContact O-CB 3.16Å; N148-R152 PolarHBondContact O-N 2.88Å; N149-R152 VanDerWaalsContact OD1-CZ 3.23Å; N149-R152 PolarHBondContact OD1-NH1 2.81Å; N149-R152 PolarHBondContact OD1-NH2 3.28Å; R152-D154 PolarHBondContact O-N 3.26Å; R152-F155 PolarHBondContact O-N 3.41Å; R152-I156 HydrophobicContact CG-CD1 3.73Å; R152-I156 WeakPolarHBondContact O-CD1 3.35Å; R152-I156 WeakPolarHBondContact O-CG1 3.45Å; R152-I156 PolarHBondContact O-N 3.27Å; R152-L195 HydrophobicContact CG-CD2 4.19Å |
| 153 | C | 87.1 | Confident | 88.2 | Confident | 45 Ų | 45 | 51.3 Ų | 51.3 | 30% | 0.304 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -68 | -37.9 | -173.9 | -56.9 | 0 | 0 | 0 | 0 | 111.4 | F151 R157 E199 | F151-C153 PolarHBondContact O-N 3.2Å; C153-R157 WeakPolarHBondContact O-CB 3.41Å; C153-R157 WeakPolarHBondContact O-CD 3.48Å; C153-R157 WeakPolarHBondContact O-CG 3.29Å; C153-R157 PolarHBondContact O-N 3.25Å; C153-E199 PolarHBondContact SG-OE1 3.22Å; C153-E199 VanDerWaalsContact SG-OE1 3.36Å |
| 154 | D | 87.4 | Confident | 88.3 | Confident | 80 Ų | 80 | 49.9 Ų | 49.9 | 43% | 0.428 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -64.8 | -46 | 176.8 | -63.5 | -29 | 0 | 0 | 0 | 111.1 | Y102 F151 R152 I156 R157 T158 | Y102-D154 HydrophobicContact CE1-CB 4.22Å; Y102-D154 WeakPolarHBondContact OH-CB 3.41Å; F151-D154 PolarHBondContact O-N 2.86Å; R152-D154 PolarHBondContact O-N 3.26Å; D154-I156 PolarHBondContact O-N 2.82Å; D154-R157 PolarHBondContact O-N 2.97Å; D154-T158 WeakPolarHBondContact O-CG2 3.49Å; D154-T158 PolarHBondContact O-N 2.73Å |
| 155 | F | 89.9 | Confident | 88.4 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.4 | -45.3 | 177.9 | 177.6 | -109.1 | 0 | 0 | 0 | 111.6 | Y102 F142 I145 I146 F151 R152 R157 T158 L160 L161 | Y102-F155 HydrophobicContact CD2-CB 4.08Å; Y102-F155 AromaticContact CD2-CD2 3.71Å; Y102-F155 HydrophobicContact CD2-CD2 3.71Å; Y102-F155 HydrophobicContact CD2-CG 4.3Å; Y102-F155 HydrophobicContact CE2-CB 3.74Å; Y102-F155 AromaticContact CE2-CD2 3.66Å; Y102-F155 HydrophobicContact CE2-CD2 3.66Å; Y102-F155 HydrophobicContact CE2-CG 4.19Å; Y102-F155 PolarHBondContact OH-N 3.42Å; F142-F155 HydrophobicContact CB-CE1 4.17Å; F142-F155 HydrophobicContact CB-CZ 4.01Å; F142-F155 HydrophobicContact CD1-CE2 4.15Å; F142-F155 AromaticContact CD1-CZ 3.57Å; F142-F155 HydrophobicContact CD1-CZ 3.57Å; F142-F155 HydrophobicContact CD2-CE1 4.44Å; F142-F155 AromaticContact CD2-CZ 3.76Å; F142-F155 HydrophobicContact CD2-CZ 3.76Å; F142-F155 HydrophobicContact CE1-CE2 4.1Å; F142-F155 AromaticContact CE1-CZ 3.85Å; F142-F155 HydrophobicContact CE1-CZ 3.85Å; F142-F155 HydrophobicContact CE2-CZ 4.04Å; F142-F155 HydrophobicContact CG-CE1 4.16Å; F142-F155 AromaticContact CG-CZ 3.52Å; F142-F155 HydrophobicContact CG-CZ 3.52Å; F142-F155 HydrophobicContact CZ-CE2 4.41Å; F142-F155 HydrophobicContact CZ-CZ 4.08Å; I145-F155 HydrophobicContact CB-CD1 4.39Å; I145-F155 HydrophobicContact CB-CG 4.45Å; I145-F155 HydrophobicContact CD1-CD2 4.38Å; I145-F155 HydrophobicContact CD1-CE2 4.1Å; I145-F155 HydrophobicContact CD1-CZ 4.4Å; I145-F155 HydrophobicContact CG2-CB 3.77Å; I145-F155 HydrophobicContact CG2-CD1 3.89Å; I145-F155 HydrophobicContact CG2-CD2 3.9Å; I145-F155 HydrophobicContact CG2-CE1 4.49Å; I145-F155 HydrophobicContact CG2-CG 3.56Å; I146-F155 HydrophobicContact CD1-CD1 4.45Å; I146-F155 HydrophobicContact CD1-CE1 4.14Å; I146-F155 HydrophobicContact CG1-CD1 3.83Å; I146-F155 HydrophobicContact CG1-CE1 3.98Å; F151-F155 WeakPolarHBondContact O-CB 3.26Å; F151-F155 PolarHBondContact O-N 3.3Å; R152-F155 PolarHBondContact O-N 3.41Å; F155-R157 VanDerWaalsContact C-N 3.32Å; F155-R157 PolarHBondContact O-N 2.72Å; F155-T158 WeakPolarHBondContact O-CB 3.5Å; F155-T158 WeakPolarHBondContact O-CG2 3.39Å; F155-T158 PolarHBondContact O-N 3.02Å; F155-T158 VanDerWaalsContact O-N 3.17Å; F155-T158 PolarHBondContact O-OG1 2.91Å; F155-L160 HydrophobicContact CD2-CD1 4.43Å; F155-L160 HydrophobicContact CE2-CD1 3.86Å; F155-L161 HydrophobicContact CE1-CD2 3.91Å; F155-L161 HydrophobicContact CE1-CG 4.3Å; F155-L161 HydrophobicContact CZ-CD2 4.31Å |
| 156 | I | 87.5 | Confident | 88.3 | Confident | 13 Ų | 13 | 47.2 Ų | 47.2 | 7% | 0.067 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.8 | -38.8 | 178.6 | -72.5 | 157.8 | 0 | 0 | 0 | 111.5 | R152 D154 T158 G159 L161 V191 L195 F203 | R152-I156 HydrophobicContact CG-CD1 3.73Å; R152-I156 WeakPolarHBondContact O-CD1 3.35Å; R152-I156 WeakPolarHBondContact O-CG1 3.45Å; R152-I156 PolarHBondContact O-N 3.27Å; D154-I156 PolarHBondContact O-N 2.82Å; I156-T158 PolarHBondContact O-N 3.37Å; I156-G159 PolarHBondContact O-N 3.29Å; I156-L161 HydrophobicContact CG1-CD1 4.12Å; I156-V191 HydrophobicContact CD1-CG1 4.35Å; I156-L195 HydrophobicContact CD1-CD1 3.68Å; I156-L195 HydrophobicContact CD1-CD2 3.68Å; I156-L195 HydrophobicContact CD1-CG 3.89Å; I156-L195 HydrophobicContact CG2-CD1 4.42Å; I156-F203 HydrophobicContact CG2-CB 4.3Å; I156-F203 HydrophobicContact CG2-CD2 3.5Å; I156-F203 HydrophobicContact CG2-CE2 4.17Å; I156-F203 HydrophobicContact CG2-CG 4.15Å |
| 157 | R | 85.3 | Confident | 88.4 | Confident | 208 Ų | 208 | 47.2 Ų | 47.2 | 79% | 0.785 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -65.2 | -15.1 | 177.6 | -75.1 | 172 | 179.5 | -156.5 | 0.3 | 114 | C153 D154 F155 G159 | C153-R157 WeakPolarHBondContact O-CB 3.41Å; C153-R157 WeakPolarHBondContact O-CD 3.48Å; C153-R157 WeakPolarHBondContact O-CG 3.29Å; C153-R157 PolarHBondContact O-N 3.25Å; D154-R157 PolarHBondContact O-N 2.97Å; F155-R157 VanDerWaalsContact C-N 3.32Å; F155-R157 PolarHBondContact O-N 2.72Å; R157-G159 PolarHBondContact O-N 3.08Å |
| 158 | T | 87.4 | Confident | 88.4 | Confident | 65 Ų | 65 | 43.8 Ų | 43.8 | 40% | 0.399 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69 | -18.8 | 175.6 | 67.6 | 0 | 0 | 0 | 0 | 113.6 | D154 F155 I156 L160 | D154-T158 WeakPolarHBondContact O-CG2 3.49Å; D154-T158 PolarHBondContact O-N 2.73Å; F155-T158 WeakPolarHBondContact O-CB 3.5Å; F155-T158 WeakPolarHBondContact O-CG2 3.39Å; F155-T158 PolarHBondContact O-N 3.02Å; F155-T158 VanDerWaalsContact O-N 3.17Å; F155-T158 PolarHBondContact O-OG1 2.91Å; I156-T158 PolarHBondContact O-N 3.37Å; T158-L160 PolarHBondContact O-N 2.88Å; T158-L160 WeakPolarHBondContact OG1-CB 3.44Å; T158-L160 WeakPolarHBondContact OG1-CD1 3.05Å; T158-L160 VanDerWaalsContact OG1-CG 3.22Å; T158-L160 WeakPolarHBondContact OG1-CG 3.39Å; T158-L160 PolarHBondContact OG1-N 3.13Å |
| 159 | G | 86.2 | Confident | 88.4 | Confident | 26 Ų | 26 | 44.8 Ų | 44.8 | 27% | 0.268 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 71.7 | 6.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | I156 R157 L161 T162 | I156-G159 PolarHBondContact O-N 3.29Å; R157-G159 PolarHBondContact O-N 3.08Å; G159-L161 PolarHBondContact O-N 2.87Å; G159-T162 WeakPolarHBondContact O-CB 3.39Å; G159-T162 PolarHBondContact O-N 3.16Å; G159-T162 PolarHBondContact O-OG1 3.33Å |
| 160 | L | 90.6 | Very high | 88.5 | Confident | 14 Ų | 14 | 39.7 Ų | 39.7 | 7% | 0.073 | 19% | 0.192 | C | C | . | . | G | 310 helix | trans | -59.8 | -31.5 | -179.9 | -74 | 172.3 | 0 | 0 | 0 | 113.1 | I108 L112 F142 F155 T158 T162 Y163 | I108-L160 HydrophobicContact CG2-CD1 3.52Å; L112-L160 HydrophobicContact CB-CD2 4.33Å; L112-L160 HydrophobicContact CD1-CD2 3.85Å; L112-L160 HydrophobicContact CD2-CD2 4.03Å; L112-L160 HydrophobicContact CG-CD2 4.29Å; F142-L160 HydrophobicContact CE2-CB 4.42Å; F142-L160 HydrophobicContact CZ-CB 4.46Å; F155-L160 HydrophobicContact CD2-CD1 4.43Å; F155-L160 HydrophobicContact CE2-CD1 3.86Å; T158-L160 PolarHBondContact O-N 2.88Å; T158-L160 WeakPolarHBondContact OG1-CB 3.44Å; T158-L160 WeakPolarHBondContact OG1-CD1 3.05Å; T158-L160 VanDerWaalsContact OG1-CG 3.22Å; T158-L160 WeakPolarHBondContact OG1-CG 3.39Å; T158-L160 PolarHBondContact OG1-N 3.13Å; L160-T162 PolarHBondContact O-N 2.93Å; L160-Y163 PolarHBondContact O-N 3.37Å |
| 161 | L | 92.2 | Very high | 88.2 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | G | 310 helix | trans | -63.6 | -27.9 | 177.8 | -63.3 | 179.8 | 0 | 0 | 0 | 112.5 | F142 I146 F155 I156 G159 Y163 L164 L187 Y188 V191 F203 | F142-L161 HydrophobicContact CD2-CD2 3.84Å; I146-L161 HydrophobicContact CD1-CD1 4.31Å; I146-L161 HydrophobicContact CD1-CD2 4.31Å; F155-L161 HydrophobicContact CE1-CD2 3.91Å; F155-L161 HydrophobicContact CE1-CG 4.3Å; F155-L161 HydrophobicContact CZ-CD2 4.31Å; I156-L161 HydrophobicContact CG1-CD1 4.12Å; G159-L161 PolarHBondContact O-N 2.87Å; L161-Y163 VanDerWaalsContact C-N 3.29Å; L161-Y163 PolarHBondContact O-N 2.89Å; L161-L164 WeakPolarHBondContact O-CB 3.34Å; L161-L164 PolarHBondContact O-N 3.22Å; L161-L164 VanDerWaalsContact O-N 3.13Å; L161-L187 HydrophobicContact CD2-CD1 4.18Å; L161-L187 HydrophobicContact CD2-CD2 3.96Å; L161-L187 HydrophobicContact CD2-CG 4.33Å; L161-Y188 HydrophobicContact CB-CE1 4.37Å; L161-Y188 PolarHBondContact O-OH 3.11Å; L161-V191 HydrophobicContact CD1-CG2 3.75Å; L161-F203 HydrophobicContact CB-CE2 4.1Å; L161-F203 HydrophobicContact CB-CZ 4.01Å; L161-F203 HydrophobicContact CD1-CE2 4.02Å; L161-F203 HydrophobicContact CD1-CZ 4.09Å |
| 162 | T | 88.1 | Confident | 87.4 | Confident | 21 Ų | 21 | 41.5 Ų | 41.5 | 13% | 0.129 | 21% | 0.209 | C | C | . | . | G | 310 helix | trans | -68.2 | -31.1 | -178.3 | -49.3 | 0 | 0 | 0 | 0 | 111.4 | G159 L160 L164 L165 E207 N235 | G159-T162 WeakPolarHBondContact O-CB 3.39Å; G159-T162 PolarHBondContact O-N 3.16Å; G159-T162 PolarHBondContact O-OG1 3.33Å; L160-T162 PolarHBondContact O-N 2.93Å; T162-L164 PolarHBondContact O-N 3.15Å; T162-L164 VanDerWaalsContact O-N 3.11Å; T162-L165 HydrophobicContact CG2-CD1 4.03Å; T162-L165 WeakPolarHBondContact O-CB 3.39Å; T162-L165 PolarHBondContact O-N 3.48Å; T162-L165 VanDerWaalsContact O-N 3.09Å; T162-E207 PolarHBondContact OG1-OE1 3.42Å; T162-N235 HydrophobicContact CG2-CB 4.05Å; T162-N235 VanDerWaalsContact CG2-OD1 3.31Å; T162-N235 WeakPolarHBondContact CG2-OD1 3.32Å |
| 163 | Y | 90.6 | Very high | 86.1 | Confident | 108 Ų | 108 | 50.2 Ų | 50.2 | 42% | 0.424 | 25% | 0.251 | S | S | . | . | G | 310 helix | trans | -63.9 | -15.4 | 174.2 | -70 | -87.7 | 0 | 0 | 0 | 113.7 | L112 Y119 L160 L161 | L112-Y163 HydrophobicContact CD1-CD2 4.26Å; L112-Y163 HydrophobicContact CD1-CE2 4.44Å; L112-Y163 HydrophobicContact CD1-CG 4.29Å; Y119-Y163 HydrophobicContact CE2-CD1 4.43Å; L160-Y163 PolarHBondContact O-N 3.37Å; L161-Y163 VanDerWaalsContact C-N 3.29Å; L161-Y163 PolarHBondContact O-N 2.89Å |
| 164 | L | 93.7 | Very high | 85.2 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 25% | 0.252 | C | S | . | . | G | 310 helix | trans | -88.6 | -16.1 | 176.7 | -64.8 | 175.1 | 0 | 0 | 0 | 113.3 | I115 I139 F142 L161 T162 Y167 L184 L187 | I115-L164 HydrophobicContact CD1-CD2 4.01Å; I115-L164 HydrophobicContact CG1-CD2 4.14Å; I115-L164 HydrophobicContact CG2-CD2 4.25Å; I139-L164 HydrophobicContact CG1-CD1 4.11Å; I139-L164 HydrophobicContact CG1-CD2 4.48Å; F142-L164 HydrophobicContact CD2-CD1 3.65Å; F142-L164 HydrophobicContact CE2-CD1 3.91Å; L161-L164 WeakPolarHBondContact O-CB 3.34Å; L161-L164 PolarHBondContact O-N 3.22Å; L161-L164 VanDerWaalsContact O-N 3.13Å; T162-L164 PolarHBondContact O-N 3.15Å; T162-L164 VanDerWaalsContact O-N 3.11Å; L164-Y167 HydrophobicContact CD2-CD2 4.31Å; L164-Y167 HydrophobicContact CD2-CE2 4.35Å; L164-Y167 WeakPolarHBondContact O-CB 3.16Å; L164-Y167 PolarHBondContact O-N 3.47Å; L164-Y167 VanDerWaalsContact O-N 3.17Å; L164-L184 HydrophobicContact CB-CD2 4Å; L164-L187 HydrophobicContact CD1-CD2 3.5Å; L164-L187 VanDerWaalsContact CD1-CD2 3.5Å |
| 165 | L | 91.8 | Very high | 84.7 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 27% | 0.265 | C | S | . | . | G | 310 helix | trans | -60.9 | -41.2 | -176.3 | -66.5 | 174.4 | 0 | 0 | 0 | 113.6 | T162 Y167 F168 Y188 N235 L237 | T162-L165 HydrophobicContact CG2-CD1 4.03Å; T162-L165 WeakPolarHBondContact O-CB 3.39Å; T162-L165 PolarHBondContact O-N 3.48Å; T162-L165 VanDerWaalsContact O-N 3.09Å; L165-Y167 PolarHBondContact O-N 3.37Å; L165-Y167 VanDerWaalsContact O-N 3.1Å; L165-F168 HydrophobicContact CD2-CD2 4.45Å; L165-F168 HydrophobicContact CD2-CE2 4.32Å; L165-F168 WeakPolarHBondContact O-CB 3.34Å; L165-F168 WeakPolarHBondContact O-CD2 3.43Å; L165-F168 PolarHBondContact O-N 3.35Å; L165-F168 VanDerWaalsContact O-N 3.08Å; L165-Y188 HydrophobicContact CD2-CE1 3.99Å; L165-Y188 HydrophobicContact CD2-CE2 3.98Å; L165-Y188 VanDerWaalsContact CD2-CZ 3.47Å; L165-Y188 WeakPolarHBondContact CD2-OH 3.36Å; L165-Y188 WeakPolarHBondContact CG-OH 3.37Å; L165-N235 HydrophobicContact CD1-CB 4.2Å; L165-N235 VanDerWaalsContact CD1-O 3.24Å; L165-N235 WeakPolarHBondContact CD1-O 3.42Å; L165-L237 HydrophobicContact CD2-CB 4.12Å; L165-L237 HydrophobicContact CD2-CD1 3.74Å |
| 166 | P | 89.7 | Confident | 84.4 | Confident | 5 Ų | 5 | 55.2 Ų | 55.2 | 3% | 0.032 | 28% | 0.28 | C | S | . | . | G | 310 helix | trans | -63.4 | -19.4 | 179.2 | -28.1 | 40.7 | 0 | 0 | 0 | 114.3 | Y119 P120 F168 N169 | Y119-P166 HydrophobicContact CE1-CG 4.5Å; Y119-P166 HydrophobicContact CE2-CG 4.17Å; Y119-P166 WeakPolarHBondContact OH-CG 3.39Å; P120-P166 HydrophobicContact CG-CB 3.82Å; P166-F168 PolarHBondContact O-N 2.84Å; P166-N169 WeakPolarHBondContact O-CB 3.27Å; P166-N169 PolarHBondContact O-N 2.83Å |
| 167 | Y | 91.6 | Very high | 84.3 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 28% | 0.28 | C | S | . | . | G | 310 helix | trans | -66.8 | -18.6 | 175.7 | -70.9 | -93.5 | 0 | 0 | 0 | 113.1 | I115 H118 Y119 F127 I135 L164 L165 N169 I170 | I115-Y167 HydrophobicContact CG2-CE2 3.97Å; I115-Y167 PolarHBondContact O-OH 2.84Å; H118-Y167 PolarHBondContact O-OH 3.35Å; Y119-Y167 HydrophobicContact CD2-CE2 4.27Å; Y119-Y167 PolarHBondContact N-OH 3.36Å; F127-Y167 HydrophobicContact CE2-CD1 4.31Å; F127-Y167 AromaticContact CE2-CE1 3.9Å; F127-Y167 HydrophobicContact CE2-CE1 3.9Å; F127-Y167 HydrophobicContact CZ-CD1 4.14Å; F127-Y167 AromaticContact CZ-CE1 3.76Å; F127-Y167 HydrophobicContact CZ-CE1 3.76Å; I135-Y167 HydrophobicContact CB-CE1 4.42Å; I135-Y167 HydrophobicContact CD1-CE1 3.94Å; I135-Y167 WeakPolarHBondContact CD1-OH 3.41Å; I135-Y167 HydrophobicContact CG1-CD1 4.33Å; I135-Y167 HydrophobicContact CG1-CE1 3.65Å; I135-Y167 HydrophobicContact CG2-CD1 3.96Å; I135-Y167 HydrophobicContact CG2-CE1 4.05Å; I135-Y167 HydrophobicContact CG2-CG 4.38Å; L164-Y167 HydrophobicContact CD2-CD2 4.31Å; L164-Y167 HydrophobicContact CD2-CE2 4.35Å; L164-Y167 WeakPolarHBondContact O-CB 3.16Å; L164-Y167 PolarHBondContact O-N 3.47Å; L164-Y167 VanDerWaalsContact O-N 3.17Å; L165-Y167 PolarHBondContact O-N 3.37Å; L165-Y167 VanDerWaalsContact O-N 3.1Å; Y167-N169 PolarHBondContact O-N 3.37Å; Y167-I170 HydrophobicContact CD1-CD1 3.6Å; Y167-I170 HydrophobicContact CE1-CD1 4.37Å; Y167-I170 HydrophobicContact CG-CD1 4.32Å; Y167-I170 PolarHBondContact O-N 2.94Å |
| 168 | F | 90.5 | Very high | 84.4 | Confident | 1 Ų | 1 | 47 Ų | 47 | 0% | 0.004 | 25% | 0.25 | C | S | . | . | G | 310 helix | trans | -66.3 | -19.9 | 168.6 | -80.1 | -73.3 | 0 | 0 | 0 | 113.6 | L165 P166 I170 H181 L184 L185 Y188 L237 H240 A244 | L165-F168 HydrophobicContact CD2-CD2 4.45Å; L165-F168 HydrophobicContact CD2-CE2 4.32Å; L165-F168 WeakPolarHBondContact O-CB 3.34Å; L165-F168 WeakPolarHBondContact O-CD2 3.43Å; L165-F168 PolarHBondContact O-N 3.35Å; L165-F168 VanDerWaalsContact O-N 3.08Å; P166-F168 PolarHBondContact O-N 2.84Å; F168-I170 VanDerWaalsContact C-N 3.33Å; F168-H181 PolarHBondContact O-NE2 3.25Å; F168-L184 HydrophobicContact CD1-CB 4.38Å; F168-L184 HydrophobicContact CD1-CD1 4.05Å; F168-L184 HydrophobicContact CD2-CD1 4.15Å; F168-L184 HydrophobicContact CE1-CB 3.72Å; F168-L184 HydrophobicContact CE1-CD1 4.24Å; F168-L184 HydrophobicContact CE2-CB 3.94Å; F168-L184 HydrophobicContact CE2-CD1 4.35Å; F168-L184 HydrophobicContact CG-CD1 4.02Å; F168-L184 HydrophobicContact CZ-CB 3.48Å; F168-L184 VanDerWaalsContact CZ-CB 3.48Å; F168-L184 HydrophobicContact CZ-CD1 4.4Å; F168-L184 HydrophobicContact CZ-CG 4.48Å; F168-L185 HydrophobicContact CE1-CD2 4Å; F168-L185 HydrophobicContact CE1-CG 4.03Å; F168-L185 HydrophobicContact CZ-CD2 4.21Å; F168-L185 HydrophobicContact CZ-CG 4.45Å; F168-Y188 AromaticContact CE2-CD2 3.88Å; F168-Y188 HydrophobicContact CE2-CD2 3.88Å; F168-Y188 AromaticContact CE2-CE2 3.62Å; F168-Y188 HydrophobicContact CE2-CE2 3.62Å; F168-Y188 HydrophobicContact CZ-CD2 4.03Å; F168-Y188 HydrophobicContact CZ-CE2 4.19Å; F168-L237 HydrophobicContact CE2-CD1 4.3Å; F168-H240 HydrophobicContact CB-CB 3.95Å; F168-H240 HydrophobicContact CD2-CB 3.71Å; F168-H240 HydrophobicContact CE2-CB 4.26Å; F168-H240 HydrophobicContact CG-CB 3.84Å; F168-A244 HydrophobicContact CD1-CB 4.06Å; F168-A244 HydrophobicContact CE1-CB 4.03Å |
| 169 | N | 86.3 | Confident | 84.5 | Confident | 42 Ų | 42 | 49.5 Ų | 49.5 | 23% | 0.225 | 26% | 0.257 | C | S | . | . | G | 310 helix | trans | -89.8 | 5.1 | -178.6 | -65.1 | -50.3 | 0 | 0 | 0 | 113.2 | P166 Y167 E171 H240 K243 | P166-N169 WeakPolarHBondContact O-CB 3.27Å; P166-N169 PolarHBondContact O-N 2.83Å; Y167-N169 PolarHBondContact O-N 3.37Å; N169-E171 PolarHBondContact O-N 3.42Å; N169-H240 PolarHBondContact ND2-CE1 2.99Å; N169-K243 PolarHBondContact OD1-NZ 3.43Å |
| 170 | I | 85.6 | Confident | 84.8 | Confident | 17 Ų | 17 | 48.2 Ų | 48.2 | 9% | 0.087 | 25% | 0.245 | C | C | . | . | trans | -74.8 | 109.5 | -179.5 | -63.8 | 174.3 | 0 | 0 | 0 | 108.8 | P120 F127 F132 Y167 F168 I177 L180 | P120-I170 HydrophobicContact CB-CD1 4.18Å; P120-I170 HydrophobicContact CB-CG1 3.96Å; P120-I170 HydrophobicContact CG-CD1 4.43Å; P120-I170 HydrophobicContact CG-CG1 4.39Å; F127-I170 HydrophobicContact CB-CG2 4.33Å; F127-I170 HydrophobicContact CD2-CD1 3.77Å; F127-I170 HydrophobicContact CE2-CD1 3.73Å; F127-I170 HydrophobicContact CG-CD1 4.31Å; F127-I170 HydrophobicContact CZ-CD1 4.22Å; F132-I170 HydrophobicContact CZ-CG2 4.4Å; Y167-I170 HydrophobicContact CD1-CD1 3.6Å; Y167-I170 HydrophobicContact CE1-CD1 4.37Å; Y167-I170 HydrophobicContact CG-CD1 4.32Å; Y167-I170 PolarHBondContact O-N 2.94Å; F168-I170 VanDerWaalsContact C-N 3.33Å; I170-I177 HydrophobicContact CG2-CD1 4Å; I170-I177 HydrophobicContact CG2-CG1 4.3Å; I170-L180 HydrophobicContact CD1-CD2 4.01Å | ||
| 171 | E | 77.5 | Confident | 84.9 | Confident | 144 Ų | 144 | 47.8 Ų | 47.8 | 67% | 0.673 | 24% | 0.242 | S | C | * | . | trans | -103.6 | 107.9 | 177.2 | -66.4 | 173.9 | -171.8 | 0 | 0 | 109.2 | N169 | N169-E171 PolarHBondContact O-N 3.42Š| ||
| 172 | S | 67.5 | Low | 85 | Confident | 55 Ų | 55 | 49.4 Ų | 49.4 | 39% | 0.385 | 25% | 0.25 | S | S | . | . | trans | -147.1 | 163.4 | 170.9 | 100.1 | 0 | 0 | 0 | 0 | 110 | A174 I177 | S172-A174 VanDerWaalsContact C-N 3.26Å; S172-A174 PolarHBondContact O-N 3.24Å; S172-I177 VanDerWaalsContact O-CD1 3.23Å; S172-I177 WeakPolarHBondContact O-CD1 3.44Å; S172-I177 WeakPolarHBondContact OG-CD1 3.45Å | ||
| 173 | Q | 62.4 | Low | 85.3 | Confident | 210 Ų | 210 | 49.8 Ų | 49.8 | 98% | 0.981 | 25% | 0.254 | S | S | * | . | S | Bend | trans | -85.7 | 9.3 | -173.8 | -67.1 | -177.8 | -18.8 | 0 | 0 | 113.9 | ||
| 174 | A | 67.7 | Low | 85.6 | Confident | 40 Ų | 40 | 44.6 Ų | 44.6 | 33% | 0.331 | 23% | 0.234 | S | C | . | . | S | Bend | trans | -88.8 | 139.9 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | S172 N176 I177 | S172-A174 VanDerWaalsContact C-N 3.26Å; S172-A174 PolarHBondContact O-N 3.24Å; A174-N176 HydrophobicContact CB-CB 4.26Å; A174-N176 PolarHBondContact O-N 2.97Å; A174-I177 PolarHBondContact O-N 3.4Å |
| 175 | D | 76 | Confident | 85.7 | Confident | 133 Ų | 133 | 44.6 Ų | 44.6 | 71% | 0.711 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -49.2 | -28.7 | 169.2 | -65 | -28.5 | 0 | 0 | 0 | 112.2 | I177 E178 H179 | D175-I177 VanDerWaalsContact C-N 3.26Å; D175-I177 PolarHBondContact O-N 2.7Å; D175-E178 WeakPolarHBondContact O-CB 3.5Å; D175-E178 PolarHBondContact O-N 2.96Å; D175-H179 PolarHBondContact O-CD2 3.3Å; D175-H179 VanDerWaalsContact O-CD2 3.3Å; D175-H179 PolarHBondContact O-N 2.87Å |
| 176 | N | 83.5 | Confident | 85.9 | Confident | 58 Ų | 58 | 46.2 Ų | 46.2 | 31% | 0.31 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -59.2 | -29.3 | 176.9 | -66.5 | -17.6 | 0 | 0 | 0 | 114.3 | S129 F132 A174 H179 L180 | S129-N176 PolarHBondContact OG-ND2 3.05Å; F132-N176 HydrophobicContact CB-CB 4.26Å; F132-N176 HydrophobicContact CD1-CB 4.23Å; F132-N176 HydrophobicContact CD2-CB 3.59Å; F132-N176 HydrophobicContact CE2-CB 3.92Å; F132-N176 HydrophobicContact CG-CB 3.78Å; F132-N176 HydrophobicContact CZ-CB 4.39Å; A174-N176 HydrophobicContact CB-CB 4.26Å; A174-N176 PolarHBondContact O-N 2.97Å; N176-H179 PolarHBondContact O-N 3.45Å; N176-L180 PolarHBondContact O-N 3.43Å |
| 177 | I | 85.7 | Confident | 86.2 | Confident | 13 Ų | 13 | 46 Ų | 46 | 7% | 0.067 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -71.4 | -38.6 | 179.3 | -77.9 | 172.7 | 0 | 0 | 0 | 111.7 | F132 I170 S172 A174 D175 H179 L180 H181 | F132-I177 HydrophobicContact CE1-CG1 3.6Å; F132-I177 HydrophobicContact CZ-CD1 4.19Å; F132-I177 HydrophobicContact CZ-CG1 3.46Å; F132-I177 VanDerWaalsContact CZ-CG1 3.46Å; I170-I177 HydrophobicContact CG2-CD1 4Å; I170-I177 HydrophobicContact CG2-CG1 4.3Å; S172-I177 VanDerWaalsContact O-CD1 3.23Å; S172-I177 WeakPolarHBondContact O-CD1 3.44Å; S172-I177 WeakPolarHBondContact OG-CD1 3.45Å; A174-I177 PolarHBondContact O-N 3.4Å; D175-I177 VanDerWaalsContact C-N 3.26Å; D175-I177 PolarHBondContact O-N 2.7Å; I177-H179 PolarHBondContact O-N 3Å; I177-L180 WeakPolarHBondContact O-CB 3.34Å; I177-L180 PolarHBondContact O-N 2.65Å; I177-L180 VanDerWaalsContact O-N 3.1Å; I177-H181 VanDerWaalsContact CG2-CE1 3.46Å; I177-H181 WeakPolarHBondContact CG2-CE1 3.38Å; I177-H181 PolarHBondContact O-N 3.13Å |
| 178 | E | 87.8 | Confident | 86.4 | Confident | 34 Ų | 34 | 46.1 Ų | 46.1 | 16% | 0.159 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.6 | -42.7 | 176.5 | 172.4 | 138.2 | -126.9 | 0 | 0 | 110.6 | D175 L180 H181 I182 N249 T250 | D175-E178 WeakPolarHBondContact O-CB 3.5Å; D175-E178 PolarHBondContact O-N 2.96Å; E178-L180 PolarHBondContact O-N 3.46Å; E178-H181 PolarHBondContact O-N 3.46Å; E178-I182 HydrophobicContact CG-CD1 3.89Å; E178-I182 WeakPolarHBondContact O-CB 3.43Å; E178-I182 WeakPolarHBondContact O-CD1 3.48Å; E178-I182 VanDerWaalsContact O-CG1 3.31Å; E178-I182 WeakPolarHBondContact O-CG1 3.42Å; E178-I182 PolarHBondContact O-N 3Å; E178-N249 PolarHBondContact OE1-N 3.37Å; E178-T250 HydrophobicContact CG-CG2 3.99Å; E178-T250 WeakPolarHBondContact OE1-CA 3.36Å; E178-T250 WeakPolarHBondContact OE1-CB 3.44Å; E178-T250 WeakPolarHBondContact OE1-CG2 3.35Å; E178-T250 PolarHBondContact OE1-N 2.69Å; E178-T250 PolarHBondContact OE1-OG1 3.08Å; E178-T250 WeakPolarHBondContact OE2-CG2 3.16Å |
| 179 | H | 90.1 | Very high | 86.6 | Confident | 118 Ų | 118 | 47.1 Ų | 47.1 | 55% | 0.546 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -61.5 | -41.4 | 172.9 | -73.5 | -74 | 0 | 0 | 0 | 112.9 | D175 N176 I177 S183 | D175-H179 PolarHBondContact O-CD2 3.3Å; D175-H179 VanDerWaalsContact O-CD2 3.3Å; D175-H179 PolarHBondContact O-N 2.87Å; N176-H179 PolarHBondContact O-N 3.45Å; I177-H179 PolarHBondContact O-N 3Å; H179-S183 WeakPolarHBondContact O-CB 3.37Å; H179-S183 PolarHBondContact O-N 2.95Å; H179-S183 PolarHBondContact O-OG 3.38Å |
| 180 | L | 92.2 | Very high | 87 | Confident | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.4 | -49 | 175.5 | 177.6 | 63.9 | 0 | 0 | 0 | 111.7 | F132 I135 I139 I170 N176 I177 E178 I182 S183 L184 | F132-L180 HydrophobicContact CD1-CB 4.07Å; F132-L180 HydrophobicContact CD1-CD2 3.96Å; F132-L180 HydrophobicContact CE1-CB 4.27Å; F132-L180 HydrophobicContact CE1-CD2 3.76Å; I135-L180 HydrophobicContact CB-CD1 4.45Å; I135-L180 HydrophobicContact CG2-CD1 3.76Å; I139-L180 HydrophobicContact CD1-CD1 3.91Å; I170-L180 HydrophobicContact CD1-CD2 4.01Å; N176-L180 PolarHBondContact O-N 3.43Å; I177-L180 WeakPolarHBondContact O-CB 3.34Å; I177-L180 PolarHBondContact O-N 2.65Å; I177-L180 VanDerWaalsContact O-N 3.1Å; E178-L180 PolarHBondContact O-N 3.46Å; L180-I182 PolarHBondContact O-N 3.47Å; L180-S183 WeakPolarHBondContact O-CB 3.47Å; L180-S183 PolarHBondContact O-N 3.41Å; L180-S183 VanDerWaalsContact O-N 3.13Å; L180-L184 HydrophobicContact CD1-CD1 4.23Å; L180-L184 HydrophobicContact CD1-CG 4.31Å; L180-L184 HydrophobicContact CG-CD1 4.05Å; L180-L184 WeakPolarHBondContact O-CG 3.47Å; L180-L184 PolarHBondContact O-N 2.9Å |
| 181 | H | 92.7 | Very high | 87.3 | Confident | 4 Ų | 4 | 45.5 Ų | 45.5 | 2% | 0.019 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.6 | -41.9 | 179.1 | -71.1 | 173.7 | 0 | 0 | 0 | 111.9 | F168 I177 E178 S183 L184 L185 Q247 | F168-H181 PolarHBondContact O-NE2 3.25Å; I177-H181 VanDerWaalsContact CG2-CE1 3.46Å; I177-H181 WeakPolarHBondContact CG2-CE1 3.38Å; I177-H181 PolarHBondContact O-N 3.13Å; E178-H181 PolarHBondContact O-N 3.46Å; H181-S183 VanDerWaalsContact C-N 3.31Å; H181-S183 PolarHBondContact O-N 2.86Å; H181-L184 PolarHBondContact O-N 3.47Å; H181-L185 VanDerWaalsContact O-CB 3.31Å; H181-L185 WeakPolarHBondContact O-CB 3.49Å; H181-L185 WeakPolarHBondContact O-CG 3.37Å; H181-L185 PolarHBondContact O-N 3Å; H181-Q247 PolarHBondContact CE1-OE1 3.32Å |
| 182 | I | 94.3 | Very high | 88 | Confident | 34 Ų | 34 | 39 Ų | 39 | 17% | 0.174 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.2 | -43.3 | 173.1 | -73.5 | 162.6 | 0 | 0 | 0 | 110.8 | E178 L180 L185 S186 V252 L256 | E178-I182 HydrophobicContact CG-CD1 3.89Å; E178-I182 WeakPolarHBondContact O-CB 3.43Å; E178-I182 WeakPolarHBondContact O-CD1 3.48Å; E178-I182 VanDerWaalsContact O-CG1 3.31Å; E178-I182 WeakPolarHBondContact O-CG1 3.42Å; E178-I182 PolarHBondContact O-N 3Å; L180-I182 PolarHBondContact O-N 3.47Å; I182-L185 PolarHBondContact O-N 3.09Å; I182-S186 VanDerWaalsContact O-CB 3.22Å; I182-S186 WeakPolarHBondContact O-CB 3.08Å; I182-S186 PolarHBondContact O-N 3.47Å; I182-V252 HydrophobicContact CG2-CG1 4.38Å; I182-L256 HydrophobicContact CG2-CD1 3.93Å |
| 183 | S | 94.8 | Very high | 89.2 | Confident | 29 Ų | 29 | 39.8 Ų | 39.8 | 20% | 0.203 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.9 | -47 | -179.8 | -59 | 0 | 0 | 0 | 0 | 111.3 | I139 Q143 H179 L180 H181 S186 L187 | I139-S183 VanDerWaalsContact CG2-O 3.27Å; I139-S183 WeakPolarHBondContact CG2-O 3.46Å; Q143-S183 PolarHBondContact NE2-O 3.48Å; Q143-S183 VanDerWaalsContact NE2-O 3.12Å; H179-S183 WeakPolarHBondContact O-CB 3.37Å; H179-S183 PolarHBondContact O-N 2.95Å; H179-S183 PolarHBondContact O-OG 3.38Å; L180-S183 WeakPolarHBondContact O-CB 3.47Å; L180-S183 PolarHBondContact O-N 3.41Å; L180-S183 VanDerWaalsContact O-N 3.13Å; H181-S183 VanDerWaalsContact C-N 3.31Å; H181-S183 PolarHBondContact O-N 2.86Å; S183-S186 PolarHBondContact O-N 3.38Å; S183-L187 PolarHBondContact O-N 3.4Å |
| 184 | L | 96.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.8 | -49.8 | 175.3 | -72.1 | 167.9 | 0 | 0 | 0 | 111.3 | I139 L164 F168 L180 H181 S186 L187 Y188 | I139-L184 HydrophobicContact CD1-CD2 3.52Å; I139-L184 HydrophobicContact CD1-CG 3.74Å; I139-L184 HydrophobicContact CG1-CD2 4.19Å; L164-L184 HydrophobicContact CB-CD2 4Å; F168-L184 HydrophobicContact CD1-CB 4.38Å; F168-L184 HydrophobicContact CD1-CD1 4.05Å; F168-L184 HydrophobicContact CD2-CD1 4.15Å; F168-L184 HydrophobicContact CE1-CB 3.72Å; F168-L184 HydrophobicContact CE1-CD1 4.24Å; F168-L184 HydrophobicContact CE2-CB 3.94Å; F168-L184 HydrophobicContact CE2-CD1 4.35Å; F168-L184 HydrophobicContact CG-CD1 4.02Å; F168-L184 HydrophobicContact CZ-CB 3.48Å; F168-L184 VanDerWaalsContact CZ-CB 3.48Å; F168-L184 HydrophobicContact CZ-CD1 4.4Å; F168-L184 HydrophobicContact CZ-CG 4.48Å; L180-L184 HydrophobicContact CD1-CD1 4.23Å; L180-L184 HydrophobicContact CD1-CG 4.31Å; L180-L184 HydrophobicContact CG-CD1 4.05Å; L180-L184 WeakPolarHBondContact O-CG 3.47Å; L180-L184 PolarHBondContact O-N 2.9Å; H181-L184 PolarHBondContact O-N 3.47Å; L184-S186 VanDerWaalsContact C-N 3.31Å; L184-S186 PolarHBondContact O-N 3.44Å; L184-L187 WeakPolarHBondContact O-CB 3.09Å; L184-L187 PolarHBondContact O-N 3.49Å; L184-L187 VanDerWaalsContact O-N 3.1Å; L184-Y188 WeakPolarHBondContact O-CD2 3.49Å; L184-Y188 PolarHBondContact O-N 3.1Å; L184-Y188 VanDerWaalsContact O-N 3.11Å |
| 185 | L | 96.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58.5 | -44.1 | 176.9 | -72.7 | 170.9 | 0 | 0 | 0 | 111.4 | F168 H181 I182 L187 Y188 V189 A244 G253 L256 A257 L260 | F168-L185 HydrophobicContact CE1-CD2 4Å; F168-L185 HydrophobicContact CE1-CG 4.03Å; F168-L185 HydrophobicContact CZ-CD2 4.21Å; F168-L185 HydrophobicContact CZ-CG 4.45Å; H181-L185 VanDerWaalsContact O-CB 3.31Å; H181-L185 WeakPolarHBondContact O-CB 3.49Å; H181-L185 WeakPolarHBondContact O-CG 3.37Å; H181-L185 PolarHBondContact O-N 3Å; I182-L185 PolarHBondContact O-N 3.09Å; L185-L187 VanDerWaalsContact C-N 3.27Å; L185-L187 PolarHBondContact O-N 3.19Å; L185-Y188 PolarHBondContact O-N 2.92Å; L185-V189 WeakPolarHBondContact O-CB 3.23Å; L185-V189 WeakPolarHBondContact O-CG2 3.38Å; L185-V189 PolarHBondContact O-N 3.35Å; L185-A244 HydrophobicContact CD1-CB 4.24Å; L185-A244 HydrophobicContact CD2-CB 4.13Å; L185-A244 HydrophobicContact CG-CB 4.43Å; L185-G253 WeakPolarHBondContact CD1-O 3.22Å; L185-L256 HydrophobicContact CB-CB 3.87Å; L185-L256 HydrophobicContact CB-CD1 4.39Å; L185-L256 HydrophobicContact CD1-CB 4.3Å; L185-A257 HydrophobicContact CD1-CB 3.94Å; L185-A257 HydrophobicContact CD2-CB 4.08Å; L185-L260 HydrophobicContact CD2-CD2 4.03Å |
| 186 | S | 95.7 | Very high | 92 | Very high | 34 Ų | 34 | 29.1 Ų | 29.1 | 24% | 0.238 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.4 | -38.6 | 176.4 | -176.7 | 0 | 0 | 0 | 0 | 112 | Q143 I182 S183 L184 T190 | Q143-S186 PolarHBondContact NE2-OG 3.49Å; I182-S186 VanDerWaalsContact O-CB 3.22Å; I182-S186 WeakPolarHBondContact O-CB 3.08Å; I182-S186 PolarHBondContact O-N 3.47Å; S183-S186 PolarHBondContact O-N 3.38Å; L184-S186 VanDerWaalsContact C-N 3.31Å; L184-S186 PolarHBondContact O-N 3.44Å; S186-T190 WeakPolarHBondContact O-CB 3.41Å; S186-T190 PolarHBondContact O-N 3.3Å; S186-T190 PolarHBondContact O-OG1 2.96Å |
| 187 | L | 96.2 | Very high | 92 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.4 | -53.9 | 176.5 | 175 | 65.8 | 0 | 0 | 0 | 111.4 | I139 F142 Q143 I146 L161 L164 S183 L184 L185 V189 T190 V191 | I139-L187 HydrophobicContact CG1-CD2 4.43Å; I139-L187 HydrophobicContact CG2-CB 3.87Å; I139-L187 HydrophobicContact CG2-CD2 4.14Å; I139-L187 HydrophobicContact CG2-CG 4.5Å; F142-L187 HydrophobicContact CB-CD1 3.92Å; Q143-L187 HydrophobicContact CB-CD1 4.44Å; Q143-L187 HydrophobicContact CG-CB 3.97Å; Q143-L187 HydrophobicContact CG-CD1 3.6Å; Q143-L187 HydrophobicContact CG-CG 4.4Å; I146-L187 HydrophobicContact CD1-CD1 3.48Å; I146-L187 VanDerWaalsContact CD1-CD1 3.48Å; L161-L187 HydrophobicContact CD2-CD1 4.18Å; L161-L187 HydrophobicContact CD2-CD2 3.96Å; L161-L187 HydrophobicContact CD2-CG 4.33Å; L164-L187 HydrophobicContact CD1-CD2 3.5Å; L164-L187 VanDerWaalsContact CD1-CD2 3.5Å; S183-L187 PolarHBondContact O-N 3.4Å; L184-L187 WeakPolarHBondContact O-CB 3.09Å; L184-L187 PolarHBondContact O-N 3.49Å; L184-L187 VanDerWaalsContact O-N 3.1Å; L185-L187 VanDerWaalsContact C-N 3.27Å; L185-L187 PolarHBondContact O-N 3.19Å; L187-V189 PolarHBondContact O-N 2.83Å; L187-T190 WeakPolarHBondContact O-CA 3.28Å; L187-T190 WeakPolarHBondContact O-CB 3.27Å; L187-T190 PolarHBondContact O-N 3.25Å; L187-T190 VanDerWaalsContact O-N 3.08Å; L187-V191 WeakPolarHBondContact O-CG2 3.33Å; L187-V191 PolarHBondContact O-N 2.99Å |
| 188 | Y | 95.5 | Very high | 91.9 | Very high | 2 Ų | 2 | 33.1 Ų | 33.1 | 1% | 0.008 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -71.8 | -28.5 | -178.4 | -66 | -76.1 | 0 | 0 | 0 | 113.1 | L161 L165 F168 L184 L185 T190 S192 F203 L237 | L161-Y188 HydrophobicContact CB-CE1 4.37Å; L161-Y188 PolarHBondContact O-OH 3.11Å; L165-Y188 HydrophobicContact CD2-CE1 3.99Å; L165-Y188 HydrophobicContact CD2-CE2 3.98Å; L165-Y188 VanDerWaalsContact CD2-CZ 3.47Å; L165-Y188 WeakPolarHBondContact CD2-OH 3.36Å; L165-Y188 WeakPolarHBondContact CG-OH 3.37Å; F168-Y188 AromaticContact CE2-CD2 3.88Å; F168-Y188 HydrophobicContact CE2-CD2 3.88Å; F168-Y188 AromaticContact CE2-CE2 3.62Å; F168-Y188 HydrophobicContact CE2-CE2 3.62Å; F168-Y188 HydrophobicContact CZ-CD2 4.03Å; F168-Y188 HydrophobicContact CZ-CE2 4.19Å; L184-Y188 WeakPolarHBondContact O-CD2 3.49Å; L184-Y188 PolarHBondContact O-N 3.1Å; L184-Y188 VanDerWaalsContact O-N 3.11Å; L185-Y188 PolarHBondContact O-N 2.92Å; Y188-T190 VanDerWaalsContact C-N 3.34Å; Y188-S192 VanDerWaalsContact O-CB 3.29Å; Y188-S192 WeakPolarHBondContact O-CB 3.47Å; Y188-S192 PolarHBondContact O-N 3.37Å; Y188-S192 PolarHBondContact O-OG 3.09Å; Y188-F203 HydrophobicContact CD1-CE1 4.42Å; Y188-F203 HydrophobicContact CE1-CE1 4.37Å; Y188-F203 HydrophobicContact CE1-CZ 4.17Å; Y188-L237 HydrophobicContact CD1-CD1 3.75Å; Y188-L237 HydrophobicContact CD1-CD2 3.62Å; Y188-L237 HydrophobicContact CD1-CG 4.34Å; Y188-L237 HydrophobicContact CD2-CD1 3.73Å; Y188-L237 HydrophobicContact CE1-CD1 4.08Å; Y188-L237 HydrophobicContact CE1-CD2 4.27Å; Y188-L237 HydrophobicContact CE2-CD1 4.1Å; Y188-L237 HydrophobicContact CG-CD1 3.57Å; Y188-L237 HydrophobicContact CG-CD2 4.01Å; Y188-L237 HydrophobicContact CG-CG 4.47Å |
| 189 | V | 95.3 | Very high | 91.6 | Very high | 22 Ų | 22 | 34.8 Ų | 34.8 | 13% | 0.133 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.7 | -43.7 | 166.8 | 170.1 | 0 | 0 | 0 | 0 | 110.1 | L185 L187 S192 S193 L256 I259 L260 | L185-V189 WeakPolarHBondContact O-CB 3.23Å; L185-V189 WeakPolarHBondContact O-CG2 3.38Å; L185-V189 PolarHBondContact O-N 3.35Å; L187-V189 PolarHBondContact O-N 2.83Å; V189-S192 WeakPolarHBondContact CA-OG 3.46Å; V189-S192 PolarHBondContact O-N 2.96Å; V189-S192 PolarHBondContact O-OG 2.7Å; V189-S192 VanDerWaalsContact O-OG 3.13Å; V189-S193 VanDerWaalsContact O-CB 3.23Å; V189-S193 WeakPolarHBondContact O-CB 3.31Å; V189-S193 PolarHBondContact O-N 2.95Å; V189-S193 PolarHBondContact O-OG 2.84Å; V189-L256 HydrophobicContact CG2-CB 4.49Å; V189-L256 HydrophobicContact CG2-CD2 4.33Å; V189-L256 WeakPolarHBondContact CG2-O 3.49Å; V189-I259 HydrophobicContact CG1-CG2 3.98Å; V189-I259 HydrophobicContact CG2-CG2 4.26Å; V189-L260 HydrophobicContact CG2-CB 3.79Å |
| 190 | T | 93.9 | Very high | 91.2 | Very high | 21 Ų | 21 | 29.3 Ų | 29.3 | 13% | 0.129 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -61.6 | -48.7 | 177.1 | -59.5 | 0 | 0 | 0 | 0 | 110.9 | I146 L147 S186 L187 Y188 S192 S193 K194 | I146-T190 HydrophobicContact CG2-CG2 4.07Å; L147-T190 HydrophobicContact CD2-CG2 3.73Å; L147-T190 HydrophobicContact CG-CG2 4.02Å; S186-T190 WeakPolarHBondContact O-CB 3.41Å; S186-T190 PolarHBondContact O-N 3.3Å; S186-T190 PolarHBondContact O-OG1 2.96Å; L187-T190 WeakPolarHBondContact O-CA 3.28Å; L187-T190 WeakPolarHBondContact O-CB 3.27Å; L187-T190 PolarHBondContact O-N 3.25Å; L187-T190 VanDerWaalsContact O-N 3.08Å; Y188-T190 VanDerWaalsContact C-N 3.34Å; T190-S192 PolarHBondContact O-N 3.25Å; T190-S193 PolarHBondContact O-N 2.7Å; T190-S193 PolarHBondContact O-OG 3.03Å; T190-K194 WeakPolarHBondContact O-CG 3.25Å; T190-K194 PolarHBondContact O-N 3.41Å; T190-K194 VanDerWaalsContact O-N 3.13Å |
| 191 | V | 92.7 | Very high | 90.6 | Very high | 4 Ų | 4 | 31.1 Ų | 31.1 | 2% | 0.024 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -52.5 | -56.3 | 173.7 | 175.3 | 0 | 0 | 0 | 0 | 110.5 | I146 I156 L161 L187 S193 K194 L195 | I146-V191 HydrophobicContact CD1-CG2 3.47Å; I146-V191 VanDerWaalsContact CD1-CG2 3.47Å; I146-V191 HydrophobicContact CG1-CG2 4.4Å; I146-V191 HydrophobicContact CG2-CG2 4.44Å; I156-V191 HydrophobicContact CD1-CG1 4.35Å; L161-V191 HydrophobicContact CD1-CG2 3.75Å; L187-V191 WeakPolarHBondContact O-CG2 3.33Å; L187-V191 PolarHBondContact O-N 2.99Å; V191-S193 VanDerWaalsContact C-N 3.26Å; V191-S193 PolarHBondContact O-N 3.38Å; V191-K194 PolarHBondContact O-N 3.44Å; V191-K194 VanDerWaalsContact O-N 3.16Å; V191-L195 HydrophobicContact CG1-CD1 3.57Å; V191-L195 HydrophobicContact CG1-CG 4.3Å; V191-L195 WeakPolarHBondContact O-CB 3.44Å; V191-L195 WeakPolarHBondContact O-CG 3.39Å; V191-L195 PolarHBondContact O-N 2.85Å |
| 192 | S | 91.5 | Very high | 89.8 | Confident | 7 Ų | 7 | 35 Ų | 35 | 5% | 0.049 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -70.2 | -20.9 | -174 | 68 | 0 | 0 | 0 | 0 | 114.1 | Y188 V189 T190 I200 R263 | Y188-S192 VanDerWaalsContact O-CB 3.29Å; Y188-S192 WeakPolarHBondContact O-CB 3.47Å; Y188-S192 PolarHBondContact O-N 3.37Å; Y188-S192 PolarHBondContact O-OG 3.09Å; V189-S192 WeakPolarHBondContact CA-OG 3.46Å; V189-S192 PolarHBondContact O-N 2.96Å; V189-S192 PolarHBondContact O-OG 2.7Å; V189-S192 VanDerWaalsContact O-OG 3.13Å; T190-S192 PolarHBondContact O-N 3.25Å; S192-I200 WeakPolarHBondContact O-CD1 3.5Å; S192-R263 PolarHBondContact O-NE 3.05Å; S192-R263 PolarHBondContact O-NH2 3.11Å |
| 193 | S | 91.7 | Very high | 88.9 | Confident | 72 Ų | 72 | 33.9 Ų | 33.9 | 50% | 0.503 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -80.5 | -27.3 | 173.7 | 75.6 | 0 | 0 | 0 | 0 | 113.5 | V189 T190 V191 | V189-S193 VanDerWaalsContact O-CB 3.23Å; V189-S193 WeakPolarHBondContact O-CB 3.31Å; V189-S193 PolarHBondContact O-N 2.95Å; V189-S193 PolarHBondContact O-OG 2.84Å; T190-S193 PolarHBondContact O-N 2.7Å; T190-S193 PolarHBondContact O-OG 3.03Å; V191-S193 VanDerWaalsContact C-N 3.26Å; V191-S193 PolarHBondContact O-N 3.38Å |
| 194 | K | 90.1 | Very high | 87.6 | Confident | 98 Ų | 98 | 34.1 Ų | 34.1 | 43% | 0.426 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -99.7 | -16.3 | -175.6 | -63.5 | -58.5 | 178.9 | -177.6 | 0 | 113.8 | T190 V191 | T190-K194 WeakPolarHBondContact O-CG 3.25Å; T190-K194 PolarHBondContact O-N 3.41Å; T190-K194 VanDerWaalsContact O-N 3.13Å; V191-K194 PolarHBondContact O-N 3.44Å; V191-K194 VanDerWaalsContact O-N 3.16Å |
| 195 | L | 88.1 | Confident | 85.8 | Confident | 7 Ų | 7 | 36.8 Ų | 36.8 | 4% | 0.037 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -95.3 | 146.9 | 175.5 | -66.8 | -177.7 | 0 | 0 | 0 | 112.2 | R152 I156 V191 E199 I200 R263 | R152-L195 HydrophobicContact CG-CD2 4.19Å; I156-L195 HydrophobicContact CD1-CD1 3.68Å; I156-L195 HydrophobicContact CD1-CD2 3.68Å; I156-L195 HydrophobicContact CD1-CG 3.89Å; I156-L195 HydrophobicContact CG2-CD1 4.42Å; V191-L195 HydrophobicContact CG1-CD1 3.57Å; V191-L195 HydrophobicContact CG1-CG 4.3Å; V191-L195 WeakPolarHBondContact O-CB 3.44Å; V191-L195 WeakPolarHBondContact O-CG 3.39Å; V191-L195 PolarHBondContact O-N 2.85Å; L195-E199 HydrophobicContact CB-CB 4.03Å; L195-E199 HydrophobicContact CD1-CB 4.33Å; L195-E199 HydrophobicContact CD2-CB 4.07Å; L195-E199 HydrophobicContact CG-CB 4.38Å; L195-I200 HydrophobicContact CB-CD1 4.34Å; L195-I200 HydrophobicContact CB-CG1 3.7Å; L195-I200 HydrophobicContact CD1-CG1 4.27Å; L195-R263 PolarHBondContact O-NH2 3.25Å |
| 196 | S | 87.7 | Confident | 83.9 | Confident | 54 Ų | 54 | 39.4 Ų | 39.4 | 38% | 0.378 | 23% | 0.226 | S | C | . | . | trans | -65.1 | 162 | 164.8 | 65 | 0 | 0 | 0 | 0 | 110.9 | D198 E199 I200 | S196-D198 VanDerWaalsContact C-N 3.29Å; S196-D198 PolarHBondContact O-N 2.9Å; S196-E199 WeakPolarHBondContact CB-OE2 3.22Å; S196-E199 PolarHBondContact N-OE2 3.26Å; S196-E199 PolarHBondContact O-N 2.97Å; S196-E199 WeakPolarHBondContact OG-CB 3.45Å; S196-E199 VanDerWaalsContact OG-CD 3.27Å; S196-E199 WeakPolarHBondContact OG-CG 3.2Å; S196-E199 PolarHBondContact OG-N 3.04Å; S196-E199 PolarHBondContact OG-OE2 2.95Å; S196-I200 VanDerWaalsContact O-CG1 3.32Å; S196-I200 WeakPolarHBondContact O-CG1 3.49Å; S196-I200 PolarHBondContact O-N 3.23Å | ||
| 197 | M | 83.8 | Confident | 81.9 | Confident | 37 Ų | 37 | 39.1 Ų | 39.1 | 18% | 0.182 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.7 | -38 | 179.1 | -73 | -56.7 | -60.8 | 0 | 0 | 112.2 | E199 I200 E201 R263 N266 | M197-E199 VanDerWaalsContact C-N 3.31Å; M197-E199 PolarHBondContact O-N 3.34Å; M197-I200 PolarHBondContact O-N 3.28Å; M197-I200 HydrophobicContact SD-CD1 4.01Å; M197-E201 WeakPolarHBondContact O-CG 3.33Å; M197-E201 PolarHBondContact O-N 3.17Å; M197-R263 PolarHBondContact SD-NH1 2.67Å; M197-R263 VanDerWaalsContact SD-NH1 3.41Å; M197-N266 VanDerWaalsContact CE-C 3.48Å; M197-N266 HydrophobicContact CE-CB 3.65Å; M197-N266 HydrophobicContact SD-CB 4.12Å; M197-N266 PolarHBondContact SD-ND2 2.61Å |
| 198 | D | 83.2 | Confident | 79.6 | Confident | 119 Ų | 119 | 45.3 Ų | 45.3 | 64% | 0.636 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -63.8 | -38.6 | 177.8 | -58.8 | -26.2 | 0 | 0 | 0 | 111.2 | S196 E201 C202 | S196-D198 VanDerWaalsContact C-N 3.29Å; S196-D198 PolarHBondContact O-N 2.9Å; D198-E201 PolarHBondContact O-N 3.27Å; D198-C202 WeakPolarHBondContact O-CB 3.35Å; D198-C202 PolarHBondContact O-N 2.76Å; D198-C202 PolarHBondContact O-SG 3.13Å; D198-C202 VanDerWaalsContact O-SG 3.35Å |
| 199 | E | 81.7 | Confident | 77.1 | Confident | 68 Ų | 68 | 48.9 Ų | 48.9 | 32% | 0.318 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -70.3 | -36.8 | 175.3 | -71.2 | 168.2 | 129.8 | 0 | 0 | 112.8 | C153 L195 S196 M197 E201 C202 F203 | C153-E199 PolarHBondContact SG-OE1 3.22Å; C153-E199 VanDerWaalsContact SG-OE1 3.36Å; L195-E199 HydrophobicContact CB-CB 4.03Å; L195-E199 HydrophobicContact CD1-CB 4.33Å; L195-E199 HydrophobicContact CD2-CB 4.07Å; L195-E199 HydrophobicContact CG-CB 4.38Å; S196-E199 WeakPolarHBondContact CB-OE2 3.22Å; S196-E199 PolarHBondContact N-OE2 3.26Å; S196-E199 PolarHBondContact O-N 2.97Å; S196-E199 WeakPolarHBondContact OG-CB 3.45Å; S196-E199 VanDerWaalsContact OG-CD 3.27Å; S196-E199 WeakPolarHBondContact OG-CG 3.2Å; S196-E199 PolarHBondContact OG-N 3.04Å; S196-E199 PolarHBondContact OG-OE2 2.95Å; M197-E199 VanDerWaalsContact C-N 3.31Å; M197-E199 PolarHBondContact O-N 3.34Å; E199-E201 VanDerWaalsContact C-N 3.34Å; E199-C202 PolarHBondContact O-N 3.31Å; E199-F203 WeakPolarHBondContact O-CB 3.46Å; E199-F203 PolarHBondContact O-N 3.41Å |
| 200 | I | 81.6 | Confident | 74.9 | Confident | 4 Ų | 4 | 51.9 Ų | 51.9 | 2% | 0.021 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 173.3 | -67 | 165.8 | 0 | 0 | 0 | 109.6 | S192 L195 S196 M197 F203 L204 R263 | S192-I200 WeakPolarHBondContact O-CD1 3.5Å; L195-I200 HydrophobicContact CB-CD1 4.34Å; L195-I200 HydrophobicContact CB-CG1 3.7Å; L195-I200 HydrophobicContact CD1-CG1 4.27Å; S196-I200 VanDerWaalsContact O-CG1 3.32Å; S196-I200 WeakPolarHBondContact O-CG1 3.49Å; S196-I200 PolarHBondContact O-N 3.23Å; M197-I200 PolarHBondContact O-N 3.28Å; M197-I200 HydrophobicContact SD-CD1 4.01Å; I200-F203 WeakPolarHBondContact O-CB 3.44Å; I200-F203 PolarHBondContact O-N 3.45Å; I200-L204 HydrophobicContact CG2-CD1 3.66Å; I200-L204 HydrophobicContact CG2-CG 4.16Å; I200-L204 WeakPolarHBondContact O-CB 3.41Å; I200-L204 VanDerWaalsContact O-CG 3.23Å; I200-L204 WeakPolarHBondContact O-CG 3.18Å; I200-L204 PolarHBondContact O-N 3.16Å; I200-R263 HydrophobicContact CD1-CG 4.38Å |
| 201 | E | 80.1 | Confident | 72.6 | Confident | 38 Ų | 38 | 54.8 Ų | 54.8 | 18% | 0.178 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 174.5 | -72.8 | -167.8 | 172.1 | 0 | 0 | 110.8 | M197 D198 E199 F203 L204 L205 S267 K268 N269 | M197-E201 WeakPolarHBondContact O-CG 3.33Å; M197-E201 PolarHBondContact O-N 3.17Å; D198-E201 PolarHBondContact O-N 3.27Å; E199-E201 VanDerWaalsContact C-N 3.34Å; E201-F203 VanDerWaalsContact C-N 3.31Å; E201-F203 PolarHBondContact O-N 2.86Å; E201-L204 PolarHBondContact O-N 3.04Å; E201-L205 HydrophobicContact CB-CD1 4.04Å; E201-L205 WeakPolarHBondContact O-CA 3.35Å; E201-L205 WeakPolarHBondContact O-CB 3.49Å; E201-L205 WeakPolarHBondContact O-CD1 3.5Å; E201-L205 WeakPolarHBondContact O-CG 3.47Å; E201-L205 PolarHBondContact O-N 2.62Å; E201-S267 WeakPolarHBondContact CG-OG 3.45Å; E201-S267 WeakPolarHBondContact OE1-CA 3.38Å; E201-S267 WeakPolarHBondContact OE1-CB 3.45Å; E201-S267 PolarHBondContact OE1-OG 3.29Å; E201-K268 PolarHBondContact OE1-N 3.36Å; E201-N269 PolarHBondContact OE2-ND2 3.25Å |
| 202 | C | 75.4 | Confident | 70.3 | Confident | 85 Ų | 85 | 58 Ų | 58 | 57% | 0.574 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -60.6 | -39.2 | 172.3 | -74.8 | 0 | 0 | 0 | 0 | 112.4 | D198 E199 S206 | D198-C202 WeakPolarHBondContact O-CB 3.35Å; D198-C202 PolarHBondContact O-N 2.76Å; D198-C202 PolarHBondContact O-SG 3.13Å; D198-C202 VanDerWaalsContact O-SG 3.35Å; E199-C202 PolarHBondContact O-N 3.31Å; C202-S206 WeakPolarHBondContact O-CA 3.3Å; C202-S206 WeakPolarHBondContact O-CB 3.36Å; C202-S206 PolarHBondContact O-N 2.97Å; C202-S206 PolarHBondContact O-OG 3.13Å |
| 203 | F | 74.5 | Confident | 68 | Low | 10 Ų | 10 | 62.4 Ų | 62.4 | 4% | 0.044 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -62.7 | -55 | 175.4 | 174.8 | -108.8 | 0 | 0 | 0 | 110.7 | I156 L161 Y188 E199 I200 E201 L205 S206 E207 L237 | I156-F203 HydrophobicContact CG2-CB 4.3Å; I156-F203 HydrophobicContact CG2-CD2 3.5Å; I156-F203 HydrophobicContact CG2-CE2 4.17Å; I156-F203 HydrophobicContact CG2-CG 4.15Å; L161-F203 HydrophobicContact CB-CE2 4.1Å; L161-F203 HydrophobicContact CB-CZ 4.01Å; L161-F203 HydrophobicContact CD1-CE2 4.02Å; L161-F203 HydrophobicContact CD1-CZ 4.09Å; Y188-F203 HydrophobicContact CD1-CE1 4.42Å; Y188-F203 HydrophobicContact CE1-CE1 4.37Å; Y188-F203 HydrophobicContact CE1-CZ 4.17Å; E199-F203 WeakPolarHBondContact O-CB 3.46Å; E199-F203 PolarHBondContact O-N 3.41Å; I200-F203 WeakPolarHBondContact O-CB 3.44Å; I200-F203 PolarHBondContact O-N 3.45Å; E201-F203 VanDerWaalsContact C-N 3.31Å; E201-F203 PolarHBondContact O-N 2.86Å; F203-L205 PolarHBondContact O-N 3.21Å; F203-S206 PolarHBondContact O-OG 3.04Å; F203-E207 WeakPolarHBondContact O-CG 3.31Å; F203-E207 PolarHBondContact O-N 3.49Å; F203-L237 HydrophobicContact CE1-CD2 4.4Å |
| 204 | L | 67.7 | Low | 65.9 | Low | 34 Ų | 34 | 62.5 Ų | 62.5 | 18% | 0.178 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -65.2 | -32.5 | 179.8 | -64.1 | 171.3 | 0 | 0 | 0 | 113.9 | I200 E201 L237 L264 | I200-L204 HydrophobicContact CG2-CD1 3.66Å; I200-L204 HydrophobicContact CG2-CG 4.16Å; I200-L204 WeakPolarHBondContact O-CB 3.41Å; I200-L204 VanDerWaalsContact O-CG 3.23Å; I200-L204 WeakPolarHBondContact O-CG 3.18Å; I200-L204 PolarHBondContact O-N 3.16Å; E201-L204 PolarHBondContact O-N 3.04Å; L204-L237 HydrophobicContact CD2-CB 4.19Å; L204-L237 HydrophobicContact CD2-CD2 4.1Å; L204-L264 HydrophobicContact CD1-CD2 3.75Å; L204-L264 HydrophobicContact CD2-CD2 4.07Å; L204-L264 HydrophobicContact CG-CD2 4.49Å |
| 205 | L | 59 | Low | 63.6 | Low | 56 Ų | 56 | 59.8 Ų | 59.8 | 29% | 0.293 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -95 | -25.7 | -178 | -63.4 | 167.8 | 0 | 0 | 0 | 112.9 | E201 F203 E207 Y208 N209 N269 | E201-L205 HydrophobicContact CB-CD1 4.04Å; E201-L205 WeakPolarHBondContact O-CA 3.35Å; E201-L205 WeakPolarHBondContact O-CB 3.49Å; E201-L205 WeakPolarHBondContact O-CD1 3.5Å; E201-L205 WeakPolarHBondContact O-CG 3.47Å; E201-L205 PolarHBondContact O-N 2.62Å; F203-L205 PolarHBondContact O-N 3.21Å; L205-E207 PolarHBondContact O-N 3.47Å; L205-Y208 CarbonylContact O-C 3.59Å; L205-Y208 WeakPolarHBondContact O-CA 3.2Å; L205-Y208 WeakPolarHBondContact O-CB 3.31Å; L205-Y208 PolarHBondContact O-N 3.43Å; L205-N209 WeakPolarHBondContact O-CB 3.31Å; L205-N209 PolarHBondContact O-N 2.93Å; L205-N209 PolarHBondContact O-ND2 3.22Å; L205-N269 WeakPolarHBondContact CD1-ND2 3.32Å |
| 206 | S | 56.7 | Low | 61.6 | Low | 56 Ų | 56 | 67.3 Ų | 67.3 | 39% | 0.392 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60 | -40.2 | 170.2 | 63.2 | 0 | 0 | 0 | 0 | 108.5 | C202 F203 Y208 N209 T210 | C202-S206 WeakPolarHBondContact O-CA 3.3Å; C202-S206 WeakPolarHBondContact O-CB 3.36Å; C202-S206 PolarHBondContact O-N 2.97Å; C202-S206 PolarHBondContact O-OG 3.13Å; F203-S206 PolarHBondContact O-OG 3.04Å; S206-Y208 PolarHBondContact O-N 2.87Å; S206-N209 PolarHBondContact O-N 2.6Å; S206-T210 PolarHBondContact O-N 2.84Å; S206-T210 PolarHBondContact O-OG1 3.39Å |
| 207 | E | 52.9 | Low | 59.7 | Low | 27 Ų | 27 | 72.7 Ų | 72.7 | 13% | 0.126 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -53.5 | -37.1 | 170.4 | -66.4 | 175 | 156.3 | 0 | 0 | 112.6 | T162 F203 L205 | T162-E207 PolarHBondContact OG1-OE1 3.42Å; F203-E207 WeakPolarHBondContact O-CG 3.31Å; F203-E207 PolarHBondContact O-N 3.49Å; L205-E207 PolarHBondContact O-N 3.47Å |
| 208 | Y | 48.1 | Very low | 57.7 | Low | 130 Ų | 130 | 77.1 Ų | 77.1 | 51% | 0.51 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -77.6 | -42.5 | 176.1 | -172 | -105.1 | 0 | 0 | 0 | 113.6 | L205 S206 L212 | L205-Y208 CarbonylContact O-C 3.59Å; L205-Y208 WeakPolarHBondContact O-CA 3.2Å; L205-Y208 WeakPolarHBondContact O-CB 3.31Å; L205-Y208 PolarHBondContact O-N 3.43Å; S206-Y208 PolarHBondContact O-N 2.87Å; Y208-L212 HydrophobicContact CD1-CD1 3.93Å; Y208-L212 HydrophobicContact CE1-CD1 3.52Å |
| 209 | N | 42.6 | Very low | 55.3 | Low | 77 Ų | 77 | 80.6 Ų | 80.6 | 41% | 0.412 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -88.8 | -29.8 | -169.7 | -72 | -33.8 | 0 | 0 | 0 | 114.3 | L205 S206 Y211 N213 | L205-N209 WeakPolarHBondContact O-CB 3.31Å; L205-N209 PolarHBondContact O-N 2.93Å; L205-N209 PolarHBondContact O-ND2 3.22Å; S206-N209 PolarHBondContact O-N 2.6Å; N209-Y211 PolarHBondContact O-N 3.11Å; N209-N213 PolarHBondContact O-N 3.25Å; N209-N213 PolarHBondContact O-ND2 3.46Å |
| 210 | T | 49.4 | Very low | 53.4 | Low | 86 Ų | 86 | 80.4 Ų | 80.4 | 53% | 0.528 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.7 | -26.1 | -179.3 | -21 | 0 | 0 | 0 | 0 | 111.6 | S206 N214 | S206-T210 PolarHBondContact O-N 2.84Å; S206-T210 PolarHBondContact O-OG1 3.39Å; T210-N214 PolarHBondContact O-ND2 3.41Å |
| 211 | Y | 47.2 | Very low | 51.6 | Low | 82 Ų | 82 | 84.7 Ų | 84.7 | 32% | 0.322 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -86.7 | -43.8 | 179.7 | -170.3 | -94.8 | 0 | 0 | 0 | 113.1 | N209 N213 N214 E215 N228 Y231 | N209-Y211 PolarHBondContact O-N 3.11Å; Y211-N213 PolarHBondContact O-N 3.46Å; Y211-N214 WeakPolarHBondContact O-CA 3.45Å; Y211-N214 WeakPolarHBondContact O-CB 3.37Å; Y211-N214 PolarHBondContact O-N 2.91Å; Y211-E215 HydrophobicContact CD1-CG 4.24Å; Y211-E215 VanDerWaalsContact CE1-CD 3.49Å; Y211-E215 HydrophobicContact CE1-CG 3.72Å; Y211-E215 VanDerWaalsContact CE1-OE1 3.25Å; Y211-E215 WeakPolarHBondContact CE1-OE1 3.5Å; Y211-E215 PolarHBondContact O-N 3.13Å; Y211-E215 VanDerWaalsContact O-N 3.15Å; Y211-N228 VanDerWaalsContact CE1-OD1 3.25Å; Y211-N228 WeakPolarHBondContact CE1-OD1 3.49Å; Y211-Y231 HydrophobicContact CD2-CE1 4.44Å; Y211-Y231 HydrophobicContact CG-CE1 4.44Å |
| 212 | L | 42.9 | Very low | 50 | Low | 72 Ų | 72 | 91.2 Ų | 91.2 | 38% | 0.377 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -54.3 | -39.3 | 174.3 | -78.5 | 165.8 | 0 | 0 | 0 | 112.2 | Y208 N214 E215 E216 | Y208-L212 HydrophobicContact CD1-CD1 3.93Å; Y208-L212 HydrophobicContact CE1-CD1 3.52Å; L212-N214 PolarHBondContact O-N 2.94Å; L212-E215 PolarHBondContact O-N 3.25Å; L212-E216 PolarHBondContact O-N 2.9Å |
| 213 | N | 44.2 | Very low | 48.5 | Very low | 98 Ų | 98 | 94.6 Ų | 94.6 | 52% | 0.524 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -69.8 | -18.8 | 177 | -68.4 | -22.4 | 0 | 0 | 0 | 114 | N209 Y211 | N209-N213 PolarHBondContact O-N 3.25Å; N209-N213 PolarHBondContact O-ND2 3.46Å; Y211-N213 PolarHBondContact O-N 3.46Å |
| 214 | N | 47 | Very low | 47.2 | Very low | 74 Ų | 74 | 98.1 Ų | 98.1 | 40% | 0.396 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -87.6 | -27.1 | 175.4 | -69.4 | -26.8 | 0 | 0 | 0 | 112 | T210 Y211 L212 R217 | T210-N214 PolarHBondContact O-ND2 3.41Å; Y211-N214 WeakPolarHBondContact O-CA 3.45Å; Y211-N214 WeakPolarHBondContact O-CB 3.37Å; Y211-N214 PolarHBondContact O-N 2.91Å; L212-N214 PolarHBondContact O-N 2.94Å; N214-R217 PolarHBondContact O-N 3.32Å |
| 215 | E | 41.1 | Very low | 46.3 | Very low | 42 Ų | 42 | 104.3 Ų | 104.3 | 20% | 0.196 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -72.1 | -34.1 | 175.9 | -77.3 | -169.6 | 151.1 | 0 | 0 | 113.2 | Y211 L212 R217 L218 N228 | Y211-E215 HydrophobicContact CD1-CG 4.24Å; Y211-E215 VanDerWaalsContact CE1-CD 3.49Å; Y211-E215 HydrophobicContact CE1-CG 3.72Å; Y211-E215 VanDerWaalsContact CE1-OE1 3.25Å; Y211-E215 WeakPolarHBondContact CE1-OE1 3.5Å; Y211-E215 PolarHBondContact O-N 3.13Å; Y211-E215 VanDerWaalsContact O-N 3.15Å; L212-E215 PolarHBondContact O-N 3.25Å; E215-R217 PolarHBondContact O-N 3.48Å; E215-L218 PolarHBondContact O-N 3.16Å; E215-N228 PolarHBondContact OE1-ND2 2.96Å; E215-N228 PolarHBondContact OE1-OD1 3Å; E215-N228 PolarHBondContact OE2-ND2 3.28Å |
| 216 | E | 46.8 | Very low | 45.9 | Very low | 165 Ų | 165 | 107.6 Ų | 107.6 | 77% | 0.771 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | -12.5 | 171.1 | -74.8 | -170 | 167.9 | 0 | 0 | 113 | L212 | L212-E216 PolarHBondContact O-N 2.9Š|
| 217 | R | 47.4 | Very low | 45.5 | Very low | 166 Ų | 166 | 111.9 Ų | 111.9 | 63% | 0.626 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.2 | -10.7 | 178.1 | -65.2 | -177.9 | 172.2 | 168 | 0.4 | 114.9 | Y22 N214 E215 | Y22-R217 PolarHBondContact OH-NH1 3.3Å; N214-R217 PolarHBondContact O-N 3.32Å; E215-R217 PolarHBondContact O-N 3.48Å |
| 218 | L | 41.4 | Very low | 45.6 | Very low | 130 Ų | 130 | 112 Ų | 112 | 68% | 0.681 | 56% | 0.558 | S | S | * | * | trans | -117.4 | 66.3 | -178.5 | -69 | 171.4 | 0 | 0 | 0 | 109 | E215 G220 | E215-L218 PolarHBondContact O-N 3.16Å; L218-G220 PolarHBondContact O-N 3.34Å | ||
| 219 | E | 33.8 | Very low | 46.1 | Very low | 192 Ų | 192 | 110.8 Ų | 110.8 | 90% | 0.897 | 56% | 0.56 | S | S | * | * | trans | -62.1 | 100.6 | 170.3 | -69.6 | -178.2 | 162.7 | 0 | 0 | 109.9 | ||||
| 220 | G | 41.4 | Very low | 46.8 | Very low | 65 Ų | 65 | 111.1 Ų | 111.1 | 67% | 0.67 | 57% | 0.565 | S | S | * | * | trans | 125.3 | 82.6 | 151.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | L218 | L218-G220 PolarHBondContact O-N 3.34Š| ||
| 221 | V | 44.8 | Very low | 47.2 | Very low | 94 Ų | 94 | 111.7 Ų | 111.7 | 57% | 0.57 | 56% | 0.558 | S | S | * | * | trans | -148.2 | 116.6 | 142 | -175.3 | 0 | 0 | 0 | 0 | 110.2 | K223 E224 | V221-K223 HydrophobicContact CG1-CB 4.39Å; V221-K223 HydrophobicContact CG1-CG 4.5Å; V221-K223 PolarHBondContact O-N 2.98Å; V221-E224 WeakPolarHBondContact O-CG 3.21Å | ||
| 222 | D | 45.8 | Very low | 48.1 | Very low | 175 Ų | 175 | 110.8 Ų | 110.8 | 94% | 0.936 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | 45.2 | 178.7 | -64.1 | -49.9 | 0 | 0 | 0 | 115.6 | ||
| 223 | K | 44.3 | Very low | 49.1 | Very low | 155 Ų | 155 | 110.4 Ų | 110.4 | 67% | 0.674 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.8 | 12.8 | 175.4 | -67 | -173.3 | 179.7 | 177 | 0 | 113.7 | V221 | V221-K223 HydrophobicContact CG1-CB 4.39Å; V221-K223 HydrophobicContact CG1-CG 4.5Å; V221-K223 PolarHBondContact O-N 2.98Å |
| 224 | E | 47 | Very low | 50 | Low | 84 Ų | 84 | 108.9 Ų | 108.9 | 39% | 0.393 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -73.1 | -29.7 | -163.5 | -78 | 162.8 | -170.7 | 0 | 0 | 115.8 | V221 N226 F227 N228 | V221-E224 WeakPolarHBondContact O-CG 3.21Å; E224-N226 PolarHBondContact O-N 3.31Å; E224-F227 PolarHBondContact O-N 3.17Å; E224-N228 WeakPolarHBondContact O-CB 3.49Å; E224-N228 PolarHBondContact O-N 3.17Å |
| 225 | E | 49.3 | Very low | 51.3 | Low | 165 Ų | 165 | 106.2 Ų | 106.2 | 77% | 0.771 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -59.2 | -44.3 | -177 | -70.2 | -174.6 | 165.6 | 0 | 0 | 112.6 | D229 | E225-D229 PolarHBondContact O-N 3.27Å; E225-D229 VanDerWaalsContact O-N 3.12Å |
| 226 | N | 49.3 | Very low | 53.5 | Low | 125 Ų | 125 | 105 Ų | 105 | 67% | 0.668 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -73 | -34.3 | -177.8 | -77.5 | -19.3 | 0 | 0 | 0 | 113.4 | E224 T230 | E224-N226 PolarHBondContact O-N 3.31Å; N226-T230 WeakPolarHBondContact O-CB 3.38Å; N226-T230 PolarHBondContact O-N 3.38Å; N226-T230 VanDerWaalsContact O-N 3.1Å; N226-T230 PolarHBondContact O-OG1 3.27Å |
| 227 | F | 49.2 | Very low | 55.6 | Low | 146 Ų | 146 | 97.4 Ų | 97.4 | 64% | 0.64 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -69.8 | -41.9 | 177.8 | -83.3 | -79.3 | 0 | 0 | 0 | 110.7 | E224 T230 Y231 | E224-F227 PolarHBondContact O-N 3.17Å; F227-T230 PolarHBondContact O-N 3.33Å; F227-Y231 VanDerWaalsContact O-CB 3.31Å; F227-Y231 WeakPolarHBondContact O-CB 3.32Å; F227-Y231 PolarHBondContact O-N 3.48Å |
| 228 | N | 54.4 | Low | 57.7 | Low | 29 Ų | 29 | 89.6 Ų | 89.6 | 16% | 0.155 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 179.3 | -72 | -6.8 | 0 | 0 | 0 | 111.1 | Y211 E215 E224 T230 Y231 N232 | Y211-N228 VanDerWaalsContact CE1-OD1 3.25Å; Y211-N228 WeakPolarHBondContact CE1-OD1 3.49Å; E215-N228 PolarHBondContact OE1-ND2 2.96Å; E215-N228 PolarHBondContact OE1-OD1 3Å; E215-N228 PolarHBondContact OE2-ND2 3.28Å; E224-N228 WeakPolarHBondContact O-CB 3.49Å; E224-N228 PolarHBondContact O-N 3.17Å; N228-T230 PolarHBondContact O-N 2.91Å; N228-Y231 PolarHBondContact O-N 2.98Å; N228-N232 WeakPolarHBondContact O-CB 3.35Å; N228-N232 PolarHBondContact O-N 3.12Å; N228-N232 PolarHBondContact O-ND2 3.11Å |
| 229 | D | 59.8 | Low | 60.1 | Low | 104 Ų | 104 | 84.4 Ų | 84.4 | 56% | 0.556 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -62 | -43.5 | 175.1 | -77.3 | -16.4 | 0 | 0 | 0 | 112.4 | E225 V233 | E225-D229 PolarHBondContact O-N 3.27Å; E225-D229 VanDerWaalsContact O-N 3.12Å; D229-V233 WeakPolarHBondContact O-CB 3.45Å; D229-V233 WeakPolarHBondContact O-CG2 3.45Å; D229-V233 PolarHBondContact O-N 2.68Å |
| 230 | T | 56.4 | Low | 62.8 | Low | 84 Ų | 84 | 75.2 Ų | 75.2 | 52% | 0.515 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -66.5 | -44.6 | -179.5 | -54.3 | 0 | 0 | 0 | 0 | 111.5 | N226 F227 N228 V233 L234 | N226-T230 WeakPolarHBondContact O-CB 3.38Å; N226-T230 PolarHBondContact O-N 3.38Å; N226-T230 VanDerWaalsContact O-N 3.1Å; N226-T230 PolarHBondContact O-OG1 3.27Å; F227-T230 PolarHBondContact O-N 3.33Å; N228-T230 PolarHBondContact O-N 2.91Å; T230-V233 PolarHBondContact O-N 2.89Å; T230-L234 HydrophobicContact CG2-CD1 4.14Å; T230-L234 WeakPolarHBondContact O-CB 3.38Å; T230-L234 VanDerWaalsContact O-CG 3.27Å; T230-L234 WeakPolarHBondContact O-CG 3.4Å; T230-L234 PolarHBondContact O-N 3.12Å |
| 231 | Y | 57 | Low | 65.4 | Low | 98 Ų | 98 | 72.1 Ų | 72.1 | 38% | 0.384 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65.2 | -44.3 | 177.2 | -179.4 | -94.9 | 0 | 0 | 0 | 111.9 | Y211 F227 N228 V233 L234 N235 | Y211-Y231 HydrophobicContact CD2-CE1 4.44Å; Y211-Y231 HydrophobicContact CG-CE1 4.44Å; F227-Y231 VanDerWaalsContact O-CB 3.31Å; F227-Y231 WeakPolarHBondContact O-CB 3.32Å; F227-Y231 PolarHBondContact O-N 3.48Å; N228-Y231 PolarHBondContact O-N 2.98Å; Y231-V233 VanDerWaalsContact C-N 3.31Å; Y231-V233 PolarHBondContact O-N 2.9Å; Y231-L234 PolarHBondContact O-N 3.3Å; Y231-L234 VanDerWaalsContact O-N 3.12Å; Y231-N235 WeakPolarHBondContact CE1-ND2 3.36Å; Y231-N235 WeakPolarHBondContact CE2-ND2 3.48Å; Y231-N235 PolarHBondContact O-N 3.37Å; Y231-N235 PolarHBondContact OH-ND2 3.1Å |
| 232 | N | 66.5 | Low | 67.7 | Low | 63 Ų | 63 | 67.7 Ų | 67.7 | 34% | 0.337 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.5 | -43.1 | 176.9 | -73.6 | -27.4 | 0 | 0 | 0 | 111.1 | N228 N235 D236 | N228-N232 WeakPolarHBondContact O-CB 3.35Å; N228-N232 PolarHBondContact O-N 3.12Å; N228-N232 PolarHBondContact O-ND2 3.11Å; N232-N235 PolarHBondContact O-N 2.99Å; N232-D236 VanDerWaalsContact O-CB 3.27Å; N232-D236 WeakPolarHBondContact O-CB 3.45Å; N232-D236 PolarHBondContact O-N 3.31Å; N232-D236 VanDerWaalsContact O-N 3.12Å |
| 233 | V | 64.4 | Low | 69.9 | Low | 65 Ų | 65 | 62.4 Ų | 62.4 | 39% | 0.394 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -67.9 | -35.8 | 176.1 | 172.6 | 0 | 0 | 0 | 0 | 111.9 | D229 T230 Y231 N235 I239 | D229-V233 WeakPolarHBondContact O-CB 3.45Å; D229-V233 WeakPolarHBondContact O-CG2 3.45Å; D229-V233 PolarHBondContact O-N 2.68Å; T230-V233 PolarHBondContact O-N 2.89Å; Y231-V233 VanDerWaalsContact C-N 3.31Å; Y231-V233 PolarHBondContact O-N 2.9Å; V233-N235 VanDerWaalsContact C-N 3.34Å; V233-I239 HydrophobicContact CG1-CD1 4.47Å; V233-I239 HydrophobicContact CG2-CD1 4.32Å |
| 234 | L | 62.4 | Low | 72.2 | Confident | 65 Ų | 65 | 55 Ų | 55 | 34% | 0.34 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -67.8 | -32 | 178 | -78.7 | 169.4 | 0 | 0 | 0 | 113 | T230 Y231 H240 | T230-L234 HydrophobicContact CG2-CD1 4.14Å; T230-L234 WeakPolarHBondContact O-CB 3.38Å; T230-L234 VanDerWaalsContact O-CG 3.27Å; T230-L234 WeakPolarHBondContact O-CG 3.4Å; T230-L234 PolarHBondContact O-N 3.12Å; Y231-L234 PolarHBondContact O-N 3.3Å; Y231-L234 VanDerWaalsContact O-N 3.12Å; L234-H240 PolarHBondContact O-NE2 3.22Å |
| 235 | N | 74.7 | Confident | 74.4 | Confident | 19 Ų | 19 | 51 Ų | 51 | 10% | 0.102 | 26% | 0.256 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.1 | 9.7 | 180 | -63.5 | -37.7 | 0 | 0 | 0 | 113.8 | T162 L165 Y231 N232 V233 L237 | T162-N235 HydrophobicContact CG2-CB 4.05Å; T162-N235 VanDerWaalsContact CG2-OD1 3.31Å; T162-N235 WeakPolarHBondContact CG2-OD1 3.32Å; L165-N235 HydrophobicContact CD1-CB 4.2Å; L165-N235 VanDerWaalsContact CD1-O 3.24Å; L165-N235 WeakPolarHBondContact CD1-O 3.42Å; Y231-N235 WeakPolarHBondContact CE1-ND2 3.36Å; Y231-N235 WeakPolarHBondContact CE2-ND2 3.48Å; Y231-N235 PolarHBondContact O-N 3.37Å; Y231-N235 PolarHBondContact OH-ND2 3.1Å; N232-N235 PolarHBondContact O-N 2.99Å; V233-N235 VanDerWaalsContact C-N 3.34Å; N235-L237 PolarHBondContact O-N 3.26Å |
| 236 | D | 86.7 | Confident | 76.4 | Confident | 15 Ų | 15 | 47.2 Ų | 47.2 | 8% | 0.08 | 24% | 0.24 | C | C | . | . | trans | -87.3 | 96.7 | 179.3 | -175.3 | 8.3 | 0 | 0 | 0 | 112.2 | N232 F238 I239 H240 R273 | N232-D236 VanDerWaalsContact O-CB 3.27Å; N232-D236 WeakPolarHBondContact O-CB 3.45Å; N232-D236 PolarHBondContact O-N 3.31Å; N232-D236 VanDerWaalsContact O-N 3.12Å; D236-F238 PolarHBondContact O-N 2.88Å; D236-F238 VanDerWaalsContact O-N 3.12Å; D236-F238 WeakPolarHBondContact OD1-CA 3.46Å; D236-F238 VanDerWaalsContact OD1-CB 3.22Å; D236-F238 WeakPolarHBondContact OD1-CB 3.28Å; D236-F238 PolarHBondContact OD1-N 3.46Å; D236-I239 HydrophobicContact CB-CB 4.15Å; D236-I239 HydrophobicContact CB-CD1 4.13Å; D236-I239 HydrophobicContact CB-CG1 4.36Å; D236-I239 PolarHBondContact O-N 3.24Å; D236-I239 WeakPolarHBondContact OD2-CD1 3.48Å; D236-I239 WeakPolarHBondContact OD2-CG1 3.49Å; D236-H240 PolarHBondContact O-CD2 3.18Å; D236-H240 PolarHBondContact O-N 2.87Å; D236-R273 IonicContact OD1-NH1 3.52Å; D236-R273 PolarHBondContact OD1-NH1 2.96Å; D236-R273 VanDerWaalsContact OD1-NH1 3.11Å; D236-R273 IonicContact OD2-CZ 2.61Å; D236-R273 IonicContact OD2-NH1 3.11Å; D236-R273 PolarHBondContact OD2-NH1 2.74Å; D236-R273 IonicContact OD2-NH2 2.81Å; D236-R273 PolarHBondContact OD2-NH2 2.94Å | ||
| 237 | L | 91.3 | Very high | 78.3 | Confident | 6 Ų | 6 | 44.2 Ų | 44.2 | 3% | 0.031 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -52.7 | -32.6 | 173.7 | -179.8 | 60.4 | 0 | 0 | 0 | 112.7 | L165 F168 Y188 F203 L204 N235 T241 L260 L264 | L165-L237 HydrophobicContact CD2-CB 4.12Å; L165-L237 HydrophobicContact CD2-CD1 3.74Å; F168-L237 HydrophobicContact CE2-CD1 4.3Å; Y188-L237 HydrophobicContact CD1-CD1 3.75Å; Y188-L237 HydrophobicContact CD1-CD2 3.62Å; Y188-L237 HydrophobicContact CD1-CG 4.34Å; Y188-L237 HydrophobicContact CD2-CD1 3.73Å; Y188-L237 HydrophobicContact CE1-CD1 4.08Å; Y188-L237 HydrophobicContact CE1-CD2 4.27Å; Y188-L237 HydrophobicContact CE2-CD1 4.1Å; Y188-L237 HydrophobicContact CG-CD1 3.57Å; Y188-L237 HydrophobicContact CG-CD2 4.01Å; Y188-L237 HydrophobicContact CG-CG 4.47Å; F203-L237 HydrophobicContact CE1-CD2 4.4Å; L204-L237 HydrophobicContact CD2-CB 4.19Å; L204-L237 HydrophobicContact CD2-CD2 4.1Å; N235-L237 PolarHBondContact O-N 3.26Å; L237-T241 WeakPolarHBondContact O-CB 3.34Å; L237-T241 PolarHBondContact O-N 3.35Å; L237-T241 PolarHBondContact O-OG1 3.39Å; L237-L260 HydrophobicContact CD1-CD2 4.29Å; L237-L264 HydrophobicContact CD2-CD2 4.21Å; L237-L264 HydrophobicContact CG-CD1 4.25Å |
| 238 | F | 91.9 | Very high | 80.2 | Confident | 3 Ų | 3 | 37.3 Ų | 37.3 | 1% | 0.013 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -68.7 | -47.3 | 179.7 | -174 | -92.8 | 0 | 0 | 0 | 111.9 | D236 H240 T241 L242 L261 L264 L265 Q270 L274 L280 L284 | D236-F238 PolarHBondContact O-N 2.88Å; D236-F238 VanDerWaalsContact O-N 3.12Å; D236-F238 WeakPolarHBondContact OD1-CA 3.46Å; D236-F238 VanDerWaalsContact OD1-CB 3.22Å; D236-F238 WeakPolarHBondContact OD1-CB 3.28Å; D236-F238 PolarHBondContact OD1-N 3.46Å; F238-H240 VanDerWaalsContact C-N 3.33Å; F238-H240 PolarHBondContact O-N 3.47Å; F238-T241 PolarHBondContact O-N 3.05Å; F238-L242 HydrophobicContact CD1-CD1 3.99Å; F238-L242 HydrophobicContact CD1-CG 4.32Å; F238-L242 HydrophobicContact CE1-CD1 3.59Å; F238-L242 HydrophobicContact CE1-CG 4.08Å; F238-L242 HydrophobicContact CZ-CD1 4.39Å; F238-L242 WeakPolarHBondContact O-CG 3.32Å; F238-L242 PolarHBondContact O-N 3.36Å; F238-L261 HydrophobicContact CD2-CD1 4.02Å; F238-L261 HydrophobicContact CE2-CD1 3.44Å; F238-L261 VanDerWaalsContact CE2-CD1 3.44Å; F238-L261 HydrophobicContact CZ-CD1 3.84Å; F238-L264 HydrophobicContact CB-CD1 4.35Å; F238-L264 HydrophobicContact CD2-CB 3.99Å; F238-L264 HydrophobicContact CD2-CD1 4.09Å; F238-L265 HydrophobicContact CE2-CD2 3.76Å; F238-L265 HydrophobicContact CE2-CG 4.15Å; F238-L265 HydrophobicContact CZ-CD2 4Å; F238-Q270 HydrophobicContact CD2-CG 3.88Å; F238-Q270 VanDerWaalsContact CD2-NE2 3.29Å; F238-Q270 HydrophobicContact CE2-CG 3.96Å; F238-Q270 HydrophobicContact CG-CG 4.48Å; F238-L274 HydrophobicContact CE1-CD2 3.95Å; F238-L274 HydrophobicContact CZ-CD1 4.02Å; F238-L274 HydrophobicContact CZ-CD2 4Å; F238-L274 HydrophobicContact CZ-CG 4.42Å; F238-L280 HydrophobicContact CD1-CD1 4Å; F238-L280 HydrophobicContact CD1-CD2 4.16Å; F238-L280 HydrophobicContact CD1-CG 4.32Å; F238-L280 HydrophobicContact CE1-CD1 3.96Å; F238-L280 HydrophobicContact CE1-CD2 4.11Å; F238-L280 HydrophobicContact CE1-CG 3.99Å; F238-L284 HydrophobicContact CZ-CD1 4.29Å; F238-L284 HydrophobicContact CZ-CD2 4.36Å |
| 239 | I | 91 | Very high | 81.8 | Confident | 20 Ų | 20 | 41.8 Ų | 41.8 | 10% | 0.103 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.5 | -42.6 | 175.4 | -75.9 | 167.7 | 0 | 0 | 0 | 110.6 | V233 D236 T241 L242 K243 L280 | V233-I239 HydrophobicContact CG1-CD1 4.47Å; V233-I239 HydrophobicContact CG2-CD1 4.32Å; D236-I239 HydrophobicContact CB-CB 4.15Å; D236-I239 HydrophobicContact CB-CD1 4.13Å; D236-I239 HydrophobicContact CB-CG1 4.36Å; D236-I239 PolarHBondContact O-N 3.24Å; D236-I239 WeakPolarHBondContact OD2-CD1 3.48Å; D236-I239 WeakPolarHBondContact OD2-CG1 3.49Å; I239-T241 VanDerWaalsContact C-N 3.32Å; I239-T241 PolarHBondContact O-N 3.26Å; I239-L242 PolarHBondContact O-N 3.18Å; I239-K243 HydrophobicContact CG2-CD 4.34Å; I239-K243 WeakPolarHBondContact O-CG 3.36Å; I239-K243 PolarHBondContact O-N 3.46Å; I239-L280 HydrophobicContact CD1-CD1 4.46Å; I239-L280 HydrophobicContact CG1-CD1 3.84Å |
| 240 | H | 92.1 | Very high | 83.3 | Confident | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.5 | -40 | 176.4 | -68.9 | -46 | 0 | 0 | 0 | 112.2 | F168 N169 L234 D236 F238 L242 K243 A244 | F168-H240 HydrophobicContact CB-CB 3.95Å; F168-H240 HydrophobicContact CD2-CB 3.71Å; F168-H240 HydrophobicContact CE2-CB 4.26Å; F168-H240 HydrophobicContact CG-CB 3.84Å; N169-H240 PolarHBondContact ND2-CE1 2.99Å; L234-H240 PolarHBondContact O-NE2 3.22Å; D236-H240 PolarHBondContact O-CD2 3.18Å; D236-H240 PolarHBondContact O-N 2.87Å; F238-H240 VanDerWaalsContact C-N 3.33Å; F238-H240 PolarHBondContact O-N 3.47Å; H240-L242 PolarHBondContact O-N 3.46Å; H240-K243 PolarHBondContact O-N 3.27Å; H240-A244 VanDerWaalsContact O-CB 3.31Å; H240-A244 WeakPolarHBondContact O-CB 3.45Å; H240-A244 PolarHBondContact O-N 3.06Å |
| 241 | T | 94.5 | Very high | 84.8 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -63.2 | -40.6 | 175.6 | -56.4 | 0 | 0 | 0 | 0 | 111.6 | L237 F238 I239 A244 L245 A257 L260 L261 | L237-T241 WeakPolarHBondContact O-CB 3.34Å; L237-T241 PolarHBondContact O-N 3.35Å; L237-T241 PolarHBondContact O-OG1 3.39Å; F238-T241 PolarHBondContact O-N 3.05Å; I239-T241 VanDerWaalsContact C-N 3.32Å; I239-T241 PolarHBondContact O-N 3.26Å; T241-A244 PolarHBondContact O-N 3.05Å; T241-L245 WeakPolarHBondContact O-CB 3.48Å; T241-L245 PolarHBondContact O-N 2.87Å; T241-A257 WeakPolarHBondContact CG2-O 3.37Å; T241-L260 HydrophobicContact CG2-CB 4.09Å; T241-L260 HydrophobicContact CG2-CD2 4.06Å; T241-L260 HydrophobicContact CG2-CG 4.06Å; T241-L260 WeakPolarHBondContact OG1-CD2 3.46Å; T241-L261 HydrophobicContact CG2-CB 4.04Å; T241-L261 HydrophobicContact CG2-CD1 4.49Å |
| 242 | L | 94.4 | Very high | 86.5 | Confident | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.7 | -43.4 | 175.3 | -70.6 | -178.8 | 0 | 0 | 0 | 112.3 | F238 I239 H240 L245 L261 L280 Q283 L284 C287 | F238-L242 HydrophobicContact CD1-CD1 3.99Å; F238-L242 HydrophobicContact CD1-CG 4.32Å; F238-L242 HydrophobicContact CE1-CD1 3.59Å; F238-L242 HydrophobicContact CE1-CG 4.08Å; F238-L242 HydrophobicContact CZ-CD1 4.39Å; F238-L242 WeakPolarHBondContact O-CG 3.32Å; F238-L242 PolarHBondContact O-N 3.36Å; I239-L242 PolarHBondContact O-N 3.18Å; H240-L242 PolarHBondContact O-N 3.46Å; L242-L245 WeakPolarHBondContact O-CB 3.41Å; L242-L245 PolarHBondContact O-N 3.42Å; L242-L261 HydrophobicContact CD2-CD1 3.8Å; L242-L261 HydrophobicContact CD2-CD2 4.03Å; L242-L261 HydrophobicContact CG-CD1 4.47Å; L242-L280 HydrophobicContact CD1-CD1 4.08Å; L242-Q283 HydrophobicContact CD1-CG 4.15Å; L242-L284 HydrophobicContact CD2-CB 4.42Å; L242-L284 HydrophobicContact CD2-CD1 3.74Å; L242-C287 HydrophobicContact CD2-CB 4.31Å |
| 243 | K | 91.6 | Very high | 87.8 | Confident | 64 Ų | 64 | 33.6 Ų | 33.6 | 28% | 0.278 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -63 | -47.7 | 175.8 | -71.1 | 176.1 | 179.2 | 173.6 | 0 | 111.2 | N169 I239 H240 L245 I246 Q247 | N169-K243 PolarHBondContact OD1-NZ 3.43Å; I239-K243 HydrophobicContact CG2-CD 4.34Å; I239-K243 WeakPolarHBondContact O-CG 3.36Å; I239-K243 PolarHBondContact O-N 3.46Å; H240-K243 PolarHBondContact O-N 3.27Å; K243-L245 VanDerWaalsContact C-N 3.25Å; K243-L245 PolarHBondContact O-N 3.36Å; K243-I246 PolarHBondContact O-N 3.35Å; K243-I246 VanDerWaalsContact O-N 3.12Å; K243-Q247 WeakPolarHBondContact O-CB 3.5Å; K243-Q247 WeakPolarHBondContact O-CG 3.29Å; K243-Q247 PolarHBondContact O-N 3.43Å |
| 244 | A | 92.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -60.2 | -35.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F168 L185 H240 T241 I246 Q247 C248 | F168-A244 HydrophobicContact CD1-CB 4.06Å; F168-A244 HydrophobicContact CE1-CB 4.03Å; L185-A244 HydrophobicContact CD1-CB 4.24Å; L185-A244 HydrophobicContact CD2-CB 4.13Å; L185-A244 HydrophobicContact CG-CB 4.43Å; H240-A244 VanDerWaalsContact O-CB 3.31Å; H240-A244 WeakPolarHBondContact O-CB 3.45Å; H240-A244 PolarHBondContact O-N 3.06Å; T241-A244 PolarHBondContact O-N 3.05Å; A244-I246 VanDerWaalsContact C-N 3.29Å; A244-I246 PolarHBondContact O-N 2.82Å; A244-Q247 PolarHBondContact O-N 3.01Å; A244-C248 WeakPolarHBondContact O-CB 3.37Å; A244-C248 PolarHBondContact O-N 2.76Å; A244-C248 PolarHBondContact O-SG 3.07Å |
| 245 | L | 93.8 | Very high | 90.8 | Very high | 1 Ų | 1 | 31.9 Ų | 31.9 | 1% | 0.005 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.4 | -38 | 176.6 | -177.3 | 59.1 | 0 | 0 | 0 | 112.8 | T241 L242 K243 A257 L258 L261 C287 M291 | T241-L245 WeakPolarHBondContact O-CB 3.48Å; T241-L245 PolarHBondContact O-N 2.87Å; L242-L245 WeakPolarHBondContact O-CB 3.41Å; L242-L245 PolarHBondContact O-N 3.42Å; K243-L245 VanDerWaalsContact C-N 3.25Å; K243-L245 PolarHBondContact O-N 3.36Å; L245-A257 HydrophobicContact CB-CB 3.99Å; L245-A257 HydrophobicContact CD1-CB 3.86Å; L245-L258 HydrophobicContact CD1-CD2 3.99Å; L245-L258 HydrophobicContact CD1-CG 3.77Å; L245-L258 HydrophobicContact CD2-CD2 3.97Å; L245-L261 HydrophobicContact CD2-CD2 4.08Å; L245-C287 HydrophobicContact CD2-CB 4.1Å; L245-M291 HydrophobicContact CD1-CE 4.13Å; L245-M291 HydrophobicContact CD1-CG 3.8Å; L245-M291 HydrophobicContact CD1-SD 3.74Å; L245-M291 HydrophobicContact CD2-CG 3.95Å; L245-M291 HydrophobicContact CG-CG 3.85Å; L245-M291 HydrophobicContact CG-SD 4.14Å |
| 246 | I | 90.3 | Very high | 91.8 | Very high | 84 Ų | 84 | 32.2 Ų | 32.2 | 43% | 0.431 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -81.5 | -39.8 | 177.7 | -63.3 | 175.1 | 0 | 0 | 0 | 111 | K243 A244 C287 | K243-I246 PolarHBondContact O-N 3.35Å; K243-I246 VanDerWaalsContact O-N 3.12Å; A244-I246 VanDerWaalsContact C-N 3.29Å; A244-I246 PolarHBondContact O-N 2.82Å; I246-C287 HydrophobicContact CD1-CB 4.46Å; I246-C287 WeakPolarHBondContact CD1-SG 3.41Å |
| 247 | Q | 88.6 | Confident | 92.3 | Very high | 63 Ų | 63 | 31.5 Ų | 31.5 | 29% | 0.294 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -75 | -27.4 | -174.6 | -72 | 175.4 | -20.5 | 0 | 0 | 113.9 | H181 K243 A244 N249 | H181-Q247 PolarHBondContact CE1-OE1 3.32Å; K243-Q247 WeakPolarHBondContact O-CB 3.5Å; K243-Q247 WeakPolarHBondContact O-CG 3.29Å; K243-Q247 PolarHBondContact O-N 3.43Å; A244-Q247 PolarHBondContact O-N 3.01Å; Q247-N249 PolarHBondContact O-N 3.2Å |
| 248 | C | 90.1 | Very high | 92.6 | Very high | 1 Ų | 1 | 31.2 Ų | 31.2 | 1% | 0.007 | 16% | 0.16 | C | C | . | . | trans | -69.9 | 125.5 | 179.4 | -70.9 | 0 | 0 | 0 | 0 | 111.6 | A244 K254 | A244-C248 WeakPolarHBondContact O-CB 3.37Å; A244-C248 PolarHBondContact O-N 2.76Å; A244-C248 PolarHBondContact O-SG 3.07Å; C248-K254 HydrophobicContact CB-CG 4.31Å; C248-K254 WeakPolarHBondContact O-CE 3.44Å; C248-K254 PolarHBondContact O-NZ 3.21Å; C248-K254 VanDerWaalsContact O-NZ 3.15Å | ||
| 249 | N | 88.6 | Confident | 92.8 | Very high | 122 Ų | 122 | 33.1 Ų | 33.1 | 65% | 0.652 | 17% | 0.17 | S | C | * | . | trans | -86 | -41.4 | 179.5 | -69.7 | -39 | 0 | 0 | 0 | 111.4 | E178 Q247 K254 | E178-N249 PolarHBondContact OE1-N 3.37Å; Q247-N249 PolarHBondContact O-N 3.2Å; N249-K254 PolarHBondContact O-NZ 3.48Å | ||
| 250 | T | 90.4 | Very high | 93 | Very high | 50 Ų | 50 | 32.2 Ų | 32.2 | 31% | 0.307 | 17% | 0.165 | S | C | . | . | S | Bend | trans | -68.1 | 148.9 | 177 | 59.9 | 0 | 0 | 0 | 0 | 112.1 | E178 V252 G253 K254 | E178-T250 HydrophobicContact CG-CG2 3.99Å; E178-T250 WeakPolarHBondContact OE1-CA 3.36Å; E178-T250 WeakPolarHBondContact OE1-CB 3.44Å; E178-T250 WeakPolarHBondContact OE1-CG2 3.35Å; E178-T250 PolarHBondContact OE1-N 2.69Å; E178-T250 PolarHBondContact OE1-OG1 3.08Å; E178-T250 WeakPolarHBondContact OE2-CG2 3.16Å; T250-V252 VanDerWaalsContact C-N 3.26Å; T250-V252 PolarHBondContact O-N 3.3Å; T250-G253 PolarHBondContact O-N 2.99Å; T250-G253 PolarHBondContact OG1-N 3.41Å; T250-K254 PolarHBondContact O-N 3.5Å |
| 251 | E | 89.1 | Confident | 93.2 | Very high | 40 Ų | 40 | 32.2 Ų | 32.2 | 19% | 0.187 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -70.4 | -25.9 | 176.8 | -63.6 | 177.3 | -120.6 | 0 | 0 | 112.2 | K255 Y294 K316 Y317 | E251-K255 WeakPolarHBondContact O-CB 3.47Å; E251-K255 PolarHBondContact O-N 3.45Å; E251-Y294 WeakPolarHBondContact CG-OH 3.2Å; E251-K316 VanDerWaalsContact CD-CE 3.41Å; E251-K316 IonicContact OE1-NZ 2.73Å; E251-K316 PolarHBondContact OE1-NZ 3.12Å; E251-K316 WeakPolarHBondContact OE2-CD 3.34Å; E251-K316 WeakPolarHBondContact OE2-CE 3.41Å; E251-K316 WeakPolarHBondContact OE2-CG 3.22Å; E251-K316 IonicContact OE2-NZ 3.82Å; E251-K316 PolarHBondContact OE2-NZ 3.31Å; E251-Y317 PolarHBondContact OE1-OH 2.97Å |
| 252 | V | 92 | Very high | 93.2 | Very high | 87 Ų | 87 | 32.6 Ų | 32.6 | 53% | 0.527 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -66.5 | -49 | 175.3 | 179.6 | 0 | 0 | 0 | 0 | 110.2 | I182 T250 K255 L256 | I182-V252 HydrophobicContact CG2-CG1 4.38Å; T250-V252 VanDerWaalsContact C-N 3.26Å; T250-V252 PolarHBondContact O-N 3.3Å; V252-K255 PolarHBondContact O-N 2.8Å; V252-L256 HydrophobicContact CG1-CD1 4.1Å; V252-L256 WeakPolarHBondContact O-CG 3.45Å; V252-L256 PolarHBondContact O-N 2.72Å |
| 253 | G | 93.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.4 | -49.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | L185 T250 K255 L256 A257 | L185-G253 WeakPolarHBondContact CD1-O 3.22Å; T250-G253 PolarHBondContact O-N 2.99Å; T250-G253 PolarHBondContact OG1-N 3.41Å; G253-K255 VanDerWaalsContact C-N 3.34Å; G253-K255 PolarHBondContact O-N 3.4Å; G253-L256 PolarHBondContact O-N 3.4Å; G253-A257 WeakPolarHBondContact O-CB 3.5Å; G253-A257 PolarHBondContact O-N 3.02Å |
| 254 | K | 94.6 | Very high | 93.2 | Very high | 19 Ų | 19 | 33.2 Ų | 33.2 | 8% | 0.083 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -56.4 | -44.3 | 175.6 | -78.5 | 168.7 | 171.5 | 139.7 | 0 | 113.1 | C248 N249 T250 A257 L258 M291 Y294 L320 | C248-K254 HydrophobicContact CB-CG 4.31Å; C248-K254 WeakPolarHBondContact O-CE 3.44Å; C248-K254 PolarHBondContact O-NZ 3.21Å; C248-K254 VanDerWaalsContact O-NZ 3.15Å; N249-K254 PolarHBondContact O-NZ 3.48Å; T250-K254 PolarHBondContact O-N 3.5Å; K254-A257 PolarHBondContact O-N 3.46Å; K254-L258 WeakPolarHBondContact O-CG 3.48Å; K254-L258 PolarHBondContact O-N 3.33Å; K254-M291 HydrophobicContact CB-CE 3.83Å; K254-M291 HydrophobicContact CD-CE 3.94Å; K254-M291 HydrophobicContact CD-SD 4.05Å; K254-M291 HydrophobicContact CG-CE 3.95Å; K254-M291 HydrophobicContact CG-SD 4.04Å; K254-Y294 HydrophobicContact CD-CD1 4.29Å; K254-Y294 HydrophobicContact CD-CE1 3.91Å; K254-L320 HydrophobicContact CB-CD1 4.48Å |
| 255 | K | 95.1 | Very high | 93.3 | Very high | 75 Ų | 75 | 33.2 Ų | 33.2 | 33% | 0.326 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -61.7 | -47.4 | 176.9 | 176.8 | -173.8 | 169.6 | -165.3 | 0 | 111.5 | E251 V252 G253 L258 I259 L320 F323 | E251-K255 WeakPolarHBondContact O-CB 3.47Å; E251-K255 PolarHBondContact O-N 3.45Å; V252-K255 PolarHBondContact O-N 2.8Å; G253-K255 VanDerWaalsContact C-N 3.34Å; G253-K255 PolarHBondContact O-N 3.4Å; K255-L258 PolarHBondContact O-N 3.35Å; K255-I259 HydrophobicContact CG-CD1 3.89Å; K255-I259 VanDerWaalsContact O-CG1 3.27Å; K255-I259 WeakPolarHBondContact O-CG1 3.3Å; K255-I259 PolarHBondContact O-N 2.85Å; K255-L320 HydrophobicContact CB-CD1 4.29Å; K255-F323 HydrophobicContact CD-CE2 4.27Å; K255-F323 HydrophobicContact CG-CD2 4.15Å; K255-F323 HydrophobicContact CG-CE2 3.78Å |
| 256 | L | 96.7 | Very high | 93.2 | Very high | 27 Ų | 27 | 35.7 Ų | 35.7 | 14% | 0.141 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64 | -41.5 | 179.4 | -69.6 | 171.8 | 0 | 0 | 0 | 111.6 | I182 L185 V189 V252 G253 I259 L260 | I182-L256 HydrophobicContact CG2-CD1 3.93Å; L185-L256 HydrophobicContact CB-CB 3.87Å; L185-L256 HydrophobicContact CB-CD1 4.39Å; L185-L256 HydrophobicContact CD1-CB 4.3Å; V189-L256 HydrophobicContact CG2-CB 4.49Å; V189-L256 HydrophobicContact CG2-CD2 4.33Å; V189-L256 WeakPolarHBondContact CG2-O 3.49Å; V252-L256 HydrophobicContact CG1-CD1 4.1Å; V252-L256 WeakPolarHBondContact O-CG 3.45Å; V252-L256 PolarHBondContact O-N 2.72Å; G253-L256 PolarHBondContact O-N 3.4Å; L256-I259 PolarHBondContact O-N 2.89Å; L256-L260 WeakPolarHBondContact O-CB 3.27Å; L256-L260 PolarHBondContact O-N 3.21Å |
| 257 | A | 96.7 | Very high | 93.1 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61 | -44.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | L185 T241 L245 G253 K254 L260 L261 | L185-A257 HydrophobicContact CD1-CB 3.94Å; L185-A257 HydrophobicContact CD2-CB 4.08Å; T241-A257 WeakPolarHBondContact CG2-O 3.37Å; L245-A257 HydrophobicContact CB-CB 3.99Å; L245-A257 HydrophobicContact CD1-CB 3.86Å; G253-A257 WeakPolarHBondContact O-CB 3.5Å; G253-A257 PolarHBondContact O-N 3.02Å; K254-A257 PolarHBondContact O-N 3.46Å; A257-L260 PolarHBondContact O-N 3.02Å; A257-L261 WeakPolarHBondContact O-CB 3.44Å; A257-L261 PolarHBondContact O-N 3.24Å |
| 258 | L | 97.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.1 | -40.9 | 175.8 | -73.9 | 170.6 | 0 | 0 | 0 | 112.9 | L245 K254 K255 L261 A262 L288 M291 L320 F323 I324 | L245-L258 HydrophobicContact CD1-CD2 3.99Å; L245-L258 HydrophobicContact CD1-CG 3.77Å; L245-L258 HydrophobicContact CD2-CD2 3.97Å; K254-L258 WeakPolarHBondContact O-CG 3.48Å; K254-L258 PolarHBondContact O-N 3.33Å; K255-L258 PolarHBondContact O-N 3.35Å; L258-L261 PolarHBondContact O-N 3.06Å; L258-A262 WeakPolarHBondContact O-CB 3.44Å; L258-A262 PolarHBondContact O-N 3.07Å; L258-L288 HydrophobicContact CD2-CD2 3.98Å; L258-M291 HydrophobicContact CD1-CE 3.92Å; L258-L320 HydrophobicContact CD1-CD1 3.55Å; L258-L320 HydrophobicContact CD1-CG 4.05Å; L258-F323 HydrophobicContact CB-CB 3.77Å; L258-F323 HydrophobicContact CD1-CB 4.21Å; L258-I324 HydrophobicContact CD1-CD1 4.43Å; L258-I324 HydrophobicContact CD1-CG1 3.69Å; L258-I324 HydrophobicContact CD2-CG1 3.99Å |
| 259 | I | 95.8 | Very high | 92.9 | Very high | 43 Ų | 43 | 38.8 Ų | 38.8 | 22% | 0.221 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.4 | -48.3 | 176.3 | -70.8 | 166 | 0 | 0 | 0 | 110.2 | V189 K255 L256 L261 R263 F323 | V189-I259 HydrophobicContact CG1-CG2 3.98Å; V189-I259 HydrophobicContact CG2-CG2 4.26Å; K255-I259 HydrophobicContact CG-CD1 3.89Å; K255-I259 VanDerWaalsContact O-CG1 3.27Å; K255-I259 WeakPolarHBondContact O-CG1 3.3Å; K255-I259 PolarHBondContact O-N 2.85Å; L256-I259 PolarHBondContact O-N 2.89Å; I259-L261 VanDerWaalsContact C-N 3.35Å; I259-R263 WeakPolarHBondContact O-CB 3.46Å; I259-R263 PolarHBondContact O-N 3.43Å; I259-R263 VanDerWaalsContact O-N 3.09Å; I259-F323 HydrophobicContact CD1-CE1 4.09Å; I259-F323 HydrophobicContact CD1-CE2 4.05Å; I259-F323 HydrophobicContact CD1-CZ 3.73Å; I259-F323 HydrophobicContact CG1-CD1 3.77Å; I259-F323 HydrophobicContact CG1-CD2 4.24Å; I259-F323 HydrophobicContact CG1-CE1 3.56Å; I259-F323 HydrophobicContact CG1-CE2 4.04Å; I259-F323 HydrophobicContact CG1-CG 4.12Å; I259-F323 HydrophobicContact CG1-CZ 3.69Å |
| 260 | L | 95.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -62 | -45.4 | 177.5 | -175.6 | 55.2 | 0 | 0 | 0 | 110.9 | L185 V189 L237 T241 L256 A257 R263 L264 | L185-L260 HydrophobicContact CD2-CD2 4.03Å; V189-L260 HydrophobicContact CG2-CB 3.79Å; L237-L260 HydrophobicContact CD1-CD2 4.29Å; T241-L260 HydrophobicContact CG2-CB 4.09Å; T241-L260 HydrophobicContact CG2-CD2 4.06Å; T241-L260 HydrophobicContact CG2-CG 4.06Å; T241-L260 WeakPolarHBondContact OG1-CD2 3.46Å; L256-L260 WeakPolarHBondContact O-CB 3.27Å; L256-L260 PolarHBondContact O-N 3.21Å; A257-L260 PolarHBondContact O-N 3.02Å; L260-R263 WeakPolarHBondContact O-CB 3.26Å; L260-R263 PolarHBondContact O-N 3.37Å; L260-R263 VanDerWaalsContact O-N 3.16Å; L260-L264 HydrophobicContact CD1-CD1 4.4Å; L260-L264 HydrophobicContact CD1-CG 4.26Å; L260-L264 HydrophobicContact CG-CD1 4.09Å; L260-L264 HydrophobicContact CG-CG 4.39Å; L260-L264 VanDerWaalsContact O-CG 3.31Å; L260-L264 WeakPolarHBondContact O-CG 3.3Å; L260-L264 PolarHBondContact O-N 3.3Å |
| 261 | L | 96.2 | Very high | 92.9 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -60.2 | -48.6 | 180 | -174.3 | 63.2 | 0 | 0 | 0 | 111.9 | F238 T241 L242 L245 A257 L258 I259 R263 L264 L265 L284 L288 | F238-L261 HydrophobicContact CD2-CD1 4.02Å; F238-L261 HydrophobicContact CE2-CD1 3.44Å; F238-L261 VanDerWaalsContact CE2-CD1 3.44Å; F238-L261 HydrophobicContact CZ-CD1 3.84Å; T241-L261 HydrophobicContact CG2-CB 4.04Å; T241-L261 HydrophobicContact CG2-CD1 4.49Å; L242-L261 HydrophobicContact CD2-CD1 3.8Å; L242-L261 HydrophobicContact CD2-CD2 4.03Å; L242-L261 HydrophobicContact CG-CD1 4.47Å; L245-L261 HydrophobicContact CD2-CD2 4.08Å; A257-L261 WeakPolarHBondContact O-CB 3.44Å; A257-L261 PolarHBondContact O-N 3.24Å; L258-L261 PolarHBondContact O-N 3.06Å; I259-L261 VanDerWaalsContact C-N 3.35Å; L261-R263 PolarHBondContact O-N 2.93Å; L261-L264 PolarHBondContact O-N 2.96Å; L261-L265 HydrophobicContact CG-CD1 4.16Å; L261-L265 WeakPolarHBondContact O-CB 3.23Å; L261-L265 VanDerWaalsContact O-CG 3.25Å; L261-L265 WeakPolarHBondContact O-CG 3.47Å; L261-L265 PolarHBondContact O-N 3.25Å; L261-L284 HydrophobicContact CD1-CD1 4.07Å; L261-L284 HydrophobicContact CD2-CD1 3.77Å; L261-L284 HydrophobicContact CG-CD1 4.24Å; L261-L288 HydrophobicContact CD2-CD2 4.11Å |
| 262 | A | 95.2 | Very high | 92.9 | Very high | 9 Ų | 9 | 32.4 Ų | 32.4 | 7% | 0.074 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -58.1 | -40.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L258 L265 N266 E326 | L258-A262 WeakPolarHBondContact O-CB 3.44Å; L258-A262 PolarHBondContact O-N 3.07Å; A262-L265 PolarHBondContact O-N 3.41Å; A262-N266 PolarHBondContact O-N 3.47Å; A262-E326 HydrophobicContact CB-CB 4.29Å |
| 263 | R | 93.3 | Very high | 92.7 | Very high | 72 Ų | 72 | 32.4 Ų | 32.4 | 27% | 0.272 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -67.9 | -41 | 177.9 | -172.2 | 57.4 | 169.9 | 170.3 | 5.1 | 112.6 | S192 L195 M197 I200 I259 L260 L261 N266 | S192-R263 PolarHBondContact O-NE 3.05Å; S192-R263 PolarHBondContact O-NH2 3.11Å; L195-R263 PolarHBondContact O-NH2 3.25Å; M197-R263 PolarHBondContact SD-NH1 2.67Å; M197-R263 VanDerWaalsContact SD-NH1 3.41Å; I200-R263 HydrophobicContact CD1-CG 4.38Å; I259-R263 WeakPolarHBondContact O-CB 3.46Å; I259-R263 PolarHBondContact O-N 3.43Å; I259-R263 VanDerWaalsContact O-N 3.09Å; L260-R263 WeakPolarHBondContact O-CB 3.26Å; L260-R263 PolarHBondContact O-N 3.37Å; L260-R263 VanDerWaalsContact O-N 3.16Å; L261-R263 PolarHBondContact O-N 2.93Å; R263-N266 VanDerWaalsContact O-CB 3.28Å; R263-N266 WeakPolarHBondContact O-CB 2.88Å; R263-N266 PolarHBondContact O-N 2.95Å |
| 264 | L | 92.7 | Very high | 92.5 | Very high | 4 Ų | 4 | 32.4 Ų | 32.4 | 2% | 0.021 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.2 | -38.4 | 175 | -66 | 174.4 | 0 | 0 | 0 | 111.6 | L204 L237 F238 L260 L261 N266 S267 | L204-L264 HydrophobicContact CD1-CD2 3.75Å; L204-L264 HydrophobicContact CD2-CD2 4.07Å; L204-L264 HydrophobicContact CG-CD2 4.49Å; L237-L264 HydrophobicContact CD2-CD2 4.21Å; L237-L264 HydrophobicContact CG-CD1 4.25Å; F238-L264 HydrophobicContact CB-CD1 4.35Å; F238-L264 HydrophobicContact CD2-CB 3.99Å; F238-L264 HydrophobicContact CD2-CD1 4.09Å; L260-L264 HydrophobicContact CD1-CD1 4.4Å; L260-L264 HydrophobicContact CD1-CG 4.26Å; L260-L264 HydrophobicContact CG-CD1 4.09Å; L260-L264 HydrophobicContact CG-CG 4.39Å; L260-L264 VanDerWaalsContact O-CG 3.31Å; L260-L264 WeakPolarHBondContact O-CG 3.3Å; L260-L264 PolarHBondContact O-N 3.3Å; L261-L264 PolarHBondContact O-N 2.96Å; L264-N266 PolarHBondContact O-N 2.7Å; L264-S267 WeakPolarHBondContact O-CB 3.5Å; L264-S267 PolarHBondContact O-N 2.81Å; L264-S267 VanDerWaalsContact O-N 3.14Å |
| 265 | L | 93.5 | Very high | 92.3 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67.1 | -16.3 | 175.9 | -71.2 | 174.1 | 0 | 0 | 0 | 113.8 | F238 L261 A262 S267 R271 L274 L284 C327 Q330 L331 | F238-L265 HydrophobicContact CE2-CD2 3.76Å; F238-L265 HydrophobicContact CE2-CG 4.15Å; F238-L265 HydrophobicContact CZ-CD2 4Å; L261-L265 HydrophobicContact CG-CD1 4.16Å; L261-L265 WeakPolarHBondContact O-CB 3.23Å; L261-L265 VanDerWaalsContact O-CG 3.25Å; L261-L265 WeakPolarHBondContact O-CG 3.47Å; L261-L265 PolarHBondContact O-N 3.25Å; A262-L265 PolarHBondContact O-N 3.41Å; L265-S267 PolarHBondContact O-N 3.11Å; L265-R271 WeakPolarHBondContact O-CG 3.37Å; L265-R271 PolarHBondContact O-NH1 2.87Å; L265-L274 HydrophobicContact CD2-CD1 3.32Å; L265-L284 HydrophobicContact CD1-CD1 4.46Å; L265-L284 HydrophobicContact CD1-CD2 4.43Å; L265-L284 HydrophobicContact CD2-CD2 3.99Å; L265-C327 HydrophobicContact CD1-CB 3.83Å; L265-Q330 HydrophobicContact CB-CB 3.64Å; L265-Q330 HydrophobicContact CB-CG 4.05Å; L265-L331 HydrophobicContact CD2-CD2 3.92Å |
| 266 | N | 92.1 | Very high | 91.9 | Very high | 53 Ų | 53 | 38.6 Ų | 38.6 | 28% | 0.283 | 18% | 0.177 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -20.9 | 173.5 | -167.9 | 29.5 | 0 | 0 | 0 | 112.2 | M197 A262 R263 L264 R271 Q330 | M197-N266 VanDerWaalsContact CE-C 3.48Å; M197-N266 HydrophobicContact CE-CB 3.65Å; M197-N266 HydrophobicContact SD-CB 4.12Å; M197-N266 PolarHBondContact SD-ND2 2.61Å; A262-N266 PolarHBondContact O-N 3.47Å; R263-N266 VanDerWaalsContact O-CB 3.28Å; R263-N266 WeakPolarHBondContact O-CB 2.88Å; R263-N266 PolarHBondContact O-N 2.95Å; L264-N266 PolarHBondContact O-N 2.7Å; N266-R271 PolarHBondContact O-NH1 3.22Å; N266-R271 PolarHBondContact O-NH2 2.93Å; N266-Q330 PolarHBondContact OD1-OE1 3.37Å |
| 267 | S | 88.8 | Confident | 91.6 | Very high | 4 Ų | 4 | 40.4 Ų | 40.4 | 3% | 0.028 | 19% | 0.187 | C | C | . | . | trans | -69.7 | 131.9 | 175.2 | 171 | 0 | 0 | 0 | 0 | 111.7 | E201 L264 L265 N269 Q270 R271 | E201-S267 WeakPolarHBondContact CG-OG 3.45Å; E201-S267 WeakPolarHBondContact OE1-CA 3.38Å; E201-S267 WeakPolarHBondContact OE1-CB 3.45Å; E201-S267 PolarHBondContact OE1-OG 3.29Å; L264-S267 WeakPolarHBondContact O-CB 3.5Å; L264-S267 PolarHBondContact O-N 2.81Å; L264-S267 VanDerWaalsContact O-N 3.14Å; L265-S267 PolarHBondContact O-N 3.11Å; S267-N269 VanDerWaalsContact C-N 3.3Å; S267-N269 PolarHBondContact O-N 3.48Å; S267-N269 PolarHBondContact OG-N 2.97Å; S267-Q270 PolarHBondContact O-N 2.9Å; S267-Q270 PolarHBondContact OG-N 2.88Å; S267-R271 PolarHBondContact O-N 3.12Å; S267-R271 VanDerWaalsContact O-N 3.13Å | ||
| 268 | K | 88.2 | Confident | 91.3 | Very high | 140 Ų | 140 | 44.6 Ų | 44.6 | 61% | 0.609 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -67.3 | -34.7 | 176.2 | -175.5 | -178 | 175.9 | -174.3 | 0 | 111.6 | E201 R271 T272 | E201-K268 PolarHBondContact OE1-N 3.36Å; K268-R271 PolarHBondContact O-N 3.38Å; K268-T272 WeakPolarHBondContact O-CB 3.49Å; K268-T272 PolarHBondContact O-N 3.34Å; K268-T272 PolarHBondContact O-OG1 2.95Å |
| 269 | N | 86.7 | Confident | 91 | Very high | 70 Ų | 70 | 50.7 Ų | 50.7 | 37% | 0.374 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -67.1 | -42.8 | 178.1 | -66.2 | -33 | 0 | 0 | 0 | 110.7 | E201 L205 S267 R271 T272 R273 | E201-N269 PolarHBondContact OE2-ND2 3.25Å; L205-N269 WeakPolarHBondContact CD1-ND2 3.32Å; S267-N269 VanDerWaalsContact C-N 3.3Å; S267-N269 PolarHBondContact O-N 3.48Å; S267-N269 PolarHBondContact OG-N 2.97Å; N269-R271 PolarHBondContact O-N 3.49Å; N269-T272 PolarHBondContact O-N 2.9Å; N269-R273 WeakPolarHBondContact O-CB 3.43Å; N269-R273 PolarHBondContact O-N 3.24Å |
| 270 | Q | 88.5 | Confident | 90.8 | Very high | 18 Ų | 18 | 48.9 Ų | 48.9 | 8% | 0.084 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.3 | -40.3 | 175.3 | -172 | 57.3 | 24.6 | 0 | 0 | 112.5 | F238 S267 T272 R273 L274 | F238-Q270 HydrophobicContact CD2-CG 3.88Å; F238-Q270 VanDerWaalsContact CD2-NE2 3.29Å; F238-Q270 HydrophobicContact CE2-CG 3.96Å; F238-Q270 HydrophobicContact CG-CG 4.48Å; S267-Q270 PolarHBondContact O-N 2.9Å; S267-Q270 PolarHBondContact OG-N 2.88Å; Q270-T272 PolarHBondContact O-N 3.09Å; Q270-R273 WeakPolarHBondContact O-CB 3.37Å; Q270-R273 PolarHBondContact O-N 3.39Å; Q270-L274 WeakPolarHBondContact O-CG 3.49Å; Q270-L274 PolarHBondContact O-N 3.1Å |
| 271 | R | 89.7 | Confident | 90.7 | Very high | 24 Ų | 24 | 49 Ų | 49 | 9% | 0.091 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.5 | -40.1 | 173.8 | -71.2 | -171 | -65.3 | -108.8 | -2.5 | 112.7 | L265 N266 S267 K268 N269 L274 Y275 Q330 D334 L337 | L265-R271 WeakPolarHBondContact O-CG 3.37Å; L265-R271 PolarHBondContact O-NH1 2.87Å; N266-R271 PolarHBondContact O-NH1 3.22Å; N266-R271 PolarHBondContact O-NH2 2.93Å; S267-R271 PolarHBondContact O-N 3.12Å; S267-R271 VanDerWaalsContact O-N 3.13Å; K268-R271 PolarHBondContact O-N 3.38Å; N269-R271 PolarHBondContact O-N 3.49Å; R271-L274 PolarHBondContact O-N 3.08Å; R271-Y275 PolarHBondContact O-N 3.36Å; R271-Q330 WeakPolarHBondContact CD-O 3.49Å; R271-D334 HydrophobicContact CB-CB 4.45Å; R271-L337 HydrophobicContact CB-CD1 3.73Å; R271-L337 HydrophobicContact CG-CD1 3.94Å |
| 272 | T | 88.8 | Confident | 90.7 | Very high | 36 Ų | 36 | 53.2 Ų | 53.2 | 22% | 0.221 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65.5 | -41.1 | 176.1 | -58.7 | 0 | 0 | 0 | 0 | 111.1 | K268 N269 Q270 L274 Y275 H276 R336 | K268-T272 WeakPolarHBondContact O-CB 3.49Å; K268-T272 PolarHBondContact O-N 3.34Å; K268-T272 PolarHBondContact O-OG1 2.95Å; N269-T272 PolarHBondContact O-N 2.9Å; Q270-T272 PolarHBondContact O-N 3.09Å; T272-L274 PolarHBondContact O-N 3.1Å; T272-Y275 WeakPolarHBondContact O-CB 3.39Å; T272-Y275 PolarHBondContact O-N 3.38Å; T272-Y275 VanDerWaalsContact O-N 3.16Å; T272-H276 PolarHBondContact O-CD2 2.77Å; T272-H276 PolarHBondContact O-N 3.17Å; T272-R336 PolarHBondContact OG1-NH2 3.3Å |
| 273 | R | 88.2 | Confident | 90.6 | Very high | 87 Ų | 87 | 56.2 Ų | 56.2 | 33% | 0.328 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -59.2 | -44.8 | 173.1 | -177.4 | -179.3 | 173.3 | -146 | -6.8 | 112.2 | D236 N269 Q270 Y275 H276 N277 L280 | D236-R273 IonicContact OD1-NH1 3.52Å; D236-R273 PolarHBondContact OD1-NH1 2.96Å; D236-R273 VanDerWaalsContact OD1-NH1 3.11Å; D236-R273 IonicContact OD2-CZ 2.61Å; D236-R273 IonicContact OD2-NH1 3.11Å; D236-R273 PolarHBondContact OD2-NH1 2.74Å; D236-R273 IonicContact OD2-NH2 2.81Å; D236-R273 PolarHBondContact OD2-NH2 2.94Å; N269-R273 WeakPolarHBondContact O-CB 3.43Å; N269-R273 PolarHBondContact O-N 3.24Å; Q270-R273 WeakPolarHBondContact O-CB 3.37Å; Q270-R273 PolarHBondContact O-N 3.39Å; R273-Y275 VanDerWaalsContact C-N 3.29Å; R273-Y275 PolarHBondContact O-N 3.18Å; R273-H276 PolarHBondContact O-N 3.49Å; R273-N277 WeakPolarHBondContact O-CB 3.36Å; R273-N277 PolarHBondContact O-N 3.14Å; R273-L280 HydrophobicContact CG-CD2 4.36Å |
| 274 | L | 90 | Very high | 90.8 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.6 | -32.8 | 175.4 | -74.8 | 166.9 | 0 | 0 | 0 | 112.9 | F238 L265 Q270 R271 T272 L280 L284 L331 L337 | F238-L274 HydrophobicContact CE1-CD2 3.95Å; F238-L274 HydrophobicContact CZ-CD1 4.02Å; F238-L274 HydrophobicContact CZ-CD2 4Å; F238-L274 HydrophobicContact CZ-CG 4.42Å; L265-L274 HydrophobicContact CD2-CD1 3.32Å; Q270-L274 WeakPolarHBondContact O-CG 3.49Å; Q270-L274 PolarHBondContact O-N 3.1Å; R271-L274 PolarHBondContact O-N 3.08Å; T272-L274 PolarHBondContact O-N 3.1Å; L274-L280 HydrophobicContact CD2-CB 4.28Å; L274-L280 HydrophobicContact CD2-CD2 3.82Å; L274-L280 HydrophobicContact CD2-CG 3.69Å; L274-L284 HydrophobicContact CD1-CD2 3.91Å; L274-L284 HydrophobicContact CD2-CD2 4.17Å; L274-L331 HydrophobicContact CD1-CD2 4.07Å; L274-L337 HydrophobicContact CB-CD1 4.45Å; L274-L337 HydrophobicContact CB-CD2 4.14Å |
| 275 | Y | 88.9 | Confident | 90.9 | Very high | 90 Ų | 90 | 53.2 Ų | 53.2 | 35% | 0.353 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -68.3 | -40.1 | 176.7 | 173.9 | -109.3 | 0 | 0 | 0 | 112.3 | R271 T272 R273 R336 R340 | R271-Y275 PolarHBondContact O-N 3.36Å; T272-Y275 WeakPolarHBondContact O-CB 3.39Å; T272-Y275 PolarHBondContact O-N 3.38Å; T272-Y275 VanDerWaalsContact O-N 3.16Å; R273-Y275 VanDerWaalsContact C-N 3.29Å; R273-Y275 PolarHBondContact O-N 3.18Å; Y275-R336 HydrophobicContact CD2-CB 3.53Å; Y275-R336 HydrophobicContact CD2-CG 4.47Å; Y275-R336 HydrophobicContact CE2-CB 3.68Å; Y275-R336 HydrophobicContact CE2-CG 4.37Å; Y275-R336 HydrophobicContact CG-CB 4.01Å; Y275-R340 PolarHBondContact O-NH1 2.68Å |
| 276 | H | 88.1 | Confident | 91 | Very high | 134 Ų | 134 | 55.9 Ų | 55.9 | 62% | 0.62 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -83 | -20.8 | -178.9 | -69.3 | -65.6 | 0 | 0 | 0 | 114 | T272 R273 | T272-H276 PolarHBondContact O-CD2 2.77Å; T272-H276 PolarHBondContact O-N 3.17Å; R273-H276 PolarHBondContact O-N 3.49Å |
| 277 | N | 88.7 | Confident | 91.2 | Very high | 64 Ų | 64 | 53.4 Ų | 53.4 | 34% | 0.342 | 26% | 0.263 | S | S | . | . | trans | -109.4 | 96.2 | 179.4 | -170.2 | -31.6 | 0 | 0 | 0 | 111.4 | R273 N279 L280 F281 | R273-N277 WeakPolarHBondContact O-CB 3.36Å; R273-N277 PolarHBondContact O-N 3.14Å; N277-N279 VanDerWaalsContact C-N 3.31Å; N277-N279 PolarHBondContact O-N 3.44Å; N277-N279 PolarHBondContact OD1-N 3.02Å; N277-L280 HydrophobicContact CB-CB 3.98Å; N277-L280 PolarHBondContact O-N 2.97Å; N277-L280 PolarHBondContact OD1-N 3.43Å; N277-F281 PolarHBondContact O-N 3.01Å | ||
| 278 | D | 91 | Very high | 91.6 | Very high | 88 Ų | 88 | 53.2 Ų | 53.2 | 47% | 0.471 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.1 | -40.3 | -179.5 | -71.8 | -24.3 | 0 | 0 | 0 | 113.2 | F281 N282 R340 | D278-F281 PolarHBondContact O-N 3.28Å; D278-N282 WeakPolarHBondContact O-CB 3.23Å; D278-N282 PolarHBondContact O-N 2.99Å; D278-N282 PolarHBondContact O-ND2 3.45Å; D278-R340 IonicContact OD1-CZ 2.77Å; D278-R340 IonicContact OD1-NH1 2.79Å; D278-R340 PolarHBondContact OD1-NH1 3Å; D278-R340 IonicContact OD1-NH2 2.72Å; D278-R340 PolarHBondContact OD1-NH2 3.39Å |
| 279 | N | 91.6 | Very high | 91.9 | Very high | 129 Ų | 129 | 47.9 Ų | 47.9 | 69% | 0.69 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -64.5 | -44.4 | -179.2 | -68.2 | -24.2 | 0 | 0 | 0 | 110.8 | N277 N282 Q283 | N277-N279 VanDerWaalsContact C-N 3.31Å; N277-N279 PolarHBondContact O-N 3.44Å; N277-N279 PolarHBondContact OD1-N 3.02Å; N279-N282 PolarHBondContact O-N 3.25Å; N279-Q283 WeakPolarHBondContact O-CB 3.43Å; N279-Q283 PolarHBondContact O-N 3.2Å |
| 280 | L | 91.3 | Very high | 92.3 | Very high | 5 Ų | 5 | 48.5 Ų | 48.5 | 3% | 0.026 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.3 | -40.9 | 178.7 | -170.6 | 66.5 | 0 | 0 | 0 | 111.7 | F238 I239 L242 R273 L274 N277 Q283 L284 | F238-L280 HydrophobicContact CD1-CD1 4Å; F238-L280 HydrophobicContact CD1-CD2 4.16Å; F238-L280 HydrophobicContact CD1-CG 4.32Å; F238-L280 HydrophobicContact CE1-CD1 3.96Å; F238-L280 HydrophobicContact CE1-CD2 4.11Å; F238-L280 HydrophobicContact CE1-CG 3.99Å; I239-L280 HydrophobicContact CD1-CD1 4.46Å; I239-L280 HydrophobicContact CG1-CD1 3.84Å; L242-L280 HydrophobicContact CD1-CD1 4.08Å; R273-L280 HydrophobicContact CG-CD2 4.36Å; L274-L280 HydrophobicContact CD2-CB 4.28Å; L274-L280 HydrophobicContact CD2-CD2 3.82Å; L274-L280 HydrophobicContact CD2-CG 3.69Å; N277-L280 HydrophobicContact CB-CB 3.98Å; N277-L280 PolarHBondContact O-N 2.97Å; N277-L280 PolarHBondContact OD1-N 3.43Å; L280-Q283 PolarHBondContact O-N 3.45Å; L280-L284 WeakPolarHBondContact O-CB 3.48Å; L280-L284 PolarHBondContact O-N 3.38Å |
| 281 | F | 94.2 | Very high | 92.6 | Very high | 3 Ų | 3 | 48 Ų | 48 | 1% | 0.013 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.6 | -47.9 | 174 | 178.6 | -95.9 | 0 | 0 | 0 | 111.6 | N277 D278 Q283 L284 I285 L337 R340 S344 | N277-F281 PolarHBondContact O-N 3.01Å; D278-F281 PolarHBondContact O-N 3.28Å; F281-Q283 VanDerWaalsContact C-N 3.31Å; F281-Q283 PolarHBondContact O-N 3.47Å; F281-L284 WeakPolarHBondContact O-CB 3.09Å; F281-L284 PolarHBondContact O-N 3.37Å; F281-I285 HydrophobicContact CD1-CG1 4.19Å; F281-I285 HydrophobicContact CE1-CD1 4.48Å; F281-I285 HydrophobicContact CE1-CG1 3.78Å; F281-I285 HydrophobicContact CE2-CD1 4.3Å; F281-I285 HydrophobicContact CE2-CG1 4.25Å; F281-I285 HydrophobicContact CZ-CD1 4.02Å; F281-I285 HydrophobicContact CZ-CG1 3.81Å; F281-I285 WeakPolarHBondContact O-CG1 3.04Å; F281-I285 PolarHBondContact O-N 3Å; F281-L337 HydrophobicContact CD2-CD2 3.87Å; F281-L337 HydrophobicContact CE2-CD2 3.97Å; F281-R340 HydrophobicContact CE1-CB 4Å; F281-R340 HydrophobicContact CE2-CB 4.39Å; F281-R340 HydrophobicContact CZ-CB 3.75Å; F281-S344 WeakPolarHBondContact CE1-OG 3.27Å |
| 282 | N | 94.7 | Very high | 92.8 | Very high | 87 Ų | 87 | 46.8 Ų | 46.8 | 47% | 0.465 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -64.1 | -37.3 | 178.9 | -69 | -23.5 | 0 | 0 | 0 | 111.8 | D278 N279 I285 S286 | D278-N282 WeakPolarHBondContact O-CB 3.23Å; D278-N282 PolarHBondContact O-N 2.99Å; D278-N282 PolarHBondContact O-ND2 3.45Å; N279-N282 PolarHBondContact O-N 3.25Å; N282-I285 PolarHBondContact O-N 3.4Å; N282-S286 VanDerWaalsContact O-CB 3.3Å; N282-S286 WeakPolarHBondContact O-CB 3.41Å; N282-S286 PolarHBondContact O-N 3.07Å |
| 283 | Q | 94.5 | Very high | 93 | Very high | 72 Ų | 72 | 49.6 Ų | 49.6 | 34% | 0.336 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.6 | -46.7 | 173.8 | -173.5 | -177.9 | -7.9 | 0 | 0 | 111.4 | L242 N279 L280 F281 I285 S286 C287 | L242-Q283 HydrophobicContact CD1-CG 4.15Å; N279-Q283 WeakPolarHBondContact O-CB 3.43Å; N279-Q283 PolarHBondContact O-N 3.2Å; L280-Q283 PolarHBondContact O-N 3.45Å; F281-Q283 VanDerWaalsContact C-N 3.31Å; F281-Q283 PolarHBondContact O-N 3.47Å; Q283-I285 PolarHBondContact O-N 3.1Å; Q283-S286 PolarHBondContact O-N 3.16Å; Q283-C287 PolarHBondContact O-N 3.42Å; Q283-C287 PolarHBondContact O-SG 3.19Å |
| 284 | L | 96.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -56.6 | -50.8 | 175.3 | 170.6 | 66.3 | 0 | 0 | 0 | 111.4 | F238 L242 L261 L265 L274 L280 F281 S286 C287 L288 L331 | F238-L284 HydrophobicContact CZ-CD1 4.29Å; F238-L284 HydrophobicContact CZ-CD2 4.36Å; L242-L284 HydrophobicContact CD2-CB 4.42Å; L242-L284 HydrophobicContact CD2-CD1 3.74Å; L261-L284 HydrophobicContact CD1-CD1 4.07Å; L261-L284 HydrophobicContact CD2-CD1 3.77Å; L261-L284 HydrophobicContact CG-CD1 4.24Å; L265-L284 HydrophobicContact CD1-CD1 4.46Å; L265-L284 HydrophobicContact CD1-CD2 4.43Å; L265-L284 HydrophobicContact CD2-CD2 3.99Å; L274-L284 HydrophobicContact CD1-CD2 3.91Å; L274-L284 HydrophobicContact CD2-CD2 4.17Å; L280-L284 WeakPolarHBondContact O-CB 3.48Å; L280-L284 PolarHBondContact O-N 3.38Å; F281-L284 WeakPolarHBondContact O-CB 3.09Å; F281-L284 PolarHBondContact O-N 3.37Å; L284-S286 VanDerWaalsContact C-N 3.32Å; L284-S286 PolarHBondContact O-N 3.28Å; L284-C287 PolarHBondContact O-N 3.24Å; L284-L288 HydrophobicContact CD1-CD1 4Å; L284-L288 HydrophobicContact CD1-CG 4.15Å; L284-L288 HydrophobicContact CG-CD1 4.19Å; L284-L288 WeakPolarHBondContact O-CG 3.5Å; L284-L288 PolarHBondContact O-N 3Å; L284-L331 HydrophobicContact CD2-CD1 3.91Å; L284-L331 HydrophobicContact CD2-CD2 3.82Å; L284-L331 HydrophobicContact CD2-CG 4.4Å |
| 285 | I | 96.2 | Very high | 93.2 | Very high | 13 Ų | 13 | 47.2 Ų | 47.2 | 7% | 0.067 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61.8 | -42.3 | 179.8 | -64 | -59.6 | 0 | 0 | 0 | 110.8 | F281 N282 Q283 C287 L288 T289 F328 L331 L341 S344 | F281-I285 HydrophobicContact CD1-CG1 4.19Å; F281-I285 HydrophobicContact CE1-CD1 4.48Å; F281-I285 HydrophobicContact CE1-CG1 3.78Å; F281-I285 HydrophobicContact CE2-CD1 4.3Å; F281-I285 HydrophobicContact CE2-CG1 4.25Å; F281-I285 HydrophobicContact CZ-CD1 4.02Å; F281-I285 HydrophobicContact CZ-CG1 3.81Å; F281-I285 WeakPolarHBondContact O-CG1 3.04Å; F281-I285 PolarHBondContact O-N 3Å; N282-I285 PolarHBondContact O-N 3.4Å; Q283-I285 PolarHBondContact O-N 3.1Å; I285-C287 PolarHBondContact O-N 3.43Å; I285-L288 PolarHBondContact O-N 3.28Å; I285-T289 WeakPolarHBondContact O-CB 3.42Å; I285-T289 PolarHBondContact O-N 2.99Å; I285-T289 PolarHBondContact O-OG1 3.08Å; I285-F328 HydrophobicContact CD1-CE1 4.02Å; I285-L331 HydrophobicContact CD1-CD1 4.21Å; I285-L341 HydrophobicContact CD1-CD1 3.72Å; I285-S344 VanDerWaalsContact CG2-O 3.29Å; I285-S344 WeakPolarHBondContact CG2-O 3.44Å |
| 286 | S | 95.7 | Very high | 93.2 | Very high | 56 Ų | 56 | 44.2 Ų | 44.2 | 39% | 0.392 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -59.3 | -46.4 | 175.5 | -175.9 | 0 | 0 | 0 | 0 | 111.7 | N282 Q283 L284 L288 T289 Q290 | N282-S286 VanDerWaalsContact O-CB 3.3Å; N282-S286 WeakPolarHBondContact O-CB 3.41Å; N282-S286 PolarHBondContact O-N 3.07Å; Q283-S286 PolarHBondContact O-N 3.16Å; L284-S286 VanDerWaalsContact C-N 3.32Å; L284-S286 PolarHBondContact O-N 3.28Å; S286-L288 PolarHBondContact O-N 3.24Å; S286-T289 WeakPolarHBondContact O-CB 3.27Å; S286-T289 PolarHBondContact O-N 3.39Å; S286-Q290 WeakPolarHBondContact O-CG 3.46Å; S286-Q290 PolarHBondContact O-N 3.39Å |
| 287 | C | 95.9 | Very high | 93.3 | Very high | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.007 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60.3 | -47.2 | 176.9 | -62.8 | 0 | 0 | 0 | 0 | 111.7 | L242 L245 I246 Q283 L284 I285 T289 Q290 M291 | L242-C287 HydrophobicContact CD2-CB 4.31Å; L245-C287 HydrophobicContact CD2-CB 4.1Å; I246-C287 HydrophobicContact CD1-CB 4.46Å; I246-C287 WeakPolarHBondContact CD1-SG 3.41Å; Q283-C287 PolarHBondContact O-N 3.42Å; Q283-C287 PolarHBondContact O-SG 3.19Å; L284-C287 PolarHBondContact O-N 3.24Å; I285-C287 PolarHBondContact O-N 3.43Å; C287-T289 VanDerWaalsContact C-N 3.34Å; C287-T289 PolarHBondContact O-N 3.5Å; C287-Q290 PolarHBondContact O-N 2.81Å; C287-M291 WeakPolarHBondContact O-CG 3.36Å; C287-M291 PolarHBondContact O-N 2.82Å |
| 288 | L | 96.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.3 | -37.2 | 178.2 | -66.3 | 178 | 0 | 0 | 0 | 112 | L258 L261 L284 I285 S286 M291 I292 C327 F328 | L258-L288 HydrophobicContact CD2-CD2 3.98Å; L261-L288 HydrophobicContact CD2-CD2 4.11Å; L284-L288 HydrophobicContact CD1-CD1 4Å; L284-L288 HydrophobicContact CD1-CG 4.15Å; L284-L288 HydrophobicContact CG-CD1 4.19Å; L284-L288 WeakPolarHBondContact O-CG 3.5Å; L284-L288 PolarHBondContact O-N 3Å; I285-L288 PolarHBondContact O-N 3.28Å; S286-L288 PolarHBondContact O-N 3.24Å; L288-M291 WeakPolarHBondContact O-CB 3.36Å; L288-M291 PolarHBondContact O-N 3.2Å; L288-I292 WeakPolarHBondContact O-CD1 3.38Å; L288-I292 WeakPolarHBondContact O-CG1 3.47Å; L288-I292 PolarHBondContact O-N 3.29Å; L288-C327 HydrophobicContact CD1-CB 4.03Å; L288-C327 HydrophobicContact CD2-CB 4.02Å; L288-F328 HydrophobicContact CB-CE2 4.12Å; L288-F328 HydrophobicContact CB-CZ 3.73Å; L288-F328 HydrophobicContact CD1-CD1 4.32Å; L288-F328 HydrophobicContact CD1-CE1 3.86Å; L288-F328 HydrophobicContact CD1-CE2 4.07Å; L288-F328 HydrophobicContact CD1-CZ 3.73Å; L288-F328 HydrophobicContact CG-CZ 4.37Å |
| 289 | T | 95.1 | Very high | 92.8 | Very high | 29 Ų | 29 | 39.9 Ų | 39.9 | 18% | 0.178 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.8 | -46.9 | 174.8 | -53.5 | 0 | 0 | 0 | 0 | 111 | I285 S286 C287 M291 I292 Q293 P346 | I285-T289 WeakPolarHBondContact O-CB 3.42Å; I285-T289 PolarHBondContact O-N 2.99Å; I285-T289 PolarHBondContact O-OG1 3.08Å; S286-T289 WeakPolarHBondContact O-CB 3.27Å; S286-T289 PolarHBondContact O-N 3.39Å; C287-T289 VanDerWaalsContact C-N 3.34Å; C287-T289 PolarHBondContact O-N 3.5Å; T289-M291 VanDerWaalsContact C-N 3.27Å; T289-M291 PolarHBondContact O-N 3.49Å; T289-I292 WeakPolarHBondContact O-CB 3.35Å; T289-I292 PolarHBondContact O-N 3.05Å; T289-Q293 WeakPolarHBondContact O-CG 3.47Å; T289-Q293 PolarHBondContact O-N 2.71Å; T289-P346 HydrophobicContact CG2-CB 4.21Å; T289-P346 HydrophobicContact CG2-CG 4.32Å; T289-P346 WeakPolarHBondContact OG1-CG 3.28Å |
| 290 | Q | 94.6 | Very high | 92.3 | Very high | 82 Ų | 82 | 37.7 Ų | 37.7 | 38% | 0.383 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -61.6 | -37.6 | 176.3 | -71 | 176.6 | 10 | 0 | 0 | 111.7 | S286 C287 Q293 Y294 | S286-Q290 WeakPolarHBondContact O-CG 3.46Å; S286-Q290 PolarHBondContact O-N 3.39Å; C287-Q290 PolarHBondContact O-N 2.81Å; Q290-Q293 PolarHBondContact O-N 3.45Å; Q290-Y294 WeakPolarHBondContact O-CB 3.47Å; Q290-Y294 PolarHBondContact O-N 2.83Å |
| 291 | M | 94.9 | Very high | 91.8 | Very high | 7 Ų | 7 | 42.5 Ų | 42.5 | 3% | 0.034 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -66.3 | -39.1 | 175.7 | -75.8 | -57.2 | -60.6 | 0 | 0 | 112.9 | L245 K254 L258 C287 L288 T289 Y294 V295 L320 I324 | L245-M291 HydrophobicContact CD1-CE 4.13Å; L245-M291 HydrophobicContact CD1-CG 3.8Å; L245-M291 HydrophobicContact CD1-SD 3.74Å; L245-M291 HydrophobicContact CD2-CG 3.95Å; L245-M291 HydrophobicContact CG-CG 3.85Å; L245-M291 HydrophobicContact CG-SD 4.14Å; K254-M291 HydrophobicContact CB-CE 3.83Å; K254-M291 HydrophobicContact CD-CE 3.94Å; K254-M291 HydrophobicContact CD-SD 4.05Å; K254-M291 HydrophobicContact CG-CE 3.95Å; K254-M291 HydrophobicContact CG-SD 4.04Å; L258-M291 HydrophobicContact CD1-CE 3.92Å; C287-M291 WeakPolarHBondContact O-CG 3.36Å; C287-M291 PolarHBondContact O-N 2.82Å; L288-M291 WeakPolarHBondContact O-CB 3.36Å; L288-M291 PolarHBondContact O-N 3.2Å; T289-M291 VanDerWaalsContact C-N 3.27Å; T289-M291 PolarHBondContact O-N 3.49Å; M291-Y294 HydrophobicContact CE-CD1 4.4Å; M291-Y294 WeakPolarHBondContact O-CB 3.33Å; M291-Y294 PolarHBondContact O-N 3.48Å; M291-V295 WeakPolarHBondContact O-CG2 3.24Å; M291-V295 PolarHBondContact O-N 3.35Å; M291-L320 HydrophobicContact CE-CD1 4.23Å; M291-L320 HydrophobicContact CE-CD2 3.9Å; M291-L320 HydrophobicContact CE-CG 4.21Å; M291-I324 HydrophobicContact CB-CD1 3.8Å; M291-I324 HydrophobicContact CB-CG1 4.32Å |
| 292 | I | 93.7 | Very high | 90.8 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.1 | -47.7 | 172.4 | -76.5 | 158.5 | 0 | 0 | 0 | 110.6 | L288 T289 Y294 V295 I296 I324 F328 P346 E348 L349 F354 | L288-I292 WeakPolarHBondContact O-CD1 3.38Å; L288-I292 WeakPolarHBondContact O-CG1 3.47Å; L288-I292 PolarHBondContact O-N 3.29Å; T289-I292 WeakPolarHBondContact O-CB 3.35Å; T289-I292 PolarHBondContact O-N 3.05Å; I292-Y294 VanDerWaalsContact C-N 3.33Å; I292-Y294 PolarHBondContact O-N 3.41Å; I292-V295 PolarHBondContact O-N 2.82Å; I292-I296 HydrophobicContact CG2-CD1 3.82Å; I292-I296 WeakPolarHBondContact O-CG1 3.08Å; I292-I296 PolarHBondContact O-N 2.99Å; I292-I324 HydrophobicContact CD1-CG2 4.12Å; I292-I324 HydrophobicContact CG1-CD1 4.36Å; I292-I324 HydrophobicContact CG1-CG2 3.9Å; I292-F328 HydrophobicContact CD1-CE2 3.89Å; I292-F328 HydrophobicContact CD1-CZ 4.19Å; I292-P346 HydrophobicContact CD1-CB 3.81Å; I292-P346 HydrophobicContact CD1-CG 3.6Å; I292-E348 HydrophobicContact CG2-CB 3.75Å; I292-E348 HydrophobicContact CG2-CG 4.19Å; I292-L349 HydrophobicContact CD1-CD1 3.43Å; I292-L349 VanDerWaalsContact CD1-CD1 3.43Å; I292-L349 HydrophobicContact CD1-CG 3.75Å; I292-L349 HydrophobicContact CG1-CD1 4.37Å; I292-L349 HydrophobicContact CG1-CG 4.44Å; I292-F354 HydrophobicContact CG2-CE2 3.82Å; I292-F354 HydrophobicContact CG2-CZ 3.83Å |
| 293 | Q | 92.5 | Very high | 89.4 | Confident | 94 Ų | 94 | 46.6 Ų | 46.6 | 44% | 0.439 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.9 | -40.3 | 178 | -71.2 | 176.5 | -11.6 | 0 | 0 | 111.8 | T289 Q290 V295 I296 Q297 E348 | T289-Q293 WeakPolarHBondContact O-CG 3.47Å; T289-Q293 PolarHBondContact O-N 2.71Å; Q290-Q293 PolarHBondContact O-N 3.45Å; Q293-V295 PolarHBondContact O-N 3.01Å; Q293-I296 PolarHBondContact O-N 3.04Å; Q293-Q297 VanDerWaalsContact O-CB 3.31Å; Q293-Q297 WeakPolarHBondContact O-CB 3.48Å; Q293-Q297 PolarHBondContact O-N 3.45Å; Q293-E348 WeakPolarHBondContact CG-OE1 3.42Å; Q293-E348 PolarHBondContact NE2-OE1 3.02Å; Q293-E348 VanDerWaalsContact NE2-OE1 3.14Å |
| 294 | Y | 91.7 | Very high | 87.9 | Confident | 37 Ų | 37 | 52.1 Ų | 52.1 | 15% | 0.145 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.7 | -46.6 | 173.2 | 172.8 | -97.2 | 0 | 0 | 0 | 111.7 | E251 K254 Q290 M291 I292 Q297 K298 Y317 L320 | E251-Y294 WeakPolarHBondContact CG-OH 3.2Å; K254-Y294 HydrophobicContact CD-CD1 4.29Å; K254-Y294 HydrophobicContact CD-CE1 3.91Å; Q290-Y294 WeakPolarHBondContact O-CB 3.47Å; Q290-Y294 PolarHBondContact O-N 2.83Å; M291-Y294 HydrophobicContact CE-CD1 4.4Å; M291-Y294 WeakPolarHBondContact O-CB 3.33Å; M291-Y294 PolarHBondContact O-N 3.48Å; I292-Y294 VanDerWaalsContact C-N 3.33Å; I292-Y294 PolarHBondContact O-N 3.41Å; Y294-Q297 PolarHBondContact O-N 2.95Å; Y294-K298 HydrophobicContact CE1-CG 4.25Å; Y294-K298 HydrophobicContact CE2-CG 4.21Å; Y294-K298 WeakPolarHBondContact O-CB 3.07Å; Y294-K298 VanDerWaalsContact O-CG 3.3Å; Y294-K298 WeakPolarHBondContact O-CG 3.27Å; Y294-K298 PolarHBondContact O-N 3.44Å; Y294-K298 WeakPolarHBondContact OH-CE 3.41Å; Y294-Y317 HydrophobicContact CE1-CE1 4.02Å; Y294-L320 HydrophobicContact CD1-CD2 4.19Å; Y294-L320 HydrophobicContact CE1-CD2 4.07Å |
| 295 | V | 90.8 | Very high | 86.6 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.7 | -48.2 | 177.3 | 175.9 | 0 | 0 | 0 | 0 | 110.3 | M291 I292 Q293 Q297 K298 F299 L320 I324 F354 | M291-V295 WeakPolarHBondContact O-CG2 3.24Å; M291-V295 PolarHBondContact O-N 3.35Å; I292-V295 PolarHBondContact O-N 2.82Å; Q293-V295 PolarHBondContact O-N 3.01Å; V295-Q297 PolarHBondContact O-N 3.44Å; V295-K298 PolarHBondContact O-N 2.9Å; V295-F299 HydrophobicContact CG1-CD2 3.68Å; V295-F299 HydrophobicContact CG1-CE2 3.49Å; V295-F299 VanDerWaalsContact CG1-CE2 3.49Å; V295-F299 WeakPolarHBondContact O-CD2 3.33Å; V295-F299 PolarHBondContact O-N 2.59Å; V295-L320 HydrophobicContact CG2-CD2 3.78Å; V295-L320 HydrophobicContact CG2-CG 4.25Å; V295-I324 HydrophobicContact CG2-CD1 3.98Å; V295-F354 HydrophobicContact CB-CE1 4.46Å; V295-F354 HydrophobicContact CG1-CE1 3.87Å |
| 296 | I | 89.2 | Confident | 85.5 | Confident | 27 Ų | 27 | 59.7 Ų | 59.7 | 14% | 0.138 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.1 | -47 | 179 | -68.1 | 164.1 | 0 | 0 | 0 | 111.3 | I292 Q293 K298 F299 T300 E348 L353 F354 I357 | I292-I296 HydrophobicContact CG2-CD1 3.82Å; I292-I296 WeakPolarHBondContact O-CG1 3.08Å; I292-I296 PolarHBondContact O-N 2.99Å; Q293-I296 PolarHBondContact O-N 3.04Å; I296-K298 VanDerWaalsContact C-N 3.28Å; I296-K298 PolarHBondContact O-N 3.36Å; I296-F299 PolarHBondContact O-N 3.17Å; I296-F299 VanDerWaalsContact O-N 3.15Å; I296-T300 PolarHBondContact O-N 3.24Å; I296-T300 PolarHBondContact O-OG1 3.39Å; I296-T300 VanDerWaalsContact O-OG1 3.07Å; I296-E348 HydrophobicContact CD1-CB 3.64Å; I296-E348 HydrophobicContact CD1-CG 3.59Å; I296-L353 HydrophobicContact CD1-CD2 3.83Å; I296-L353 HydrophobicContact CG1-CD2 4.47Å; I296-F354 HydrophobicContact CD1-CE1 4.44Å; I296-F354 HydrophobicContact CD1-CE2 4.02Å; I296-F354 HydrophobicContact CD1-CZ 3.71Å; I296-F354 HydrophobicContact CG1-CE1 3.76Å; I296-F354 HydrophobicContact CG1-CE2 4.24Å; I296-F354 HydrophobicContact CG1-CZ 3.5Å; I296-F354 VanDerWaalsContact CG1-CZ 3.5Å; I296-I357 HydrophobicContact CG1-CD1 4.32Å; I296-I357 HydrophobicContact CG2-CD1 4.23Å |
| 297 | Q | 89.2 | Confident | 84.5 | Confident | 116 Ų | 116 | 63.3 Ų | 63.3 | 54% | 0.542 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.5 | -41.5 | 179.4 | -172.9 | -176.4 | 16 | 0 | 0 | 111.3 | Q293 Y294 V295 T300 N301 | Q293-Q297 VanDerWaalsContact O-CB 3.31Å; Q293-Q297 WeakPolarHBondContact O-CB 3.48Å; Q293-Q297 PolarHBondContact O-N 3.45Å; Y294-Q297 PolarHBondContact O-N 2.95Å; V295-Q297 PolarHBondContact O-N 3.44Å; Q297-T300 PolarHBondContact O-N 3.17Å; Q297-N301 WeakPolarHBondContact O-CB 3.27Å; Q297-N301 PolarHBondContact O-N 3.2Å; Q297-N301 PolarHBondContact O-ND2 2.99Å |
| 298 | K | 87.9 | Confident | 83.4 | Confident | 63 Ų | 63 | 69.1 Ų | 69.1 | 27% | 0.274 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -63 | -45.4 | 175.4 | -73 | -68 | -165.7 | 174.9 | 0 | 111.5 | Y294 V295 I296 T300 N301 E302 F313 Y317 | Y294-K298 HydrophobicContact CE1-CG 4.25Å; Y294-K298 HydrophobicContact CE2-CG 4.21Å; Y294-K298 WeakPolarHBondContact O-CB 3.07Å; Y294-K298 VanDerWaalsContact O-CG 3.3Å; Y294-K298 WeakPolarHBondContact O-CG 3.27Å; Y294-K298 PolarHBondContact O-N 3.44Å; Y294-K298 WeakPolarHBondContact OH-CE 3.41Å; V295-K298 PolarHBondContact O-N 2.9Å; I296-K298 VanDerWaalsContact C-N 3.28Å; I296-K298 PolarHBondContact O-N 3.36Å; K298-T300 VanDerWaalsContact C-N 3.35Å; K298-T300 PolarHBondContact O-N 3.46Å; K298-N301 PolarHBondContact O-N 3.12Å; K298-E302 PolarHBondContact O-N 3.22Å; K298-F313 HydrophobicContact CB-CE2 4.32Å; K298-F313 HydrophobicContact CB-CZ 4.13Å; K298-F313 VanDerWaalsContact O-CZ 3.27Å; K298-F313 WeakPolarHBondContact O-CZ 3.3Å; K298-Y317 HydrophobicContact CB-CD1 4.11Å; K298-Y317 HydrophobicContact CB-CE1 3.53Å; K298-Y317 HydrophobicContact CB-CE2 4.36Å; K298-Y317 HydrophobicContact CD-CE1 4.41Å; K298-Y317 WeakPolarHBondContact CD-OH 3.18Å; K298-Y317 HydrophobicContact CG-CE1 3.59Å; K298-Y317 WeakPolarHBondContact CG-OH 3.41Å |
| 299 | F | 82.6 | Confident | 82.2 | Confident | 16 Ų | 16 | 75.9 Ų | 75.9 | 7% | 0.07 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 176.2 | -85.7 | -71 | 0 | 0 | 0 | 112.6 | V295 I296 I303 F313 Y314 Y317 I357 L358 | V295-F299 HydrophobicContact CG1-CD2 3.68Å; V295-F299 HydrophobicContact CG1-CE2 3.49Å; V295-F299 VanDerWaalsContact CG1-CE2 3.49Å; V295-F299 WeakPolarHBondContact O-CD2 3.33Å; V295-F299 PolarHBondContact O-N 2.59Å; I296-F299 PolarHBondContact O-N 3.17Å; I296-F299 VanDerWaalsContact O-N 3.15Å; F299-I303 WeakPolarHBondContact O-CG1 3.37Å; F299-F313 HydrophobicContact CD1-CD1 4.38Å; F299-F313 AromaticContact CD1-CE1 3.48Å; F299-F313 HydrophobicContact CD1-CE1 3.48Å; F299-F313 VanDerWaalsContact CD1-CE1 3.48Å; F299-F313 HydrophobicContact CD1-CZ 4.25Å; F299-F313 HydrophobicContact CE1-CD1 4.19Å; F299-F313 AromaticContact CE1-CE1 3.63Å; F299-F313 HydrophobicContact CE1-CE1 3.63Å; F299-F313 HydrophobicContact CG-CE1 4.1Å; F299-F313 HydrophobicContact CG-CZ 4.46Å; F299-F313 HydrophobicContact CZ-CE1 4.39Å; F299-Y314 HydrophobicContact CE1-CD2 4.48Å; F299-Y317 HydrophobicContact CE2-CG 4.31Å; F299-Y317 HydrophobicContact CZ-CG 4.39Å; F299-I357 HydrophobicContact CB-CG2 3.49Å; F299-I357 VanDerWaalsContact CB-CG2 3.49Å; F299-I357 HydrophobicContact CD1-CG2 3.74Å; F299-I357 HydrophobicContact CD2-CG2 3.88Å; F299-I357 HydrophobicContact CG-CG2 3.43Å; F299-I357 VanDerWaalsContact CG-CG2 3.43Å; F299-L358 HydrophobicContact CE1-CD2 3.57Å; F299-L358 HydrophobicContact CE2-CD2 3.95Å; F299-L358 HydrophobicContact CZ-CD2 3.24Å; F299-L358 HydrophobicContact CZ-CG 4.34Å |
| 300 | T | 81.4 | Confident | 81.3 | Confident | 83 Ų | 83 | 78.7 Ų | 78.7 | 51% | 0.509 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -65.7 | -40.3 | -179.8 | -57.6 | 0 | 0 | 0 | 0 | 112.3 | I296 Q297 K298 | I296-T300 PolarHBondContact O-N 3.24Å; I296-T300 PolarHBondContact O-OG1 3.39Å; I296-T300 VanDerWaalsContact O-OG1 3.07Å; Q297-T300 PolarHBondContact O-N 3.17Å; K298-T300 VanDerWaalsContact C-N 3.35Å; K298-T300 PolarHBondContact O-N 3.46Å |
| 301 | N | 80 | Confident | 80.6 | Confident | 106 Ų | 106 | 79 Ų | 79 | 57% | 0.567 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -72.7 | -30.1 | -177.1 | -70.7 | -10 | 0 | 0 | 0 | 113.3 | Q297 K298 | Q297-N301 WeakPolarHBondContact O-CB 3.27Å; Q297-N301 PolarHBondContact O-N 3.2Å; Q297-N301 PolarHBondContact O-ND2 2.99Å; K298-N301 PolarHBondContact O-N 3.12Å |
| 302 | E | 72.6 | Confident | 79.9 | Confident | 59 Ų | 59 | 84.9 Ų | 84.9 | 28% | 0.276 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | 10.9 | -171.7 | -66.8 | -158.2 | -153.9 | 0 | 0 | 115 | K298 Q304 Q305 F313 | K298-E302 PolarHBondContact O-N 3.22Å; E302-Q304 PolarHBondContact O-N 3.24Å; E302-Q305 HydrophobicContact CB-CG 4.33Å; E302-Q305 PolarHBondContact O-N 3.39Å; E302-F313 HydrophobicContact CB-CD2 4.17Å; E302-F313 HydrophobicContact CB-CE1 4.21Å; E302-F313 HydrophobicContact CB-CE2 3.76Å; E302-F313 HydrophobicContact CB-CZ 3.84Å; E302-F313 HydrophobicContact CG-CD2 4.16Å; E302-F313 HydrophobicContact CG-CE2 3.65Å; E302-F313 HydrophobicContact CG-CZ 4.14Å; E302-F313 VanDerWaalsContact OE1-CE2 3.3Å; E302-F313 WeakPolarHBondContact OE1-CE2 3.44Å; E302-F313 WeakPolarHBondContact OE2-CD2 3.4Å; E302-F313 VanDerWaalsContact OE2-CE2 3.24Å; E302-F313 WeakPolarHBondContact OE2-CE2 3.42Å |
| 303 | I | 65.3 | Low | 79.5 | Confident | 117 Ų | 117 | 85.8 Ų | 85.8 | 60% | 0.6 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | -24.3 | 176.9 | -63.3 | 176.3 | 0 | 0 | 0 | 112.4 | F299 | F299-I303 WeakPolarHBondContact O-CG1 3.37Š|
| 304 | Q | 64.5 | Low | 79.1 | Confident | 188 Ų | 188 | 83.6 Ų | 83.6 | 88% | 0.879 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | 1.3 | -175 | -61.6 | -176.1 | -17.1 | 0 | 0 | 115.2 | E302 | E302-Q304 PolarHBondContact O-N 3.24Š|
| 305 | Q | 68.6 | Low | 78.8 | Confident | 99 Ų | 99 | 88.8 Ų | 88.8 | 46% | 0.463 | 43% | 0.43 | S | S | . | . | S | Bend | trans | -84.4 | 156.2 | -173.8 | -68.6 | -66.5 | -11 | 0 | 0 | 114.3 | E302 | E302-Q305 HydrophobicContact CB-CG 4.33Å; E302-Q305 PolarHBondContact O-N 3.39Å |
| 306 | P | 72.7 | Confident | 78.7 | Confident | 74 Ų | 74 | 93.8 Ų | 93.8 | 48% | 0.481 | 45% | 0.452 | S | S | . | . | trans | -59.5 | 154.2 | 175.9 | -16.8 | 26.8 | 0 | 0 | 0 | 113.2 | I308 Y309 K310 | P306-I308 VanDerWaalsContact C-N 3.34Å; P306-I308 PolarHBondContact O-N 3.5Å; P306-I308 VanDerWaalsContact O-N 3.17Å; P306-Y309 HydrophobicContact CB-CD2 4.06Å; P306-Y309 HydrophobicContact CG-CD2 3.87Å; P306-Y309 HydrophobicContact CG-CE2 4.42Å; P306-Y309 PolarHBondContact O-N 3.45Å; P306-Y309 VanDerWaalsContact O-N 3.13Å; P306-K310 PolarHBondContact O-N 2.96Å | ||
| 307 | L | 74.6 | Confident | 78.6 | Confident | 131 Ų | 131 | 92.6 Ų | 92.6 | 69% | 0.686 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -53.5 | -41.7 | -172.3 | -172.7 | 69.3 | 0 | 0 | 0 | 114.5 | K310 I311 | L307-K310 WeakPolarHBondContact O-CB 3.48Å; L307-K310 PolarHBondContact O-N 2.87Å; L307-I311 WeakPolarHBondContact O-CG1 3.48Å; L307-I311 PolarHBondContact O-N 3.19Å |
| 308 | I | 72.8 | Confident | 78.6 | Confident | 124 Ų | 124 | 88.5 Ų | 88.5 | 64% | 0.636 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -64.8 | -45.8 | -178.4 | -63.8 | 173.3 | 0 | 0 | 0 | 110.8 | P306 K310 I311 Q312 | P306-I308 VanDerWaalsContact C-N 3.34Å; P306-I308 PolarHBondContact O-N 3.5Å; P306-I308 VanDerWaalsContact O-N 3.17Å; I308-K310 VanDerWaalsContact C-N 3.28Å; I308-K310 PolarHBondContact O-N 3.21Å; I308-I311 PolarHBondContact O-N 3.32Å; I308-Q312 PolarHBondContact O-N 3.06Å |
| 309 | Y | 71.8 | Confident | 78.8 | Confident | 142 Ų | 142 | 91.8 Ų | 91.8 | 56% | 0.557 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -63.2 | -38.6 | 175.2 | -68.7 | -71.9 | 0 | 0 | 0 | 110.8 | P306 I311 Q312 F313 | P306-Y309 HydrophobicContact CB-CD2 4.06Å; P306-Y309 HydrophobicContact CG-CD2 3.87Å; P306-Y309 HydrophobicContact CG-CE2 4.42Å; P306-Y309 PolarHBondContact O-N 3.45Å; P306-Y309 VanDerWaalsContact O-N 3.13Å; Y309-I311 VanDerWaalsContact C-N 3.35Å; Y309-I311 PolarHBondContact O-N 3.41Å; Y309-Q312 PolarHBondContact O-N 3.13Å; Y309-F313 WeakPolarHBondContact O-CB 3.25Å; Y309-F313 PolarHBondContact O-N 3.33Å |
| 310 | K | 75.5 | Confident | 79.2 | Confident | 88 Ų | 88 | 91.4 Ų | 91.4 | 38% | 0.383 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58.7 | -40.6 | 176.1 | -160.5 | 174.5 | -175.8 | 173 | 0 | 112.9 | P306 L307 I308 Y314 | P306-K310 PolarHBondContact O-N 2.96Å; L307-K310 WeakPolarHBondContact O-CB 3.48Å; L307-K310 PolarHBondContact O-N 2.87Å; I308-K310 VanDerWaalsContact C-N 3.28Å; I308-K310 PolarHBondContact O-N 3.21Å; K310-Y314 WeakPolarHBondContact O-CB 3.42Å; K310-Y314 PolarHBondContact O-N 3.34Å |
| 311 | I | 79.6 | Confident | 79.8 | Confident | 89 Ų | 89 | 87.5 Ų | 87.5 | 46% | 0.456 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -68.8 | -46 | 178.5 | -65.6 | 167.7 | 0 | 0 | 0 | 111.8 | L307 I308 Y309 Y314 K315 | L307-I311 WeakPolarHBondContact O-CG1 3.48Å; L307-I311 PolarHBondContact O-N 3.19Å; I308-I311 PolarHBondContact O-N 3.32Å; Y309-I311 VanDerWaalsContact C-N 3.35Å; Y309-I311 PolarHBondContact O-N 3.41Å; I311-Y314 WeakPolarHBondContact O-CB 3.34Å; I311-Y314 PolarHBondContact O-N 3.36Å; I311-K315 WeakPolarHBondContact O-CG 3.41Å; I311-K315 PolarHBondContact O-N 2.81Å |
| 312 | Q | 82.1 | Confident | 80.4 | Confident | 129 Ų | 129 | 85.8 Ų | 85.8 | 60% | 0.603 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -65.9 | -44.5 | 179.5 | -70.5 | -175.7 | -11 | 0 | 0 | 111.1 | I308 Y309 K315 K316 | I308-Q312 PolarHBondContact O-N 3.06Å; Y309-Q312 PolarHBondContact O-N 3.13Å; Q312-K315 PolarHBondContact O-N 2.96Å; Q312-K316 WeakPolarHBondContact O-CB 3.21Å; Q312-K316 PolarHBondContact O-N 3.49Å |
| 313 | F | 83.7 | Confident | 81.5 | Confident | 20 Ų | 20 | 83.7 Ų | 83.7 | 9% | 0.088 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -54.4 | -52.2 | 172.3 | 176.2 | -90.7 | 0 | 0 | 0 | 111 | K298 F299 E302 Y309 K315 K316 Y317 | K298-F313 HydrophobicContact CB-CE2 4.32Å; K298-F313 HydrophobicContact CB-CZ 4.13Å; K298-F313 VanDerWaalsContact O-CZ 3.27Å; K298-F313 WeakPolarHBondContact O-CZ 3.3Å; F299-F313 HydrophobicContact CD1-CD1 4.38Å; F299-F313 AromaticContact CD1-CE1 3.48Å; F299-F313 HydrophobicContact CD1-CE1 3.48Å; F299-F313 VanDerWaalsContact CD1-CE1 3.48Å; F299-F313 HydrophobicContact CD1-CZ 4.25Å; F299-F313 HydrophobicContact CE1-CD1 4.19Å; F299-F313 AromaticContact CE1-CE1 3.63Å; F299-F313 HydrophobicContact CE1-CE1 3.63Å; F299-F313 HydrophobicContact CG-CE1 4.1Å; F299-F313 HydrophobicContact CG-CZ 4.46Å; F299-F313 HydrophobicContact CZ-CE1 4.39Å; E302-F313 HydrophobicContact CB-CD2 4.17Å; E302-F313 HydrophobicContact CB-CE1 4.21Å; E302-F313 HydrophobicContact CB-CE2 3.76Å; E302-F313 HydrophobicContact CB-CZ 3.84Å; E302-F313 HydrophobicContact CG-CD2 4.16Å; E302-F313 HydrophobicContact CG-CE2 3.65Å; E302-F313 HydrophobicContact CG-CZ 4.14Å; E302-F313 VanDerWaalsContact OE1-CE2 3.3Å; E302-F313 WeakPolarHBondContact OE1-CE2 3.44Å; E302-F313 WeakPolarHBondContact OE2-CD2 3.4Å; E302-F313 VanDerWaalsContact OE2-CE2 3.24Å; E302-F313 WeakPolarHBondContact OE2-CE2 3.42Å; Y309-F313 WeakPolarHBondContact O-CB 3.25Å; Y309-F313 PolarHBondContact O-N 3.33Å; F313-K315 PolarHBondContact O-N 3.35Å; F313-K316 WeakPolarHBondContact O-CB 3.39Å; F313-K316 PolarHBondContact O-N 3.11Å; F313-K316 VanDerWaalsContact O-N 3.08Å; F313-Y317 HydrophobicContact CD1-CD2 4.12Å; F313-Y317 AromaticContact CD2-CD2 3.52Å; F313-Y317 HydrophobicContact CD2-CD2 3.52Å; F313-Y317 AromaticContact CD2-CE2 3.22Å; F313-Y317 HydrophobicContact CD2-CE2 3.22Å; F313-Y317 AromaticContact CE1-CD2 3.9Å; F313-Y317 HydrophobicContact CE1-CD2 3.9Å; F313-Y317 HydrophobicContact CE1-CE2 4.39Å; F313-Y317 AromaticContact CE2-CD2 3.28Å; F313-Y317 HydrophobicContact CE2-CD2 3.28Å; F313-Y317 AromaticContact CE2-CE2 2.93Å; F313-Y317 HydrophobicContact CE2-CE2 2.93Å; F313-Y317 HydrophobicContact CE2-CG 4.37Å; F313-Y317 AromaticContact CE2-CZ 3.74Å; F313-Y317 AromaticContact CG-CD2 3.91Å; F313-Y317 HydrophobicContact CG-CD2 3.91Å; F313-Y317 HydrophobicContact CG-CE2 4.07Å; F313-Y317 AromaticContact CZ-CD2 3.44Å; F313-Y317 HydrophobicContact CZ-CD2 3.44Å; F313-Y317 VanDerWaalsContact CZ-CD2 3.44Å; F313-Y317 AromaticContact CZ-CE2 3.57Å; F313-Y317 HydrophobicContact CZ-CE2 3.57Å; F313-Y317 HydrophobicContact CZ-CG 4.21Å; F313-Y317 VanDerWaalsContact O-CD2 3.3Å; F313-Y317 WeakPolarHBondContact O-CD2 3.35Å; F313-Y317 PolarHBondContact O-N 2.97Å |
| 314 | Y | 83.8 | Confident | 82.9 | Confident | 47 Ų | 47 | 78.1 Ų | 78.1 | 18% | 0.184 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -52.8 | -52.2 | 177.8 | 179.1 | -89.1 | 0 | 0 | 0 | 112.5 | F299 K310 I311 K316 K318 L358 D361 | F299-Y314 HydrophobicContact CE1-CD2 4.48Å; K310-Y314 WeakPolarHBondContact O-CB 3.42Å; K310-Y314 PolarHBondContact O-N 3.34Å; I311-Y314 WeakPolarHBondContact O-CB 3.34Å; I311-Y314 PolarHBondContact O-N 3.36Å; Y314-K316 VanDerWaalsContact C-N 3.27Å; Y314-K316 PolarHBondContact O-N 3.46Å; Y314-K318 HydrophobicContact CE1-CB 4.47Å; Y314-K318 HydrophobicContact CE1-CD 3.87Å; Y314-K318 WeakPolarHBondContact O-CB 3.38Å; Y314-K318 PolarHBondContact O-N 3.24Å; Y314-L358 HydrophobicContact CD2-CD2 3.82Å; Y314-L358 HydrophobicContact CE2-CB 3.83Å; Y314-L358 HydrophobicContact CE2-CD2 3.3Å; Y314-L358 HydrophobicContact CE2-CG 4.17Å; Y314-L358 PolarHBondContact OH-O 2.84Å; Y314-D361 WeakPolarHBondContact OH-CB 3.22Å; Y314-D361 PolarHBondContact OH-OD2 3.31Å |
| 315 | K | 86.4 | Confident | 84.4 | Confident | 146 Ų | 146 | 69.4 Ų | 69.4 | 64% | 0.635 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -60.1 | -38.7 | 178.9 | -73.5 | -178.5 | 178.9 | -176.9 | 0 | 112.2 | I311 Q312 F313 R319 | I311-K315 WeakPolarHBondContact O-CG 3.41Å; I311-K315 PolarHBondContact O-N 2.81Å; Q312-K315 PolarHBondContact O-N 2.96Å; F313-K315 PolarHBondContact O-N 3.35Å; K315-R319 WeakPolarHBondContact O-CB 3.48Å; K315-R319 PolarHBondContact O-N 2.89Å; K315-R319 VanDerWaalsContact O-N 3.11Å |
| 316 | K | 87.7 | Confident | 85.6 | Confident | 106 Ų | 106 | 67.7 Ų | 67.7 | 46% | 0.461 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -66.4 | -51.6 | -177.4 | -165.6 | 179.3 | -168 | -157.2 | 0 | 111.6 | E251 Q312 F313 Y314 R319 L320 | E251-K316 VanDerWaalsContact CD-CE 3.41Å; E251-K316 IonicContact OE1-NZ 2.73Å; E251-K316 PolarHBondContact OE1-NZ 3.12Å; E251-K316 WeakPolarHBondContact OE2-CD 3.34Å; E251-K316 WeakPolarHBondContact OE2-CE 3.41Å; E251-K316 WeakPolarHBondContact OE2-CG 3.22Å; E251-K316 IonicContact OE2-NZ 3.82Å; E251-K316 PolarHBondContact OE2-NZ 3.31Å; Q312-K316 WeakPolarHBondContact O-CB 3.21Å; Q312-K316 PolarHBondContact O-N 3.49Å; F313-K316 WeakPolarHBondContact O-CB 3.39Å; F313-K316 PolarHBondContact O-N 3.11Å; F313-K316 VanDerWaalsContact O-N 3.08Å; Y314-K316 VanDerWaalsContact C-N 3.27Å; Y314-K316 PolarHBondContact O-N 3.46Å; K316-R319 PolarHBondContact O-N 3.4Å; K316-L320 PolarHBondContact O-N 2.98Å |
| 317 | Y | 88.4 | Confident | 86.8 | Confident | 1 Ų | 1 | 64.1 Ų | 64.1 | 0% | 0.004 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -78.6 | -29 | -178.1 | -70.5 | -80.5 | 0 | 0 | 0 | 113.3 | E251 Y294 K298 F299 F313 R319 L320 L321 | E251-Y317 PolarHBondContact OE1-OH 2.97Å; Y294-Y317 HydrophobicContact CE1-CE1 4.02Å; K298-Y317 HydrophobicContact CB-CD1 4.11Å; K298-Y317 HydrophobicContact CB-CE1 3.53Å; K298-Y317 HydrophobicContact CB-CE2 4.36Å; K298-Y317 HydrophobicContact CD-CE1 4.41Å; K298-Y317 WeakPolarHBondContact CD-OH 3.18Å; K298-Y317 HydrophobicContact CG-CE1 3.59Å; K298-Y317 WeakPolarHBondContact CG-OH 3.41Å; F299-Y317 HydrophobicContact CE2-CG 4.31Å; F299-Y317 HydrophobicContact CZ-CG 4.39Å; F313-Y317 HydrophobicContact CD1-CD2 4.12Å; F313-Y317 AromaticContact CD2-CD2 3.52Å; F313-Y317 HydrophobicContact CD2-CD2 3.52Å; F313-Y317 AromaticContact CD2-CE2 3.22Å; F313-Y317 HydrophobicContact CD2-CE2 3.22Å; F313-Y317 AromaticContact CE1-CD2 3.9Å; F313-Y317 HydrophobicContact CE1-CD2 3.9Å; F313-Y317 HydrophobicContact CE1-CE2 4.39Å; F313-Y317 AromaticContact CE2-CD2 3.28Å; F313-Y317 HydrophobicContact CE2-CD2 3.28Å; F313-Y317 AromaticContact CE2-CE2 2.93Å; F313-Y317 HydrophobicContact CE2-CE2 2.93Å; F313-Y317 HydrophobicContact CE2-CG 4.37Å; F313-Y317 AromaticContact CE2-CZ 3.74Å; F313-Y317 AromaticContact CG-CD2 3.91Å; F313-Y317 HydrophobicContact CG-CD2 3.91Å; F313-Y317 HydrophobicContact CG-CE2 4.07Å; F313-Y317 AromaticContact CZ-CD2 3.44Å; F313-Y317 HydrophobicContact CZ-CD2 3.44Å; F313-Y317 VanDerWaalsContact CZ-CD2 3.44Å; F313-Y317 AromaticContact CZ-CE2 3.57Å; F313-Y317 HydrophobicContact CZ-CE2 3.57Å; F313-Y317 HydrophobicContact CZ-CG 4.21Å; F313-Y317 VanDerWaalsContact O-CD2 3.3Å; F313-Y317 WeakPolarHBondContact O-CD2 3.35Å; F313-Y317 PolarHBondContact O-N 2.97Å; Y317-R319 VanDerWaalsContact C-N 3.29Å; Y317-R319 PolarHBondContact O-N 3.44Å; Y317-L320 HydrophobicContact CD1-CD2 4.33Å; Y317-L320 PolarHBondContact O-N 2.98Å; Y317-L321 WeakPolarHBondContact O-CB 3.47Å; Y317-L321 PolarHBondContact O-N 3.46Å |
| 318 | K | 89.6 | Confident | 87.8 | Confident | 30 Ų | 30 | 57.9 Ų | 57.9 | 13% | 0.13 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.9 | -42.6 | 166.2 | 179.5 | 176.4 | 173.8 | 178.8 | 0 | 110.9 | Y314 L321 Q322 D361 D363 V364 W367 | Y314-K318 HydrophobicContact CE1-CB 4.47Å; Y314-K318 HydrophobicContact CE1-CD 3.87Å; Y314-K318 WeakPolarHBondContact O-CB 3.38Å; Y314-K318 PolarHBondContact O-N 3.24Å; K318-L321 PolarHBondContact O-N 3.34Å; K318-Q322 PolarHBondContact O-N 3.45Å; K318-D361 WeakPolarHBondContact CE-OD1 3.34Å; K318-D361 WeakPolarHBondContact CE-OD2 3.36Å; K318-D361 IonicContact NZ-OD1 3.42Å; K318-D361 PolarHBondContact NZ-OD1 3.15Å; K318-D361 IonicContact NZ-OD2 2.73Å; K318-D361 PolarHBondContact NZ-OD2 3.34Å; K318-D363 IonicContact NZ-OD2 3.87Å; K318-D363 PolarHBondContact NZ-OD2 3.32Å; K318-V364 HydrophobicContact CD-CG2 4.37Å; K318-V364 HydrophobicContact CG-CG2 4.23Å; K318-W367 HydrophobicContact CG-CH2 4.42Å; K318-W367 HydrophobicContact CG-CZ3 4.41Å |
| 319 | R | 90.7 | Very high | 88.9 | Confident | 132 Ų | 132 | 54.6 Ų | 54.6 | 50% | 0.498 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -67.2 | -36.6 | 177 | -171 | 174.7 | -175.5 | 144.1 | 2.7 | 112.5 | K315 K316 Y317 Q322 F323 | K315-R319 WeakPolarHBondContact O-CB 3.48Å; K315-R319 PolarHBondContact O-N 2.89Å; K315-R319 VanDerWaalsContact O-N 3.11Å; K316-R319 PolarHBondContact O-N 3.4Å; Y317-R319 VanDerWaalsContact C-N 3.29Å; Y317-R319 PolarHBondContact O-N 3.44Å; R319-Q322 WeakPolarHBondContact O-CB 3.46Å; R319-Q322 PolarHBondContact O-N 3.22Å; R319-F323 HydrophobicContact CG-CD2 4.32Å; R319-F323 HydrophobicContact CG-CE2 3.64Å; R319-F323 HydrophobicContact CG-CZ 4.19Å; R319-F323 WeakPolarHBondContact O-CD2 2.94Å; R319-F323 PolarHBondContact O-N 3.06Å |
| 320 | L | 92.3 | Very high | 90 | Very high | 8 Ų | 8 | 49.6 Ų | 49.6 | 4% | 0.042 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.5 | -44.3 | 174.2 | -164.7 | 68 | 0 | 0 | 0 | 111 | K254 K255 L258 M291 Y294 V295 K316 Y317 Q322 F323 I324 | K254-L320 HydrophobicContact CB-CD1 4.48Å; K255-L320 HydrophobicContact CB-CD1 4.29Å; L258-L320 HydrophobicContact CD1-CD1 3.55Å; L258-L320 HydrophobicContact CD1-CG 4.05Å; M291-L320 HydrophobicContact CE-CD1 4.23Å; M291-L320 HydrophobicContact CE-CD2 3.9Å; M291-L320 HydrophobicContact CE-CG 4.21Å; Y294-L320 HydrophobicContact CD1-CD2 4.19Å; Y294-L320 HydrophobicContact CE1-CD2 4.07Å; V295-L320 HydrophobicContact CG2-CD2 3.78Å; V295-L320 HydrophobicContact CG2-CG 4.25Å; K316-L320 PolarHBondContact O-N 2.98Å; Y317-L320 HydrophobicContact CD1-CD2 4.33Å; Y317-L320 PolarHBondContact O-N 2.98Å; L320-Q322 VanDerWaalsContact C-N 3.32Å; L320-Q322 PolarHBondContact O-N 2.93Å; L320-F323 PolarHBondContact O-N 3.29Å; L320-I324 WeakPolarHBondContact O-CG1 3.33Å; L320-I324 PolarHBondContact O-N 2.87Å |
| 321 | L | 92.8 | Very high | 90.9 | Very high | 2 Ų | 2 | 45.4 Ų | 45.4 | 1% | 0.01 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.1 | -42.2 | 173.9 | -179.3 | 63.3 | 0 | 0 | 0 | 111.8 | Y317 K318 F323 I324 M325 F354 L358 V364 | Y317-L321 WeakPolarHBondContact O-CB 3.47Å; Y317-L321 PolarHBondContact O-N 3.46Å; K318-L321 PolarHBondContact O-N 3.34Å; L321-F323 VanDerWaalsContact C-N 3.32Å; L321-F323 PolarHBondContact O-N 3.38Å; L321-I324 WeakPolarHBondContact O-CB 3.4Å; L321-I324 PolarHBondContact O-N 3.1Å; L321-I324 VanDerWaalsContact O-N 3.11Å; L321-M325 HydrophobicContact CD1-CG 4.36Å; L321-M325 HydrophobicContact CG-CG 4.34Å; L321-M325 WeakPolarHBondContact O-CG 3.46Å; L321-M325 PolarHBondContact O-N 2.63Å; L321-F354 HydrophobicContact CD1-CD1 4.26Å; L321-F354 HydrophobicContact CD1-CE1 4.05Å; L321-F354 HydrophobicContact CD1-CE2 4.32Å; L321-F354 HydrophobicContact CD1-CG 4.48Å; L321-F354 HydrophobicContact CD1-CZ 4.06Å; L321-F354 HydrophobicContact CD2-CB 4.24Å; L321-F354 HydrophobicContact CD2-CD1 3.68Å; L321-F354 HydrophobicContact CD2-CE1 4.18Å; L321-F354 HydrophobicContact CD2-CG 3.99Å; L321-L358 HydrophobicContact CD2-CD1 3.75Å; L321-V364 HydrophobicContact CD2-CG1 3.91Å; L321-V364 HydrophobicContact CD2-CG2 4.41Å |
| 322 | Q | 93.6 | Very high | 91.6 | Very high | 69 Ų | 69 | 41.1 Ų | 41.1 | 32% | 0.322 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -53.9 | -47.7 | 176 | -173.7 | -169.7 | -23.9 | 0 | 0 | 111.7 | K318 R319 L320 I324 M325 E326 W367 | K318-Q322 PolarHBondContact O-N 3.45Å; R319-Q322 WeakPolarHBondContact O-CB 3.46Å; R319-Q322 PolarHBondContact O-N 3.22Å; L320-Q322 VanDerWaalsContact C-N 3.32Å; L320-Q322 PolarHBondContact O-N 2.93Å; Q322-I324 VanDerWaalsContact C-N 3.32Å; Q322-I324 PolarHBondContact O-N 3.46Å; Q322-M325 WeakPolarHBondContact O-CB 3.46Å; Q322-M325 PolarHBondContact O-N 3.3Å; Q322-E326 PolarHBondContact NE2-OE1 3.27Å; Q322-E326 WeakPolarHBondContact O-CG 3.38Å; Q322-E326 PolarHBondContact O-N 3.33Å; Q322-W367 HydrophobicContact CB-CH2 3.7Å; Q322-W367 HydrophobicContact CB-CZ2 4.49Å; Q322-W367 HydrophobicContact CB-CZ3 3.86Å; Q322-W367 HydrophobicContact CG-CH2 3.75Å; Q322-W367 HydrophobicContact CG-CZ2 4.05Å; Q322-W367 HydrophobicContact CG-CZ3 4.23Å |
| 323 | F | 94.8 | Very high | 92.2 | Very high | 16 Ų | 16 | 39.5 Ų | 39.5 | 7% | 0.07 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.9 | -30.8 | 179.3 | -63 | -58 | 0 | 0 | 0 | 113.3 | K255 L258 I259 R319 L320 L321 E326 C327 | K255-F323 HydrophobicContact CD-CE2 4.27Å; K255-F323 HydrophobicContact CG-CD2 4.15Å; K255-F323 HydrophobicContact CG-CE2 3.78Å; L258-F323 HydrophobicContact CB-CB 3.77Å; L258-F323 HydrophobicContact CD1-CB 4.21Å; I259-F323 HydrophobicContact CD1-CE1 4.09Å; I259-F323 HydrophobicContact CD1-CE2 4.05Å; I259-F323 HydrophobicContact CD1-CZ 3.73Å; I259-F323 HydrophobicContact CG1-CD1 3.77Å; I259-F323 HydrophobicContact CG1-CD2 4.24Å; I259-F323 HydrophobicContact CG1-CE1 3.56Å; I259-F323 HydrophobicContact CG1-CE2 4.04Å; I259-F323 HydrophobicContact CG1-CG 4.12Å; I259-F323 HydrophobicContact CG1-CZ 3.69Å; R319-F323 HydrophobicContact CG-CD2 4.32Å; R319-F323 HydrophobicContact CG-CE2 3.64Å; R319-F323 HydrophobicContact CG-CZ 4.19Å; R319-F323 WeakPolarHBondContact O-CD2 2.94Å; R319-F323 PolarHBondContact O-N 3.06Å; L320-F323 PolarHBondContact O-N 3.29Å; L321-F323 VanDerWaalsContact C-N 3.32Å; L321-F323 PolarHBondContact O-N 3.38Å; F323-E326 WeakPolarHBondContact CD1-OE2 3.37Å; F323-C327 PolarHBondContact O-N 2.86Å; F323-C327 VanDerWaalsContact O-N 3.17Å; F323-C327 PolarHBondContact O-SG 3.38Å |
| 324 | I | 95.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.8 | -46.1 | 171.3 | -64.4 | 169.5 | 0 | 0 | 0 | 109.8 | L258 M291 I292 V295 L320 L321 Q322 E326 C327 F328 | L258-I324 HydrophobicContact CD1-CD1 4.43Å; L258-I324 HydrophobicContact CD1-CG1 3.69Å; L258-I324 HydrophobicContact CD2-CG1 3.99Å; M291-I324 HydrophobicContact CB-CD1 3.8Å; M291-I324 HydrophobicContact CB-CG1 4.32Å; I292-I324 HydrophobicContact CD1-CG2 4.12Å; I292-I324 HydrophobicContact CG1-CD1 4.36Å; I292-I324 HydrophobicContact CG1-CG2 3.9Å; V295-I324 HydrophobicContact CG2-CD1 3.98Å; L320-I324 WeakPolarHBondContact O-CG1 3.33Å; L320-I324 PolarHBondContact O-N 2.87Å; L321-I324 WeakPolarHBondContact O-CB 3.4Å; L321-I324 PolarHBondContact O-N 3.1Å; L321-I324 VanDerWaalsContact O-N 3.11Å; Q322-I324 VanDerWaalsContact C-N 3.32Å; Q322-I324 PolarHBondContact O-N 3.46Å; I324-E326 VanDerWaalsContact C-N 3.35Å; I324-E326 PolarHBondContact O-N 3.25Å; I324-C327 WeakPolarHBondContact O-CB 3.33Å; I324-C327 PolarHBondContact O-N 3.13Å; I324-C327 VanDerWaalsContact O-N 3.16Å; I324-F328 HydrophobicContact CG2-CD2 3.99Å; I324-F328 HydrophobicContact CG2-CE2 3.61Å; I324-F328 VanDerWaalsContact O-CD2 3.26Å; I324-F328 WeakPolarHBondContact O-CD2 3.45Å; I324-F328 PolarHBondContact O-N 2.7Å |
| 325 | M | 94.6 | Very high | 93 | Very high | 5 Ų | 5 | 42.9 Ų | 42.9 | 3% | 0.025 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.3 | -42.3 | 177.4 | -66.1 | -58.1 | -63.5 | 0 | 0 | 111.3 | L321 Q322 C327 F328 D329 L349 W367 L368 M371 | L321-M325 HydrophobicContact CD1-CG 4.36Å; L321-M325 HydrophobicContact CG-CG 4.34Å; L321-M325 WeakPolarHBondContact O-CG 3.46Å; L321-M325 PolarHBondContact O-N 2.63Å; Q322-M325 WeakPolarHBondContact O-CB 3.46Å; Q322-M325 PolarHBondContact O-N 3.3Å; M325-C327 PolarHBondContact O-N 2.88Å; M325-F328 CarbonylContact O-C 3.41Å; M325-F328 PolarHBondContact O-N 3.18Å; M325-D329 PolarHBondContact O-N 3.23Å; M325-L349 HydrophobicContact SD-CD1 4.25Å; M325-L349 HydrophobicContact SD-CD2 3.99Å; M325-W367 HydrophobicContact CE-CB 4.27Å; M325-L368 HydrophobicContact CE-CD2 4.2Å; M325-L368 HydrophobicContact SD-CD2 4.43Å; M325-M371 HydrophobicContact CE-CB 4.07Å; M325-M371 HydrophobicContact CE-CE 3.96Å; M325-M371 HydrophobicContact CE-CG 4.33Å; M325-M371 HydrophobicContact CE-SD 3.56Å; M325-M371 VanDerWaalsContact CE-SD 3.56Å; M325-M371 HydrophobicContact SD-SD 4.39Å |
| 326 | E | 95.5 | Very high | 93.3 | Very high | 62 Ų | 62 | 39.9 Ų | 39.9 | 29% | 0.29 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -56.7 | -38.9 | 174.3 | -74.2 | 172.6 | -163.1 | 0 | 0 | 111.6 | A262 Q322 F323 I324 D329 Q330 | A262-E326 HydrophobicContact CB-CB 4.29Å; Q322-E326 PolarHBondContact NE2-OE1 3.27Å; Q322-E326 WeakPolarHBondContact O-CG 3.38Å; Q322-E326 PolarHBondContact O-N 3.33Å; F323-E326 WeakPolarHBondContact CD1-OE2 3.37Å; I324-E326 VanDerWaalsContact C-N 3.35Å; I324-E326 PolarHBondContact O-N 3.25Å; E326-D329 PolarHBondContact O-N 3.26Å; E326-Q330 VanDerWaalsContact O-CG 3.32Å; E326-Q330 WeakPolarHBondContact O-CG 3.34Å; E326-Q330 PolarHBondContact O-N 3.15Å |
| 327 | C | 96.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62 | -44.6 | 173.7 | -65.2 | 0 | 0 | 0 | 0 | 112 | L265 L288 F323 I324 M325 Q330 L331 | L265-C327 HydrophobicContact CD1-CB 3.83Å; L288-C327 HydrophobicContact CD1-CB 4.03Å; L288-C327 HydrophobicContact CD2-CB 4.02Å; F323-C327 PolarHBondContact O-N 2.86Å; F323-C327 VanDerWaalsContact O-N 3.17Å; F323-C327 PolarHBondContact O-SG 3.38Å; I324-C327 WeakPolarHBondContact O-CB 3.33Å; I324-C327 PolarHBondContact O-N 3.13Å; I324-C327 VanDerWaalsContact O-N 3.16Å; M325-C327 PolarHBondContact O-N 2.88Å; C327-Q330 PolarHBondContact O-N 3.18Å; C327-L331 WeakPolarHBondContact O-CG 3.45Å; C327-L331 PolarHBondContact O-N 3.01Å |
| 328 | F | 96.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -66.4 | -40.9 | 176.9 | -73.4 | -66.6 | 0 | 0 | 0 | 112.3 | I285 L288 I292 I324 M325 Q330 L331 I332 L341 L345 P346 L349 M371 | I285-F328 HydrophobicContact CD1-CE1 4.02Å; L288-F328 HydrophobicContact CB-CE2 4.12Å; L288-F328 HydrophobicContact CB-CZ 3.73Å; L288-F328 HydrophobicContact CD1-CD1 4.32Å; L288-F328 HydrophobicContact CD1-CE1 3.86Å; L288-F328 HydrophobicContact CD1-CE2 4.07Å; L288-F328 HydrophobicContact CD1-CZ 3.73Å; L288-F328 HydrophobicContact CG-CZ 4.37Å; I292-F328 HydrophobicContact CD1-CE2 3.89Å; I292-F328 HydrophobicContact CD1-CZ 4.19Å; I324-F328 HydrophobicContact CG2-CD2 3.99Å; I324-F328 HydrophobicContact CG2-CE2 3.61Å; I324-F328 VanDerWaalsContact O-CD2 3.26Å; I324-F328 WeakPolarHBondContact O-CD2 3.45Å; I324-F328 PolarHBondContact O-N 2.7Å; M325-F328 CarbonylContact O-C 3.41Å; M325-F328 PolarHBondContact O-N 3.18Å; F328-Q330 VanDerWaalsContact C-N 3.28Å; F328-Q330 PolarHBondContact O-N 2.92Å; F328-L331 HydrophobicContact CD1-CD1 4.28Å; F328-L331 WeakPolarHBondContact O-CA 3.48Å; F328-L331 WeakPolarHBondContact O-CB 3.47Å; F328-L331 PolarHBondContact O-N 2.85Å; F328-I332 VanDerWaalsContact O-CG1 3.28Å; F328-I332 WeakPolarHBondContact O-CG1 3.31Å; F328-I332 PolarHBondContact O-N 2.81Å; F328-L341 HydrophobicContact CD1-CD1 3.74Å; F328-L341 HydrophobicContact CD1-CD2 3.93Å; F328-L341 HydrophobicContact CD1-CG 4.47Å; F328-L341 HydrophobicContact CE1-CD1 3.78Å; F328-L345 HydrophobicContact CD1-CD1 3.99Å; F328-L345 HydrophobicContact CE1-CD1 3.98Å; F328-L345 HydrophobicContact CG-CD1 4.45Å; F328-L345 HydrophobicContact CZ-CD1 4.44Å; F328-P346 HydrophobicContact CZ-CG 4.01Å; F328-L349 HydrophobicContact CD2-CD1 3.88Å; F328-L349 HydrophobicContact CE2-CD1 3.55Å; F328-L349 HydrophobicContact CZ-CD1 4.15Å; F328-M371 HydrophobicContact CB-SD 4.4Å |
| 329 | D | 95.2 | Very high | 94 | Very high | 54 Ų | 54 | 40.4 Ų | 40.4 | 29% | 0.289 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -57.9 | -43.4 | 175.8 | -71.9 | -21.1 | 0 | 0 | 0 | 110.6 | M325 E326 L331 I332 I333 | M325-D329 PolarHBondContact O-N 3.23Å; E326-D329 PolarHBondContact O-N 3.26Å; D329-L331 VanDerWaalsContact C-N 3.29Å; D329-L331 PolarHBondContact O-N 3.03Å; D329-I332 PolarHBondContact O-N 3.36Å; D329-I332 VanDerWaalsContact O-N 3.14Å; D329-I333 WeakPolarHBondContact O-CG1 3.14Å; D329-I333 PolarHBondContact O-N 3.14Å; D329-I333 VanDerWaalsContact O-N 3.15Å |
| 330 | Q | 94.7 | Very high | 94.1 | Very high | 37 Ų | 37 | 36.6 Ų | 36.6 | 17% | 0.173 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.6 | -38 | 174.7 | -66.8 | -47.1 | -47.7 | 0 | 0 | 112.7 | L265 N266 R271 E326 C327 F328 | L265-Q330 HydrophobicContact CB-CB 3.64Å; L265-Q330 HydrophobicContact CB-CG 4.05Å; N266-Q330 PolarHBondContact OD1-OE1 3.37Å; R271-Q330 WeakPolarHBondContact CD-O 3.49Å; E326-Q330 VanDerWaalsContact O-CG 3.32Å; E326-Q330 WeakPolarHBondContact O-CG 3.34Å; E326-Q330 PolarHBondContact O-N 3.15Å; C327-Q330 PolarHBondContact O-N 3.18Å; F328-Q330 VanDerWaalsContact C-N 3.28Å; F328-Q330 PolarHBondContact O-N 2.92Å |
| 331 | L | 95.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -69.3 | -37.4 | 176.1 | -62.6 | 174 | 0 | 0 | 0 | 111.9 | L265 L274 L284 I285 C327 F328 D329 I333 D334 L337 L341 | L265-L331 HydrophobicContact CD2-CD2 3.92Å; L274-L331 HydrophobicContact CD1-CD2 4.07Å; L284-L331 HydrophobicContact CD2-CD1 3.91Å; L284-L331 HydrophobicContact CD2-CD2 3.82Å; L284-L331 HydrophobicContact CD2-CG 4.4Å; I285-L331 HydrophobicContact CD1-CD1 4.21Å; C327-L331 WeakPolarHBondContact O-CG 3.45Å; C327-L331 PolarHBondContact O-N 3.01Å; F328-L331 HydrophobicContact CD1-CD1 4.28Å; F328-L331 WeakPolarHBondContact O-CA 3.48Å; F328-L331 WeakPolarHBondContact O-CB 3.47Å; F328-L331 PolarHBondContact O-N 2.85Å; D329-L331 VanDerWaalsContact C-N 3.29Å; D329-L331 PolarHBondContact O-N 3.03Å; L331-I333 VanDerWaalsContact C-N 3.3Å; L331-I333 PolarHBondContact O-N 3.4Å; L331-D334 PolarHBondContact O-N 2.97Å; L331-L337 HydrophobicContact CD2-CD1 3.84Å; L331-L337 WeakPolarHBondContact O-CB 3.37Å; L331-L341 HydrophobicContact CB-CD2 4.47Å |
| 332 | I | 94.7 | Very high | 94.1 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -70.4 | -26.9 | -177 | -67.9 | 165.2 | 0 | 0 | 0 | 112.2 | F328 D329 D334 R338 L341 M371 Q374 L375 | F328-I332 VanDerWaalsContact O-CG1 3.28Å; F328-I332 WeakPolarHBondContact O-CG1 3.31Å; F328-I332 PolarHBondContact O-N 2.81Å; D329-I332 PolarHBondContact O-N 3.36Å; D329-I332 VanDerWaalsContact O-N 3.14Å; I332-D334 PolarHBondContact O-N 3.16Å; I332-R338 HydrophobicContact CG2-CG 4.2Å; I332-R338 VanDerWaalsContact O-CZ 3.3Å; I332-R338 PolarHBondContact O-NE 3.08Å; I332-R338 PolarHBondContact O-NH2 3.4Å; I332-L341 HydrophobicContact CD1-CD2 3.99Å; I332-L341 HydrophobicContact CG1-CD2 3.56Å; I332-M371 HydrophobicContact CD1-CG 3.55Å; I332-Q374 HydrophobicContact CG2-CB 3.6Å; I332-Q374 HydrophobicContact CG2-CG 4.38Å; I332-L375 HydrophobicContact CD1-CD2 4.42Å; I332-L375 HydrophobicContact CD1-CG 4.27Å; I332-L375 HydrophobicContact CG1-CD2 4.23Å |
| 333 | I | 93.3 | Very high | 93.8 | Very high | 95 Ų | 95 | 44 Ų | 44 | 49% | 0.487 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -54.6 | -40 | 174 | -68.7 | 168.3 | 0 | 0 | 0 | 111.1 | D329 L331 | D329-I333 WeakPolarHBondContact O-CG1 3.14Å; D329-I333 PolarHBondContact O-N 3.14Å; D329-I333 VanDerWaalsContact O-N 3.15Å; L331-I333 VanDerWaalsContact C-N 3.3Å; L331-I333 PolarHBondContact O-N 3.4Å |
| 334 | D | 92.5 | Very high | 93.7 | Very high | 20 Ų | 20 | 44.7 Ų | 44.7 | 11% | 0.107 | 22% | 0.215 | C | C | . | . | S | Bend | trans | -84.3 | 116.4 | 175.7 | -168.2 | -43.6 | 0 | 0 | 0 | 110.8 | R271 L331 I332 R336 L337 R338 | R271-D334 HydrophobicContact CB-CB 4.45Å; L331-D334 PolarHBondContact O-N 2.97Å; I332-D334 PolarHBondContact O-N 3.16Å; D334-R336 PolarHBondContact O-N 3.27Å; D334-R336 VanDerWaalsContact O-N 3.11Å; D334-R336 VanDerWaalsContact OD1-CB 3.27Å; D334-R336 WeakPolarHBondContact OD1-CB 3.48Å; D334-R336 IonicContact OD1-CZ 2.65Å; D334-R336 PolarHBondContact OD1-N 2.55Å; D334-R336 IonicContact OD1-NE 3.13Å; D334-R336 PolarHBondContact OD1-NE 3.21Å; D334-R336 IonicContact OD1-NH2 3.05Å; D334-R336 IonicContact OD2-CZ 3.02Å; D334-R336 IonicContact OD2-NE 2.7Å; D334-R336 PolarHBondContact OD2-NE 2.87Å; D334-R336 IonicContact OD2-NH2 3.11Å; D334-R336 PolarHBondContact OD2-NH2 3.29Å; D334-L337 HydrophobicContact CB-CB 4.2Å; D334-L337 HydrophobicContact CB-CD1 4.07Å; D334-L337 HydrophobicContact CB-CG 4.2Å; D334-L337 PolarHBondContact O-N 3.3Å; D334-L337 VanDerWaalsContact O-N 3.14Å; D334-R338 WeakPolarHBondContact O-CB 3.3Å; D334-R338 PolarHBondContact O-N 3.5Å |
| 335 | L | 92.6 | Very high | 93.5 | Very high | 117 Ų | 117 | 44.8 Ų | 44.8 | 61% | 0.613 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -54.7 | -32.8 | -179.2 | -67.5 | 175.8 | 0 | 0 | 0 | 113.3 | N339 | L335-N339 PolarHBondContact O-N 3.19Å; L335-N339 VanDerWaalsContact O-N 3.17Å; L335-N339 PolarHBondContact O-ND2 3Å |
| 336 | R | 93.7 | Very high | 93.3 | Very high | 83 Ų | 83 | 44.9 Ų | 44.9 | 31% | 0.313 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -71.4 | -45.3 | -178.8 | -57.3 | 169.4 | -70 | 179.8 | 1 | 110.7 | T272 Y275 D334 N339 R340 | T272-R336 PolarHBondContact OG1-NH2 3.3Å; Y275-R336 HydrophobicContact CD2-CB 3.53Å; Y275-R336 HydrophobicContact CD2-CG 4.47Å; Y275-R336 HydrophobicContact CE2-CB 3.68Å; Y275-R336 HydrophobicContact CE2-CG 4.37Å; Y275-R336 HydrophobicContact CG-CB 4.01Å; D334-R336 PolarHBondContact O-N 3.27Å; D334-R336 VanDerWaalsContact O-N 3.11Å; D334-R336 VanDerWaalsContact OD1-CB 3.27Å; D334-R336 WeakPolarHBondContact OD1-CB 3.48Å; D334-R336 IonicContact OD1-CZ 2.65Å; D334-R336 PolarHBondContact OD1-N 2.55Å; D334-R336 IonicContact OD1-NE 3.13Å; D334-R336 PolarHBondContact OD1-NE 3.21Å; D334-R336 IonicContact OD1-NH2 3.05Å; D334-R336 IonicContact OD2-CZ 3.02Å; D334-R336 IonicContact OD2-NE 2.7Å; D334-R336 PolarHBondContact OD2-NE 2.87Å; D334-R336 IonicContact OD2-NH2 3.11Å; D334-R336 PolarHBondContact OD2-NH2 3.29Å; R336-N339 PolarHBondContact O-N 3.03Å; R336-R340 PolarHBondContact O-N 2.9Å |
| 337 | L | 94.1 | Very high | 93 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -70.2 | -38 | 176.8 | -67.3 | 176.9 | 0 | 0 | 0 | 111.4 | R271 L274 F281 L331 D334 N339 R340 L341 | R271-L337 HydrophobicContact CB-CD1 3.73Å; R271-L337 HydrophobicContact CG-CD1 3.94Å; L274-L337 HydrophobicContact CB-CD1 4.45Å; L274-L337 HydrophobicContact CB-CD2 4.14Å; F281-L337 HydrophobicContact CD2-CD2 3.87Å; F281-L337 HydrophobicContact CE2-CD2 3.97Å; L331-L337 HydrophobicContact CD2-CD1 3.84Å; L331-L337 WeakPolarHBondContact O-CB 3.37Å; D334-L337 HydrophobicContact CB-CB 4.2Å; D334-L337 HydrophobicContact CB-CD1 4.07Å; D334-L337 HydrophobicContact CB-CG 4.2Å; D334-L337 PolarHBondContact O-N 3.3Å; D334-L337 VanDerWaalsContact O-N 3.14Å; L337-N339 VanDerWaalsContact C-N 3.3Å; L337-N339 PolarHBondContact O-N 3.46Å; L337-R340 WeakPolarHBondContact O-CB 3.37Å; L337-R340 PolarHBondContact O-N 3.45Å; L337-R340 VanDerWaalsContact O-N 3.09Å; L337-L341 WeakPolarHBondContact O-CB 3.4Å; L337-L341 PolarHBondContact O-N 3.34Å |
| 338 | R | 94.1 | Very high | 92.6 | Very high | 60 Ų | 60 | 50 Ų | 50 | 23% | 0.226 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -52.6 | -47.6 | 172.1 | -176.7 | -170.6 | -61.2 | -163.4 | 5.3 | 111.9 | I332 D334 R340 L341 R342 Q374 L375 | I332-R338 HydrophobicContact CG2-CG 4.2Å; I332-R338 VanDerWaalsContact O-CZ 3.3Å; I332-R338 PolarHBondContact O-NE 3.08Å; I332-R338 PolarHBondContact O-NH2 3.4Å; D334-R338 WeakPolarHBondContact O-CB 3.3Å; D334-R338 PolarHBondContact O-N 3.5Å; R338-R340 VanDerWaalsContact C-N 3.31Å; R338-R340 PolarHBondContact O-N 3.34Å; R338-L341 PolarHBondContact O-N 2.89Å; R338-R342 WeakPolarHBondContact O-CG 3.11Å; R338-R342 PolarHBondContact O-N 3.36Å; R338-R342 VanDerWaalsContact O-N 3.12Å; R338-Q374 WeakPolarHBondContact CD-O 3.35Å; R338-Q374 PolarHBondContact NH1-O 3.34Å; R338-L375 HydrophobicContact CG-CD2 4.02Å |
| 339 | N | 91.6 | Very high | 92.2 | Very high | 88 Ų | 88 | 50 Ų | 50 | 47% | 0.471 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.8 | -36.9 | 178.3 | -74.9 | -22.4 | 0 | 0 | 0 | 112.5 | L335 R336 L337 | L335-N339 PolarHBondContact O-N 3.19Å; L335-N339 VanDerWaalsContact O-N 3.17Å; L335-N339 PolarHBondContact O-ND2 3Å; R336-N339 PolarHBondContact O-N 3.03Å; L337-N339 VanDerWaalsContact C-N 3.3Å; L337-N339 PolarHBondContact O-N 3.46Å |
| 340 | R | 92.7 | Very high | 91.7 | Very high | 53 Ų | 53 | 51.4 Ų | 51.4 | 20% | 0.2 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -68.4 | -44.1 | 173.8 | -65.9 | 175.5 | 64.7 | 129.8 | 14.6 | 111.7 | Y275 D278 F281 R336 L337 R338 R342 N343 S344 | Y275-R340 PolarHBondContact O-NH1 2.68Å; D278-R340 IonicContact OD1-CZ 2.77Å; D278-R340 IonicContact OD1-NH1 2.79Å; D278-R340 PolarHBondContact OD1-NH1 3Å; D278-R340 IonicContact OD1-NH2 2.72Å; D278-R340 PolarHBondContact OD1-NH2 3.39Å; F281-R340 HydrophobicContact CE1-CB 4Å; F281-R340 HydrophobicContact CE2-CB 4.39Å; F281-R340 HydrophobicContact CZ-CB 3.75Å; R336-R340 PolarHBondContact O-N 2.9Å; L337-R340 WeakPolarHBondContact O-CB 3.37Å; L337-R340 PolarHBondContact O-N 3.45Å; L337-R340 VanDerWaalsContact O-N 3.09Å; R338-R340 VanDerWaalsContact C-N 3.31Å; R338-R340 PolarHBondContact O-N 3.34Å; R340-R342 PolarHBondContact O-N 3.04Å; R340-N343 PolarHBondContact O-N 3.41Å; R340-S344 PolarHBondContact O-N 3.37Å; R340-S344 PolarHBondContact O-OG 3.2Å |
| 341 | L | 93.5 | Very high | 91.2 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -61.5 | -31.8 | -177.3 | -172.7 | 63.2 | 0 | 0 | 0 | 112.5 | I285 F328 L331 I332 L337 R338 N343 S344 L345 L375 | I285-L341 HydrophobicContact CD1-CD1 3.72Å; F328-L341 HydrophobicContact CD1-CD1 3.74Å; F328-L341 HydrophobicContact CD1-CD2 3.93Å; F328-L341 HydrophobicContact CD1-CG 4.47Å; F328-L341 HydrophobicContact CE1-CD1 3.78Å; L331-L341 HydrophobicContact CB-CD2 4.47Å; I332-L341 HydrophobicContact CD1-CD2 3.99Å; I332-L341 HydrophobicContact CG1-CD2 3.56Å; L337-L341 WeakPolarHBondContact O-CB 3.4Å; L337-L341 PolarHBondContact O-N 3.34Å; R338-L341 PolarHBondContact O-N 2.89Å; L341-N343 PolarHBondContact O-N 3.37Å; L341-N343 VanDerWaalsContact O-N 3.11Å; L341-S344 WeakPolarHBondContact CA-OG 3.34Å; L341-S344 PolarHBondContact O-N 3.29Å; L341-S344 VanDerWaalsContact O-N 3.13Å; L341-L345 HydrophobicContact CD1-CB 4.42Å; L341-L345 HydrophobicContact CD1-CD1 3.95Å; L341-L345 HydrophobicContact CD2-CD1 4.34Å; L341-L345 HydrophobicContact CG-CD1 4.11Å; L341-L345 WeakPolarHBondContact O-CB 3.44Å; L341-L345 PolarHBondContact O-N 3.44Å; L341-L375 HydrophobicContact CB-CD2 4.32Å; L341-L375 HydrophobicContact CD2-CD2 4.22Å; L341-L375 HydrophobicContact CG-CD2 4.32Å |
| 342 | R | 90.5 | Very high | 90.4 | Very high | 96 Ų | 96 | 53.6 Ų | 53.6 | 36% | 0.362 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -50.5 | -35.7 | 172.3 | -74 | 174.4 | 172.4 | -178.3 | -6.5 | 113 | R338 R340 L375 W377 | R338-R342 WeakPolarHBondContact O-CG 3.11Å; R338-R342 PolarHBondContact O-N 3.36Å; R338-R342 VanDerWaalsContact O-N 3.12Å; R340-R342 PolarHBondContact O-N 3.04Å; R342-L375 HydrophobicContact CG-CB 4.49Å; R342-L375 HydrophobicContact CG-CD2 4.01Å; R342-L375 PolarHBondContact NE-O 3.43Å; R342-L375 PolarHBondContact NH2-O 2.86Å; R342-W377 WeakPolarHBondContact O-CZ2 3.4Å |
| 343 | N | 88.9 | Confident | 89.9 | Confident | 137 Ų | 137 | 56.6 Ų | 56.6 | 73% | 0.733 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -94.4 | -25.6 | -178.4 | -62.8 | -23.9 | 0 | 0 | 0 | 112.4 | R340 L341 R350 | R340-N343 PolarHBondContact O-N 3.41Å; L341-N343 PolarHBondContact O-N 3.37Å; L341-N343 VanDerWaalsContact O-N 3.11Å; N343-R350 PolarHBondContact O-NH2 2.88Å |
| 344 | S | 91.3 | Very high | 89.4 | Confident | 32 Ų | 32 | 52 Ų | 52 | 22% | 0.224 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -105 | -0.8 | -173.2 | 71.1 | 0 | 0 | 0 | 0 | 114.9 | F281 I285 R340 L341 | F281-S344 WeakPolarHBondContact CE1-OG 3.27Å; I285-S344 VanDerWaalsContact CG2-O 3.29Å; I285-S344 WeakPolarHBondContact CG2-O 3.44Å; R340-S344 PolarHBondContact O-N 3.37Å; R340-S344 PolarHBondContact O-OG 3.2Å; L341-S344 WeakPolarHBondContact CA-OG 3.34Å; L341-S344 PolarHBondContact O-N 3.29Å; L341-S344 VanDerWaalsContact O-N 3.13Å |
| 345 | L | 92 | Very high | 88.7 | Confident | 2 Ų | 2 | 51.3 Ų | 51.3 | 1% | 0.01 | 25% | 0.249 | C | C | . | . | S | Bend | trans | -60.1 | 133.5 | 179.1 | -169 | 74.6 | 0 | 0 | 0 | 110 | F328 L341 I347 L349 R350 M371 L375 W377 | F328-L345 HydrophobicContact CD1-CD1 3.99Å; F328-L345 HydrophobicContact CE1-CD1 3.98Å; F328-L345 HydrophobicContact CG-CD1 4.45Å; F328-L345 HydrophobicContact CZ-CD1 4.44Å; L341-L345 HydrophobicContact CD1-CB 4.42Å; L341-L345 HydrophobicContact CD1-CD1 3.95Å; L341-L345 HydrophobicContact CD2-CD1 4.34Å; L341-L345 HydrophobicContact CG-CD1 4.11Å; L341-L345 WeakPolarHBondContact O-CB 3.44Å; L341-L345 PolarHBondContact O-N 3.44Å; L345-I347 PolarHBondContact O-N 3.32Å; L345-L349 HydrophobicContact CD1-CD1 4.24Å; L345-L349 HydrophobicContact CD2-CB 4.12Å; L345-L349 HydrophobicContact CG-CB 4.19Å; L345-R350 HydrophobicContact CD2-CG 4.22Å; L345-R350 PolarHBondContact O-NE 3.49Å; L345-R350 PolarHBondContact O-NH2 2.95Å; L345-M371 HydrophobicContact CD1-SD 4.06Å; L345-M371 HydrophobicContact CD2-CE 3.9Å; L345-M371 HydrophobicContact CD2-SD 4.37Å; L345-L375 HydrophobicContact CD2-CD1 3.94Å; L345-W377 HydrophobicContact CB-CH2 3.99Å; L345-W377 HydrophobicContact CD2-CH2 3.53Å; L345-W377 HydrophobicContact CD2-CZ3 3.43Å; L345-W377 VanDerWaalsContact CD2-CZ3 3.43Å; L345-W377 HydrophobicContact CG-CH2 4.39Å |
| 346 | P | 90.7 | Very high | 88.1 | Confident | 6 Ų | 6 | 49.9 Ų | 49.9 | 4% | 0.039 | 25% | 0.245 | C | C | . | . | trans | -53.7 | 135.9 | 176.6 | -29 | 39.1 | 0 | 0 | 0 | 111.9 | T289 I292 F328 E348 L349 R350 | T289-P346 HydrophobicContact CG2-CB 4.21Å; T289-P346 HydrophobicContact CG2-CG 4.32Å; T289-P346 WeakPolarHBondContact OG1-CG 3.28Å; I292-P346 HydrophobicContact CD1-CB 3.81Å; I292-P346 HydrophobicContact CD1-CG 3.6Å; F328-P346 HydrophobicContact CZ-CG 4.01Å; P346-E348 WeakPolarHBondContact CB-OE2 3.38Å; P346-E348 PolarHBondContact O-N 3.34Å; P346-L349 PolarHBondContact O-N 3.19Å; P346-R350 WeakPolarHBondContact O-CG 3.5Å; P346-R350 PolarHBondContact O-N 3.4Å | ||
| 347 | I | 88.3 | Confident | 87.5 | Confident | 128 Ų | 128 | 48 Ų | 48 | 66% | 0.656 | 24% | 0.241 | S | C | * | . | G | 310 helix | trans | -60.6 | -33.3 | -173.1 | -61.7 | 164.6 | 0 | 0 | 0 | 110.8 | L345 L349 R350 | L345-I347 PolarHBondContact O-N 3.32Å; I347-L349 PolarHBondContact O-N 2.92Å; I347-R350 WeakPolarHBondContact O-CB 3.42Å; I347-R350 PolarHBondContact O-N 3.25Å |
| 348 | E | 88.1 | Confident | 86.8 | Confident | 41 Ų | 41 | 48.1 Ų | 48.1 | 19% | 0.192 | 24% | 0.241 | C | C | . | . | G | 310 helix | trans | -61.7 | -32.2 | 178.5 | -55.5 | 89.2 | 161.4 | 0 | 0 | 112.1 | I292 Q293 I296 P346 S351 L353 F354 | I292-E348 HydrophobicContact CG2-CB 3.75Å; I292-E348 HydrophobicContact CG2-CG 4.19Å; Q293-E348 WeakPolarHBondContact CG-OE1 3.42Å; Q293-E348 PolarHBondContact NE2-OE1 3.02Å; Q293-E348 VanDerWaalsContact NE2-OE1 3.14Å; I296-E348 HydrophobicContact CD1-CB 3.64Å; I296-E348 HydrophobicContact CD1-CG 3.59Å; P346-E348 WeakPolarHBondContact CB-OE2 3.38Å; P346-E348 PolarHBondContact O-N 3.34Å; E348-S351 PolarHBondContact O-OG 3.24Å; E348-L353 HydrophobicContact CB-CD2 4.1Å; E348-L353 HydrophobicContact CG-CD2 4.42Å; E348-F354 HydrophobicContact CB-CE2 4.42Å |
| 349 | L | 88.5 | Confident | 86.1 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 26% | 0.262 | C | S | . | . | G | 310 helix | trans | -85.4 | -6.5 | 173.6 | -71.9 | -176.1 | 0 | 0 | 0 | 113.6 | I292 M325 F328 L345 P346 I347 S351 F354 L368 M371 W372 | I292-L349 HydrophobicContact CD1-CD1 3.43Å; I292-L349 VanDerWaalsContact CD1-CD1 3.43Å; I292-L349 HydrophobicContact CD1-CG 3.75Å; I292-L349 HydrophobicContact CG1-CD1 4.37Å; I292-L349 HydrophobicContact CG1-CG 4.44Å; M325-L349 HydrophobicContact SD-CD1 4.25Å; M325-L349 HydrophobicContact SD-CD2 3.99Å; F328-L349 HydrophobicContact CD2-CD1 3.88Å; F328-L349 HydrophobicContact CE2-CD1 3.55Å; F328-L349 HydrophobicContact CZ-CD1 4.15Å; L345-L349 HydrophobicContact CD1-CD1 4.24Å; L345-L349 HydrophobicContact CD2-CB 4.12Å; L345-L349 HydrophobicContact CG-CB 4.19Å; P346-L349 PolarHBondContact O-N 3.19Å; I347-L349 PolarHBondContact O-N 2.92Å; L349-S351 VanDerWaalsContact C-N 3.27Å; L349-F354 HydrophobicContact CD2-CD2 3.73Å; L349-F354 HydrophobicContact CD2-CE2 3.7Å; L349-F354 HydrophobicContact CG-CE2 4.46Å; L349-L368 HydrophobicContact CD2-CD2 3.85Å; L349-M371 HydrophobicContact CB-CE 4.19Å; L349-W372 WeakPolarHBondContact O-CZ2 3.25Å; L349-W372 PolarHBondContact O-NE1 3.22Å |
| 350 | R | 85.1 | Confident | 85.4 | Confident | 85 Ų | 85 | 52.9 Ų | 52.9 | 32% | 0.321 | 27% | 0.266 | S | S | . | . | G | 310 helix | trans | -85.1 | -0.1 | 174.8 | -52.5 | -173.1 | -173.3 | -172.5 | -3.8 | 113.1 | N343 L345 P346 I347 W377 | N343-R350 PolarHBondContact O-NH2 2.88Å; L345-R350 HydrophobicContact CD2-CG 4.22Å; L345-R350 PolarHBondContact O-NE 3.49Å; L345-R350 PolarHBondContact O-NH2 2.95Å; P346-R350 WeakPolarHBondContact O-CG 3.5Å; P346-R350 PolarHBondContact O-N 3.4Å; I347-R350 WeakPolarHBondContact O-CB 3.42Å; I347-R350 PolarHBondContact O-N 3.25Å; R350-W377 HydrophobicContact CB-CH2 4.42Å; R350-W377 HydrophobicContact CB-CZ3 4.03Å; R350-W377 HydrophobicContact CG-CH2 3.65Å; R350-W377 HydrophobicContact CG-CZ3 3.69Å |
| 351 | S | 82.9 | Confident | 85 | Confident | 43 Ų | 43 | 51.7 Ų | 51.7 | 30% | 0.301 | 26% | 0.264 | S | S | . | . | S | Bend | trans | -132.4 | 164.6 | -175.6 | 69.8 | 0 | 0 | 0 | 0 | 110.9 | E348 L349 L353 | E348-S351 PolarHBondContact O-OG 3.24Å; L349-S351 VanDerWaalsContact C-N 3.27Å; S351-L353 PolarHBondContact O-N 2.99Å; S351-L353 VanDerWaalsContact OG-CB 3.27Å; S351-L353 WeakPolarHBondContact OG-CB 3.22Å; S351-L353 PolarHBondContact OG-N 3.08Å |
| 352 | N | 80.1 | Confident | 84.7 | Confident | 39 Ų | 39 | 59.5 Ų | 59.5 | 21% | 0.209 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | 12.3 | 173 | -78.3 | -39.4 | 0 | 0 | 0 | 113.8 | F354 S355 V356 W372 V380 N381 | N352-F354 VanDerWaalsContact C-N 3.34Å; N352-F354 PolarHBondContact O-N 3.12Å; N352-S355 WeakPolarHBondContact O-CB 3.33Å; N352-S355 PolarHBondContact O-N 3.06Å; N352-V356 WeakPolarHBondContact O-CG2 3.37Å; N352-V356 PolarHBondContact O-N 2.8Å; N352-W372 VanDerWaalsContact OD1-CH2 3.27Å; N352-W372 WeakPolarHBondContact OD1-CH2 3.42Å; N352-V380 PolarHBondContact ND2-O 3.02Å; N352-N381 PolarHBondContact ND2-OXT 3.05Å |
| 353 | L | 84.1 | Confident | 84.7 | Confident | 63 Ų | 63 | 58.7 Ų | 58.7 | 33% | 0.33 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -50.2 | -49.7 | -176.7 | -179.6 | 71.4 | 0 | 0 | 0 | 112.5 | I296 E348 S351 V356 I357 | I296-L353 HydrophobicContact CD1-CD2 3.83Å; I296-L353 HydrophobicContact CG1-CD2 4.47Å; E348-L353 HydrophobicContact CB-CD2 4.1Å; E348-L353 HydrophobicContact CG-CD2 4.42Å; S351-L353 PolarHBondContact O-N 2.99Å; S351-L353 VanDerWaalsContact OG-CB 3.27Å; S351-L353 WeakPolarHBondContact OG-CB 3.22Å; S351-L353 PolarHBondContact OG-N 3.08Å; L353-V356 PolarHBondContact O-N 3.43Å; L353-I357 HydrophobicContact CD1-CD1 3.87Å; L353-I357 HydrophobicContact CD1-CG1 4.26Å; L353-I357 HydrophobicContact CD2-CD1 4.19Å; L353-I357 HydrophobicContact CG-CD1 3.66Å; L353-I357 HydrophobicContact CG-CG1 4.32Å; L353-I357 WeakPolarHBondContact O-CB 3.48Å; L353-I357 VanDerWaalsContact O-CG1 3.27Å; L353-I357 WeakPolarHBondContact O-CG1 3.37Å; L353-I357 PolarHBondContact O-N 3.38Å |
| 354 | F | 82.5 | Confident | 84.6 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.8 | -35.5 | 179.7 | -82.2 | -74.3 | 0 | 0 | 0 | 113.2 | I292 V295 I296 L321 E348 L349 N352 V356 I357 L358 V364 L368 | I292-F354 HydrophobicContact CG2-CE2 3.82Å; I292-F354 HydrophobicContact CG2-CZ 3.83Å; V295-F354 HydrophobicContact CB-CE1 4.46Å; V295-F354 HydrophobicContact CG1-CE1 3.87Å; I296-F354 HydrophobicContact CD1-CE1 4.44Å; I296-F354 HydrophobicContact CD1-CE2 4.02Å; I296-F354 HydrophobicContact CD1-CZ 3.71Å; I296-F354 HydrophobicContact CG1-CE1 3.76Å; I296-F354 HydrophobicContact CG1-CE2 4.24Å; I296-F354 HydrophobicContact CG1-CZ 3.5Å; I296-F354 VanDerWaalsContact CG1-CZ 3.5Å; L321-F354 HydrophobicContact CD1-CD1 4.26Å; L321-F354 HydrophobicContact CD1-CE1 4.05Å; L321-F354 HydrophobicContact CD1-CE2 4.32Å; L321-F354 HydrophobicContact CD1-CG 4.48Å; L321-F354 HydrophobicContact CD1-CZ 4.06Å; L321-F354 HydrophobicContact CD2-CB 4.24Å; L321-F354 HydrophobicContact CD2-CD1 3.68Å; L321-F354 HydrophobicContact CD2-CE1 4.18Å; L321-F354 HydrophobicContact CD2-CG 3.99Å; E348-F354 HydrophobicContact CB-CE2 4.42Å; L349-F354 HydrophobicContact CD2-CD2 3.73Å; L349-F354 HydrophobicContact CD2-CE2 3.7Å; L349-F354 HydrophobicContact CG-CE2 4.46Å; N352-F354 VanDerWaalsContact C-N 3.34Å; N352-F354 PolarHBondContact O-N 3.12Å; F354-V356 VanDerWaalsContact C-N 3.31Å; F354-V356 PolarHBondContact O-N 2.85Å; F354-I357 PolarHBondContact O-N 3.04Å; F354-L358 WeakPolarHBondContact O-CB 3.21Å; F354-L358 VanDerWaalsContact O-CG 3.32Å; F354-L358 WeakPolarHBondContact O-CG 3.45Å; F354-L358 PolarHBondContact O-N 3.41Å; F354-V364 HydrophobicContact CB-CG1 4.12Å; F354-L368 HydrophobicContact CB-CD1 4.25Å |
| 355 | S | 78.2 | Confident | 84.4 | Confident | 4 Ų | 4 | 53.9 Ų | 53.9 | 3% | 0.028 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.9 | -44.8 | 172.4 | 177.4 | 0 | 0 | 0 | 0 | 110.2 | N352 L358 L359 H360 | N352-S355 WeakPolarHBondContact O-CB 3.33Å; N352-S355 PolarHBondContact O-N 3.06Å; S355-L358 CarbonylContact O-C 3.58Å; S355-L358 PolarHBondContact O-N 2.72Å; S355-L359 PolarHBondContact O-N 2.79Å; S355-H360 WeakPolarHBondContact O-CA 3.32Å; S355-H360 PolarHBondContact O-N 3.18Å |
| 356 | V | 78.9 | Confident | 84.3 | Confident | 87 Ų | 87 | 58 Ų | 58 | 53% | 0.527 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -65.6 | -49 | 177.2 | 176.8 | 0 | 0 | 0 | 0 | 112 | N352 L353 F354 L358 L359 | N352-V356 WeakPolarHBondContact O-CG2 3.37Å; N352-V356 PolarHBondContact O-N 2.8Å; L353-V356 PolarHBondContact O-N 3.43Å; F354-V356 VanDerWaalsContact C-N 3.31Å; F354-V356 PolarHBondContact O-N 2.85Å; V356-L358 PolarHBondContact O-N 3.46Å; V356-L359 PolarHBondContact O-N 3.33Å; V356-L359 VanDerWaalsContact O-N 3.1Å |
| 357 | I | 81 | Confident | 84.3 | Confident | 45 Ų | 45 | 60.6 Ų | 60.6 | 23% | 0.231 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -59.8 | -36.9 | 179.3 | -71.2 | 174.7 | 0 | 0 | 0 | 111 | I296 F299 L353 F354 L359 | I296-I357 HydrophobicContact CG1-CD1 4.32Å; I296-I357 HydrophobicContact CG2-CD1 4.23Å; F299-I357 HydrophobicContact CB-CG2 3.49Å; F299-I357 VanDerWaalsContact CB-CG2 3.49Å; F299-I357 HydrophobicContact CD1-CG2 3.74Å; F299-I357 HydrophobicContact CD2-CG2 3.88Å; F299-I357 HydrophobicContact CG-CG2 3.43Å; F299-I357 VanDerWaalsContact CG-CG2 3.43Å; L353-I357 HydrophobicContact CD1-CD1 3.87Å; L353-I357 HydrophobicContact CD1-CG1 4.26Å; L353-I357 HydrophobicContact CD2-CD1 4.19Å; L353-I357 HydrophobicContact CG-CD1 3.66Å; L353-I357 HydrophobicContact CG-CG1 4.32Å; L353-I357 WeakPolarHBondContact O-CB 3.48Å; L353-I357 VanDerWaalsContact O-CG1 3.27Å; L353-I357 WeakPolarHBondContact O-CG1 3.37Å; L353-I357 PolarHBondContact O-N 3.38Å; F354-I357 PolarHBondContact O-N 3.04Å; I357-L359 VanDerWaalsContact C-N 3.29Å; I357-L359 PolarHBondContact O-N 3.37Å |
| 358 | L | 80.8 | Confident | 84.3 | Confident | 1 Ų | 1 | 54.6 Ų | 54.6 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.1 | 21.2 | 179.8 | -66.1 | 167.1 | 0 | 0 | 0 | 113.4 | F299 Y314 L321 F354 S355 V356 H360 D361 V364 | F299-L358 HydrophobicContact CE1-CD2 3.57Å; F299-L358 HydrophobicContact CE2-CD2 3.95Å; F299-L358 HydrophobicContact CZ-CD2 3.24Å; F299-L358 HydrophobicContact CZ-CG 4.34Å; Y314-L358 HydrophobicContact CD2-CD2 3.82Å; Y314-L358 HydrophobicContact CE2-CB 3.83Å; Y314-L358 HydrophobicContact CE2-CD2 3.3Å; Y314-L358 HydrophobicContact CE2-CG 4.17Å; Y314-L358 PolarHBondContact OH-O 2.84Å; L321-L358 HydrophobicContact CD2-CD1 3.75Å; F354-L358 WeakPolarHBondContact O-CB 3.21Å; F354-L358 VanDerWaalsContact O-CG 3.32Å; F354-L358 WeakPolarHBondContact O-CG 3.45Å; F354-L358 PolarHBondContact O-N 3.41Å; S355-L358 CarbonylContact O-C 3.58Å; S355-L358 PolarHBondContact O-N 2.72Å; V356-L358 PolarHBondContact O-N 3.46Å; L358-H360 VanDerWaalsContact C-N 3.35Å; L358-H360 PolarHBondContact O-N 3.06Å; L358-D361 HydrophobicContact CB-CB 4.18Å; L358-D361 PolarHBondContact O-N 3.32Å; L358-V364 HydrophobicContact CD1-CB 4.06Å; L358-V364 HydrophobicContact CD1-CG1 3.88Å; L358-V364 HydrophobicContact CD1-CG2 3.49Å; L358-V364 VanDerWaalsContact CD1-CG2 3.49Å |
| 359 | L | 78.8 | Confident | 84.4 | Confident | 125 Ų | 125 | 54.5 Ų | 54.5 | 65% | 0.654 | 27% | 0.273 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 40.7 | 173.9 | -53.8 | 173.6 | 0 | 0 | 0 | 113.9 | S355 V356 I357 | S355-L359 PolarHBondContact O-N 2.79Å; V356-L359 PolarHBondContact O-N 3.33Å; V356-L359 VanDerWaalsContact O-N 3.1Å; I357-L359 VanDerWaalsContact C-N 3.29Å; I357-L359 PolarHBondContact O-N 3.37Å |
| 360 | H | 76.9 | Confident | 84.5 | Confident | 124 Ų | 124 | 58.1 Ų | 58.1 | 57% | 0.574 | 29% | 0.292 | S | S | * | . | S | Bend | trans | 59.9 | 42 | -179.4 | -55.9 | -71.4 | 0 | 0 | 0 | 113.8 | S355 L358 Q362 | S355-H360 WeakPolarHBondContact O-CA 3.32Å; S355-H360 PolarHBondContact O-N 3.18Å; L358-H360 VanDerWaalsContact C-N 3.35Å; L358-H360 PolarHBondContact O-N 3.06Å; H360-Q362 PolarHBondContact O-N 2.87Å |
| 361 | D | 84.4 | Confident | 84.8 | Confident | 27 Ų | 27 | 54.1 Ų | 54.1 | 14% | 0.144 | 28% | 0.277 | C | S | . | . | trans | -60.8 | 121.5 | 172.4 | -170.6 | -68.7 | 0 | 0 | 0 | 111.5 | Y314 K318 L358 D363 V364 Q365 | Y314-D361 WeakPolarHBondContact OH-CB 3.22Å; Y314-D361 PolarHBondContact OH-OD2 3.31Å; K318-D361 WeakPolarHBondContact CE-OD1 3.34Å; K318-D361 WeakPolarHBondContact CE-OD2 3.36Å; K318-D361 IonicContact NZ-OD1 3.42Å; K318-D361 PolarHBondContact NZ-OD1 3.15Å; K318-D361 IonicContact NZ-OD2 2.73Å; K318-D361 PolarHBondContact NZ-OD2 3.34Å; L358-D361 HydrophobicContact CB-CB 4.18Å; L358-D361 PolarHBondContact O-N 3.32Å; D361-D363 VanDerWaalsContact C-N 3.29Å; D361-D363 PolarHBondContact O-N 3.15Å; D361-D363 WeakPolarHBondContact OD1-CB 3.44Å; D361-D363 PolarHBondContact OD1-N 3.31Å; D361-V364 HydrophobicContact CB-CB 4.44Å; D361-V364 HydrophobicContact CB-CG2 4.28Å; D361-V364 PolarHBondContact O-N 3.2Å; D361-V364 PolarHBondContact OD1-N 3.43Å; D361-Q365 PolarHBondContact O-N 3.42Å | ||
| 362 | Q | 87.3 | Confident | 85.2 | Confident | 164 Ų | 164 | 52.2 Ų | 52.2 | 77% | 0.766 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -62.9 | -34.5 | -174.5 | -66.8 | -178.9 | -14.6 | 0 | 0 | 112.6 | H360 L366 | H360-Q362 PolarHBondContact O-N 2.87Å; Q362-L366 WeakPolarHBondContact O-CB 3.31Å; Q362-L366 PolarHBondContact O-N 2.85Å |
| 363 | D | 88.9 | Confident | 85.7 | Confident | 80 Ų | 80 | 58.3 Ų | 58.3 | 43% | 0.428 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -68.7 | -45.3 | -179.7 | -57.9 | -38.6 | 0 | 0 | 0 | 110.1 | K318 D361 L366 W367 | K318-D363 IonicContact NZ-OD2 3.87Å; K318-D363 PolarHBondContact NZ-OD2 3.32Å; D361-D363 VanDerWaalsContact C-N 3.29Å; D361-D363 PolarHBondContact O-N 3.15Å; D361-D363 WeakPolarHBondContact OD1-CB 3.44Å; D361-D363 PolarHBondContact OD1-N 3.31Å; D363-L366 PolarHBondContact O-N 2.73Å; D363-W367 HydrophobicContact CB-CH2 4.49Å; D363-W367 HydrophobicContact CB-CZ2 3.97Å; D363-W367 VanDerWaalsContact O-CD1 3.22Å; D363-W367 PolarHBondContact O-N 3.29Å |
| 364 | V | 87.4 | Confident | 86 | Confident | 1 Ų | 1 | 58.9 Ų | 58.9 | 1% | 0.006 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.4 | -40.4 | -179.2 | 179.1 | 0 | 0 | 0 | 0 | 111.1 | K318 L321 F354 L358 D361 L366 W367 L368 | K318-V364 HydrophobicContact CD-CG2 4.37Å; K318-V364 HydrophobicContact CG-CG2 4.23Å; L321-V364 HydrophobicContact CD2-CG1 3.91Å; L321-V364 HydrophobicContact CD2-CG2 4.41Å; F354-V364 HydrophobicContact CB-CG1 4.12Å; L358-V364 HydrophobicContact CD1-CB 4.06Å; L358-V364 HydrophobicContact CD1-CG1 3.88Å; L358-V364 HydrophobicContact CD1-CG2 3.49Å; L358-V364 VanDerWaalsContact CD1-CG2 3.49Å; D361-V364 HydrophobicContact CB-CB 4.44Å; D361-V364 HydrophobicContact CB-CG2 4.28Å; D361-V364 PolarHBondContact O-N 3.2Å; D361-V364 PolarHBondContact OD1-N 3.43Å; V364-L366 VanDerWaalsContact C-N 3.31Å; V364-L366 PolarHBondContact O-N 2.96Å; V364-W367 HydrophobicContact CB-CE3 4.34Å; V364-W367 HydrophobicContact CG2-CE3 3.91Å; V364-W367 HydrophobicContact CG2-CZ3 3.81Å; V364-W367 PolarHBondContact O-N 3.02Å; V364-L368 HydrophobicContact CG1-CD1 4.22Å; V364-L368 HydrophobicContact CG1-CG 4.43Å; V364-L368 WeakPolarHBondContact O-CG 3.5Å; V364-L368 PolarHBondContact O-N 2.95Å |
| 365 | Q | 87.3 | Confident | 86.4 | Confident | 66 Ų | 66 | 58.9 Ų | 58.9 | 31% | 0.308 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59 | -45.6 | 173.4 | -176.8 | 173.9 | -16 | 0 | 0 | 110.9 | D361 W367 L368 E369 | D361-Q365 PolarHBondContact O-N 3.42Å; Q365-W367 PolarHBondContact O-N 2.8Å; Q365-L368 PolarHBondContact O-N 3.04Å; Q365-E369 HydrophobicContact CG-CG 4.3Å; Q365-E369 PolarHBondContact NE2-OE1 2.99Å; Q365-E369 WeakPolarHBondContact O-CB 3.25Å; Q365-E369 VanDerWaalsContact O-CG 3.28Å; Q365-E369 WeakPolarHBondContact O-CG 3.25Å; Q365-E369 PolarHBondContact O-N 2.96Å |
| 366 | L | 89.5 | Confident | 86.8 | Confident | 89 Ų | 89 | 61.2 Ų | 61.2 | 47% | 0.466 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 177.4 | -176.2 | 63.9 | 0 | 0 | 0 | 112.2 | Q362 D363 V364 N370 | Q362-L366 WeakPolarHBondContact O-CB 3.31Å; Q362-L366 PolarHBondContact O-N 2.85Å; D363-L366 PolarHBondContact O-N 2.73Å; V364-L366 VanDerWaalsContact C-N 3.31Å; V364-L366 PolarHBondContact O-N 2.96Å; L366-N370 VanDerWaalsContact O-CB 3.25Å; L366-N370 WeakPolarHBondContact O-CB 3.42Å; L366-N370 PolarHBondContact O-N 2.96Å; L366-N370 PolarHBondContact O-ND2 3.29Å |
| 367 | W | 90.7 | Very high | 87 | Confident | 60 Ų | 60 | 60.1 Ų | 60.1 | 23% | 0.227 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -61.1 | -46.6 | 176.2 | -60.3 | -20.3 | 0 | 0 | 0 | 111.8 | K318 Q322 M325 D363 V364 Q365 M371 | K318-W367 HydrophobicContact CG-CH2 4.42Å; K318-W367 HydrophobicContact CG-CZ3 4.41Å; Q322-W367 HydrophobicContact CB-CH2 3.7Å; Q322-W367 HydrophobicContact CB-CZ2 4.49Å; Q322-W367 HydrophobicContact CB-CZ3 3.86Å; Q322-W367 HydrophobicContact CG-CH2 3.75Å; Q322-W367 HydrophobicContact CG-CZ2 4.05Å; Q322-W367 HydrophobicContact CG-CZ3 4.23Å; M325-W367 HydrophobicContact CE-CB 4.27Å; D363-W367 HydrophobicContact CB-CH2 4.49Å; D363-W367 HydrophobicContact CB-CZ2 3.97Å; D363-W367 VanDerWaalsContact O-CD1 3.22Å; D363-W367 PolarHBondContact O-N 3.29Å; V364-W367 HydrophobicContact CB-CE3 4.34Å; V364-W367 HydrophobicContact CG2-CE3 3.91Å; V364-W367 HydrophobicContact CG2-CZ3 3.81Å; V364-W367 PolarHBondContact O-N 3.02Å; Q365-W367 PolarHBondContact O-N 2.8Å; W367-M371 WeakPolarHBondContact O-CB 3.47Å; W367-M371 PolarHBondContact O-N 2.83Å |
| 368 | L | 89.2 | Confident | 86.8 | Confident | 2 Ų | 2 | 65.1 Ų | 65.1 | 1% | 0.01 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.1 | -46.7 | 178.2 | -68.6 | 173.9 | 0 | 0 | 0 | 111.8 | M325 L349 F354 V364 Q365 N370 M371 W372 | M325-L368 HydrophobicContact CE-CD2 4.2Å; M325-L368 HydrophobicContact SD-CD2 4.43Å; L349-L368 HydrophobicContact CD2-CD2 3.85Å; F354-L368 HydrophobicContact CB-CD1 4.25Å; V364-L368 HydrophobicContact CG1-CD1 4.22Å; V364-L368 HydrophobicContact CG1-CG 4.43Å; V364-L368 WeakPolarHBondContact O-CG 3.5Å; V364-L368 PolarHBondContact O-N 2.95Å; Q365-L368 PolarHBondContact O-N 3.04Å; L368-N370 VanDerWaalsContact C-N 3.35Å; L368-N370 PolarHBondContact O-N 3.17Å; L368-M371 HydrophobicContact CD2-CE 3.97Å; L368-M371 PolarHBondContact O-N 2.96Å; L368-W372 HydrophobicContact CB-CH2 4.12Å; L368-W372 HydrophobicContact CB-CZ2 4.01Å; L368-W372 HydrophobicContact CB-CZ3 4.42Å; L368-W372 HydrophobicContact CD1-CH2 4.47Å; L368-W372 HydrophobicContact CD1-CZ2 4.42Å; L368-W372 HydrophobicContact CD2-CZ2 4.45Å; L368-W372 WeakPolarHBondContact O-CB 3.23Å; L368-W372 PolarHBondContact O-N 2.95Å |
| 369 | E | 89.8 | Confident | 85.9 | Confident | 40 Ų | 40 | 71.2 Ų | 71.2 | 19% | 0.187 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.4 | -43.1 | 179 | -73.3 | -177.3 | 179.2 | 0 | 0 | 111.8 | Q365 W372 F373 K379 | Q365-E369 HydrophobicContact CG-CG 4.3Å; Q365-E369 PolarHBondContact NE2-OE1 2.99Å; Q365-E369 WeakPolarHBondContact O-CB 3.25Å; Q365-E369 VanDerWaalsContact O-CG 3.28Å; Q365-E369 WeakPolarHBondContact O-CG 3.25Å; Q365-E369 PolarHBondContact O-N 2.96Å; E369-W372 PolarHBondContact O-N 2.8Å; E369-F373 VanDerWaalsContact O-CB 3.27Å; E369-F373 WeakPolarHBondContact O-CB 3.42Å; E369-F373 PolarHBondContact O-N 2.97Å; E369-K379 VanDerWaalsContact CD-CE 3.44Å; E369-K379 WeakPolarHBondContact OE1-CE 3.36Å; E369-K379 IonicContact OE1-NZ 3.49Å; E369-K379 PolarHBondContact OE1-NZ 3.18Å; E369-K379 VanDerWaalsContact OE2-CE 3.32Å; E369-K379 WeakPolarHBondContact OE2-CE 3.44Å; E369-K379 IonicContact OE2-NZ 2.72Å; E369-K379 PolarHBondContact OE2-NZ 3.05Å |
| 370 | N | 91.4 | Very high | 84.8 | Confident | 76 Ų | 76 | 68.3 Ų | 68.3 | 41% | 0.406 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 176.1 | -74.6 | -18.8 | 0 | 0 | 0 | 111.5 | L366 L368 F373 Q374 | L366-N370 VanDerWaalsContact O-CB 3.25Å; L366-N370 WeakPolarHBondContact O-CB 3.42Å; L366-N370 PolarHBondContact O-N 2.96Å; L366-N370 PolarHBondContact O-ND2 3.29Å; L368-N370 VanDerWaalsContact C-N 3.35Å; L368-N370 PolarHBondContact O-N 3.17Å; N370-F373 PolarHBondContact O-N 2.88Å; N370-Q374 VanDerWaalsContact O-CG 3.27Å; N370-Q374 WeakPolarHBondContact O-CG 3.47Å; N370-Q374 PolarHBondContact O-N 2.82Å |
| 371 | M | 91.3 | Very high | 83.3 | Confident | 0 Ų | 0 | 72.1 Ų | 72.1 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -61.9 | -47.2 | 177.7 | -176.7 | -170.7 | 58.2 | 0 | 0 | 111.2 | M325 F328 I332 L345 L349 W367 L368 Q374 L375 | M325-M371 HydrophobicContact CE-CB 4.07Å; M325-M371 HydrophobicContact CE-CE 3.96Å; M325-M371 HydrophobicContact CE-CG 4.33Å; M325-M371 HydrophobicContact CE-SD 3.56Å; M325-M371 VanDerWaalsContact CE-SD 3.56Å; M325-M371 HydrophobicContact SD-SD 4.39Å; F328-M371 HydrophobicContact CB-SD 4.4Å; I332-M371 HydrophobicContact CD1-CG 3.55Å; L345-M371 HydrophobicContact CD1-SD 4.06Å; L345-M371 HydrophobicContact CD2-CE 3.9Å; L345-M371 HydrophobicContact CD2-SD 4.37Å; L349-M371 HydrophobicContact CB-CE 4.19Å; W367-M371 WeakPolarHBondContact O-CB 3.47Å; W367-M371 PolarHBondContact O-N 2.83Å; L368-M371 HydrophobicContact CD2-CE 3.97Å; L368-M371 PolarHBondContact O-N 2.96Å; M371-Q374 PolarHBondContact O-N 2.73Å; M371-L375 HydrophobicContact CG-CD1 4.11Å; M371-L375 WeakPolarHBondContact O-CB 3.46Å; M371-L375 VanDerWaalsContact O-CG 3.3Å; M371-L375 WeakPolarHBondContact O-CG 3.38Å; M371-L375 PolarHBondContact O-N 3.2Å |
| 372 | W | 91.1 | Very high | 83.3 | Confident | 3 Ų | 3 | 74.4 Ų | 74.4 | 1% | 0.011 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.3 | -44 | 177.3 | -64.7 | -21.5 | 0 | 0 | 0 | 112 | L349 N352 L368 E369 Q374 L375 G376 W377 | L349-W372 WeakPolarHBondContact O-CZ2 3.25Å; L349-W372 PolarHBondContact O-NE1 3.22Å; N352-W372 VanDerWaalsContact OD1-CH2 3.27Å; N352-W372 WeakPolarHBondContact OD1-CH2 3.42Å; L368-W372 HydrophobicContact CB-CH2 4.12Å; L368-W372 HydrophobicContact CB-CZ2 4.01Å; L368-W372 HydrophobicContact CB-CZ3 4.42Å; L368-W372 HydrophobicContact CD1-CH2 4.47Å; L368-W372 HydrophobicContact CD1-CZ2 4.42Å; L368-W372 HydrophobicContact CD2-CZ2 4.45Å; L368-W372 WeakPolarHBondContact O-CB 3.23Å; L368-W372 PolarHBondContact O-N 2.95Å; E369-W372 PolarHBondContact O-N 2.8Å; W372-Q374 VanDerWaalsContact C-N 3.34Å; W372-Q374 PolarHBondContact O-N 2.82Å; W372-L375 CarbonylContact O-C 3.51Å; W372-L375 WeakPolarHBondContact O-CA 3.25Å; W372-L375 PolarHBondContact O-N 3.48Å; W372-L375 VanDerWaalsContact O-N 3.11Å; W372-G376 PolarHBondContact O-N 2.73Å; W372-W377 HydrophobicContact CB-CB 4.17Å; W372-W377 AromaticContact CD1-CE3 3.54Å; W372-W377 AromaticContact CD1-CZ3 3.91Å; W372-W377 HydrophobicContact CG-CE3 4.16Å; W372-W377 PolarHBondContact O-N 3.43Å |
| 373 | F | 90.9 | Very high | 83.1 | Confident | 168 Ų | 168 | 69.7 Ų | 69.7 | 74% | 0.737 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -58.4 | -46 | 175.4 | 177.8 | -100.7 | 0 | 0 | 0 | 111.6 | E369 N370 L375 G376 | E369-F373 VanDerWaalsContact O-CB 3.27Å; E369-F373 WeakPolarHBondContact O-CB 3.42Å; E369-F373 PolarHBondContact O-N 2.97Å; N370-F373 PolarHBondContact O-N 2.88Å; F373-L375 VanDerWaalsContact C-N 3.28Å; F373-L375 PolarHBondContact O-N 2.94Å; F373-G376 PolarHBondContact O-N 2.89Å |
| 374 | Q | 90.4 | Very high | 82.7 | Confident | 75 Ų | 75 | 69.1 Ų | 69.1 | 35% | 0.35 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.1 | -31.2 | 177.3 | -69.4 | 177.8 | 9.1 | 0 | 0 | 112.7 | I332 R338 N370 M371 W372 G376 | I332-Q374 HydrophobicContact CG2-CB 3.6Å; I332-Q374 HydrophobicContact CG2-CG 4.38Å; R338-Q374 WeakPolarHBondContact CD-O 3.35Å; R338-Q374 PolarHBondContact NH1-O 3.34Å; N370-Q374 VanDerWaalsContact O-CG 3.27Å; N370-Q374 WeakPolarHBondContact O-CG 3.47Å; N370-Q374 PolarHBondContact O-N 2.82Å; M371-Q374 PolarHBondContact O-N 2.73Å; W372-Q374 VanDerWaalsContact C-N 3.34Å; W372-Q374 PolarHBondContact O-N 2.82Å; Q374-G376 VanDerWaalsContact C-N 3.26Å |
| 375 | L | 90.1 | Very high | 82.5 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -76.3 | -10.2 | 171.8 | -69.6 | 172 | 0 | 0 | 0 | 112.9 | I332 R338 L341 R342 L345 M371 W372 F373 W377 | I332-L375 HydrophobicContact CD1-CD2 4.42Å; I332-L375 HydrophobicContact CD1-CG 4.27Å; I332-L375 HydrophobicContact CG1-CD2 4.23Å; R338-L375 HydrophobicContact CG-CD2 4.02Å; L341-L375 HydrophobicContact CB-CD2 4.32Å; L341-L375 HydrophobicContact CD2-CD2 4.22Å; L341-L375 HydrophobicContact CG-CD2 4.32Å; R342-L375 HydrophobicContact CG-CB 4.49Å; R342-L375 HydrophobicContact CG-CD2 4.01Å; R342-L375 PolarHBondContact NE-O 3.43Å; R342-L375 PolarHBondContact NH2-O 2.86Å; L345-L375 HydrophobicContact CD2-CD1 3.94Å; M371-L375 HydrophobicContact CG-CD1 4.11Å; M371-L375 WeakPolarHBondContact O-CB 3.46Å; M371-L375 VanDerWaalsContact O-CG 3.3Å; M371-L375 WeakPolarHBondContact O-CG 3.38Å; M371-L375 PolarHBondContact O-N 3.2Å; W372-L375 CarbonylContact O-C 3.51Å; W372-L375 WeakPolarHBondContact O-CA 3.25Å; W372-L375 PolarHBondContact O-N 3.48Å; W372-L375 VanDerWaalsContact O-N 3.11Å; F373-L375 VanDerWaalsContact C-N 3.28Å; F373-L375 PolarHBondContact O-N 2.94Å; L375-W377 HydrophobicContact CB-CD2 4.42Å; L375-W377 HydrophobicContact CB-CG 4.5Å; L375-W377 HydrophobicContact CD1-CZ3 4.45Å |
| 376 | G | 86.7 | Confident | 82.2 | Confident | 53 Ų | 53 | 73.6 Ų | 73.6 | 55% | 0.546 | 38% | 0.377 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.5 | 30.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | W372 F373 Q374 | W372-G376 PolarHBondContact O-N 2.73Å; F373-G376 PolarHBondContact O-N 2.89Å; Q374-G376 VanDerWaalsContact C-N 3.26Å |
| 377 | W | 84.2 | Confident | 81.7 | Confident | 63 Ų | 63 | 72.5 Ų | 72.5 | 24% | 0.239 | 37% | 0.371 | C | S | . | . | P | Polyproline II helix | trans | -96.5 | 135.2 | 170 | -63.5 | -11.6 | 0 | 0 | 0 | 109.5 | R342 L345 R350 W372 L375 | R342-W377 WeakPolarHBondContact O-CZ2 3.4Å; L345-W377 HydrophobicContact CB-CH2 3.99Å; L345-W377 HydrophobicContact CD2-CH2 3.53Å; L345-W377 HydrophobicContact CD2-CZ3 3.43Å; L345-W377 VanDerWaalsContact CD2-CZ3 3.43Å; L345-W377 HydrophobicContact CG-CH2 4.39Å; R350-W377 HydrophobicContact CB-CH2 4.42Å; R350-W377 HydrophobicContact CB-CZ3 4.03Å; R350-W377 HydrophobicContact CG-CH2 3.65Å; R350-W377 HydrophobicContact CG-CZ3 3.69Å; W372-W377 HydrophobicContact CB-CB 4.17Å; W372-W377 AromaticContact CD1-CE3 3.54Å; W372-W377 AromaticContact CD1-CZ3 3.91Å; W372-W377 HydrophobicContact CG-CE3 4.16Å; W372-W377 PolarHBondContact O-N 3.43Å; L375-W377 HydrophobicContact CB-CD2 4.42Å; L375-W377 HydrophobicContact CB-CG 4.5Å; L375-W377 HydrophobicContact CD1-CZ3 4.45Å |
| 378 | D | 75.7 | Confident | 81 | Confident | 150 Ų | 150 | 73.4 Ų | 73.4 | 80% | 0.802 | 38% | 0.381 | S | S | * | . | P | Polyproline II helix | trans | -67.6 | 153.8 | 168.1 | -65.2 | -37.5 | 0 | 0 | 0 | 109.5 | V380 | D378-V380 PolarHBondContact O-N 2.97Š|
| 379 | K | 61.9 | Low | 80.4 | Confident | 130 Ų | 130 | 78.9 Ų | 78.9 | 57% | 0.565 | 41% | 0.409 | S | S | * | . | P | Polyproline II helix | trans | -50.6 | 117.5 | 177.3 | -72.9 | -166.5 | 178.6 | -157.3 | 0 | 109.1 | E369 N381 | E369-K379 VanDerWaalsContact CD-CE 3.44Å; E369-K379 WeakPolarHBondContact OE1-CE 3.36Å; E369-K379 IonicContact OE1-NZ 3.49Å; E369-K379 PolarHBondContact OE1-NZ 3.18Å; E369-K379 VanDerWaalsContact OE2-CE 3.32Å; E369-K379 WeakPolarHBondContact OE2-CE 3.44Å; E369-K379 IonicContact OE2-NZ 2.72Å; E369-K379 PolarHBondContact OE2-NZ 3.05Å; K379-N381 PolarHBondContact O-N 3Å; K379-N381 VanDerWaalsContact O-N 3.12Å |
| 380 | V | 56.6 | Low | 79.6 | Confident | 64 Ų | 64 | 82.2 Ų | 82.2 | 39% | 0.388 | 43% | 0.428 | S | S | . | . | trans | -70.2 | 108.7 | 167.5 | -176 | 0 | 0 | 0 | 0 | 105.2 | N352 D378 | N352-V380 PolarHBondContact ND2-O 3.02Å; D378-V380 PolarHBondContact O-N 2.97Å | ||
| 381 | N | 45.4 | Very low | 78.6 | Confident | 204 Ų | 204 | 82.7 Ų | 82.7 | 100% | 1.091 | 43% | 0.43 | S | S | * | . | trans | -56.7 | 0 | 173.8 | -78.1 | -21.1 | 0 | 0 | 0 | 110.3 | N352 K379 | N352-N381 PolarHBondContact ND2-OXT 3.05Å; K379-N381 PolarHBondContact O-N 3Å; K379-N381 VanDerWaalsContact O-N 3.12Å |
Retrieved 381 of 381 residues in 1001.4 ms
(Link to these results)