| 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 | 46.9 | Very low | 50.9 | Low | 240 Ų | 240 | 153.2 Ų | 153.2 | 100% | 1.182 | 80% | 0.8 | S | S | * | * | 0 | 114.1 | 0 | -72.6 | -173.5 | 158.1 | 0 | 0 | 105.9 | E3 | M1-E3 PolarHBondContact O-N 3.21Š| |||
| 2 | S | 49.9 | Very low | 50.5 | Low | 115 Ų | 115 | 158.2 Ų | 158.2 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -84 | 106.7 | -173 | -54.2 | 0 | 0 | 0 | 0 | 109.5 | N4 | S2-N4 PolarHBondContact O-N 3.19Š| ||
| 3 | E | 47 | Very low | 51 | Low | 180 Ų | 180 | 160.5 Ų | 160.5 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | trans | -88 | 90.6 | 165.7 | -85.3 | 176.9 | 130.5 | 0 | 0 | 108.4 | M1 T5 | M1-E3 PolarHBondContact O-N 3.21Å; E3-T5 PolarHBondContact O-N 3.42Å | ||
| 4 | N | 49.9 | Very low | 51.5 | Low | 146 Ų | 146 | 160.9 Ų | 160.9 | 78% | 0.781 | 80% | 0.799 | S | S | * | * | trans | -79.8 | 90.9 | 164.9 | -76.8 | -3.4 | 0 | 0 | 0 | 108 | S2 E6 | S2-N4 PolarHBondContact O-N 3.19Å; N4-E6 PolarHBondContact O-N 3.06Å | ||
| 5 | T | 54.3 | Low | 51.5 | Low | 112 Ų | 112 | 157.9 Ų | 157.9 | 69% | 0.687 | 79% | 0.793 | S | S | * | * | trans | -87.2 | 86.4 | 171 | -55.9 | 0 | 0 | 0 | 0 | 108.7 | E3 I7 | E3-T5 PolarHBondContact O-N 3.42Å; T5-I7 HydrophobicContact CG2-CD1 4.43Å; T5-I7 HydrophobicContact CG2-CG1 3.92Å; T5-I7 PolarHBondContact O-N 3.28Å | ||
| 6 | E | 46.9 | Very low | 51.7 | Low | 166 Ų | 166 | 157.7 Ų | 157.7 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | trans | -76.4 | 95.6 | 172.7 | -171.8 | 113 | -163.8 | 0 | 0 | 109.2 | N4 Q8 | N4-E6 PolarHBondContact O-N 3.06Å; E6-Q8 HydrophobicContact CG-CG 4.41Å; E6-Q8 PolarHBondContact O-N 3.34Å | ||
| 7 | I | 53.7 | Low | 52 | Low | 146 Ų | 146 | 157.3 Ų | 157.3 | 75% | 0.749 | 79% | 0.789 | S | S | * | * | trans | -82.8 | 98.7 | 175.2 | -55.1 | 178.2 | 0 | 0 | 0 | 107.7 | T5 | T5-I7 HydrophobicContact CG2-CD1 4.43Å; T5-I7 HydrophobicContact CG2-CG1 3.92Å; T5-I7 PolarHBondContact O-N 3.28Å | ||
| 8 | Q | 48.5 | Very low | 52.1 | Low | 162 Ų | 162 | 156.7 Ų | 156.7 | 76% | 0.757 | 79% | 0.787 | S | S | * | * | trans | -77.3 | 127.1 | 170 | -67.8 | -160.4 | 43.4 | 0 | 0 | 110.6 | E6 E10 | E6-Q8 HydrophobicContact CG-CG 4.41Å; E6-Q8 PolarHBondContact O-N 3.34Å; Q8-E10 PolarHBondContact O-N 3.5Å | ||
| 9 | P | 55.9 | Low | 52.1 | Low | 109 Ų | 109 | 153.7 Ų | 153.7 | 71% | 0.708 | 78% | 0.78 | S | S | * | * | trans | -84.5 | 93.9 | 176.4 | 32.4 | -30.8 | 0 | 0 | 0 | 110.2 | I11 | P9-I11 PolarHBondContact O-N 3.19Š| ||
| 10 | E | 52.8 | Low | 52.2 | Low | 160 Ų | 160 | 151.3 Ų | 151.3 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | trans | -79.3 | 83.7 | 172.6 | -162.8 | 171.9 | 157.2 | 0 | 0 | 110.1 | Q8 R12 | Q8-E10 PolarHBondContact O-N 3.5Å; E10-R12 VanDerWaalsContact C-N 3.28Å; E10-R12 PolarHBondContact O-N 3.12Å | ||
| 11 | I | 53.9 | Low | 52.1 | Low | 149 Ų | 149 | 152.1 Ų | 152.1 | 76% | 0.764 | 78% | 0.779 | S | S | * | * | trans | -72.8 | 87.2 | 172.9 | -55.1 | 176.1 | 0 | 0 | 0 | 107.9 | P9 K13 | P9-I11 PolarHBondContact O-N 3.19Å; I11-K13 PolarHBondContact O-N 3.38Å | ||
| 12 | R | 46.3 | Very low | 52.4 | Low | 213 Ų | 213 | 148.2 Ų | 148.2 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | trans | -60.5 | 104.3 | 168.7 | -83 | -175.1 | 173 | -161.8 | -1.4 | 109.4 | E10 H14 | E10-R12 VanDerWaalsContact C-N 3.28Å; E10-R12 PolarHBondContact O-N 3.12Å; R12-H14 PolarHBondContact O-N 3.24Å; R12-H14 VanDerWaalsContact O-N 3.11Å | ||
| 13 | K | 57.1 | Low | 52.1 | Low | 188 Ų | 188 | 147.1 Ų | 147.1 | 82% | 0.817 | 76% | 0.756 | S | S | * | * | trans | -63.9 | 109.8 | 165.2 | -63.6 | -175.6 | -178.6 | -177.2 | 0 | 107.8 | I11 V15 | I11-K13 PolarHBondContact O-N 3.38Å; K13-V15 VanDerWaalsContact C-N 3.33Å; K13-V15 PolarHBondContact O-N 2.92Å | ||
| 14 | H | 57.4 | Low | 51.9 | Low | 167 Ų | 167 | 144.1 Ų | 144.1 | 77% | 0.773 | 75% | 0.75 | S | S | * | * | trans | -69.7 | 92.5 | 173 | -164.2 | 66.6 | 0 | 0 | 0 | 107.9 | R12 Q16 | R12-H14 PolarHBondContact O-N 3.24Å; R12-H14 VanDerWaalsContact O-N 3.11Å; H14-Q16 PolarHBondContact O-N 3.36Å; H14-Q16 VanDerWaalsContact O-N 3.14Å | ||
| 15 | V | 52.8 | Low | 51.5 | Low | 116 Ų | 116 | 145.9 Ų | 145.9 | 70% | 0.703 | 75% | 0.753 | S | S | * | * | trans | -74.8 | 99.9 | 171.3 | 174.9 | 0 | 0 | 0 | 0 | 106.7 | K13 N17 | K13-V15 VanDerWaalsContact C-N 3.33Å; K13-V15 PolarHBondContact O-N 2.92Å; V15-N17 PolarHBondContact O-N 2.75Å | ||
| 16 | Q | 54.3 | Low | 51 | Low | 154 Ų | 154 | 144.6 Ų | 144.6 | 72% | 0.72 | 75% | 0.745 | S | S | * | * | trans | -70.9 | 102.1 | 174.2 | -159.4 | 151.4 | -0.3 | 0 | 0 | 107.6 | H14 I18 | H14-Q16 PolarHBondContact O-N 3.36Å; H14-Q16 VanDerWaalsContact O-N 3.14Å; Q16-I18 PolarHBondContact O-N 2.85Å | ||
| 17 | N | 56.9 | Low | 50.6 | Low | 151 Ų | 151 | 141.2 Ų | 141.2 | 81% | 0.807 | 75% | 0.745 | S | S | * | * | trans | -72.1 | 91.2 | -177.7 | -142.2 | 27.8 | 0 | 0 | 0 | 108.1 | V15 P19 | V15-N17 PolarHBondContact O-N 2.75Å; N17-P19 VanDerWaalsContact O-CD 3.31Å; N17-P19 WeakPolarHBondContact O-CD 3.38Å | ||
| 18 | I | 53 | Low | 50 | Low | 147 Ų | 147 | 143.1 Ų | 143.1 | 75% | 0.754 | 75% | 0.749 | S | S | * | * | trans | -76.5 | 115.7 | 177.7 | -60.4 | 171 | 0 | 0 | 0 | 107.6 | Q16 | Q16-I18 PolarHBondContact O-N 2.85Š| ||
| 19 | P | 52.6 | Low | 49.4 | Very low | 100 Ų | 100 | 143.5 Ų | 143.5 | 65% | 0.649 | 76% | 0.756 | S | S | * | * | trans | -67.6 | 147.6 | 179.4 | 26.8 | -32.7 | 0 | 0 | 0 | 111.3 | N17 I21 | N17-P19 VanDerWaalsContact O-CD 3.31Å; N17-P19 WeakPolarHBondContact O-CD 3.38Å; P19-I21 PolarHBondContact O-N 3.13Å | ||
| 20 | P | 54.5 | Low | 48.5 | Very low | 104 Ų | 104 | 141.7 Ų | 141.7 | 68% | 0.675 | 76% | 0.757 | S | S | * | * | trans | -64.2 | 131.7 | -179.5 | 26.1 | -32.4 | 0 | 0 | 0 | 110.5 | H22 | P20-H22 PolarHBondContact O-N 3.44Š| ||
| 21 | I | 50.5 | Low | 47.7 | Very low | 169 Ų | 169 | 144.2 Ų | 144.2 | 87% | 0.867 | 77% | 0.766 | S | S | * | * | trans | -65.9 | 100.5 | 174.1 | -57.8 | 171.8 | 0 | 0 | 0 | 107 | P19 A23 | P19-I21 PolarHBondContact O-N 3.13Å; I21-A23 PolarHBondContact O-N 3.36Å | ||
| 22 | H | 52 | Low | 47.1 | Very low | 159 Ų | 159 | 142.4 Ų | 142.4 | 74% | 0.736 | 77% | 0.766 | S | S | * | * | trans | -60.6 | 122.1 | 170.3 | -86.6 | -91.7 | 0 | 0 | 0 | 108.6 | P20 V24 | P20-H22 PolarHBondContact O-N 3.44Å; H22-V24 PolarHBondContact O-N 2.98Å | ||
| 23 | A | 43.1 | Very low | 46.7 | Very low | 92 Ų | 92 | 141.5 Ų | 141.5 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | trans | -58.4 | 106.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | I21 Q25 | I21-A23 PolarHBondContact O-N 3.36Å; A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 3.02Å | ||
| 24 | V | 44.4 | Very low | 46 | Very low | 117 Ų | 117 | 139.3 Ų | 139.3 | 71% | 0.709 | 77% | 0.766 | S | S | * | * | trans | -74 | 89.2 | 175.7 | 177.2 | 0 | 0 | 0 | 0 | 107.5 | H22 T26 | H22-V24 PolarHBondContact O-N 2.98Å; V24-T26 HydrophobicContact CG1-CG2 3.37Å; V24-T26 PolarHBondContact O-N 3.49Å; V24-T26 VanDerWaalsContact O-N 3.08Å | ||
| 25 | Q | 40.4 | Very low | 45.4 | Very low | 182 Ų | 182 | 139.8 Ų | 139.8 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -76.9 | 73.1 | 167.9 | -166.8 | 79.8 | 22.9 | 0 | 0 | 108.4 | A23 A27 | A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 3.02Å; Q25-A27 PolarHBondContact O-N 2.94Å | ||
| 26 | T | 43.7 | Very low | 44.9 | Very low | 86 Ų | 86 | 139 Ų | 139 | 53% | 0.528 | 77% | 0.773 | S | S | . | * | trans | -86.4 | 95.6 | 173.6 | 44.2 | 0 | 0 | 0 | 0 | 109.9 | V24 F28 | V24-T26 HydrophobicContact CG1-CG2 3.37Å; V24-T26 PolarHBondContact O-N 3.49Å; V24-T26 VanDerWaalsContact O-N 3.08Å; T26-F28 VanDerWaalsContact C-N 3.34Å; T26-F28 HydrophobicContact CG2-CE2 4.18Å; T26-F28 PolarHBondContact O-N 3.2Å; T26-F28 VanDerWaalsContact O-N 3.1Å | ||
| 27 | A | 39.3 | Very low | 44.6 | Very low | 94 Ų | 94 | 140.8 Ų | 140.8 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | trans | -63.3 | 96.9 | 153.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | Q25 D29 | Q25-A27 PolarHBondContact O-N 2.94Å; A27-D29 VanDerWaalsContact C-N 3.32Å; A27-D29 PolarHBondContact O-N 3.03Å; A27-D29 VanDerWaalsContact O-N 3.13Å | ||
| 28 | F | 41.4 | Very low | 44 | Very low | 186 Ų | 186 | 141.9 Ų | 141.9 | 82% | 0.816 | 79% | 0.785 | S | S | * | * | trans | -80.2 | 84.5 | 170.4 | -90 | -87.6 | 0 | 0 | 0 | 108.6 | T26 | T26-F28 VanDerWaalsContact C-N 3.34Å; T26-F28 HydrophobicContact CG2-CE2 4.18Å; T26-F28 PolarHBondContact O-N 3.2Å; T26-F28 VanDerWaalsContact O-N 3.1Å | ||
| 29 | D | 35.1 | Very low | 43.4 | Very low | 170 Ų | 170 | 142.2 Ų | 142.2 | 91% | 0.909 | 79% | 0.789 | S | S | * | * | trans | -114.5 | 93.4 | 163.9 | -128.3 | -21 | 0 | 0 | 0 | 106.3 | A27 | A27-D29 VanDerWaalsContact C-N 3.32Å; A27-D29 PolarHBondContact O-N 3.03Å; A27-D29 VanDerWaalsContact O-N 3.13Å | ||
| 30 | G | 37.4 | Very low | 42.9 | Very low | 71 Ų | 71 | 142.5 Ų | 142.5 | 73% | 0.732 | 79% | 0.793 | S | S | * | * | trans | -155.6 | 85.3 | -168.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 31 | K | 35.7 | Very low | 42.1 | Very low | 213 Ų | 213 | 145.8 Ų | 145.8 | 93% | 0.926 | 80% | 0.804 | S | S | * | * | trans | -83.5 | 105.7 | 173.4 | -165.3 | 170.5 | -175.1 | 170.8 | 0 | 108.7 | ||||
| 32 | S | 41.2 | Very low | 41.5 | Very low | 112 Ų | 112 | 143 Ų | 143 | 78% | 0.783 | 80% | 0.799 | S | S | * | * | trans | -153.3 | 110.4 | 165.4 | -72.4 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 33 | K | 38.6 | Very low | 41 | Very low | 194 Ų | 194 | 144.1 Ų | 144.1 | 84% | 0.843 | 81% | 0.807 | S | S | * | * | 44.3 | 80.8 | 59.6 | -94.4 | -168.1 | 177.4 | -176.2 | 0 | 112 | |||||
| 34 | D | 42.6 | Very low | 40.9 | Very low | 142 Ų | 142 | 149 Ų | 149 | 76% | 0.759 | 81% | 0.811 | S | S | * | * | 152.5 | 79.5 | 128.7 | -77.2 | -13.9 | 0 | 0 | 0 | 110.2 | |||||
| 35 | D | 43.8 | Very low | 40.6 | Very low | 177 Ų | 177 | 149.3 Ų | 149.3 | 95% | 0.947 | 82% | 0.816 | S | S | * | * | trans | -108.9 | 81.1 | 162.3 | -78.7 | -35.8 | 0 | 0 | 0 | 108.4 | ||||
| 36 | S | 42.8 | Very low | 40.5 | Very low | 98 Ų | 98 | 150 Ų | 150 | 69% | 0.685 | 82% | 0.819 | S | S | * | * | trans | -104.3 | 78.2 | 166.6 | 62.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 37 | H | 47 | Very low | 40.1 | Very low | 193 Ų | 193 | 154.6 Ų | 154.6 | 89% | 0.894 | 83% | 0.832 | S | S | * | * | trans | -151.8 | 83.5 | 163.5 | -86.5 | -42.1 | 0 | 0 | 0 | 109.5 | ||||
| 38 | I | 44.7 | Very low | 40.2 | Very low | 173 Ų | 173 | 156.1 Ų | 156.1 | 89% | 0.887 | 83% | 0.833 | S | S | * | * | trans | -106.5 | 123 | 155.2 | 56.9 | 168.7 | 0 | 0 | 0 | 108.7 | ||||
| 39 | D | 41.2 | Very low | 39.8 | Very low | 155 Ų | 155 | 155.9 Ų | 155.9 | 83% | 0.829 | 83% | 0.832 | S | S | * | * | trans | -68.8 | 147 | -169.9 | -145.1 | -14.1 | 0 | 0 | 0 | 111.7 | L41 | D39-L41 PolarHBondContact O-N 3.1Å; D39-L41 VanDerWaalsContact O-N 3.15Å | ||
| 40 | S | 40.8 | Very low | 40.1 | Very low | 106 Ų | 106 | 154 Ų | 154 | 74% | 0.741 | 83% | 0.827 | S | S | * | * | trans | -75.6 | 97.2 | -170.9 | -65.1 | 0 | 0 | 0 | 0 | 111.4 | S42 | S40-S42 PolarHBondContact O-N 3.15Å; S40-S42 VanDerWaalsContact O-N 3.15Å | ||
| 41 | L | 39.3 | Very low | 39.9 | Very low | 172 Ų | 172 | 155.5 Ų | 155.5 | 90% | 0.901 | 83% | 0.826 | S | S | * | * | trans | -84.5 | 88.7 | 166 | -73.3 | 176.7 | 0 | 0 | 0 | 110.8 | D39 M43 | D39-L41 PolarHBondContact O-N 3.1Å; D39-L41 VanDerWaalsContact O-N 3.15Å; L41-M43 PolarHBondContact O-N 2.69Å | ||
| 42 | S | 37 | Very low | 40.2 | Very low | 111 Ų | 111 | 153.4 Ų | 153.4 | 78% | 0.776 | 83% | 0.825 | S | S | * | * | trans | -55.2 | 100.8 | 167 | 162.9 | 0 | 0 | 0 | 0 | 112.2 | S40 | S40-S42 PolarHBondContact O-N 3.15Å; S40-S42 VanDerWaalsContact O-N 3.15Å | ||
| 43 | M | 41.6 | Very low | 40 | Very low | 182 Ų | 182 | 154.3 Ų | 154.3 | 90% | 0.897 | 83% | 0.826 | S | S | * | * | trans | -116.2 | 128.3 | 161.8 | -69.9 | -171.8 | 73.3 | 0 | 0 | 110.9 | L41 | L41-M43 PolarHBondContact O-N 2.69Š| ||
| 44 | K | 41 | Very low | 40.2 | Very low | 194 Ų | 194 | 153.4 Ų | 153.4 | 84% | 0.843 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 156.3 | -171.8 | -86.7 | 174.9 | 175.2 | 173.7 | 0 | 113.2 | ||
| 45 | P | 38.1 | Very low | 40.5 | Very low | 125 Ų | 125 | 154.4 Ų | 154.4 | 81% | 0.812 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 123.9 | -171.8 | 33.3 | -32.5 | 0 | 0 | 0 | 112.1 | ||
| 46 | E | 39.1 | Very low | 40.7 | Very low | 195 Ų | 195 | 152.8 Ų | 152.8 | 91% | 0.911 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 134.6 | 161 | -96.8 | -167.5 | 145.7 | 0 | 0 | 110.3 | ||
| 47 | K | 34.5 | Very low | 41.4 | Very low | 184 Ų | 184 | 153.8 Ų | 153.8 | 80% | 0.8 | 82% | 0.823 | S | S | * | * | trans | -120.9 | 111.4 | -171.3 | -174.7 | -175.7 | -167 | 174.3 | 0 | 108.8 | ||||
| 48 | P | 42.3 | Very low | 42 | Very low | 125 Ų | 125 | 152.6 Ų | 152.6 | 81% | 0.812 | 82% | 0.818 | S | S | * | * | trans | -108.6 | 137.8 | 155.2 | 16.7 | 1.6 | 0 | 0 | 0 | 110.8 | ||||
| 49 | K | 33.2 | Very low | 42.8 | Very low | 182 Ų | 182 | 150.2 Ų | 150.2 | 79% | 0.791 | 81% | 0.806 | S | S | * | * | trans | -92.1 | 129.5 | 178.6 | -68.2 | 165.7 | 166.9 | 173.8 | 0 | 109.4 | ||||
| 50 | T | 40 | Very low | 44.4 | Very low | 130 Ų | 130 | 145.9 Ų | 145.9 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | trans | -170.2 | 97.2 | 149.2 | 43.3 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 51 | S | 34.1 | Very low | 46.1 | Very low | 102 Ų | 102 | 144.8 Ų | 144.8 | 71% | 0.713 | 79% | 0.785 | S | S | * | * | 34.7 | 78.9 | 94.3 | 76.5 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 52 | D | 42.3 | Very low | 48.2 | Very low | 169 Ų | 169 | 138.6 Ų | 138.6 | 90% | 0.904 | 76% | 0.763 | S | S | * | * | -144.8 | 114.2 | 129.4 | -86.6 | -35.1 | 0 | 0 | 0 | 107.6 | |||||
| 53 | T | 35.7 | Very low | 50.5 | Low | 131 Ų | 131 | 136.7 Ų | 136.7 | 80% | 0.804 | 74% | 0.744 | S | S | * | * | trans | -88 | 104.7 | 174.3 | -62.9 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 54 | E | 42.5 | Very low | 52.4 | Low | 175 Ų | 175 | 132.6 Ų | 132.6 | 82% | 0.818 | 73% | 0.725 | S | S | * | * | trans | 178.2 | 136.5 | 141.4 | -107.1 | 166.7 | 173.8 | 0 | 0 | 111.2 | ||||
| 55 | E | 50.7 | Low | 54.3 | Low | 163 Ų | 163 | 126.1 Ų | 126.1 | 76% | 0.762 | 71% | 0.708 | S | S | * | * | trans | 69.5 | 88.6 | 163 | -46.8 | -135.4 | 157.6 | 0 | 0 | 115.1 | T57 | E55-T57 PolarHBondContact O-N 3.05Š| ||
| 56 | V | 46.3 | Very low | 56.5 | Low | 143 Ų | 143 | 126.7 Ų | 126.7 | 87% | 0.867 | 70% | 0.7 | S | S | * | * | trans | -48 | 82.1 | 146.8 | -171.1 | 0 | 0 | 0 | 0 | 107.4 | E58 | V56-E58 PolarHBondContact O-N 3.44Š| ||
| 57 | T | 58.7 | Low | 58.4 | Low | 119 Ų | 119 | 121.8 Ų | 121.8 | 73% | 0.73 | 68% | 0.679 | S | S | * | * | trans | -65.2 | 101.9 | 164.2 | 50.8 | 0 | 0 | 0 | 0 | 104.4 | E55 I59 | E55-T57 PolarHBondContact O-N 3.05Å; T57-I59 PolarHBondContact O-N 3.42Å | ||
| 58 | E | 58.6 | Low | 60.6 | Low | 169 Ų | 169 | 119.5 Ų | 119.5 | 79% | 0.79 | 67% | 0.671 | S | S | * | * | trans | -38.5 | 115.3 | 172.2 | -61.7 | 176.9 | 168.8 | 0 | 0 | 107.8 | V56 S60 | V56-E58 PolarHBondContact O-N 3.44Å; E58-S60 VanDerWaalsContact C-N 3.32Å; E58-S60 PolarHBondContact O-N 3.1Å | ||
| 59 | I | 62.6 | Low | 62.3 | Low | 123 Ų | 123 | 116.6 Ų | 116.6 | 63% | 0.631 | 65% | 0.653 | S | S | * | * | trans | -57.5 | 106.5 | 170.9 | -53.1 | 169 | 0 | 0 | 0 | 104.2 | T57 D63 L64 | T57-I59 PolarHBondContact O-N 3.42Å; I59-D63 HydrophobicContact CG2-CB 3.95Å; I59-L64 HydrophobicContact CG2-CD1 4.48Å; I59-L64 HydrophobicContact CG2-CG 4.35Å | ||
| 60 | S | 74.1 | Confident | 64.5 | Low | 63 Ų | 63 | 110.3 Ų | 110.3 | 44% | 0.441 | 64% | 0.635 | S | S | . | * | trans | -66.9 | 150.2 | -174.1 | 177.5 | 0 | 0 | 0 | 0 | 107.9 | E58 G62 D63 L64 | E58-S60 VanDerWaalsContact C-N 3.32Å; E58-S60 PolarHBondContact O-N 3.1Å; S60-G62 PolarHBondContact O-N 3.42Å; S60-G62 PolarHBondContact OG-N 3.4Å; S60-D63 PolarHBondContact N-OD2 3.46Å; S60-D63 PolarHBondContact O-N 3.02Å; S60-L64 PolarHBondContact O-N 3.41Å; S60-L64 VanDerWaalsContact O-N 3.13Å | ||
| 61 | A | 76 | Confident | 66.1 | Low | 84 Ų | 84 | 108.8 Ų | 108.8 | 69% | 0.694 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -54.6 | -23.3 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | A65 | A61-A65 WeakPolarHBondContact O-CB 3.42Å; A61-A65 PolarHBondContact O-N 2.82Å |
| 62 | G | 83.7 | Confident | 67.8 | Low | 41 Ų | 41 | 106.3 Ų | 106.3 | 42% | 0.423 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -65.1 | -47.4 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | S60 L64 A65 E66 | S60-G62 PolarHBondContact O-N 3.42Å; S60-G62 PolarHBondContact OG-N 3.4Å; G62-L64 VanDerWaalsContact C-N 3.33Å; G62-L64 PolarHBondContact O-N 3.48Å; G62-A65 CarbonylContact O-C 3.57Å; G62-A65 WeakPolarHBondContact O-CB 3.4Å; G62-A65 PolarHBondContact O-N 3.48Å; G62-A65 VanDerWaalsContact O-N 3.13Å; G62-E66 PolarHBondContact O-N 3.21Å |
| 63 | D | 85.3 | Confident | 69.1 | Low | 72 Ų | 72 | 105.9 Ų | 105.9 | 39% | 0.385 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65.1 | -39.9 | 179.7 | -50.7 | -29.2 | 0 | 0 | 0 | 110.8 | I59 S60 A65 E66 I67 | I59-D63 HydrophobicContact CG2-CB 3.95Å; S60-D63 PolarHBondContact N-OD2 3.46Å; S60-D63 PolarHBondContact O-N 3.02Å; D63-A65 VanDerWaalsContact C-N 3.33Å; D63-A65 PolarHBondContact O-N 2.97Å; D63-E66 PolarHBondContact O-N 2.91Å; D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.32Å; D63-I67 PolarHBondContact O-N 3.12Å |
| 64 | L | 81.2 | Confident | 70.6 | Confident | 95 Ų | 95 | 104.2 Ų | 104.2 | 50% | 0.497 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -63.4 | -38.9 | 173.2 | -101.6 | 157.4 | 0 | 0 | 0 | 112 | I59 S60 G62 H68 | I59-L64 HydrophobicContact CG2-CD1 4.48Å; I59-L64 HydrophobicContact CG2-CG 4.35Å; S60-L64 PolarHBondContact O-N 3.41Å; S60-L64 VanDerWaalsContact O-N 3.13Å; G62-L64 VanDerWaalsContact C-N 3.33Å; G62-L64 PolarHBondContact O-N 3.48Å; L64-H68 WeakPolarHBondContact O-CB 3.35Å; L64-H68 PolarHBondContact O-N 3.03Å |
| 65 | A | 81.2 | Confident | 71.4 | Confident | 58 Ų | 58 | 98.8 Ų | 98.8 | 48% | 0.479 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.2 | -37.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | A61 G62 D63 H68 S69 | A61-A65 WeakPolarHBondContact O-CB 3.42Å; A61-A65 PolarHBondContact O-N 2.82Å; G62-A65 CarbonylContact O-C 3.57Å; G62-A65 WeakPolarHBondContact O-CB 3.4Å; G62-A65 PolarHBondContact O-N 3.48Å; G62-A65 VanDerWaalsContact O-N 3.13Å; D63-A65 VanDerWaalsContact C-N 3.33Å; D63-A65 PolarHBondContact O-N 2.97Å; A65-H68 PolarHBondContact O-N 3.3Å; A65-S69 WeakPolarHBondContact O-CB 3.48Å; A65-S69 PolarHBondContact O-N 3.22Å |
| 66 | E | 85.2 | Confident | 71.9 | Confident | 138 Ų | 138 | 96.2 Ų | 96.2 | 65% | 0.645 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.1 | -42.6 | 175.7 | -168.7 | 171.4 | -165.5 | 0 | 0 | 111.4 | G62 D63 H68 S69 A70 | G62-E66 PolarHBondContact O-N 3.21Å; D63-E66 PolarHBondContact O-N 2.91Å; E66-H68 PolarHBondContact O-N 3.49Å; E66-S69 PolarHBondContact O-N 2.88Å; E66-A70 WeakPolarHBondContact O-CB 3.46Å; E66-A70 PolarHBondContact O-N 3.14Å |
| 67 | I | 77.9 | Confident | 72.5 | Confident | 91 Ų | 91 | 95.6 Ų | 95.6 | 47% | 0.467 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.5 | -42.2 | 173.2 | -66.1 | 165 | 0 | 0 | 0 | 110.7 | D63 S69 A70 I71 | D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.32Å; D63-I67 PolarHBondContact O-N 3.12Å; I67-S69 VanDerWaalsContact C-N 3.31Å; I67-S69 PolarHBondContact O-N 3.4Å; I67-A70 PolarHBondContact O-N 3.47Å; I67-I71 HydrophobicContact CG2-CD1 3.75Å; I67-I71 HydrophobicContact CG2-CG1 4.32Å; I67-I71 WeakPolarHBondContact O-CB 3.36Å; I67-I71 VanDerWaalsContact O-CG1 3.27Å; I67-I71 WeakPolarHBondContact O-CG1 3.48Å; I67-I71 PolarHBondContact O-N 3.35Å |
| 68 | H | 81.6 | Confident | 72.6 | Confident | 137 Ų | 137 | 95.8 Ų | 95.8 | 63% | 0.634 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.9 | -40.8 | 174.9 | -109.6 | -95.6 | 0 | 0 | 0 | 112 | L64 A65 E66 A72 | L64-H68 WeakPolarHBondContact O-CB 3.35Å; L64-H68 PolarHBondContact O-N 3.03Å; A65-H68 PolarHBondContact O-N 3.3Å; E66-H68 PolarHBondContact O-N 3.49Å; H68-A72 WeakPolarHBondContact O-CB 3.35Å; H68-A72 PolarHBondContact O-N 2.87Å |
| 69 | S | 77.2 | Confident | 72.9 | Confident | 63 Ų | 63 | 92.1 Ų | 92.1 | 44% | 0.441 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.5 | -44.9 | 176.1 | -154.5 | 0 | 0 | 0 | 0 | 110.8 | A65 E66 I67 I71 A72 E73 | A65-S69 WeakPolarHBondContact O-CB 3.48Å; A65-S69 PolarHBondContact O-N 3.22Å; E66-S69 PolarHBondContact O-N 2.88Å; I67-S69 VanDerWaalsContact C-N 3.31Å; I67-S69 PolarHBondContact O-N 3.4Å; S69-I71 PolarHBondContact O-N 2.97Å; S69-A72 WeakPolarHBondContact O-CB 3.35Å; S69-A72 PolarHBondContact O-N 3.38Å; S69-E73 WeakPolarHBondContact O-CB 3.44Å; S69-E73 WeakPolarHBondContact O-CG 3.4Å; S69-E73 PolarHBondContact O-N 2.81Å |
| 70 | A | 78.9 | Confident | 73.4 | Confident | 51 Ų | 51 | 90.7 Ų | 90.7 | 42% | 0.421 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.5 | -37.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | E66 I67 E73 S74 | E66-A70 WeakPolarHBondContact O-CB 3.46Å; E66-A70 PolarHBondContact O-N 3.14Å; I67-A70 PolarHBondContact O-N 3.47Å; A70-E73 PolarHBondContact O-N 3.17Å; A70-S74 WeakPolarHBondContact O-CB 3.4Å; A70-S74 PolarHBondContact O-N 2.98Å |
| 71 | I | 75 | Confident | 73.5 | Confident | 97 Ų | 97 | 95.3 Ų | 95.3 | 50% | 0.497 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -69.3 | -41.3 | 173.4 | -68.2 | 168.4 | 0 | 0 | 0 | 110.2 | I67 S69 E73 S74 T75 | I67-I71 HydrophobicContact CG2-CD1 3.75Å; I67-I71 HydrophobicContact CG2-CG1 4.32Å; I67-I71 WeakPolarHBondContact O-CB 3.36Å; I67-I71 VanDerWaalsContact O-CG1 3.27Å; I67-I71 WeakPolarHBondContact O-CG1 3.48Å; I67-I71 PolarHBondContact O-N 3.35Å; S69-I71 PolarHBondContact O-N 2.97Å; I71-E73 VanDerWaalsContact C-N 3.28Å; I71-E73 PolarHBondContact O-N 3.35Å; I71-S74 PolarHBondContact O-N 3.36Å; I71-T75 HydrophobicContact CG2-CG2 4.1Å; I71-T75 WeakPolarHBondContact O-CB 3.43Å; I71-T75 WeakPolarHBondContact O-CG2 3.36Å; I71-T75 PolarHBondContact O-N 3.39Å; I71-T75 PolarHBondContact O-OG1 2.92Å |
| 72 | A | 70.4 | Confident | 73.6 | Confident | 50 Ų | 50 | 94.6 Ų | 94.6 | 41% | 0.413 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.7 | -39.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | H68 S69 T75 | H68-A72 WeakPolarHBondContact O-CB 3.35Å; H68-A72 PolarHBondContact O-N 2.87Å; S69-A72 WeakPolarHBondContact O-CB 3.35Å; S69-A72 PolarHBondContact O-N 3.38Å; A72-T75 PolarHBondContact O-OG1 3.33Å |
| 73 | E | 69.3 | Low | 73.4 | Confident | 160 Ų | 160 | 95.7 Ų | 95.7 | 75% | 0.748 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -72.3 | -36.6 | 174.9 | -73.2 | 177.6 | -167.4 | 0 | 0 | 113.2 | S69 A70 I71 | S69-E73 WeakPolarHBondContact O-CB 3.44Å; S69-E73 WeakPolarHBondContact O-CG 3.4Å; S69-E73 PolarHBondContact O-N 2.81Å; A70-E73 PolarHBondContact O-N 3.17Å; I71-E73 VanDerWaalsContact C-N 3.28Å; I71-E73 PolarHBondContact O-N 3.35Å |
| 74 | S | 65.4 | Low | 73.3 | Confident | 96 Ų | 96 | 96.7 Ų | 96.7 | 67% | 0.671 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -85.1 | -21.9 | -178.2 | -179.3 | 0 | 0 | 0 | 0 | 113.4 | A70 I71 P76 | A70-S74 WeakPolarHBondContact O-CB 3.4Å; A70-S74 PolarHBondContact O-N 2.98Å; I71-S74 PolarHBondContact O-N 3.36Å; S74-P76 WeakPolarHBondContact O-CD 3.49Å; S74-P76 VanDerWaalsContact O-N 3.16Å |
| 75 | T | 61.1 | Low | 73.5 | Confident | 62 Ų | 62 | 93.9 Ų | 93.9 | 38% | 0.38 | 54% | 0.536 | S | S | . | . | S | Bend | trans | -64.1 | 118 | 169.5 | 44 | 0 | 0 | 0 | 0 | 106.3 | I71 A72 H77 | I71-T75 HydrophobicContact CG2-CG2 4.1Å; I71-T75 WeakPolarHBondContact O-CB 3.43Å; I71-T75 WeakPolarHBondContact O-CG2 3.36Å; I71-T75 PolarHBondContact O-N 3.39Å; I71-T75 PolarHBondContact O-OG1 2.92Å; A72-T75 PolarHBondContact O-OG1 3.33Å; T75-H77 PolarHBondContact O-N 2.93Å; T75-H77 PolarHBondContact O-ND1 3.26Å; T75-H77 PolarHBondContact OG1-ND1 3.27Å |
| 76 | P | 60.7 | Low | 73.5 | Confident | 109 Ų | 109 | 96.1 Ų | 96.1 | 71% | 0.708 | 54% | 0.54 | S | S | * | . | trans | -60.6 | 95.7 | 167.3 | 26.4 | -30.5 | 0 | 0 | 0 | 104.7 | S74 L78 | S74-P76 WeakPolarHBondContact O-CD 3.49Å; S74-P76 VanDerWaalsContact O-N 3.16Å; P76-L78 PolarHBondContact O-N 2.82Å | ||
| 77 | H | 59.1 | Low | 73.6 | Confident | 129 Ų | 129 | 95.8 Ų | 95.8 | 60% | 0.597 | 54% | 0.536 | S | S | * | . | trans | -56.7 | 94.3 | 157.9 | -84.4 | 55.1 | 0 | 0 | 0 | 101.9 | T75 D79 | T75-H77 PolarHBondContact O-N 2.93Å; T75-H77 PolarHBondContact O-ND1 3.26Å; T75-H77 PolarHBondContact OG1-ND1 3.27Å; H77-D79 PolarHBondContact O-N 3.18Å | ||
| 78 | L | 61.1 | Low | 74.2 | Confident | 124 Ų | 124 | 96.6 Ų | 96.6 | 65% | 0.649 | 54% | 0.538 | S | S | * | . | trans | -57.8 | 91.6 | 159.2 | -67.5 | 174.1 | 0 | 0 | 0 | 102.1 | P76 S80 I83 | P76-L78 PolarHBondContact O-N 2.82Å; L78-S80 PolarHBondContact O-N 3.09Å; L78-S80 VanDerWaalsContact O-N 3.17Å; L78-I83 HydrophobicContact CB-CD1 3.88Å; L78-I83 HydrophobicContact CB-CG1 4.16Å | ||
| 79 | D | 63.9 | Low | 74.5 | Confident | 92 Ų | 92 | 95.8 Ų | 95.8 | 49% | 0.492 | 53% | 0.534 | S | S | . | . | trans | -51.6 | 131 | -168.4 | -71.3 | -42.7 | 0 | 0 | 0 | 106.1 | H77 E81 T82 I83 | H77-D79 PolarHBondContact O-N 3.18Å; D79-E81 HydrophobicContact CB-CB 4.45Å; D79-E81 CarbonylContact O-C 3.54Å; D79-E81 PolarHBondContact O-N 3.08Å; D79-T82 HydrophobicContact CB-CG2 4.1Å; D79-T82 PolarHBondContact N-OG1 3.49Å; D79-T82 WeakPolarHBondContact O-CA 3.2Å; D79-T82 WeakPolarHBondContact O-CB 3.47Å; D79-T82 PolarHBondContact O-N 3.31Å; D79-T82 PolarHBondContact O-OG1 2.88Å; D79-I83 PolarHBondContact O-N 3.32Å | ||
| 80 | S | 73.1 | Confident | 75 | Confident | 92 Ų | 92 | 97.3 Ų | 97.3 | 64% | 0.643 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -46.6 | -33 | 178.1 | 56.2 | 0 | 0 | 0 | 0 | 111.5 | L78 I83 D84 | L78-S80 PolarHBondContact O-N 3.09Å; L78-S80 VanDerWaalsContact O-N 3.17Å; S80-I83 PolarHBondContact O-N 3.46Å; S80-D84 VanDerWaalsContact O-CB 3.31Å; S80-D84 WeakPolarHBondContact O-CB 3.35Å; S80-D84 VanDerWaalsContact O-CG 3.3Å; S80-D84 PolarHBondContact O-N 3.24Å |
| 81 | E | 76 | Confident | 75.7 | Confident | 161 Ų | 161 | 97.2 Ų | 97.2 | 75% | 0.752 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.3 | -44.6 | 171.4 | -170.4 | 175.1 | -179.7 | 0 | 0 | 114.3 | D79 G85 | D79-E81 HydrophobicContact CB-CB 4.45Å; D79-E81 CarbonylContact O-C 3.54Å; D79-E81 PolarHBondContact O-N 3.08Å; E81-G85 PolarHBondContact O-N 3.08Å |
| 82 | T | 78.7 | Confident | 76.3 | Confident | 68 Ų | 68 | 98.2 Ų | 98.2 | 42% | 0.417 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66 | -42 | 176.5 | 64.1 | 0 | 0 | 0 | 0 | 111.7 | D79 L86 | D79-T82 HydrophobicContact CB-CG2 4.1Å; D79-T82 PolarHBondContact N-OG1 3.49Å; D79-T82 WeakPolarHBondContact O-CA 3.2Å; D79-T82 WeakPolarHBondContact O-CB 3.47Å; D79-T82 PolarHBondContact O-N 3.31Å; D79-T82 PolarHBondContact O-OG1 2.88Å; T82-L86 WeakPolarHBondContact O-CG 3.5Å; T82-L86 PolarHBondContact O-N 3.09Å |
| 83 | I | 78.3 | Confident | 77.1 | Confident | 65 Ų | 65 | 99.2 Ų | 99.2 | 33% | 0.333 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.9 | -45 | 178.2 | -65.6 | -179.7 | 0 | 0 | 0 | 110.2 | L78 D79 S80 L86 K87 | L78-I83 HydrophobicContact CB-CD1 3.88Å; L78-I83 HydrophobicContact CB-CG1 4.16Å; D79-I83 PolarHBondContact O-N 3.32Å; S80-I83 PolarHBondContact O-N 3.46Å; I83-L86 PolarHBondContact O-N 2.94Å; I83-K87 HydrophobicContact CG2-CD 4.21Å; I83-K87 WeakPolarHBondContact O-CG 3.43Å; I83-K87 PolarHBondContact O-N 2.83Å |
| 84 | D | 83.7 | Confident | 78.1 | Confident | 92 Ų | 92 | 94 Ų | 94 | 49% | 0.492 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.8 | -36.7 | -179.6 | -73.6 | -16.6 | 0 | 0 | 0 | 111.8 | S80 K87 E88 | S80-D84 VanDerWaalsContact O-CB 3.31Å; S80-D84 WeakPolarHBondContact O-CB 3.35Å; S80-D84 VanDerWaalsContact O-CG 3.3Å; S80-D84 PolarHBondContact O-N 3.24Å; D84-K87 PolarHBondContact O-N 2.97Å; D84-K87 IonicContact OD1-NZ 3.96Å; D84-E88 WeakPolarHBondContact O-CB 3.42Å; D84-E88 PolarHBondContact O-N 3.38Å |
| 85 | G | 85.4 | Confident | 79.3 | Confident | 37 Ų | 37 | 96.5 Ų | 96.5 | 38% | 0.381 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61 | -43.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113 | E81 E88 Q89 | E81-G85 PolarHBondContact O-N 3.08Å; G85-E88 PolarHBondContact O-N 3.08Å; G85-Q89 PolarHBondContact O-N 3.46Å |
| 86 | L | 82 | Confident | 80.6 | Confident | 105 Ų | 105 | 97.4 Ų | 97.4 | 55% | 0.55 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.9 | -42.2 | 176 | -74 | 173.5 | 0 | 0 | 0 | 112.2 | T82 I83 E88 Q89 V90 | T82-L86 WeakPolarHBondContact O-CG 3.5Å; T82-L86 PolarHBondContact O-N 3.09Å; I83-L86 PolarHBondContact O-N 2.94Å; L86-E88 VanDerWaalsContact C-N 3.31Å; L86-E88 PolarHBondContact O-N 3.22Å; L86-Q89 PolarHBondContact O-N 3.48Å; L86-V90 WeakPolarHBondContact O-CG2 3.48Å; L86-V90 PolarHBondContact O-N 3.48Å |
| 87 | K | 87.6 | Confident | 82 | Confident | 130 Ų | 130 | 98.1 Ų | 98.1 | 57% | 0.565 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.8 | -42.5 | 174.8 | -74.8 | 172.3 | -177.3 | 166.1 | 0 | 111.7 | I83 D84 V90 A91 | I83-K87 HydrophobicContact CG2-CD 4.21Å; I83-K87 WeakPolarHBondContact O-CG 3.43Å; I83-K87 PolarHBondContact O-N 2.83Å; D84-K87 PolarHBondContact O-N 2.97Å; D84-K87 IonicContact OD1-NZ 3.96Å; K87-V90 PolarHBondContact O-N 3.23Å; K87-A91 WeakPolarHBondContact O-CB 3.44Å; K87-A91 PolarHBondContact O-N 3.01Å |
| 88 | E | 89.7 | Confident | 83.4 | Confident | 109 Ų | 109 | 98.5 Ų | 98.5 | 51% | 0.509 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.1 | -41.9 | 176.5 | -162.4 | -163.3 | -175.8 | 0 | 0 | 111.3 | D84 G85 L86 A91 K92 | D84-E88 WeakPolarHBondContact O-CB 3.42Å; D84-E88 PolarHBondContact O-N 3.38Å; G85-E88 PolarHBondContact O-N 3.08Å; L86-E88 VanDerWaalsContact C-N 3.31Å; L86-E88 PolarHBondContact O-N 3.22Å; E88-A91 PolarHBondContact O-N 3.39Å; E88-K92 VanDerWaalsContact CD-CE 3.44Å; E88-K92 HydrophobicContact CG-CD 4.28Å; E88-K92 WeakPolarHBondContact O-CB 3.45Å; E88-K92 VanDerWaalsContact O-CG 3.27Å; E88-K92 WeakPolarHBondContact O-CG 3.35Å; E88-K92 PolarHBondContact O-N 2.94Å; E88-K92 WeakPolarHBondContact OE1-CE 3.48Å; E88-K92 IonicContact OE1-NZ 2.95Å; E88-K92 PolarHBondContact OE1-NZ 3.31Å; E88-K92 IonicContact OE2-NZ 2.96Å; E88-K92 PolarHBondContact OE2-NZ 2.87Å |
| 89 | Q | 88.4 | Confident | 84.7 | Confident | 119 Ų | 119 | 99.3 Ų | 99.3 | 56% | 0.556 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.3 | -44 | 177 | -169.4 | -172.5 | 70.3 | 0 | 0 | 112.1 | G85 L86 K92 T93 | G85-Q89 PolarHBondContact O-N 3.46Å; L86-Q89 PolarHBondContact O-N 3.48Å; Q89-K92 PolarHBondContact O-N 3.39Å; Q89-T93 WeakPolarHBondContact O-CB 3.36Å; Q89-T93 PolarHBondContact O-N 3.3Å; Q89-T93 PolarHBondContact O-OG1 2.87Å |
| 90 | V | 88.3 | Confident | 85.6 | Confident | 96 Ų | 96 | 102.3 Ų | 102.3 | 58% | 0.582 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.1 | -43.5 | 176.4 | 172.4 | 0 | 0 | 0 | 0 | 110.6 | L86 K87 K92 T93 A94 | L86-V90 WeakPolarHBondContact O-CG2 3.48Å; L86-V90 PolarHBondContact O-N 3.48Å; K87-V90 PolarHBondContact O-N 3.23Å; V90-K92 PolarHBondContact O-N 2.74Å; V90-T93 PolarHBondContact O-N 3.15Å; V90-A94 WeakPolarHBondContact O-CB 3.34Å; V90-A94 PolarHBondContact O-N 2.86Å |
| 91 | A | 92.2 | Very high | 86.1 | Confident | 48 Ų | 48 | 104.1 Ų | 104.1 | 40% | 0.397 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | K87 E88 T93 K95 | K87-A91 WeakPolarHBondContact O-CB 3.44Å; K87-A91 PolarHBondContact O-N 3.01Å; E88-A91 PolarHBondContact O-N 3.39Å; A91-T93 VanDerWaalsContact C-N 3.35Å; A91-K95 WeakPolarHBondContact O-CB 3.5Å; A91-K95 WeakPolarHBondContact O-CG 3.46Å; A91-K95 PolarHBondContact O-N 2.96Å |
| 92 | K | 88.7 | Confident | 86.3 | Confident | 119 Ų | 119 | 99.2 Ų | 99.2 | 52% | 0.517 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.9 | -43 | 173.7 | -76.2 | 170.3 | -179.6 | 164.8 | 0 | 111.2 | E88 Q89 V90 L96 | E88-K92 VanDerWaalsContact CD-CE 3.44Å; E88-K92 HydrophobicContact CG-CD 4.28Å; E88-K92 WeakPolarHBondContact O-CB 3.45Å; E88-K92 VanDerWaalsContact O-CG 3.27Å; E88-K92 WeakPolarHBondContact O-CG 3.35Å; E88-K92 PolarHBondContact O-N 2.94Å; E88-K92 WeakPolarHBondContact OE1-CE 3.48Å; E88-K92 IonicContact OE1-NZ 2.95Å; E88-K92 PolarHBondContact OE1-NZ 3.31Å; E88-K92 IonicContact OE2-NZ 2.96Å; E88-K92 PolarHBondContact OE2-NZ 2.87Å; Q89-K92 PolarHBondContact O-N 3.39Å; V90-K92 PolarHBondContact O-N 2.74Å; K92-L96 WeakPolarHBondContact O-CB 3.28Å; K92-L96 PolarHBondContact O-N 3.26Å |
| 93 | T | 86.1 | Confident | 86.4 | Confident | 70 Ų | 70 | 101.5 Ų | 101.5 | 43% | 0.429 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.4 | -45.3 | 179.9 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | Q89 V90 A91 K95 L96 Q97 | Q89-T93 WeakPolarHBondContact O-CB 3.36Å; Q89-T93 PolarHBondContact O-N 3.3Å; Q89-T93 PolarHBondContact O-OG1 2.87Å; V90-T93 PolarHBondContact O-N 3.15Å; A91-T93 VanDerWaalsContact C-N 3.35Å; T93-K95 VanDerWaalsContact C-N 3.34Å; T93-K95 PolarHBondContact O-N 3.38Å; T93-L96 WeakPolarHBondContact O-CB 3.41Å; T93-L96 PolarHBondContact O-N 3.02Å; T93-L96 VanDerWaalsContact O-N 3.15Å; T93-Q97 PolarHBondContact O-N 2.85Å |
| 94 | A | 91.5 | Very high | 86.2 | Confident | 50 Ų | 50 | 104 Ų | 104 | 41% | 0.413 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | V90 L96 Q97 Q98 | V90-A94 WeakPolarHBondContact O-CB 3.34Å; V90-A94 PolarHBondContact O-N 2.86Å; A94-L96 PolarHBondContact O-N 3.47Å; A94-Q97 PolarHBondContact O-N 3.2Å; A94-Q98 WeakPolarHBondContact O-CB 3.44Å; A94-Q98 PolarHBondContact O-N 3.09Å |
| 95 | K | 89.8 | Confident | 85.6 | Confident | 150 Ų | 150 | 104.7 Ų | 104.7 | 65% | 0.652 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.8 | -39.8 | 174.2 | -75.4 | 178.6 | -180 | 179.9 | 0 | 112.4 | A91 T93 Q98 K99 | A91-K95 WeakPolarHBondContact O-CB 3.5Å; A91-K95 WeakPolarHBondContact O-CG 3.46Å; A91-K95 PolarHBondContact O-N 2.96Å; T93-K95 VanDerWaalsContact C-N 3.34Å; T93-K95 PolarHBondContact O-N 3.38Å; K95-Q98 PolarHBondContact O-N 3.24Å; K95-K99 WeakPolarHBondContact O-CB 3.41Å; K95-K99 PolarHBondContact O-N 3.43Å |
| 96 | L | 89.2 | Confident | 84.8 | Confident | 80 Ų | 80 | 105.4 Ų | 105.4 | 42% | 0.419 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.4 | -42.4 | 177 | -178.4 | 65 | 0 | 0 | 0 | 111.7 | K92 T93 A94 K99 R100 | K92-L96 WeakPolarHBondContact O-CB 3.28Å; K92-L96 PolarHBondContact O-N 3.26Å; T93-L96 WeakPolarHBondContact O-CB 3.41Å; T93-L96 PolarHBondContact O-N 3.02Å; T93-L96 VanDerWaalsContact O-N 3.15Å; A94-L96 PolarHBondContact O-N 3.47Å; L96-K99 PolarHBondContact O-N 2.98Å; L96-R100 WeakPolarHBondContact O-CG 3.27Å; L96-R100 PolarHBondContact O-N 3.18Å |
| 97 | Q | 89.7 | Confident | 83.7 | Confident | 125 Ų | 125 | 103.3 Ų | 103.3 | 58% | 0.584 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.2 | -44.5 | 175.4 | -75.5 | -178.4 | -26.6 | 0 | 0 | 111.6 | T93 A94 K99 R100 Q101 | T93-Q97 PolarHBondContact O-N 2.85Å; A94-Q97 PolarHBondContact O-N 3.2Å; Q97-K99 VanDerWaalsContact C-N 3.34Å; Q97-K99 PolarHBondContact O-N 3.08Å; Q97-R100 PolarHBondContact O-N 2.95Å; Q97-Q101 PolarHBondContact O-N 2.9Å |
| 98 | Q | 87.9 | Confident | 82.2 | Confident | 136 Ų | 136 | 102.8 Ų | 102.8 | 64% | 0.636 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.1 | -42.6 | 175.5 | -172.9 | 179.5 | 35 | 0 | 0 | 111.7 | A94 K95 Q101 A102 | A94-Q98 WeakPolarHBondContact O-CB 3.44Å; A94-Q98 PolarHBondContact O-N 3.09Å; K95-Q98 PolarHBondContact O-N 3.24Å; Q98-Q101 PolarHBondContact O-N 3.17Å; Q98-A102 WeakPolarHBondContact O-CB 3.47Å; Q98-A102 PolarHBondContact O-N 3.43Å |
| 99 | K | 88.2 | Confident | 80.6 | Confident | 141 Ų | 141 | 103.9 Ų | 103.9 | 61% | 0.613 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60.5 | -46.4 | 175.4 | -176.8 | -177.9 | 175 | -174.5 | 0 | 111.4 | K95 L96 Q97 Q101 A102 E103 | K95-K99 WeakPolarHBondContact O-CB 3.41Å; K95-K99 PolarHBondContact O-N 3.43Å; L96-K99 PolarHBondContact O-N 2.98Å; Q97-K99 VanDerWaalsContact C-N 3.34Å; Q97-K99 PolarHBondContact O-N 3.08Å; K99-Q101 VanDerWaalsContact C-N 3.34Å; K99-Q101 PolarHBondContact O-N 2.84Å; K99-A102 PolarHBondContact O-N 3.24Å; K99-E103 WeakPolarHBondContact O-CB 3.42Å; K99-E103 PolarHBondContact O-N 3.03Å |
| 100 | R | 83.6 | Confident | 78.9 | Confident | 155 Ų | 155 | 101.9 Ų | 101.9 | 59% | 0.585 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.6 | -41.5 | 177.2 | -75.4 | 176.7 | 177.1 | 168.8 | -1 | 111.8 | L96 Q97 E103 L104 | L96-R100 WeakPolarHBondContact O-CG 3.27Å; L96-R100 PolarHBondContact O-N 3.18Å; Q97-R100 PolarHBondContact O-N 2.95Å; R100-E103 PolarHBondContact O-N 2.89Å; R100-L104 WeakPolarHBondContact O-CB 3.34Å; R100-L104 PolarHBondContact O-N 3.29Å |
| 101 | Q | 83.5 | Confident | 77.3 | Confident | 130 Ų | 130 | 101.5 Ų | 101.5 | 61% | 0.607 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.1 | -42.6 | 176 | -170.7 | 177.5 | 20.2 | 0 | 0 | 111.6 | Q97 Q98 K99 L104 L105 | Q97-Q101 PolarHBondContact O-N 2.9Å; Q98-Q101 PolarHBondContact O-N 3.17Å; K99-Q101 VanDerWaalsContact C-N 3.34Å; K99-Q101 PolarHBondContact O-N 2.84Å; Q101-L104 PolarHBondContact O-N 2.94Å; Q101-L105 HydrophobicContact CG-CD1 4.41Å; Q101-L105 WeakPolarHBondContact O-CG 3.38Å; Q101-L105 PolarHBondContact O-N 2.92Å |
| 102 | A | 80.3 | Confident | 75.5 | Confident | 58 Ų | 58 | 105.3 Ų | 105.3 | 48% | 0.479 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.9 | -38.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q98 K99 A106 | Q98-A102 WeakPolarHBondContact O-CB 3.47Å; Q98-A102 PolarHBondContact O-N 3.43Å; K99-A102 PolarHBondContact O-N 3.24Å; A102-A106 VanDerWaalsContact O-CB 3.26Å; A102-A106 WeakPolarHBondContact O-CB 3.42Å; A102-A106 PolarHBondContact O-N 3.47Å |
| 103 | E | 80.6 | Confident | 74.1 | Confident | 117 Ų | 117 | 107.4 Ų | 107.4 | 55% | 0.547 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -67.6 | -37 | 176.2 | -175.2 | 169.8 | -168.6 | 0 | 0 | 112.2 | K99 R100 S107 | K99-E103 WeakPolarHBondContact O-CB 3.42Å; K99-E103 PolarHBondContact O-N 3.03Å; R100-E103 PolarHBondContact O-N 2.89Å; E103-S107 VanDerWaalsContact O-CB 3.26Å; E103-S107 WeakPolarHBondContact O-CB 3.36Å; E103-S107 PolarHBondContact O-N 3.04Å; E103-S107 PolarHBondContact O-OG 3.37Å |
| 104 | L | 73.7 | Confident | 72.8 | Confident | 118 Ų | 118 | 113.8 Ų | 113.8 | 62% | 0.618 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -69.3 | -44.7 | 176.8 | -152 | 152.1 | 0 | 0 | 0 | 111.1 | R100 Q101 A106 S107 E108 | R100-L104 WeakPolarHBondContact O-CB 3.34Å; R100-L104 PolarHBondContact O-N 3.29Å; Q101-L104 PolarHBondContact O-N 2.94Å; L104-A106 PolarHBondContact O-N 3.03Å; L104-S107 PolarHBondContact O-N 3.47Å; L104-E108 WeakPolarHBondContact O-CB 3.29Å; L104-E108 PolarHBondContact O-N 3.09Å |
| 105 | L | 71.8 | Confident | 71.5 | Confident | 106 Ų | 106 | 116 Ų | 116 | 56% | 0.555 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -63.3 | -40.6 | 174.1 | -70.3 | 173.2 | 0 | 0 | 0 | 112.4 | Q101 S107 E109 | Q101-L105 HydrophobicContact CG-CD1 4.41Å; Q101-L105 WeakPolarHBondContact O-CG 3.38Å; Q101-L105 PolarHBondContact O-N 2.92Å; L105-S107 VanDerWaalsContact C-N 3.34Å; L105-E109 PolarHBondContact O-N 3.42Å |
| 106 | A | 67.6 | Low | 70.8 | Confident | 52 Ų | 52 | 112.5 Ų | 112.5 | 43% | 0.43 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -66.9 | -36.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | A102 L104 V110 | A102-A106 VanDerWaalsContact O-CB 3.26Å; A102-A106 WeakPolarHBondContact O-CB 3.42Å; A102-A106 PolarHBondContact O-N 3.47Å; L104-A106 PolarHBondContact O-N 3.03Å; A106-V110 WeakPolarHBondContact O-CB 3.45Å; A106-V110 WeakPolarHBondContact O-CG2 3.27Å; A106-V110 PolarHBondContact O-N 3.15Å; A106-V110 VanDerWaalsContact O-N 3.14Å |
| 107 | S | 58.6 | Low | 70.4 | Confident | 60 Ų | 60 | 116.2 Ų | 116.2 | 42% | 0.42 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -69 | -40.8 | 177.3 | -61.6 | 0 | 0 | 0 | 0 | 111.7 | E103 L104 L105 E109 V110 T111 | E103-S107 VanDerWaalsContact O-CB 3.26Å; E103-S107 WeakPolarHBondContact O-CB 3.36Å; E103-S107 PolarHBondContact O-N 3.04Å; E103-S107 PolarHBondContact O-OG 3.37Å; L104-S107 PolarHBondContact O-N 3.47Å; L105-S107 VanDerWaalsContact C-N 3.34Å; S107-E109 PolarHBondContact O-N 3.29Å; S107-V110 CarbonylContact O-C 3.56Å; S107-V110 PolarHBondContact O-N 2.92Å; S107-V110 VanDerWaalsContact O-N 3.1Å; S107-T111 WeakPolarHBondContact O-CG2 3.28Å; S107-T111 PolarHBondContact O-N 2.85Å; S107-T111 PolarHBondContact O-OG1 3.36Å |
| 108 | E | 57.4 | Low | 69.8 | Low | 119 Ų | 119 | 113.2 Ų | 113.2 | 56% | 0.556 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61.5 | -42.9 | 176.9 | -171.3 | 165.6 | -175.5 | 0 | 0 | 111.6 | L104 V110 T111 | L104-E108 WeakPolarHBondContact O-CB 3.29Å; L104-E108 PolarHBondContact O-N 3.09Å; E108-V110 VanDerWaalsContact C-N 3.26Å; E108-V110 PolarHBondContact O-N 3.34Å; E108-T111 WeakPolarHBondContact CA-OG1 3.46Å; E108-T111 PolarHBondContact O-N 2.95Å; E108-T111 PolarHBondContact O-OG1 3.5Å |
| 109 | E | 55.4 | Low | 69.4 | Low | 132 Ų | 132 | 108.9 Ų | 108.9 | 62% | 0.617 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -67 | -27.6 | 175.1 | -155.3 | -171.4 | 159.7 | 0 | 0 | 112.8 | L105 S107 K113 | L105-E109 PolarHBondContact O-N 3.42Å; S107-E109 PolarHBondContact O-N 3.29Å; E109-K113 IonicContact OE1-NZ 2.69Å |
| 110 | V | 52.3 | Low | 69.1 | Low | 77 Ų | 77 | 106.2 Ų | 106.2 | 47% | 0.467 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -82.2 | -35.7 | 177.8 | 172.8 | 0 | 0 | 0 | 0 | 111.9 | A106 S107 E108 D112 K113 R114 | A106-V110 WeakPolarHBondContact O-CB 3.45Å; A106-V110 WeakPolarHBondContact O-CG2 3.27Å; A106-V110 PolarHBondContact O-N 3.15Å; A106-V110 VanDerWaalsContact O-N 3.14Å; S107-V110 CarbonylContact O-C 3.56Å; S107-V110 PolarHBondContact O-N 2.92Å; S107-V110 VanDerWaalsContact O-N 3.1Å; E108-V110 VanDerWaalsContact C-N 3.26Å; E108-V110 PolarHBondContact O-N 3.34Å; V110-D112 VanDerWaalsContact C-N 3.34Å; V110-D112 PolarHBondContact O-N 2.88Å; V110-K113 PolarHBondContact O-N 3.43Å; V110-R114 HydrophobicContact CG1-CB 4.29Å; V110-R114 VanDerWaalsContact O-CB 3.26Å; V110-R114 WeakPolarHBondContact O-CB 3.36Å; V110-R114 PolarHBondContact O-N 2.92Å |
| 111 | T | 55.4 | Low | 69.1 | Low | 89 Ų | 89 | 103.5 Ų | 103.5 | 55% | 0.546 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.1 | -37.9 | -176.9 | 42.3 | 0 | 0 | 0 | 0 | 112.6 | S107 E108 K113 R114 | S107-T111 WeakPolarHBondContact O-CG2 3.28Å; S107-T111 PolarHBondContact O-N 2.85Å; S107-T111 PolarHBondContact O-OG1 3.36Å; E108-T111 WeakPolarHBondContact CA-OG1 3.46Å; E108-T111 PolarHBondContact O-N 2.95Å; E108-T111 PolarHBondContact O-OG1 3.5Å; T111-K113 VanDerWaalsContact C-N 3.28Å; T111-K113 PolarHBondContact O-N 3.27Å; T111-R114 PolarHBondContact O-N 2.97Å |
| 112 | D | 54.4 | Low | 69.2 | Low | 127 Ų | 127 | 100.2 Ų | 100.2 | 68% | 0.679 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.2 | -35.9 | 179.3 | -86.7 | -25.2 | 0 | 0 | 0 | 112.6 | V110 | V110-D112 VanDerWaalsContact C-N 3.34Å; V110-D112 PolarHBondContact O-N 2.88Å |
| 113 | K | 59.5 | Low | 69.3 | Low | 163 Ų | 163 | 101.7 Ų | 101.7 | 71% | 0.709 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -88.3 | -23 | -179.3 | -64.1 | 173.2 | -171.5 | 160 | 0 | 112.5 | E109 V110 T111 K115 | E109-K113 IonicContact OE1-NZ 2.69Å; V110-K113 PolarHBondContact O-N 3.43Å; T111-K113 VanDerWaalsContact C-N 3.28Å; T111-K113 PolarHBondContact O-N 3.27Å; K113-K115 PolarHBondContact O-N 2.81Å |
| 114 | R | 58.1 | Low | 69.6 | Low | 204 Ų | 204 | 98.9 Ų | 98.9 | 77% | 0.77 | 52% | 0.52 | S | S | * | . | trans | -97 | 34.9 | -175.3 | -153.5 | -178 | -177.2 | -178 | -0.4 | 113 | V110 T111 S116 | V110-R114 HydrophobicContact CG1-CB 4.29Å; V110-R114 VanDerWaalsContact O-CB 3.26Å; V110-R114 WeakPolarHBondContact O-CB 3.36Å; V110-R114 PolarHBondContact O-N 2.92Å; T111-R114 PolarHBondContact O-N 2.97Å; R114-S116 PolarHBondContact O-N 3.11Å | ||
| 115 | K | 64.5 | Low | 70.3 | Confident | 98 Ų | 98 | 101.9 Ų | 101.9 | 43% | 0.426 | 52% | 0.523 | S | S | . | . | trans | -56.4 | 126.8 | 162.4 | -65.2 | -174.8 | -177.3 | -178.6 | 0 | 108.4 | K113 A119 L120 E123 | K113-K115 PolarHBondContact O-N 2.81Å; K115-A119 HydrophobicContact CB-CB 4.43Å; K115-L120 HydrophobicContact CB-CD2 4.13Å; K115-L120 HydrophobicContact CB-CG 4.3Å; K115-L120 HydrophobicContact CD-CD2 4.17Å; K115-E123 IonicContact NZ-OE1 3.62Å; K115-E123 PolarHBondContact NZ-OE1 2.97Å; K115-E123 IonicContact NZ-OE2 2.74Å; K115-E123 PolarHBondContact NZ-OE2 3.04Å | ||
| 116 | S | 74.8 | Confident | 71 | Confident | 76 Ų | 76 | 98.8 Ų | 98.8 | 53% | 0.531 | 51% | 0.509 | S | S | . | . | trans | -54.7 | 146.2 | 176.1 | 174.1 | 0 | 0 | 0 | 0 | 110.2 | R114 A118 A119 L120 | R114-S116 PolarHBondContact O-N 3.11Å; S116-A118 PolarHBondContact O-N 3.28Å; S116-A118 VanDerWaalsContact O-N 3.09Å; S116-A118 PolarHBondContact OG-N 2.84Å; S116-A119 WeakPolarHBondContact O-CA 3.41Å; S116-A119 VanDerWaalsContact O-CB 3.31Å; S116-A119 WeakPolarHBondContact O-CB 3.39Å; S116-A119 PolarHBondContact O-N 3.14Å; S116-L120 PolarHBondContact O-N 2.98Å | ||
| 117 | K | 80.9 | Confident | 71.9 | Confident | 158 Ų | 158 | 100.7 Ų | 100.7 | 69% | 0.687 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -53 | -34.4 | 175.6 | -172.3 | 176.8 | -179.6 | -178.6 | 0 | 111.6 | L120 H121 | K117-L120 PolarHBondContact O-N 3.43Å; K117-H121 PolarHBondContact O-CD2 2.94Å; K117-H121 PolarHBondContact O-N 3.12Å; K117-H121 VanDerWaalsContact O-N 3.12Å |
| 118 | A | 78.4 | Confident | 73.5 | Confident | 61 Ų | 61 | 101.8 Ų | 101.8 | 50% | 0.504 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.2 | -43 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | S116 H121 L122 | S116-A118 PolarHBondContact O-N 3.28Å; S116-A118 VanDerWaalsContact O-N 3.09Å; S116-A118 PolarHBondContact OG-N 2.84Å; A118-H121 PolarHBondContact O-N 2.74Å; A118-L122 PolarHBondContact O-N 2.82Å |
| 119 | A | 78.3 | Confident | 74.9 | Confident | 45 Ų | 45 | 100.8 Ų | 100.8 | 37% | 0.372 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.1 | -42.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | K115 S116 H121 L122 E123 | K115-A119 HydrophobicContact CB-CB 4.43Å; S116-A119 WeakPolarHBondContact O-CA 3.41Å; S116-A119 VanDerWaalsContact O-CB 3.31Å; S116-A119 WeakPolarHBondContact O-CB 3.39Å; S116-A119 PolarHBondContact O-N 3.14Å; A119-H121 VanDerWaalsContact C-N 3.32Å; A119-H121 PolarHBondContact O-N 2.83Å; A119-L122 PolarHBondContact O-N 3.25Å; A119-L122 VanDerWaalsContact O-N 3.12Å; A119-E123 WeakPolarHBondContact O-CB 3.46Å; A119-E123 PolarHBondContact O-N 3.42Å |
| 120 | L | 82.4 | Confident | 76.4 | Confident | 86 Ų | 86 | 97.2 Ų | 97.2 | 45% | 0.45 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.1 | -39.6 | 175.6 | -67.1 | 175.9 | 0 | 0 | 0 | 112.6 | K115 S116 K117 L122 S124 | K115-L120 HydrophobicContact CB-CD2 4.13Å; K115-L120 HydrophobicContact CB-CG 4.3Å; K115-L120 HydrophobicContact CD-CD2 4.17Å; S116-L120 PolarHBondContact O-N 2.98Å; K117-L120 PolarHBondContact O-N 3.43Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L120-S124 WeakPolarHBondContact O-CB 3.46Å; L120-S124 PolarHBondContact O-N 3.27Å; L120-S124 PolarHBondContact O-OG 2.95Å |
| 121 | H | 84.5 | Confident | 78.2 | Confident | 98 Ų | 98 | 98.4 Ų | 98.4 | 45% | 0.454 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.1 | -35.6 | 175.5 | -75.6 | -54.6 | 0 | 0 | 0 | 112.7 | K117 A118 A119 R125 | K117-H121 PolarHBondContact O-CD2 2.94Å; K117-H121 PolarHBondContact O-N 3.12Å; K117-H121 VanDerWaalsContact O-N 3.12Å; A118-H121 PolarHBondContact O-N 2.74Å; A119-H121 VanDerWaalsContact C-N 3.32Å; A119-H121 PolarHBondContact O-N 2.83Å; H121-R125 PolarHBondContact O-N 2.95Å; H121-R125 VanDerWaalsContact O-N 3.15Å |
| 122 | L | 84.7 | Confident | 79.9 | Confident | 61 Ų | 61 | 100.3 Ų | 100.3 | 32% | 0.319 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -72.4 | -44.6 | 176.9 | -173.8 | 50.5 | 0 | 0 | 0 | 111.3 | A118 A119 L120 S124 R125 V126 W203 | A118-L122 PolarHBondContact O-N 2.82Å; A119-L122 PolarHBondContact O-N 3.25Å; A119-L122 VanDerWaalsContact O-N 3.12Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.12Å; L122-R125 WeakPolarHBondContact O-CA 3.49Å; L122-R125 WeakPolarHBondContact O-CB 3.43Å; L122-R125 PolarHBondContact O-N 2.89Å; L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.45Å; L122-V126 PolarHBondContact O-N 3.35Å; L122-W203 HydrophobicContact CD2-CH2 3.49Å; L122-W203 VanDerWaalsContact CD2-CH2 3.49Å; L122-W203 HydrophobicContact CD2-CZ2 4.22Å; L122-W203 HydrophobicContact CD2-CZ3 4.4Å; L122-W203 HydrophobicContact CG-CH2 4.24Å |
| 123 | E | 82.3 | Confident | 81.6 | Confident | 89 Ų | 89 | 95.2 Ų | 95.2 | 42% | 0.416 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -53.3 | -49.5 | 172.2 | -178.7 | 171.8 | -178 | 0 | 0 | 110.7 | K115 A119 R125 V126 E127 | K115-E123 IonicContact NZ-OE1 3.62Å; K115-E123 PolarHBondContact NZ-OE1 2.97Å; K115-E123 IonicContact NZ-OE2 2.74Å; K115-E123 PolarHBondContact NZ-OE2 3.04Å; A119-E123 WeakPolarHBondContact O-CB 3.46Å; A119-E123 PolarHBondContact O-N 3.42Å; E123-R125 VanDerWaalsContact C-N 3.27Å; E123-R125 PolarHBondContact O-N 3.34Å; E123-V126 PolarHBondContact O-N 2.99Å; E123-E127 WeakPolarHBondContact O-CB 3.47Å; E123-E127 PolarHBondContact O-N 3.42Å |
| 124 | S | 86.3 | Confident | 82.9 | Confident | 57 Ų | 57 | 89.5 Ų | 89.5 | 40% | 0.399 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.8 | -36.2 | 176 | -58 | 0 | 0 | 0 | 0 | 112.7 | L120 L122 N128 | L120-S124 WeakPolarHBondContact O-CB 3.46Å; L120-S124 PolarHBondContact O-N 3.27Å; L120-S124 PolarHBondContact O-OG 2.95Å; L122-S124 VanDerWaalsContact C-N 3.32Å; L122-S124 PolarHBondContact O-N 3.12Å; S124-N128 WeakPolarHBondContact O-CB 3.47Å; S124-N128 VanDerWaalsContact O-CG 3.23Å; S124-N128 PolarHBondContact O-N 3.18Å; S124-N128 VanDerWaalsContact O-N 3.14Å; S124-N128 PolarHBondContact O-ND2 3Å; S124-N128 VanDerWaalsContact O-ND2 3.11Å |
| 125 | R | 89.1 | Confident | 84.7 | Confident | 181 Ų | 181 | 82.6 Ų | 82.6 | 68% | 0.683 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -72.4 | -40.8 | 178.7 | -177.2 | 59.2 | 172.8 | 179.7 | 2.3 | 111.6 | H121 L122 E123 N128 L129 | H121-R125 PolarHBondContact O-N 2.95Å; H121-R125 VanDerWaalsContact O-N 3.15Å; L122-R125 WeakPolarHBondContact O-CA 3.49Å; L122-R125 WeakPolarHBondContact O-CB 3.43Å; L122-R125 PolarHBondContact O-N 2.89Å; E123-R125 VanDerWaalsContact C-N 3.27Å; E123-R125 PolarHBondContact O-N 3.34Å; R125-N128 PolarHBondContact O-N 2.86Å; R125-L129 PolarHBondContact O-N 3.35Å |
| 126 | V | 85.3 | Confident | 86 | Confident | 42 Ų | 42 | 82.3 Ų | 82.3 | 26% | 0.255 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -67.4 | -44 | 176.9 | 171.8 | 0 | 0 | 0 | 0 | 110.3 | L122 E123 N128 L129 I130 | L122-V126 HydrophobicContact CD1-CG2 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.45Å; L122-V126 PolarHBondContact O-N 3.35Å; E123-V126 PolarHBondContact O-N 2.99Å; V126-N128 VanDerWaalsContact C-N 3.29Å; V126-N128 PolarHBondContact O-N 2.91Å; V126-L129 WeakPolarHBondContact O-CB 3.43Å; V126-L129 PolarHBondContact O-N 3.35Å; V126-I130 HydrophobicContact CG1-CD1 3.86Å; V126-I130 HydrophobicContact CG1-CG1 4.4Å; V126-I130 WeakPolarHBondContact O-CG1 3.49Å; V126-I130 PolarHBondContact O-N 3.34Å |
| 127 | E | 88.3 | Confident | 86.8 | Confident | 92 Ų | 92 | 79.5 Ų | 79.5 | 43% | 0.43 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -58.3 | -43.4 | 175.5 | -168 | -167.9 | 157.7 | 0 | 0 | 111.3 | E123 I130 K131 | E123-E127 WeakPolarHBondContact O-CB 3.47Å; E123-E127 PolarHBondContact O-N 3.42Å; E127-I130 PolarHBondContact O-N 3.47Å; E127-K131 HydrophobicContact CG-CD 4.5Å; E127-K131 WeakPolarHBondContact O-CG 3.11Å; E127-K131 PolarHBondContact O-N 3.04Å; E127-K131 WeakPolarHBondContact OE1-CE 3.27Å; E127-K131 IonicContact OE1-NZ 3.62Å; E127-K131 PolarHBondContact OE1-NZ 2.67Å |
| 128 | N | 92 | Very high | 87.4 | Confident | 82 Ų | 82 | 76.6 Ų | 76.6 | 44% | 0.439 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.9 | -40.1 | 174 | -74 | -26.3 | 0 | 0 | 0 | 112.3 | S124 R125 V126 I130 K131 E132 | S124-N128 WeakPolarHBondContact O-CB 3.47Å; S124-N128 VanDerWaalsContact O-CG 3.23Å; S124-N128 PolarHBondContact O-N 3.18Å; S124-N128 VanDerWaalsContact O-N 3.14Å; S124-N128 PolarHBondContact O-ND2 3Å; S124-N128 VanDerWaalsContact O-ND2 3.11Å; R125-N128 PolarHBondContact O-N 2.86Å; V126-N128 VanDerWaalsContact C-N 3.29Å; V126-N128 PolarHBondContact O-N 2.91Å; N128-I130 VanDerWaalsContact C-N 3.34Å; N128-K131 PolarHBondContact O-N 2.99Å; N128-E132 WeakPolarHBondContact O-CG 3.29Å; N128-E132 PolarHBondContact O-N 3.33Å |
| 129 | L | 87.2 | Confident | 88.2 | Confident | 98 Ų | 98 | 80.4 Ų | 80.4 | 51% | 0.513 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.9 | -41.6 | 175.5 | 179.9 | 63.6 | 0 | 0 | 0 | 111.5 | R125 V126 E132 M133 | R125-L129 PolarHBondContact O-N 3.35Å; V126-L129 WeakPolarHBondContact O-CB 3.43Å; V126-L129 PolarHBondContact O-N 3.35Å; L129-E132 PolarHBondContact O-N 3.14Å; L129-M133 HydrophobicContact CD1-CG 4.5Å; L129-M133 HydrophobicContact CG-SD 4.17Å; L129-M133 WeakPolarHBondContact O-CB 3.21Å; L129-M133 VanDerWaalsContact O-CG 3.28Å; L129-M133 WeakPolarHBondContact O-CG 3.36Å; L129-M133 PolarHBondContact O-N 3.37Å |
| 130 | I | 85.9 | Confident | 88.9 | Confident | 57 Ų | 57 | 79.2 Ų | 79.2 | 29% | 0.292 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 176.4 | -67 | 166.4 | 0 | 0 | 0 | 110.1 | V126 E127 N128 E132 M133 D134 | V126-I130 HydrophobicContact CG1-CD1 3.86Å; V126-I130 HydrophobicContact CG1-CG1 4.4Å; V126-I130 WeakPolarHBondContact O-CG1 3.49Å; V126-I130 PolarHBondContact O-N 3.34Å; E127-I130 PolarHBondContact O-N 3.47Å; N128-I130 VanDerWaalsContact C-N 3.34Å; I130-E132 PolarHBondContact O-N 3.47Å; I130-M133 WeakPolarHBondContact O-CB 3.43Å; I130-M133 PolarHBondContact O-N 2.79Å; I130-D134 PolarHBondContact O-N 2.81Å |
| 131 | K | 90.1 | Very high | 89.5 | Confident | 102 Ų | 102 | 78 Ų | 78 | 44% | 0.443 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -58.8 | -43.2 | 176.1 | -75.6 | 167.8 | 170.8 | 164.4 | 0 | 112.7 | E127 N128 D134 T135 | E127-K131 HydrophobicContact CG-CD 4.5Å; E127-K131 WeakPolarHBondContact O-CG 3.11Å; E127-K131 PolarHBondContact O-N 3.04Å; E127-K131 WeakPolarHBondContact OE1-CE 3.27Å; E127-K131 IonicContact OE1-NZ 3.62Å; E127-K131 PolarHBondContact OE1-NZ 2.67Å; N128-K131 PolarHBondContact O-N 2.99Å; K131-D134 PolarHBondContact O-N 3.14Å; K131-T135 WeakPolarHBondContact O-CB 3.28Å; K131-T135 PolarHBondContact O-N 3Å; K131-T135 PolarHBondContact O-OG1 2.74Å |
| 132 | E | 91.8 | Very high | 90 | Very high | 130 Ų | 130 | 78.2 Ų | 78.2 | 61% | 0.607 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -65.5 | -40.9 | 175.9 | -71.7 | -63.8 | 135.2 | 0 | 0 | 111.7 | N128 L129 I130 T135 M136 | N128-E132 WeakPolarHBondContact O-CG 3.29Å; N128-E132 PolarHBondContact O-N 3.33Å; L129-E132 PolarHBondContact O-N 3.14Å; I130-E132 PolarHBondContact O-N 3.47Å; E132-T135 PolarHBondContact O-N 3.1Å; E132-M136 WeakPolarHBondContact O-CB 3.46Å; E132-M136 PolarHBondContact O-N 3.4Å |
| 133 | M | 88.3 | Confident | 90.5 | Very high | 20 Ų | 20 | 81 Ų | 81 | 10% | 0.099 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 175.5 | -73.7 | 175.3 | 62.5 | 0 | 0 | 112.1 | L129 I130 T135 M136 V137 L191 I194 R195 | L129-M133 HydrophobicContact CD1-CG 4.5Å; L129-M133 HydrophobicContact CG-SD 4.17Å; L129-M133 WeakPolarHBondContact O-CB 3.21Å; L129-M133 VanDerWaalsContact O-CG 3.28Å; L129-M133 WeakPolarHBondContact O-CG 3.36Å; L129-M133 PolarHBondContact O-N 3.37Å; I130-M133 WeakPolarHBondContact O-CB 3.43Å; I130-M133 PolarHBondContact O-N 2.79Å; M133-T135 VanDerWaalsContact C-N 3.34Å; M133-M136 WeakPolarHBondContact O-CB 3.44Å; M133-M136 PolarHBondContact O-N 3.25Å; M133-M136 VanDerWaalsContact O-N 3.14Å; M133-V137 WeakPolarHBondContact O-CG2 3.35Å; M133-V137 PolarHBondContact O-N 3.35Å; M133-L191 HydrophobicContact CE-CD2 4.12Å; M133-L191 VanDerWaalsContact CE-O 3.29Å; M133-L191 WeakPolarHBondContact CE-O 3.45Å; M133-L191 HydrophobicContact CG-CD2 4.27Å; M133-I194 HydrophobicContact CE-CB 3.63Å; M133-I194 HydrophobicContact CE-CG2 3.55Å; M133-I194 HydrophobicContact SD-CG2 3.94Å; M133-R195 HydrophobicContact CE-CB 4.22Å |
| 134 | D | 88.6 | Confident | 91.1 | Very high | 43 Ų | 43 | 81.1 Ų | 81.1 | 23% | 0.23 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -61.9 | -44.7 | 176.4 | -76 | -27.4 | 0 | 0 | 0 | 110.5 | I130 K131 M136 V137 D138 R195 | I130-D134 PolarHBondContact O-N 2.81Å; K131-D134 PolarHBondContact O-N 3.14Å; D134-M136 VanDerWaalsContact C-N 3.25Å; D134-M136 PolarHBondContact O-N 3.42Å; D134-V137 WeakPolarHBondContact O-CB 3.33Å; D134-V137 PolarHBondContact O-N 3.06Å; D134-V137 VanDerWaalsContact O-N 3.12Å; D134-D138 PolarHBondContact O-N 2.8Å; D134-R195 IonicContact OD1-CZ 3.96Å; D134-R195 VanDerWaalsContact OD1-CZ 3.23Å; D134-R195 IonicContact OD1-NE 2.74Å; D134-R195 IonicContact OD1-NH1 3.23Å; D134-R195 PolarHBondContact OD1-NH1 2.85Å; D134-R195 IonicContact OD1-NH2 3.83Å |
| 135 | T | 94.5 | Very high | 91.5 | Very high | 58 Ų | 58 | 81.4 Ų | 81.4 | 36% | 0.356 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -58.4 | -38.3 | 173.6 | -57.5 | 0 | 0 | 0 | 0 | 112 | K131 E132 M133 K139 | K131-T135 WeakPolarHBondContact O-CB 3.28Å; K131-T135 PolarHBondContact O-N 3Å; K131-T135 PolarHBondContact O-OG1 2.74Å; E132-T135 PolarHBondContact O-N 3.1Å; M133-T135 VanDerWaalsContact C-N 3.34Å; T135-K139 HydrophobicContact CG2-CD 4.29Å; T135-K139 VanDerWaalsContact O-CG 3.29Å; T135-K139 WeakPolarHBondContact O-CG 3.37Å; T135-K139 PolarHBondContact O-N 3.18Å; T135-K139 VanDerWaalsContact O-N 3.09Å |
| 136 | M | 91.5 | Very high | 91.8 | Very high | 92 Ų | 92 | 77.2 Ų | 77.2 | 45% | 0.453 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -70.1 | -39.6 | 176.8 | -166.3 | -177.6 | -56.2 | 0 | 0 | 112 | E132 M133 D134 D138 K139 L140 L191 | E132-M136 WeakPolarHBondContact O-CB 3.46Å; E132-M136 PolarHBondContact O-N 3.4Å; M133-M136 WeakPolarHBondContact O-CB 3.44Å; M133-M136 PolarHBondContact O-N 3.25Å; M133-M136 VanDerWaalsContact O-N 3.14Å; D134-M136 VanDerWaalsContact C-N 3.25Å; D134-M136 PolarHBondContact O-N 3.42Å; M136-D138 VanDerWaalsContact C-N 3.34Å; M136-K139 PolarHBondContact O-N 3.31Å; M136-L140 HydrophobicContact CG-CD1 4.17Å; M136-L140 WeakPolarHBondContact O-CB 3.46Å; M136-L140 VanDerWaalsContact O-CG 3.27Å; M136-L140 WeakPolarHBondContact O-CG 3.42Å; M136-L140 PolarHBondContact O-N 3.05Å; M136-L191 HydrophobicContact CB-CD1 4.46Å; M136-L191 HydrophobicContact CG-CD1 4.14Å; M136-L191 HydrophobicContact SD-CD1 4Å; M136-L191 HydrophobicContact SD-CD2 4.15Å |
| 137 | V | 91.5 | Very high | 92.2 | Very high | 18 Ų | 18 | 75.7 Ų | 75.7 | 11% | 0.109 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.8 | -44.5 | 174.6 | 166.8 | 0 | 0 | 0 | 0 | 110.5 | M133 D134 L140 N141 L188 L191 | M133-V137 WeakPolarHBondContact O-CG2 3.35Å; M133-V137 PolarHBondContact O-N 3.35Å; D134-V137 WeakPolarHBondContact O-CB 3.33Å; D134-V137 PolarHBondContact O-N 3.06Å; D134-V137 VanDerWaalsContact O-N 3.12Å; V137-L140 PolarHBondContact O-N 3.26Å; V137-N141 WeakPolarHBondContact O-CB 3Å; V137-N141 PolarHBondContact O-N 3.12Å; V137-N141 PolarHBondContact O-ND2 3.21Å; V137-N141 VanDerWaalsContact O-ND2 3.17Å; V137-L188 HydrophobicContact CB-CD2 4.29Å; V137-L188 HydrophobicContact CG1-CD2 3.95Å; V137-L188 HydrophobicContact CG2-CD2 4.26Å; V137-L191 HydrophobicContact CG2-CB 3.97Å; V137-L191 HydrophobicContact CG2-CD1 3.96Å |
| 138 | D | 94 | Very high | 92.5 | Very high | 97 Ų | 97 | 75 Ų | 75 | 52% | 0.519 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.3 | -49.5 | 177.4 | -68.3 | -20.7 | 0 | 0 | 0 | 111.1 | D134 M136 L140 N141 D142 | D134-D138 PolarHBondContact O-N 2.8Å; M136-D138 VanDerWaalsContact C-N 3.34Å; D138-L140 VanDerWaalsContact C-N 3.3Å; D138-L140 PolarHBondContact O-N 2.71Å; D138-N141 PolarHBondContact O-N 3Å; D138-N141 VanDerWaalsContact O-N 3.15Å; D138-D142 PolarHBondContact O-N 3.42Å |
| 139 | K | 94.9 | Very high | 92.6 | Very high | 140 Ų | 140 | 76.5 Ų | 76.5 | 61% | 0.609 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -58.5 | -38.8 | 176.1 | -73.4 | 171.6 | -178.5 | 172.4 | 0 | 113.2 | T135 M136 K143 | T135-K139 HydrophobicContact CG2-CD 4.29Å; T135-K139 VanDerWaalsContact O-CG 3.29Å; T135-K139 WeakPolarHBondContact O-CG 3.37Å; T135-K139 PolarHBondContact O-N 3.18Å; T135-K139 VanDerWaalsContact O-N 3.09Å; M136-K139 PolarHBondContact O-N 3.31Å; K139-K143 WeakPolarHBondContact O-CB 3.34Å; K139-K143 PolarHBondContact O-N 3.18Å |
| 140 | L | 94.4 | Very high | 92.9 | Very high | 21 Ų | 21 | 74.7 Ų | 74.7 | 11% | 0.11 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -70.3 | -39.5 | 177.5 | -76.3 | 169.3 | 0 | 0 | 0 | 111.7 | M136 V137 D138 K143 R144 I184 L187 L188 L191 | M136-L140 HydrophobicContact CG-CD1 4.17Å; M136-L140 WeakPolarHBondContact O-CB 3.46Å; M136-L140 VanDerWaalsContact O-CG 3.27Å; M136-L140 WeakPolarHBondContact O-CG 3.42Å; M136-L140 PolarHBondContact O-N 3.05Å; V137-L140 PolarHBondContact O-N 3.26Å; D138-L140 VanDerWaalsContact C-N 3.3Å; D138-L140 PolarHBondContact O-N 2.71Å; L140-K143 PolarHBondContact O-N 2.83Å; L140-R144 WeakPolarHBondContact O-CB 3.24Å; L140-R144 PolarHBondContact O-N 3.22Å; L140-I184 HydrophobicContact CB-CG2 4.14Å; L140-I184 HydrophobicContact CD2-CG1 4.27Å; L140-I184 HydrophobicContact CD2-CG2 4.16Å; L140-L187 HydrophobicContact CD1-CB 4.4Å; L140-L187 HydrophobicContact CD1-CD2 3.56Å; L140-L187 HydrophobicContact CD1-CG 3.71Å; L140-L187 HydrophobicContact CD2-CD2 3.85Å; L140-L187 HydrophobicContact CG-CD2 4.35Å; L140-L188 HydrophobicContact CB-CD2 3.8Å; L140-L188 HydrophobicContact CB-CG 4.15Å; L140-L188 HydrophobicContact CD1-CD2 4.16Å; L140-L188 HydrophobicContact CD1-CG 4.46Å; L140-L191 HydrophobicContact CD1-CD1 3.5Å |
| 141 | N | 93.5 | Very high | 93.2 | Very high | 59 Ų | 59 | 72.4 Ų | 72.4 | 32% | 0.316 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63 | -45 | 172.5 | -78.1 | -41 | 0 | 0 | 0 | 111.2 | V137 D138 K143 R144 T145 L188 | V137-N141 WeakPolarHBondContact O-CB 3Å; V137-N141 PolarHBondContact O-N 3.12Å; V137-N141 PolarHBondContact O-ND2 3.21Å; V137-N141 VanDerWaalsContact O-ND2 3.17Å; D138-N141 PolarHBondContact O-N 3Å; D138-N141 VanDerWaalsContact O-N 3.15Å; N141-K143 VanDerWaalsContact C-N 3.35Å; N141-K143 PolarHBondContact O-N 3.11Å; N141-R144 WeakPolarHBondContact O-CB 3.4Å; N141-R144 PolarHBondContact O-N 3.47Å; N141-T145 WeakPolarHBondContact O-CG2 3.35Å; N141-T145 PolarHBondContact O-N 3.4Å; N141-L188 WeakPolarHBondContact OD1-CD1 3.12Å |
| 142 | D | 96.4 | Very high | 93.4 | Very high | 104 Ų | 104 | 74 Ų | 74 | 56% | 0.556 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -57.2 | -49.5 | 175.4 | -71.4 | -18.5 | 0 | 0 | 0 | 110.7 | D138 R144 T145 Q146 | D138-D142 PolarHBondContact O-N 3.42Å; D142-R144 VanDerWaalsContact C-N 3.33Å; D142-R144 PolarHBondContact O-N 3.33Å; D142-T145 PolarHBondContact O-N 2.94Å; D142-T145 VanDerWaalsContact O-N 3.15Å; D142-T145 PolarHBondContact O-OG1 3.27Å; D142-Q146 PolarHBondContact O-N 2.82Å |
| 143 | K | 94.7 | Very high | 93.4 | Very high | 120 Ų | 120 | 71.4 Ų | 71.4 | 52% | 0.522 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.2 | -41.4 | 176.9 | -172.1 | 175.2 | -179.4 | -179 | 0 | 112.4 | K139 L140 N141 Q146 L147 I184 | K139-K143 WeakPolarHBondContact O-CB 3.34Å; K139-K143 PolarHBondContact O-N 3.18Å; L140-K143 PolarHBondContact O-N 2.83Å; N141-K143 VanDerWaalsContact C-N 3.35Å; N141-K143 PolarHBondContact O-N 3.11Å; K143-Q146 PolarHBondContact O-N 3.01Å; K143-L147 WeakPolarHBondContact O-CG 3.04Å; K143-L147 PolarHBondContact O-N 2.73Å; K143-I184 HydrophobicContact CB-CD1 4.39Å; K143-I184 HydrophobicContact CD-CD1 3.94Å; K143-I184 HydrophobicContact CG-CD1 3.92Å |
| 144 | R | 94.2 | Very high | 93.5 | Very high | 91 Ų | 91 | 71.8 Ų | 71.8 | 34% | 0.343 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 174.3 | 177.6 | -174 | 135.1 | 127.3 | 2.9 | 111.2 | L140 N141 D142 Q146 L147 L148 M181 I184 N185 | L140-R144 WeakPolarHBondContact O-CB 3.24Å; L140-R144 PolarHBondContact O-N 3.22Å; N141-R144 WeakPolarHBondContact O-CB 3.4Å; N141-R144 PolarHBondContact O-N 3.47Å; D142-R144 VanDerWaalsContact C-N 3.33Å; D142-R144 PolarHBondContact O-N 3.33Å; R144-Q146 VanDerWaalsContact C-N 3.3Å; R144-Q146 PolarHBondContact O-N 3.15Å; R144-L147 PolarHBondContact O-N 3.25Å; R144-L148 WeakPolarHBondContact O-CG 3.48Å; R144-L148 PolarHBondContact O-N 3Å; R144-L148 VanDerWaalsContact O-N 3.08Å; R144-M181 HydrophobicContact CG-CG 4.29Å; R144-I184 HydrophobicContact CB-CG2 4.1Å; R144-N185 PolarHBondContact NH1-OD1 2.85Å |
| 145 | T | 95.2 | Very high | 93.6 | Very high | 63 Ų | 63 | 74.1 Ų | 74.1 | 39% | 0.387 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66 | -34.4 | 177.5 | 66.5 | 0 | 0 | 0 | 0 | 112.3 | N141 D142 L148 K149 | N141-T145 WeakPolarHBondContact O-CG2 3.35Å; N141-T145 PolarHBondContact O-N 3.4Å; D142-T145 PolarHBondContact O-N 2.94Å; D142-T145 VanDerWaalsContact O-N 3.15Å; D142-T145 PolarHBondContact O-OG1 3.27Å; T145-L148 PolarHBondContact O-N 3.34Å; T145-K149 WeakPolarHBondContact O-CG 3.31Å; T145-K149 PolarHBondContact O-N 3.5Å |
| 146 | Q | 95.6 | Very high | 93.3 | Very high | 92 Ų | 92 | 73.3 Ų | 73.3 | 43% | 0.43 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65.2 | -48.2 | 174.9 | -174.2 | 59.5 | 42.2 | 0 | 0 | 111 | D142 K143 R144 L148 K149 D150 | D142-Q146 PolarHBondContact O-N 2.82Å; K143-Q146 PolarHBondContact O-N 3.01Å; R144-Q146 VanDerWaalsContact C-N 3.3Å; R144-Q146 PolarHBondContact O-N 3.15Å; Q146-L148 VanDerWaalsContact C-N 3.27Å; Q146-L148 PolarHBondContact O-N 2.66Å; Q146-K149 WeakPolarHBondContact O-CB 3.48Å; Q146-K149 PolarHBondContact O-N 2.88Å; Q146-K149 VanDerWaalsContact O-N 3.09Å; Q146-D150 PolarHBondContact NE2-OD1 3.36Å; Q146-D150 VanDerWaalsContact O-CG 3.26Å; Q146-D150 PolarHBondContact O-N 3.27Å |
| 147 | L | 94.3 | Very high | 93 | Very high | 11 Ų | 11 | 73.8 Ų | 73.8 | 6% | 0.058 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -58 | -39.5 | 176.5 | -72.1 | 173 | 0 | 0 | 0 | 112.1 | K143 R144 K149 D150 I151 D177 R180 I184 | K143-L147 WeakPolarHBondContact O-CG 3.04Å; K143-L147 PolarHBondContact O-N 2.73Å; R144-L147 PolarHBondContact O-N 3.25Å; L147-K149 PolarHBondContact O-N 3.49Å; L147-D150 PolarHBondContact O-N 3.49Å; L147-I151 WeakPolarHBondContact O-CB 3.38Å; L147-I151 WeakPolarHBondContact O-CD1 3.45Å; L147-I151 WeakPolarHBondContact O-CG1 3.37Å; L147-I151 PolarHBondContact O-N 3.32Å; L147-D177 HydrophobicContact CD2-CB 4.03Å; L147-R180 HydrophobicContact CD1-CB 4.1Å; L147-I184 HydrophobicContact CD1-CD1 3.58Å |
| 148 | L | 93.8 | Very high | 93 | Very high | 76 Ų | 76 | 74.2 Ų | 74.2 | 40% | 0.398 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 175.5 | -74.3 | 171.6 | 0 | 0 | 0 | 112.4 | R144 T145 Q146 I151 E152 M181 | R144-L148 WeakPolarHBondContact O-CG 3.48Å; R144-L148 PolarHBondContact O-N 3Å; R144-L148 VanDerWaalsContact O-N 3.08Å; T145-L148 PolarHBondContact O-N 3.34Å; Q146-L148 VanDerWaalsContact C-N 3.27Å; Q146-L148 PolarHBondContact O-N 2.66Å; L148-I151 PolarHBondContact O-N 2.74Å; L148-E152 PolarHBondContact O-N 3.39Å; L148-M181 HydrophobicContact CD2-SD 3.77Å; L148-M181 HydrophobicContact CG-SD 4.26Å |
| 149 | K | 94.6 | Very high | 92.6 | Very high | 114 Ų | 114 | 76 Ų | 76 | 50% | 0.496 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65.9 | -41.6 | 175.6 | -67.1 | 171.3 | -169.6 | 167.7 | 0 | 111.7 | T145 Q146 L147 I151 E152 V153 | T145-K149 WeakPolarHBondContact O-CG 3.31Å; T145-K149 PolarHBondContact O-N 3.5Å; Q146-K149 WeakPolarHBondContact O-CB 3.48Å; Q146-K149 PolarHBondContact O-N 2.88Å; Q146-K149 VanDerWaalsContact O-N 3.09Å; L147-K149 PolarHBondContact O-N 3.49Å; K149-I151 VanDerWaalsContact C-N 3.34Å; K149-E152 PolarHBondContact O-N 2.85Å; K149-V153 WeakPolarHBondContact O-CG2 3.48Å; K149-V153 PolarHBondContact O-N 3.22Å |
| 150 | D | 92.7 | Very high | 92.2 | Very high | 61 Ų | 61 | 77 Ų | 77 | 33% | 0.326 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.4 | -41.2 | 179.1 | -65.5 | -19.2 | 0 | 0 | 0 | 110.8 | Q146 L147 V153 C154 | Q146-D150 PolarHBondContact NE2-OD1 3.36Å; Q146-D150 VanDerWaalsContact O-CG 3.26Å; Q146-D150 PolarHBondContact O-N 3.27Å; L147-D150 PolarHBondContact O-N 3.49Å; D150-V153 PolarHBondContact O-N 2.7Å; D150-C154 WeakPolarHBondContact O-CB 3.42Å; D150-C154 PolarHBondContact O-N 2.9Å; D150-C154 PolarHBondContact O-SG 2.82Å; D150-C154 VanDerWaalsContact O-SG 3.38Å |
| 151 | I | 93.5 | Very high | 91.7 | Very high | 8 Ų | 8 | 76.9 Ų | 76.9 | 4% | 0.041 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59.8 | -49.2 | 173 | -71.9 | 163.3 | 0 | 0 | 0 | 110.5 | L147 L148 K149 V153 C154 E155 I174 D177 | L147-I151 WeakPolarHBondContact O-CB 3.38Å; L147-I151 WeakPolarHBondContact O-CD1 3.45Å; L147-I151 WeakPolarHBondContact O-CG1 3.37Å; L147-I151 PolarHBondContact O-N 3.32Å; L148-I151 PolarHBondContact O-N 2.74Å; K149-I151 VanDerWaalsContact C-N 3.34Å; I151-V153 VanDerWaalsContact C-N 3.3Å; I151-V153 PolarHBondContact O-N 3.43Å; I151-C154 WeakPolarHBondContact O-CB 3.14Å; I151-C154 PolarHBondContact O-N 2.96Å; I151-C154 VanDerWaalsContact O-N 3.14Å; I151-E155 HydrophobicContact CG2-CG 4.28Å; I151-E155 WeakPolarHBondContact O-CG 3.47Å; I151-E155 PolarHBondContact O-N 3.42Å; I151-I174 HydrophobicContact CG2-CG2 4.19Å; I151-D177 HydrophobicContact CD1-CB 4.08Å; I151-D177 HydrophobicContact CG1-CB 3.96Å |
| 152 | E | 92.7 | Very high | 91.1 | Very high | 137 Ų | 137 | 80.7 Ų | 80.7 | 64% | 0.64 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -57.6 | -43.3 | 178.1 | -178 | -179.8 | -169.1 | 0 | 0 | 111.8 | L148 K149 E155 S156 | L148-E152 PolarHBondContact O-N 3.39Å; K149-E152 PolarHBondContact O-N 2.85Å; E152-E155 PolarHBondContact O-N 3.42Å; E152-S156 PolarHBondContact O-N 3.12Å |
| 153 | V | 91.9 | Very high | 90.7 | Very high | 74 Ų | 74 | 81.3 Ų | 81.3 | 45% | 0.448 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.7 | -50.2 | 175.1 | 170.3 | 0 | 0 | 0 | 0 | 110.2 | K149 D150 I151 E155 S156 H157 | K149-V153 WeakPolarHBondContact O-CG2 3.48Å; K149-V153 PolarHBondContact O-N 3.22Å; D150-V153 PolarHBondContact O-N 2.7Å; I151-V153 VanDerWaalsContact C-N 3.3Å; I151-V153 PolarHBondContact O-N 3.43Å; V153-E155 PolarHBondContact O-N 2.97Å; V153-S156 WeakPolarHBondContact O-CB 3.27Å; V153-S156 PolarHBondContact O-N 3.05Å; V153-S156 VanDerWaalsContact O-N 3.15Å; V153-S156 PolarHBondContact O-OG 3.29Å; V153-H157 PolarHBondContact O-CD2 3.44Å; V153-H157 PolarHBondContact O-N 3.12Å |
| 154 | C | 90.3 | Very high | 90.3 | Very high | 28 Ų | 28 | 80.2 Ų | 80.2 | 19% | 0.189 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -58.4 | -42.8 | 178.1 | -77.8 | 0 | 0 | 0 | 0 | 112.8 | D150 I151 S156 H157 I158 I170 I174 | D150-C154 WeakPolarHBondContact O-CB 3.42Å; D150-C154 PolarHBondContact O-N 2.9Å; D150-C154 PolarHBondContact O-SG 2.82Å; D150-C154 VanDerWaalsContact O-SG 3.38Å; I151-C154 WeakPolarHBondContact O-CB 3.14Å; I151-C154 PolarHBondContact O-N 2.96Å; I151-C154 VanDerWaalsContact O-N 3.14Å; C154-S156 VanDerWaalsContact C-N 3.32Å; C154-S156 PolarHBondContact O-N 3.39Å; C154-H157 WeakPolarHBondContact O-CB 3.3Å; C154-H157 PolarHBondContact O-N 3.44Å; C154-H157 VanDerWaalsContact O-N 3.1Å; C154-I158 PolarHBondContact O-N 3.05Å; C154-I170 HydrophobicContact CB-CG2 3.61Å; C154-I170 WeakPolarHBondContact O-CG2 3.17Å; C154-I174 HydrophobicContact CB-CD1 3.87Å; C154-I174 HydrophobicContact CB-CG1 3.59Å |
| 155 | E | 90.7 | Very high | 89.9 | Confident | 92 Ų | 92 | 84.5 Ų | 84.5 | 43% | 0.43 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 175.5 | -73.4 | -179.3 | 167.7 | 0 | 0 | 111.5 | I151 E152 V153 H157 I158 N159 I174 | I151-E155 HydrophobicContact CG2-CG 4.28Å; I151-E155 WeakPolarHBondContact O-CG 3.47Å; I151-E155 PolarHBondContact O-N 3.42Å; E152-E155 PolarHBondContact O-N 3.42Å; V153-E155 PolarHBondContact O-N 2.97Å; E155-H157 VanDerWaalsContact C-N 3.27Å; E155-H157 PolarHBondContact O-N 2.86Å; E155-I158 PolarHBondContact O-N 3.16Å; E155-N159 PolarHBondContact O-N 3.29Å; E155-N159 VanDerWaalsContact O-N 3.12Å; E155-N159 PolarHBondContact O-ND2 2.94Å; E155-I174 HydrophobicContact CG-CD1 3.73Å |
| 156 | S | 88.4 | Confident | 89.6 | Confident | 42 Ų | 42 | 86.1 Ų | 86.1 | 29% | 0.294 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.2 | -34.9 | 174.7 | 87.8 | 0 | 0 | 0 | 0 | 112.4 | E152 V153 C154 K160 | E152-S156 PolarHBondContact O-N 3.12Å; V153-S156 WeakPolarHBondContact O-CB 3.27Å; V153-S156 PolarHBondContact O-N 3.05Å; V153-S156 VanDerWaalsContact O-N 3.15Å; V153-S156 PolarHBondContact O-OG 3.29Å; C154-S156 VanDerWaalsContact C-N 3.32Å; C154-S156 PolarHBondContact O-N 3.39Å; S156-K160 VanDerWaalsContact O-CG 3.32Å; S156-K160 WeakPolarHBondContact O-CG 3.49Å; S156-K160 PolarHBondContact O-N 3.11Å |
| 157 | H | 86.8 | Confident | 89.2 | Confident | 101 Ų | 101 | 87.5 Ų | 87.5 | 47% | 0.468 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -71.7 | -37.8 | 175.5 | -78.1 | -76.6 | 0 | 0 | 0 | 112.3 | V153 C154 E155 N159 K160 S161 I170 | V153-H157 PolarHBondContact O-CD2 3.44Å; V153-H157 PolarHBondContact O-N 3.12Å; C154-H157 WeakPolarHBondContact O-CB 3.3Å; C154-H157 PolarHBondContact O-N 3.44Å; C154-H157 VanDerWaalsContact O-N 3.1Å; E155-H157 VanDerWaalsContact C-N 3.27Å; E155-H157 PolarHBondContact O-N 2.86Å; H157-N159 VanDerWaalsContact C-N 3.26Å; H157-N159 PolarHBondContact O-N 3.03Å; H157-K160 PolarHBondContact O-N 3Å; H157-S161 WeakPolarHBondContact O-CB 3.28Å; H157-S161 PolarHBondContact O-N 3.33Å; H157-I170 HydrophobicContact CB-CD1 4Å |
| 158 | I | 89.5 | Confident | 89 | Confident | 27 Ų | 27 | 90 Ų | 90 | 14% | 0.138 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -60 | -39.5 | 173.9 | -72.4 | 178.8 | 0 | 0 | 0 | 111.2 | C154 E155 K160 I170 M171 I174 | C154-I158 PolarHBondContact O-N 3.05Å; E155-I158 PolarHBondContact O-N 3.16Å; I158-K160 VanDerWaalsContact C-N 3.3Å; I158-K160 PolarHBondContact O-N 2.98Å; I158-I170 HydrophobicContact CD1-CB 3.98Å; I158-I170 HydrophobicContact CD1-CG2 3.73Å; I158-I170 HydrophobicContact CG1-CB 3.61Å; I158-I170 HydrophobicContact CG1-CD1 4.24Å; I158-I170 HydrophobicContact CG1-CG2 3.46Å; I158-I170 VanDerWaalsContact CG1-CG2 3.46Å; I158-M171 HydrophobicContact CD1-CB 4.27Å; I158-I174 HydrophobicContact CD1-CD1 3.36Å; I158-I174 HydrophobicContact CG1-CD1 4.41Å |
| 159 | N | 86.2 | Confident | 88.9 | Confident | 136 Ų | 136 | 94 Ų | 94 | 73% | 0.727 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -71.4 | -25.6 | 179.9 | -70.2 | -27.7 | 0 | 0 | 0 | 112.8 | E155 H157 | E155-N159 PolarHBondContact O-N 3.29Å; E155-N159 VanDerWaalsContact O-N 3.12Å; E155-N159 PolarHBondContact O-ND2 2.94Å; H157-N159 VanDerWaalsContact C-N 3.26Å; H157-N159 PolarHBondContact O-N 3.03Å |
| 160 | K | 86.9 | Confident | 88.7 | Confident | 159 Ų | 159 | 90.3 Ų | 90.3 | 69% | 0.691 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -92.7 | -28.4 | 179.2 | -68.3 | 170.4 | -173.9 | 171 | 0 | 113.4 | S156 H157 I158 | S156-K160 VanDerWaalsContact O-CG 3.32Å; S156-K160 WeakPolarHBondContact O-CG 3.49Å; S156-K160 PolarHBondContact O-N 3.11Å; H157-K160 PolarHBondContact O-N 3Å; I158-K160 VanDerWaalsContact C-N 3.3Å; I158-K160 PolarHBondContact O-N 2.98Å |
| 161 | S | 84.3 | Confident | 88.6 | Confident | 19 Ų | 19 | 93.7 Ų | 93.7 | 13% | 0.133 | 47% | 0.474 | C | S | . | . | trans | -76 | 130 | -179.1 | 179.7 | 0 | 0 | 0 | 0 | 111 | H157 E163 E166 R167 | H157-S161 WeakPolarHBondContact O-CB 3.28Å; H157-S161 PolarHBondContact O-N 3.33Å; S161-E163 PolarHBondContact OG-N 3.11Å; S161-E166 WeakPolarHBondContact OG-CB 3.2Å; S161-E166 PolarHBondContact OG-OE2 3.24Å; S161-R167 WeakPolarHBondContact O-CD 3.09Å | ||
| 162 | T | 81.4 | Confident | 88.5 | Confident | 139 Ų | 139 | 98.1 Ų | 98.1 | 85% | 0.853 | 50% | 0.498 | S | S | * | . | trans | -92.1 | -17.2 | 175.6 | 51.8 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 163 | E | 87.1 | Confident | 88.5 | Confident | 117 Ų | 117 | 95.6 Ų | 95.6 | 55% | 0.547 | 49% | 0.486 | S | S | . | . | trans | -83.8 | 120.2 | -175.3 | -65.3 | -163 | 177.2 | 0 | 0 | 111.5 | S161 K165 E166 R167 | S161-E163 PolarHBondContact OG-N 3.11Å; E163-K165 VanDerWaalsContact C-N 3.26Å; E163-K165 PolarHBondContact O-N 2.85Å; E163-E166 HydrophobicContact CB-CB 4.22Å; E163-E166 HydrophobicContact CB-CG 3.99Å; E163-E166 PolarHBondContact O-N 3.26Å; E163-R167 WeakPolarHBondContact O-CG 3.39Å; E163-R167 PolarHBondContact O-N 3.28Å | ||
| 164 | S | 85.3 | Confident | 88.5 | Confident | 98 Ų | 98 | 93 Ų | 93 | 69% | 0.685 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -55.7 | -39.2 | -177.9 | -175.9 | 0 | 0 | 0 | 0 | 113.2 | R167 S168 | S164-R167 PolarHBondContact O-N 3.03Å; S164-S168 PolarHBondContact O-N 3.31Å |
| 165 | K | 87.7 | Confident | 88.6 | Confident | 180 Ų | 180 | 98.3 Ų | 98.3 | 78% | 0.783 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -68.9 | -38.9 | -178.9 | -167.3 | 178.4 | -178.1 | -179.6 | 0 | 112.5 | E163 K169 | E163-K165 VanDerWaalsContact C-N 3.26Å; E163-K165 PolarHBondContact O-N 2.85Å; K165-K169 PolarHBondContact O-N 2.93Å |
| 166 | E | 87.1 | Confident | 88.7 | Confident | 97 Ų | 97 | 95.6 Ų | 95.6 | 45% | 0.453 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.8 | -45.3 | 174.8 | -66.9 | -171.3 | 155 | 0 | 0 | 111.1 | S161 E163 S168 K169 I170 | S161-E166 WeakPolarHBondContact OG-CB 3.2Å; S161-E166 PolarHBondContact OG-OE2 3.24Å; E163-E166 HydrophobicContact CB-CB 4.22Å; E163-E166 HydrophobicContact CB-CG 3.99Å; E163-E166 PolarHBondContact O-N 3.26Å; E166-S168 VanDerWaalsContact C-N 3.31Å; E166-S168 PolarHBondContact O-N 3.29Å; E166-K169 PolarHBondContact O-N 3.15Å; E166-K169 VanDerWaalsContact O-N 3.13Å; E166-I170 WeakPolarHBondContact O-CG1 3.33Å; E166-I170 PolarHBondContact O-N 3.46Å |
| 167 | R | 89.1 | Confident | 89 | Confident | 122 Ų | 122 | 93.9 Ų | 93.9 | 46% | 0.46 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -56.7 | -44.5 | 176.7 | -67 | -179.8 | 79.1 | -159.3 | -1.4 | 111.9 | S161 E163 S164 K169 I170 M171 | S161-R167 WeakPolarHBondContact O-CD 3.09Å; E163-R167 WeakPolarHBondContact O-CG 3.39Å; E163-R167 PolarHBondContact O-N 3.28Å; S164-R167 PolarHBondContact O-N 3.03Å; R167-K169 PolarHBondContact O-N 3.35Å; R167-I170 PolarHBondContact O-N 3.04Å; R167-M171 WeakPolarHBondContact O-CB 3.47Å; R167-M171 PolarHBondContact O-N 3.4Å |
| 168 | S | 89.7 | Confident | 89.2 | Confident | 64 Ų | 64 | 92.6 Ų | 92.6 | 45% | 0.448 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.7 | -47.5 | 175.6 | -171.4 | 0 | 0 | 0 | 0 | 111.7 | S164 E166 I170 M171 D172 | S164-S168 PolarHBondContact O-N 3.31Å; E166-S168 VanDerWaalsContact C-N 3.31Å; E166-S168 PolarHBondContact O-N 3.29Å; S168-I170 PolarHBondContact O-N 2.92Å; S168-M171 WeakPolarHBondContact O-CB 3.4Å; S168-M171 PolarHBondContact O-N 2.98Å; S168-D172 PolarHBondContact O-N 3.44Å |
| 169 | K | 90.6 | Very high | 89.4 | Confident | 159 Ų | 159 | 95.7 Ų | 95.7 | 69% | 0.691 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62.8 | -40.9 | -179.1 | -174.6 | -179.1 | 177.2 | -173 | 0 | 112.4 | K165 E166 R167 Q173 | K165-K169 PolarHBondContact O-N 2.93Å; E166-K169 PolarHBondContact O-N 3.15Å; E166-K169 VanDerWaalsContact O-N 3.13Å; R167-K169 PolarHBondContact O-N 3.35Å; K169-Q173 PolarHBondContact O-N 2.98Å; K169-Q173 VanDerWaalsContact O-N 3.12Å |
| 170 | I | 90.7 | Very high | 89.6 | Confident | 36 Ų | 36 | 95.2 Ų | 95.2 | 19% | 0.185 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -70.3 | -36.9 | 178.2 | -56.5 | 162.7 | 0 | 0 | 0 | 110.3 | C154 H157 I158 E166 R167 S168 D172 Q173 I174 | C154-I170 HydrophobicContact CB-CG2 3.61Å; C154-I170 WeakPolarHBondContact O-CG2 3.17Å; H157-I170 HydrophobicContact CB-CD1 4Å; I158-I170 HydrophobicContact CD1-CB 3.98Å; I158-I170 HydrophobicContact CD1-CG2 3.73Å; I158-I170 HydrophobicContact CG1-CB 3.61Å; I158-I170 HydrophobicContact CG1-CD1 4.24Å; I158-I170 HydrophobicContact CG1-CG2 3.46Å; I158-I170 VanDerWaalsContact CG1-CG2 3.46Å; E166-I170 WeakPolarHBondContact O-CG1 3.33Å; E166-I170 PolarHBondContact O-N 3.46Å; R167-I170 PolarHBondContact O-N 3.04Å; S168-I170 PolarHBondContact O-N 2.92Å; I170-D172 VanDerWaalsContact C-N 3.35Å; I170-D172 PolarHBondContact O-N 3.33Å; I170-Q173 WeakPolarHBondContact O-CB 3.19Å; I170-Q173 PolarHBondContact O-N 3.08Å; I170-I174 HydrophobicContact CG2-CD1 4.2Å; I170-I174 HydrophobicContact CG2-CG1 4.44Å; I170-I174 WeakPolarHBondContact O-CG1 3.4Å; I170-I174 PolarHBondContact O-N 3.23Å |
| 171 | M | 90.4 | Very high | 89.8 | Confident | 133 Ų | 133 | 89.1 Ų | 89.1 | 66% | 0.655 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -62.4 | -41.7 | 175.6 | -168.5 | 174.2 | -157 | 0 | 0 | 112 | I158 R167 S168 Q173 I174 K175 | I158-M171 HydrophobicContact CD1-CB 4.27Å; R167-M171 WeakPolarHBondContact O-CB 3.47Å; R167-M171 PolarHBondContact O-N 3.4Å; S168-M171 WeakPolarHBondContact O-CB 3.4Å; S168-M171 PolarHBondContact O-N 2.98Å; M171-Q173 VanDerWaalsContact C-N 3.32Å; M171-Q173 PolarHBondContact O-N 3.35Å; M171-I174 PolarHBondContact O-N 3.1Å; M171-K175 PolarHBondContact O-N 3.14Å |
| 172 | D | 92.4 | Very high | 90 | Very high | 100 Ų | 100 | 91.7 Ų | 91.7 | 54% | 0.535 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.2 | -39 | 174.5 | -66.4 | -29.5 | 0 | 0 | 0 | 111.6 | S168 I170 K175 A176 | S168-D172 PolarHBondContact O-N 3.44Å; I170-D172 VanDerWaalsContact C-N 3.35Å; I170-D172 PolarHBondContact O-N 3.33Å; D172-K175 PolarHBondContact O-N 2.89Å; D172-A176 PolarHBondContact O-N 3.49Å |
| 173 | Q | 91.7 | Very high | 90.4 | Very high | 84 Ų | 84 | 90.1 Ų | 90.1 | 39% | 0.393 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -64.8 | -46.7 | 176 | -176.8 | 59.5 | 43.6 | 0 | 0 | 111.9 | K169 I170 M171 K175 A176 D177 | K169-Q173 PolarHBondContact O-N 2.98Å; K169-Q173 VanDerWaalsContact O-N 3.12Å; I170-Q173 WeakPolarHBondContact O-CB 3.19Å; I170-Q173 PolarHBondContact O-N 3.08Å; M171-Q173 VanDerWaalsContact C-N 3.32Å; M171-Q173 PolarHBondContact O-N 3.35Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.22Å; Q173-A176 PolarHBondContact O-N 3.39Å; Q173-A176 VanDerWaalsContact O-N 3.17Å; Q173-D177 VanDerWaalsContact NE2-CG 3.32Å; Q173-D177 PolarHBondContact NE2-OD1 2.8Å; Q173-D177 PolarHBondContact NE2-OD2 2.95Å; Q173-D177 PolarHBondContact O-N 3.26Å |
| 174 | I | 92.1 | Very high | 90.7 | Very high | 19 Ų | 19 | 85 Ų | 85 | 10% | 0.097 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -57.8 | -43.2 | 176.1 | -70.8 | 170 | 0 | 0 | 0 | 110.3 | I151 C154 E155 I158 I170 M171 D177 H178 | I151-I174 HydrophobicContact CG2-CG2 4.19Å; C154-I174 HydrophobicContact CB-CD1 3.87Å; C154-I174 HydrophobicContact CB-CG1 3.59Å; E155-I174 HydrophobicContact CG-CD1 3.73Å; I158-I174 HydrophobicContact CD1-CD1 3.36Å; I158-I174 HydrophobicContact CG1-CD1 4.41Å; I170-I174 HydrophobicContact CG2-CD1 4.2Å; I170-I174 HydrophobicContact CG2-CG1 4.44Å; I170-I174 WeakPolarHBondContact O-CG1 3.4Å; I170-I174 PolarHBondContact O-N 3.23Å; M171-I174 PolarHBondContact O-N 3.1Å; I174-D177 PolarHBondContact O-N 3.19Å; I174-H178 VanDerWaalsContact CG2-CE1 3.43Å; I174-H178 WeakPolarHBondContact CG2-CE1 3.48Å; I174-H178 VanDerWaalsContact CG2-ND1 3.35Å; I174-H178 WeakPolarHBondContact CG2-ND1 3.25Å; I174-H178 PolarHBondContact O-N 3.48Å; I174-H178 PolarHBondContact O-ND1 3.43Å |
| 175 | K | 93.1 | Very high | 90.9 | Very high | 140 Ų | 140 | 82.5 Ų | 82.5 | 61% | 0.609 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -62 | -45.9 | 177.5 | -171.1 | -177.1 | 177.3 | -172 | 0 | 111.4 | M171 D172 Q173 D177 H178 D179 | M171-K175 PolarHBondContact O-N 3.14Å; D172-K175 PolarHBondContact O-N 2.89Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.22Å; K175-D177 VanDerWaalsContact C-N 3.3Å; K175-D177 PolarHBondContact O-N 3.19Å; K175-H178 WeakPolarHBondContact O-CB 3.34Å; K175-H178 PolarHBondContact O-N 3.23Å; K175-D179 PolarHBondContact O-N 3.04Å |
| 176 | A | 92.9 | Very high | 91 | Very high | 35 Ų | 35 | 78.5 Ų | 78.5 | 29% | 0.289 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.7 | -37.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | D172 Q173 D179 R180 | D172-A176 PolarHBondContact O-N 3.49Å; Q173-A176 PolarHBondContact O-N 3.39Å; Q173-A176 VanDerWaalsContact O-N 3.17Å; A176-D179 PolarHBondContact O-N 3.2Å; A176-R180 VanDerWaalsContact O-CG 3.28Å; A176-R180 WeakPolarHBondContact O-CG 3.36Å; A176-R180 PolarHBondContact O-N 2.92Å; A176-R180 VanDerWaalsContact O-N 3.08Å |
| 177 | D | 93.2 | Very high | 91 | Very high | 7 Ų | 7 | 77.6 Ų | 77.6 | 4% | 0.037 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -74.5 | -31.7 | 177.2 | -69.6 | -29.3 | 0 | 0 | 0 | 112.5 | L147 I151 Q173 I174 K175 R180 M181 | L147-D177 HydrophobicContact CD2-CB 4.03Å; I151-D177 HydrophobicContact CD1-CB 4.08Å; I151-D177 HydrophobicContact CG1-CB 3.96Å; Q173-D177 VanDerWaalsContact NE2-CG 3.32Å; Q173-D177 PolarHBondContact NE2-OD1 2.8Å; Q173-D177 PolarHBondContact NE2-OD2 2.95Å; Q173-D177 PolarHBondContact O-N 3.26Å; I174-D177 PolarHBondContact O-N 3.19Å; K175-D177 VanDerWaalsContact C-N 3.3Å; K175-D177 PolarHBondContact O-N 3.19Å; D177-R180 IonicContact OD1-CZ 2.86Å; D177-R180 IonicContact OD1-NH1 2.94Å; D177-R180 PolarHBondContact OD1-NH1 3.37Å; D177-M181 WeakPolarHBondContact O-CB 3.46Å; D177-M181 PolarHBondContact O-N 3.42Å |
| 178 | H | 92.3 | Very high | 91 | Very high | 74 Ų | 74 | 72.2 Ų | 72.2 | 34% | 0.343 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.4 | -45 | 168.2 | -81.6 | 86.7 | 0 | 0 | 0 | 112 | I174 K175 R180 M181 V182 | I174-H178 VanDerWaalsContact CG2-CE1 3.43Å; I174-H178 WeakPolarHBondContact CG2-CE1 3.48Å; I174-H178 VanDerWaalsContact CG2-ND1 3.35Å; I174-H178 WeakPolarHBondContact CG2-ND1 3.25Å; I174-H178 PolarHBondContact O-N 3.48Å; I174-H178 PolarHBondContact O-ND1 3.43Å; K175-H178 WeakPolarHBondContact O-CB 3.34Å; K175-H178 PolarHBondContact O-N 3.23Å; H178-R180 PolarHBondContact O-N 3.32Å; H178-M181 WeakPolarHBondContact O-CB 3.34Å; H178-M181 PolarHBondContact O-N 2.85Å; H178-M181 VanDerWaalsContact O-N 3.09Å; H178-V182 PolarHBondContact O-N 3.09Å; H178-V182 VanDerWaalsContact O-N 3.08Å |
| 179 | D | 93 | Very high | 90.9 | Very high | 91 Ų | 91 | 73.7 Ų | 73.7 | 49% | 0.487 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.8 | -45.7 | 177.8 | -68.8 | -20.5 | 0 | 0 | 0 | 110.6 | K175 A176 M181 V182 D183 | K175-D179 PolarHBondContact O-N 3.04Å; A176-D179 PolarHBondContact O-N 3.2Å; D179-M181 PolarHBondContact O-N 3.44Å; D179-V182 WeakPolarHBondContact O-CB 3.47Å; D179-V182 PolarHBondContact O-N 3.44Å; D179-V182 VanDerWaalsContact O-N 3.09Å; D179-D183 PolarHBondContact O-N 2.91Å; D179-D183 VanDerWaalsContact O-N 3.08Å |
| 180 | R | 91 | Very high | 90.5 | Very high | 126 Ų | 126 | 69.1 Ų | 69.1 | 48% | 0.475 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -59.6 | -33.7 | 173.7 | -71.5 | 166.5 | 177 | 178.1 | -2.6 | 113.1 | L147 A176 D177 H178 D183 I184 | L147-R180 HydrophobicContact CD1-CB 4.1Å; A176-R180 VanDerWaalsContact O-CG 3.28Å; A176-R180 WeakPolarHBondContact O-CG 3.36Å; A176-R180 PolarHBondContact O-N 2.92Å; A176-R180 VanDerWaalsContact O-N 3.08Å; D177-R180 IonicContact OD1-CZ 2.86Å; D177-R180 IonicContact OD1-NH1 2.94Å; D177-R180 PolarHBondContact OD1-NH1 3.37Å; H178-R180 PolarHBondContact O-N 3.32Å; R180-D183 PolarHBondContact O-N 2.98Å; R180-I184 WeakPolarHBondContact O-CD1 3.49Å; R180-I184 VanDerWaalsContact O-CG1 3.27Å; R180-I184 WeakPolarHBondContact O-CG1 3.45Å; R180-I184 PolarHBondContact O-N 3.32Å |
| 181 | M | 91 | Very high | 90.1 | Very high | 31 Ų | 31 | 68.1 Ų | 68.1 | 15% | 0.153 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -68.6 | -37.9 | 176.9 | -175.7 | -177.9 | 61.6 | 0 | 0 | 111.4 | R144 L148 D177 H178 D179 I184 N185 | R144-M181 HydrophobicContact CG-CG 4.29Å; L148-M181 HydrophobicContact CD2-SD 3.77Å; L148-M181 HydrophobicContact CG-SD 4.26Å; D177-M181 WeakPolarHBondContact O-CB 3.46Å; D177-M181 PolarHBondContact O-N 3.42Å; H178-M181 WeakPolarHBondContact O-CB 3.34Å; H178-M181 PolarHBondContact O-N 2.85Å; H178-M181 VanDerWaalsContact O-N 3.09Å; D179-M181 PolarHBondContact O-N 3.44Å; M181-I184 PolarHBondContact O-N 2.94Å; M181-N185 VanDerWaalsContact O-CG 3.25Å; M181-N185 PolarHBondContact O-N 3.15Å; M181-N185 PolarHBondContact O-ND2 3.26Å |
| 182 | V | 88.3 | Confident | 89.6 | Confident | 74 Ų | 74 | 67.3 Ų | 67.3 | 45% | 0.448 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.4 | -47.7 | 172.8 | 177.5 | 0 | 0 | 0 | 0 | 109.9 | H178 D179 I184 N185 D186 | H178-V182 PolarHBondContact O-N 3.09Å; H178-V182 VanDerWaalsContact O-N 3.08Å; D179-V182 WeakPolarHBondContact O-CB 3.47Å; D179-V182 PolarHBondContact O-N 3.44Å; D179-V182 VanDerWaalsContact O-N 3.09Å; V182-I184 VanDerWaalsContact C-N 3.29Å; V182-I184 PolarHBondContact O-N 3.02Å; V182-N185 WeakPolarHBondContact O-CB 3.42Å; V182-N185 PolarHBondContact O-N 2.97Å; V182-D186 PolarHBondContact O-N 3.37Å |
| 183 | D | 90.7 | Very high | 89 | Confident | 106 Ų | 106 | 72.3 Ų | 72.3 | 57% | 0.567 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -57.2 | -41.8 | 176.9 | -64.4 | -26.7 | 0 | 0 | 0 | 112.3 | D179 R180 D186 L187 | D179-D183 PolarHBondContact O-N 2.91Å; D179-D183 VanDerWaalsContact O-N 3.08Å; R180-D183 PolarHBondContact O-N 2.98Å; D183-D186 PolarHBondContact O-N 3.21Å; D183-L187 WeakPolarHBondContact O-CB 3.37Å; D183-L187 PolarHBondContact O-N 3.45Å |
| 184 | I | 91.7 | Very high | 88.2 | Confident | 10 Ų | 10 | 72.2 Ų | 72.2 | 5% | 0.051 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.4 | -41 | 176.3 | -70 | 164.1 | 0 | 0 | 0 | 111.1 | L140 K143 R144 L147 R180 M181 V182 L187 L188 | L140-I184 HydrophobicContact CB-CG2 4.14Å; L140-I184 HydrophobicContact CD2-CG1 4.27Å; L140-I184 HydrophobicContact CD2-CG2 4.16Å; K143-I184 HydrophobicContact CB-CD1 4.39Å; K143-I184 HydrophobicContact CD-CD1 3.94Å; K143-I184 HydrophobicContact CG-CD1 3.92Å; R144-I184 HydrophobicContact CB-CG2 4.1Å; L147-I184 HydrophobicContact CD1-CD1 3.58Å; R180-I184 WeakPolarHBondContact O-CD1 3.49Å; R180-I184 VanDerWaalsContact O-CG1 3.27Å; R180-I184 WeakPolarHBondContact O-CG1 3.45Å; R180-I184 PolarHBondContact O-N 3.32Å; M181-I184 PolarHBondContact O-N 2.94Å; V182-I184 VanDerWaalsContact C-N 3.29Å; V182-I184 PolarHBondContact O-N 3.02Å; I184-L187 PolarHBondContact O-N 3.24Å; I184-L188 HydrophobicContact CG2-CD1 4.07Å; I184-L188 HydrophobicContact CG2-CG 4.36Å; I184-L188 WeakPolarHBondContact O-CB 3.43Å; I184-L188 WeakPolarHBondContact O-CG 3.42Å; I184-L188 PolarHBondContact O-N 3.07Å |
| 185 | N | 90.3 | Very high | 87.4 | Confident | 45 Ų | 45 | 77.8 Ų | 77.8 | 24% | 0.241 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64 | -42.5 | 178.1 | -71.5 | -33.5 | 0 | 0 | 0 | 111.3 | R144 M181 V182 L187 L188 V189 | R144-N185 PolarHBondContact NH1-OD1 2.85Å; M181-N185 VanDerWaalsContact O-CG 3.25Å; M181-N185 PolarHBondContact O-N 3.15Å; M181-N185 PolarHBondContact O-ND2 3.26Å; V182-N185 WeakPolarHBondContact O-CB 3.42Å; V182-N185 PolarHBondContact O-N 2.97Å; N185-L187 VanDerWaalsContact C-N 3.33Å; N185-L187 PolarHBondContact O-N 3.19Å; N185-L188 PolarHBondContact O-N 2.89Å; N185-V189 WeakPolarHBondContact O-CG2 3.38Å; N185-V189 PolarHBondContact O-N 3.14Å |
| 186 | D | 89.9 | Confident | 86.1 | Confident | 96 Ų | 96 | 76.9 Ų | 76.9 | 51% | 0.513 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -63.9 | -39.8 | 177.2 | -72 | -11 | 0 | 0 | 0 | 111.6 | V182 D183 V189 S190 | V182-D186 PolarHBondContact O-N 3.37Å; D183-D186 PolarHBondContact O-N 3.21Å; D186-V189 PolarHBondContact O-N 2.86Å; D186-S190 WeakPolarHBondContact O-CB 3.3Å; D186-S190 PolarHBondContact O-N 2.75Å; D186-S190 PolarHBondContact O-OG 3.18Å |
| 187 | L | 88 | Confident | 84.5 | Confident | 77 Ų | 77 | 78 Ų | 78 | 40% | 0.403 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -65.9 | -40.7 | 174.3 | -175.2 | 57.5 | 0 | 0 | 0 | 112 | L140 D183 I184 N185 S190 L191 | L140-L187 HydrophobicContact CD1-CB 4.4Å; L140-L187 HydrophobicContact CD1-CD2 3.56Å; L140-L187 HydrophobicContact CD1-CG 3.71Å; L140-L187 HydrophobicContact CD2-CD2 3.85Å; L140-L187 HydrophobicContact CG-CD2 4.35Å; D183-L187 WeakPolarHBondContact O-CB 3.37Å; D183-L187 PolarHBondContact O-N 3.45Å; I184-L187 PolarHBondContact O-N 3.24Å; N185-L187 VanDerWaalsContact C-N 3.33Å; N185-L187 PolarHBondContact O-N 3.19Å; L187-S190 WeakPolarHBondContact O-CB 3.26Å; L187-S190 PolarHBondContact O-N 3.3Å; L187-L191 HydrophobicContact CG-CD1 4.23Å; L187-L191 WeakPolarHBondContact O-CG 3.31Å; L187-L191 PolarHBondContact O-N 3.27Å |
| 188 | L | 89.2 | Confident | 82.6 | Confident | 9 Ų | 9 | 81.1 Ų | 81.1 | 5% | 0.047 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 175.6 | -78.4 | 173.5 | 0 | 0 | 0 | 112.1 | V137 L140 N141 I184 N185 S190 L191 K192 | V137-L188 HydrophobicContact CB-CD2 4.29Å; V137-L188 HydrophobicContact CG1-CD2 3.95Å; V137-L188 HydrophobicContact CG2-CD2 4.26Å; L140-L188 HydrophobicContact CB-CD2 3.8Å; L140-L188 HydrophobicContact CB-CG 4.15Å; L140-L188 HydrophobicContact CD1-CD2 4.16Å; L140-L188 HydrophobicContact CD1-CG 4.46Å; N141-L188 WeakPolarHBondContact OD1-CD1 3.12Å; I184-L188 HydrophobicContact CG2-CD1 4.07Å; I184-L188 HydrophobicContact CG2-CG 4.36Å; I184-L188 WeakPolarHBondContact O-CB 3.43Å; I184-L188 WeakPolarHBondContact O-CG 3.42Å; I184-L188 PolarHBondContact O-N 3.07Å; N185-L188 PolarHBondContact O-N 2.89Å; L188-S190 VanDerWaalsContact C-N 3.33Å; L188-L191 PolarHBondContact O-N 2.95Å; L188-K192 WeakPolarHBondContact O-CB 3.45Å; L188-K192 VanDerWaalsContact O-CG 3.28Å; L188-K192 WeakPolarHBondContact O-CG 3.15Å; L188-K192 PolarHBondContact O-N 3.33Å |
| 189 | V | 85.8 | Confident | 80.6 | Confident | 96 Ų | 96 | 81.1 Ų | 81.1 | 58% | 0.582 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -63.2 | -42.7 | 174.7 | 172.3 | 0 | 0 | 0 | 0 | 110.5 | N185 D186 K192 R193 | N185-V189 WeakPolarHBondContact O-CG2 3.38Å; N185-V189 PolarHBondContact O-N 3.14Å; D186-V189 PolarHBondContact O-N 2.86Å; V189-K192 PolarHBondContact O-N 2.92Å; V189-R193 WeakPolarHBondContact O-CB 3.31Å; V189-R193 PolarHBondContact O-N 2.88Å |
| 190 | S | 83 | Confident | 78.8 | Confident | 63 Ų | 63 | 82.3 Ų | 82.3 | 44% | 0.441 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.6 | -46.1 | 178 | -58.9 | 0 | 0 | 0 | 0 | 112 | D186 L187 L188 R193 I194 | D186-S190 WeakPolarHBondContact O-CB 3.3Å; D186-S190 PolarHBondContact O-N 2.75Å; D186-S190 PolarHBondContact O-OG 3.18Å; L187-S190 WeakPolarHBondContact O-CB 3.26Å; L187-S190 PolarHBondContact O-N 3.3Å; L188-S190 VanDerWaalsContact C-N 3.33Å; S190-R193 PolarHBondContact O-N 3.36Å; S190-I194 WeakPolarHBondContact O-CG1 3.26Å; S190-I194 PolarHBondContact O-N 3.27Å; S190-I194 VanDerWaalsContact O-N 3.12Å |
| 191 | L | 82 | Confident | 77.3 | Confident | 15 Ų | 15 | 78.9 Ų | 78.9 | 8% | 0.079 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 175.7 | -75.5 | 167.2 | 0 | 0 | 0 | 111.9 | M133 M136 V137 L140 L187 L188 R193 I194 R195 | M133-L191 HydrophobicContact CE-CD2 4.12Å; M133-L191 VanDerWaalsContact CE-O 3.29Å; M133-L191 WeakPolarHBondContact CE-O 3.45Å; M133-L191 HydrophobicContact CG-CD2 4.27Å; M136-L191 HydrophobicContact CB-CD1 4.46Å; M136-L191 HydrophobicContact CG-CD1 4.14Å; M136-L191 HydrophobicContact SD-CD1 4Å; M136-L191 HydrophobicContact SD-CD2 4.15Å; V137-L191 HydrophobicContact CG2-CB 3.97Å; V137-L191 HydrophobicContact CG2-CD1 3.96Å; L140-L191 HydrophobicContact CD1-CD1 3.5Å; L187-L191 HydrophobicContact CG-CD1 4.23Å; L187-L191 WeakPolarHBondContact O-CG 3.31Å; L187-L191 PolarHBondContact O-N 3.27Å; L188-L191 PolarHBondContact O-N 2.95Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 2.92Å; L191-I194 PolarHBondContact O-N 3.08Å; L191-R195 PolarHBondContact O-N 3.37Å |
| 192 | K | 80.8 | Confident | 75.5 | Confident | 116 Ų | 116 | 81.3 Ų | 81.3 | 50% | 0.504 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62 | -38.4 | 175.6 | -77 | 177.2 | -179.2 | -179.9 | 0 | 112.1 | L188 V189 R195 N196 | L188-K192 WeakPolarHBondContact O-CB 3.45Å; L188-K192 VanDerWaalsContact O-CG 3.28Å; L188-K192 WeakPolarHBondContact O-CG 3.15Å; L188-K192 PolarHBondContact O-N 3.33Å; V189-K192 PolarHBondContact O-N 2.92Å; K192-R195 PolarHBondContact O-N 3.01Å; K192-N196 VanDerWaalsContact O-CB 3.27Å; K192-N196 WeakPolarHBondContact O-CB 3.47Å; K192-N196 PolarHBondContact O-N 2.72Å |
| 193 | R | 79.4 | Confident | 74 | Confident | 204 Ų | 204 | 83 Ų | 83 | 77% | 0.77 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -63.9 | -40.7 | 176.9 | -175.4 | 177.5 | 177.5 | -179.9 | -1.2 | 111.9 | V189 S190 L191 I197 | V189-R193 WeakPolarHBondContact O-CB 3.31Å; V189-R193 PolarHBondContact O-N 2.88Å; S190-R193 PolarHBondContact O-N 3.36Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 2.92Å; R193-I197 WeakPolarHBondContact O-CG1 3.44Å; R193-I197 PolarHBondContact O-N 2.89Å |
| 194 | I | 75.2 | Confident | 72.6 | Confident | 83 Ų | 83 | 83 Ų | 83 | 43% | 0.426 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -69.2 | -37 | 177 | -63 | 165.3 | 0 | 0 | 0 | 110.9 | M133 S190 L191 I197 | M133-I194 HydrophobicContact CE-CB 3.63Å; M133-I194 HydrophobicContact CE-CG2 3.55Å; M133-I194 HydrophobicContact SD-CG2 3.94Å; S190-I194 WeakPolarHBondContact O-CG1 3.26Å; S190-I194 PolarHBondContact O-N 3.27Å; S190-I194 VanDerWaalsContact O-N 3.12Å; L191-I194 PolarHBondContact O-N 3.08Å; I194-I197 WeakPolarHBondContact O-CG1 3.26Å |
| 195 | R | 74.6 | Confident | 71.2 | Confident | 136 Ų | 136 | 89.9 Ų | 89.9 | 51% | 0.513 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -68.5 | -44 | 175.9 | -176.8 | -179.7 | 175.6 | 179.4 | -3.9 | 112.4 | M133 D134 L191 K192 I197 | M133-R195 HydrophobicContact CE-CB 4.22Å; D134-R195 IonicContact OD1-CZ 3.96Å; D134-R195 VanDerWaalsContact OD1-CZ 3.23Å; D134-R195 IonicContact OD1-NE 2.74Å; D134-R195 IonicContact OD1-NH1 3.23Å; D134-R195 PolarHBondContact OD1-NH1 2.85Å; D134-R195 IonicContact OD1-NH2 3.83Å; L191-R195 PolarHBondContact O-N 3.37Å; K192-R195 PolarHBondContact O-N 3.01Å; R195-I197 PolarHBondContact O-N 3.25Å |
| 196 | N | 66.2 | Low | 69.8 | Low | 120 Ų | 120 | 91.4 Ų | 91.4 | 64% | 0.642 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | 16.4 | -176.5 | -77.5 | 7.5 | 0 | 0 | 0 | 113.3 | K192 P198 | K192-N196 VanDerWaalsContact O-CB 3.27Å; K192-N196 WeakPolarHBondContact O-CB 3.47Å; K192-N196 PolarHBondContact O-N 2.72Å; N196-P198 WeakPolarHBondContact O-CD 3.4Å; N196-P198 VanDerWaalsContact O-N 3.11Å |
| 197 | I | 58.1 | Low | 68.4 | Low | 59 Ų | 59 | 91.3 Ų | 91.3 | 30% | 0.303 | 44% | 0.443 | S | S | . | . | S | Bend | trans | -67.9 | 112.9 | 164.9 | -47.9 | 173.7 | 0 | 0 | 0 | 104.8 | R193 I194 R195 D199 R202 | R193-I197 WeakPolarHBondContact O-CG1 3.44Å; R193-I197 PolarHBondContact O-N 2.89Å; I194-I197 WeakPolarHBondContact O-CG1 3.26Å; R195-I197 PolarHBondContact O-N 3.25Å; I197-D199 PolarHBondContact O-N 3.45Å; I197-R202 HydrophobicContact CB-CG 4.28Å; I197-R202 HydrophobicContact CG2-CG 3.41Å; I197-R202 VanDerWaalsContact CG2-CG 3.41Å |
| 198 | P | 53.5 | Low | 67.2 | Low | 72 Ų | 72 | 93.6 Ų | 93.6 | 47% | 0.468 | 45% | 0.45 | S | S | . | . | trans | -54.8 | 121.2 | 178.7 | -16.3 | 27.8 | 0 | 0 | 0 | 106.4 | N196 D200 T201 R202 | N196-P198 WeakPolarHBondContact O-CD 3.4Å; N196-P198 VanDerWaalsContact O-N 3.11Å; P198-D200 PolarHBondContact O-N 3.17Å; P198-D200 VanDerWaalsContact O-N 3.1Å; P198-T201 HydrophobicContact CB-CG2 4.04Å; P198-T201 WeakPolarHBondContact CD-OG1 3.48Å; P198-T201 HydrophobicContact CG-CG2 4.03Å; P198-T201 PolarHBondContact O-N 3Å; P198-T201 PolarHBondContact O-OG1 3.18Å; P198-R202 PolarHBondContact O-N 3.46Å | ||
| 199 | D | 52 | Low | 66 | Low | 75 Ų | 75 | 95.5 Ų | 95.5 | 40% | 0.401 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -52.7 | -35.7 | -177.5 | -76.3 | -33.8 | 0 | 0 | 0 | 110.4 | I197 T201 R202 W203 | I197-D199 PolarHBondContact O-N 3.45Å; D199-T201 VanDerWaalsContact C-N 3.34Å; D199-T201 PolarHBondContact O-N 3.44Å; D199-R202 PolarHBondContact O-N 3.49Å; D199-R202 IonicContact OD1-CZ 2.67Å; D199-R202 IonicContact OD1-NE 3.81Å; D199-R202 IonicContact OD1-NH2 3.74Å; D199-R202 PolarHBondContact OD1-NH2 2.89Å; D199-W203 PolarHBondContact O-N 2.95Å |
| 200 | D | 55 | Low | 64.8 | Low | 115 Ų | 115 | 91.9 Ų | 91.9 | 62% | 0.615 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -52.6 | -47.3 | 171.7 | -58.1 | -16 | 0 | 0 | 0 | 111.7 | P198 R202 E204 | P198-D200 PolarHBondContact O-N 3.17Å; P198-D200 VanDerWaalsContact O-N 3.1Å; D200-R202 PolarHBondContact O-N 3.45Å; D200-E204 WeakPolarHBondContact O-CA 3.45Å; D200-E204 WeakPolarHBondContact O-CB 3.23Å; D200-E204 WeakPolarHBondContact O-CG 3.34Å; D200-E204 PolarHBondContact O-N 3.2Å |
| 201 | T | 58 | Low | 64 | Low | 55 Ų | 55 | 90.3 Ų | 90.3 | 34% | 0.337 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -71.7 | -29.6 | -176.8 | 62.1 | 0 | 0 | 0 | 0 | 114.2 | P198 D199 K205 | P198-T201 HydrophobicContact CB-CG2 4.04Å; P198-T201 WeakPolarHBondContact CD-OG1 3.48Å; P198-T201 HydrophobicContact CG-CG2 4.03Å; P198-T201 PolarHBondContact O-N 3Å; P198-T201 PolarHBondContact O-OG1 3.18Å; D199-T201 VanDerWaalsContact C-N 3.34Å; D199-T201 PolarHBondContact O-N 3.44Å; T201-K205 WeakPolarHBondContact O-CB 3.38Å; T201-K205 VanDerWaalsContact O-CG 3.24Å; T201-K205 WeakPolarHBondContact O-CG 3.45Å; T201-K205 PolarHBondContact O-N 3.37Å |
| 202 | R | 54.8 | Low | 63.1 | Low | 82 Ų | 82 | 96.2 Ų | 96.2 | 31% | 0.309 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -73.4 | -50.3 | 175.5 | -73.5 | -173.8 | -69.9 | -174.4 | -1.4 | 110 | I197 P198 D199 D200 K205 I206 | I197-R202 HydrophobicContact CB-CG 4.28Å; I197-R202 HydrophobicContact CG2-CG 3.41Å; I197-R202 VanDerWaalsContact CG2-CG 3.41Å; P198-R202 PolarHBondContact O-N 3.46Å; D199-R202 PolarHBondContact O-N 3.49Å; D199-R202 IonicContact OD1-CZ 2.67Å; D199-R202 IonicContact OD1-NE 3.81Å; D199-R202 IonicContact OD1-NH2 3.74Å; D199-R202 PolarHBondContact OD1-NH2 2.89Å; D200-R202 PolarHBondContact O-N 3.45Å; R202-K205 PolarHBondContact O-N 2.71Å; R202-I206 WeakPolarHBondContact O-CD1 3.5Å; R202-I206 VanDerWaalsContact O-CG1 3.27Å; R202-I206 WeakPolarHBondContact O-CG1 3.07Å; R202-I206 PolarHBondContact O-N 2.94Å |
| 203 | W | 55.7 | Low | 62.5 | Low | 109 Ų | 109 | 95.3 Ų | 95.3 | 41% | 0.413 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.5 | -42.7 | 179 | -69.3 | 121 | 0 | 0 | 0 | 111.3 | L122 D199 K205 I206 L207 | L122-W203 HydrophobicContact CD2-CH2 3.49Å; L122-W203 VanDerWaalsContact CD2-CH2 3.49Å; L122-W203 HydrophobicContact CD2-CZ2 4.22Å; L122-W203 HydrophobicContact CD2-CZ3 4.4Å; L122-W203 HydrophobicContact CG-CH2 4.24Å; D199-W203 PolarHBondContact O-N 2.95Å; W203-K205 VanDerWaalsContact C-N 3.32Å; W203-K205 PolarHBondContact O-N 2.98Å; W203-I206 HydrophobicContact CE3-CD1 4.29Å; W203-I206 HydrophobicContact CZ3-CD1 4.25Å; W203-I206 PolarHBondContact O-N 3.2Å; W203-L207 HydrophobicContact CB-CD1 4.44Å; W203-L207 WeakPolarHBondContact O-CB 2.99Å; W203-L207 WeakPolarHBondContact O-CG 3.46Å; W203-L207 PolarHBondContact O-N 3.16Å |
| 204 | E | 62 | Low | 61.4 | Low | 106 Ų | 106 | 94.9 Ų | 94.9 | 50% | 0.495 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -61.1 | -37.7 | 175.5 | -78.5 | 177.8 | -177.1 | 0 | 0 | 112.7 | D200 K208 | D200-E204 WeakPolarHBondContact O-CA 3.45Å; D200-E204 WeakPolarHBondContact O-CB 3.23Å; D200-E204 WeakPolarHBondContact O-CG 3.34Å; D200-E204 PolarHBondContact O-N 3.2Å; E204-K208 WeakPolarHBondContact O-CB 3.48Å; E204-K208 VanDerWaalsContact O-CG 3.28Å; E204-K208 WeakPolarHBondContact O-CG 3.4Å; E204-K208 PolarHBondContact O-N 3.32Å |
| 205 | K | 62.3 | Low | 61.3 | Low | 155 Ų | 155 | 94.7 Ų | 94.7 | 67% | 0.674 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -69.1 | -44.8 | 175.9 | -80.8 | -179.9 | 179.4 | -172.8 | 0 | 111.7 | T201 R202 W203 K208 V209 | T201-K205 WeakPolarHBondContact O-CB 3.38Å; T201-K205 VanDerWaalsContact O-CG 3.24Å; T201-K205 WeakPolarHBondContact O-CG 3.45Å; T201-K205 PolarHBondContact O-N 3.37Å; R202-K205 PolarHBondContact O-N 2.71Å; W203-K205 VanDerWaalsContact C-N 3.32Å; W203-K205 PolarHBondContact O-N 2.98Å; K205-K208 PolarHBondContact O-N 2.67Å; K205-V209 WeakPolarHBondContact O-CG2 3.35Å; K205-V209 PolarHBondContact O-N 3.13Å |
| 206 | I | 59.6 | Low | 60.6 | Low | 76 Ų | 76 | 91.1 Ų | 91.1 | 39% | 0.39 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.4 | -45.8 | 178.9 | -67 | 164.7 | 0 | 0 | 0 | 109.9 | R202 W203 V209 L210 | R202-I206 WeakPolarHBondContact O-CD1 3.5Å; R202-I206 VanDerWaalsContact O-CG1 3.27Å; R202-I206 WeakPolarHBondContact O-CG1 3.07Å; R202-I206 PolarHBondContact O-N 2.94Å; W203-I206 HydrophobicContact CE3-CD1 4.29Å; W203-I206 HydrophobicContact CZ3-CD1 4.25Å; W203-I206 PolarHBondContact O-N 3.2Å; I206-V209 PolarHBondContact O-N 3.1Å; I206-L210 HydrophobicContact CG2-CD1 3.55Å; I206-L210 HydrophobicContact CG2-CG 4.3Å; I206-L210 WeakPolarHBondContact O-CB 3.36Å; I206-L210 WeakPolarHBondContact O-CG 3.4Å; I206-L210 PolarHBondContact O-N 2.84Å |
| 207 | L | 60.9 | Low | 60.5 | Low | 94 Ų | 94 | 92.4 Ų | 92.4 | 49% | 0.492 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 176.9 | -71.2 | 170.4 | 0 | 0 | 0 | 111.6 | W203 V209 L210 D211 | W203-L207 HydrophobicContact CB-CD1 4.44Å; W203-L207 WeakPolarHBondContact O-CB 2.99Å; W203-L207 WeakPolarHBondContact O-CG 3.46Å; W203-L207 PolarHBondContact O-N 3.16Å; L207-V209 PolarHBondContact O-N 3.48Å; L207-L210 PolarHBondContact O-N 3.46Å; L207-D211 WeakPolarHBondContact O-CA 3.38Å; L207-D211 WeakPolarHBondContact O-CB 3.37Å; L207-D211 PolarHBondContact O-N 3.15Å |
| 208 | K | 64.2 | Low | 60.8 | Low | 125 Ų | 125 | 92.7 Ų | 92.7 | 54% | 0.543 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.9 | -31.4 | 176.9 | -88.4 | 177.7 | 178.1 | 170.6 | 0 | 114.2 | E204 K205 E212 | E204-K208 WeakPolarHBondContact O-CB 3.48Å; E204-K208 VanDerWaalsContact O-CG 3.28Å; E204-K208 WeakPolarHBondContact O-CG 3.4Å; E204-K208 PolarHBondContact O-N 3.32Å; K205-K208 PolarHBondContact O-N 2.67Å; K208-E212 VanDerWaalsContact O-CG 3.25Å; K208-E212 WeakPolarHBondContact O-CG 3.42Å |
| 209 | V | 63.3 | Low | 61.3 | Low | 49 Ų | 49 | 93.5 Ų | 93.5 | 30% | 0.297 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -85.3 | -34.4 | 179.3 | 174.1 | 0 | 0 | 0 | 0 | 111 | K205 I206 L207 H222 V226 L229 | K205-V209 WeakPolarHBondContact O-CG2 3.35Å; K205-V209 PolarHBondContact O-N 3.13Å; I206-V209 PolarHBondContact O-N 3.1Å; L207-V209 PolarHBondContact O-N 3.48Å; V209-H222 PolarHBondContact O-ND1 3.22Å; V209-V226 HydrophobicContact CG1-CG2 4.26Å; V209-L229 HydrophobicContact CG1-CD1 4.35Å |
| 210 | L | 60.8 | Low | 62 | Low | 21 Ų | 21 | 92.4 Ų | 92.4 | 11% | 0.11 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -82.5 | -25.7 | -177.7 | -72.7 | 178.2 | 0 | 0 | 0 | 114.2 | I206 L207 I218 H222 V226 | I206-L210 HydrophobicContact CG2-CD1 3.55Å; I206-L210 HydrophobicContact CG2-CG 4.3Å; I206-L210 WeakPolarHBondContact O-CB 3.36Å; I206-L210 WeakPolarHBondContact O-CG 3.4Å; I206-L210 PolarHBondContact O-N 2.84Å; L207-L210 PolarHBondContact O-N 3.46Å; L210-I218 HydrophobicContact CB-CD1 4.14Å; L210-I218 HydrophobicContact CB-CG1 4.09Å; L210-I218 HydrophobicContact CB-CG2 4.02Å; L210-I218 HydrophobicContact CD1-CD1 4.14Å; L210-I218 HydrophobicContact CD2-CG2 3.82Å; L210-I218 HydrophobicContact CG-CG2 4.38Å; L210-H222 HydrophobicContact CD2-CB 4.01Å; L210-H222 PolarHBondContact O-CD2 3.47Å; L210-H222 VanDerWaalsContact O-CD2 3.24Å; L210-V226 HydrophobicContact CD2-CB 4.38Å; L210-V226 HydrophobicContact CD2-CG2 3.43Å; L210-V226 VanDerWaalsContact CD2-CG2 3.43Å; L210-V226 HydrophobicContact CG-CG2 4.03Å |
| 211 | D | 66.5 | Low | 62.6 | Low | 29 Ų | 29 | 91.7 Ų | 91.7 | 16% | 0.155 | 45% | 0.447 | C | S | . | . | trans | -134.9 | 59.2 | -173.8 | -173.8 | 26.2 | 0 | 0 | 0 | 107.2 | L207 D213 R214 D215 G216 | L207-D211 WeakPolarHBondContact O-CA 3.38Å; L207-D211 WeakPolarHBondContact O-CB 3.37Å; L207-D211 PolarHBondContact O-N 3.15Å; D211-D213 PolarHBondContact O-N 3.02Å; D211-R214 VanDerWaalsContact CG-CA 3.43Å; D211-R214 PolarHBondContact O-N 3.44Å; D211-R214 VanDerWaalsContact O-N 3.11Å; D211-R214 VanDerWaalsContact OD1-C 3.28Å; D211-R214 WeakPolarHBondContact OD1-CA 3.34Å; D211-R214 PolarHBondContact OD1-N 3.06Å; D211-R214 WeakPolarHBondContact OD2-CA 3.45Å; D211-D215 PolarHBondContact OD1-N 2.94Å; D211-G216 PolarHBondContact OD1-N 2.92Å; D211-G216 PolarHBondContact OD2-N 3.37Å | ||
| 212 | E | 61.9 | Low | 62.8 | Low | 139 Ų | 139 | 90.3 Ų | 90.3 | 65% | 0.65 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -59.2 | -34.7 | -176.3 | -83 | -175.3 | 176.7 | 0 | 0 | 111.9 | K208 | K208-E212 VanDerWaalsContact O-CG 3.25Å; K208-E212 WeakPolarHBondContact O-CG 3.42Å |
| 213 | D | 68.2 | Low | 63.3 | Low | 98 Ų | 98 | 86.6 Ų | 86.6 | 52% | 0.524 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -90 | -7.3 | 177.6 | 71 | -15.6 | 0 | 0 | 0 | 113.9 | D211 D215 | D211-D213 PolarHBondContact O-N 3.02Å; D213-D215 VanDerWaalsContact C-N 3.28Å; D213-D215 PolarHBondContact O-N 3.35Å; D213-D215 PolarHBondContact OD1-N 2.91Å |
| 214 | R | 55.9 | Low | 63.8 | Low | 194 Ų | 194 | 85.6 Ų | 85.6 | 73% | 0.732 | 43% | 0.425 | S | S | * | . | trans | 60.7 | 32.9 | 178.1 | -54.5 | -177.9 | -174.6 | 174.4 | 2.9 | 113.4 | D211 G216 | D211-R214 VanDerWaalsContact CG-CA 3.43Å; D211-R214 PolarHBondContact O-N 3.44Å; D211-R214 VanDerWaalsContact O-N 3.11Å; D211-R214 VanDerWaalsContact OD1-C 3.28Å; D211-R214 WeakPolarHBondContact OD1-CA 3.34Å; D211-R214 PolarHBondContact OD1-N 3.06Å; D211-R214 WeakPolarHBondContact OD2-CA 3.45Å; R214-G216 VanDerWaalsContact C-N 3.29Å | ||
| 215 | D | 72.9 | Confident | 64 | Low | 79 Ų | 79 | 83 Ų | 83 | 42% | 0.422 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -83.8 | -10.4 | 177.5 | 91.6 | -22.4 | 0 | 0 | 0 | 112.4 | D211 D213 K217 | D211-D215 PolarHBondContact OD1-N 2.94Å; D213-D215 VanDerWaalsContact C-N 3.28Å; D213-D215 PolarHBondContact O-N 3.35Å; D213-D215 PolarHBondContact OD1-N 2.91Å; D215-K217 VanDerWaalsContact C-N 3.33Å; D215-K217 WeakPolarHBondContact OD1-CA 3.33Å; D215-K217 VanDerWaalsContact OD1-CB 3.23Å; D215-K217 WeakPolarHBondContact OD1-CB 3.35Å; D215-K217 PolarHBondContact OD1-N 2.92Å; D215-K217 WeakPolarHBondContact OD2-CD 3.42Å |
| 216 | G | 61.6 | Low | 64.1 | Low | 62 Ų | 62 | 77.9 Ų | 77.9 | 64% | 0.639 | 40% | 0.4 | S | S | * | . | S | Bend | trans | 82.2 | 8.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114 | D211 R214 | D211-G216 PolarHBondContact OD1-N 2.92Å; D211-G216 PolarHBondContact OD2-N 3.37Å; R214-G216 VanDerWaalsContact C-N 3.29Å |
| 217 | K | 64.2 | Low | 64.4 | Low | 146 Ų | 146 | 77.4 Ų | 77.4 | 64% | 0.635 | 40% | 0.397 | S | S | * | . | trans | -113 | 126.8 | 173.5 | -55.4 | 179.5 | -172.5 | 168.5 | 0 | 108.5 | D215 E219 | D215-K217 VanDerWaalsContact C-N 3.33Å; D215-K217 WeakPolarHBondContact OD1-CA 3.33Å; D215-K217 VanDerWaalsContact OD1-CB 3.23Å; D215-K217 WeakPolarHBondContact OD1-CB 3.35Å; D215-K217 PolarHBondContact OD1-N 2.92Å; D215-K217 WeakPolarHBondContact OD2-CD 3.42Å; K217-E219 PolarHBondContact O-N 3.45Å | ||
| 218 | I | 62.9 | Low | 64.8 | Low | 65 Ų | 65 | 80.2 Ų | 80.2 | 33% | 0.333 | 41% | 0.408 | S | S | . | . | trans | -92.6 | 105.1 | 175.5 | -57.8 | 171.1 | 0 | 0 | 0 | 106.4 | L210 H222 V223 | L210-I218 HydrophobicContact CB-CD1 4.14Å; L210-I218 HydrophobicContact CB-CG1 4.09Å; L210-I218 HydrophobicContact CB-CG2 4.02Å; L210-I218 HydrophobicContact CD1-CD1 4.14Å; L210-I218 HydrophobicContact CD2-CG2 3.82Å; L210-I218 HydrophobicContact CG-CG2 4.38Å; I218-H222 HydrophobicContact CG2-CB 4.13Å; I218-V223 HydrophobicContact CG2-CG2 3.72Å | ||
| 219 | E | 65.6 | Low | 64.8 | Low | 90 Ų | 90 | 79 Ų | 79 | 42% | 0.421 | 41% | 0.407 | S | S | . | . | trans | -64.9 | 153.9 | 171 | -57.9 | -170.4 | 171.6 | 0 | 0 | 112 | K217 N221 H222 V223 E252 | K217-E219 PolarHBondContact O-N 3.45Å; E219-N221 PolarHBondContact O-N 2.81Å; E219-N221 PolarHBondContact OE2-ND2 3.34Å; E219-H222 WeakPolarHBondContact O-CA 3.34Å; E219-H222 VanDerWaalsContact O-CB 3.3Å; E219-H222 WeakPolarHBondContact O-CB 3.27Å; E219-H222 PolarHBondContact O-N 3.13Å; E219-V223 PolarHBondContact O-N 3.47Å; E219-E252 WeakPolarHBondContact CA-OE1 3.46Å | ||
| 220 | L | 65.8 | Low | 64.7 | Low | 52 Ų | 52 | 79 Ų | 79 | 27% | 0.272 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -54.7 | -39.6 | 178.3 | -174.8 | 51.8 | 0 | 0 | 0 | 110.9 | H222 V223 L224 I249 E252 | L220-H222 PolarHBondContact O-N 3.3Å; L220-V223 PolarHBondContact O-N 3.2Å; L220-V223 VanDerWaalsContact O-N 3.14Å; L220-L224 HydrophobicContact CD1-CG 4.49Å; L220-L224 HydrophobicContact CG-CD1 4.16Å; L220-L224 HydrophobicContact CG-CG 4.49Å; L220-L224 WeakPolarHBondContact O-CG 3.5Å; L220-L224 PolarHBondContact O-N 3.45Å; L220-I249 HydrophobicContact CD1-CB 4.03Å; L220-I249 HydrophobicContact CD1-CD1 4.08Å; L220-I249 HydrophobicContact CD1-CG1 3.52Å; L220-I249 HydrophobicContact CD1-CG2 3.63Å; L220-E252 WeakPolarHBondContact CA-OE2 3.4Å; L220-E252 WeakPolarHBondContact CB-OE1 3.4Å; L220-E252 WeakPolarHBondContact CB-OE2 3.29Å; L220-E252 PolarHBondContact N-OE1 2.88Å; L220-E252 PolarHBondContact N-OE2 3.26Å |
| 221 | N | 66.7 | Low | 64.9 | Low | 100 Ų | 100 | 80.5 Ų | 80.5 | 54% | 0.535 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -57.3 | -37.5 | 178 | -60.8 | -44 | 0 | 0 | 0 | 110.8 | E219 S225 | E219-N221 PolarHBondContact O-N 2.81Å; E219-N221 PolarHBondContact OE2-ND2 3.34Å; N221-S225 WeakPolarHBondContact O-CB 3.4Å; N221-S225 PolarHBondContact O-N 2.94Å; N221-S225 PolarHBondContact O-OG 2.85Å |
| 222 | H | 62.4 | Low | 64.8 | Low | 26 Ų | 26 | 83.4 Ų | 83.4 | 12% | 0.12 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -74.2 | -38 | 177.8 | -59.8 | -58 | 0 | 0 | 0 | 112.2 | V209 L210 I218 E219 L220 S225 V226 | V209-H222 PolarHBondContact O-ND1 3.22Å; L210-H222 HydrophobicContact CD2-CB 4.01Å; L210-H222 PolarHBondContact O-CD2 3.47Å; L210-H222 VanDerWaalsContact O-CD2 3.24Å; I218-H222 HydrophobicContact CG2-CB 4.13Å; E219-H222 WeakPolarHBondContact O-CA 3.34Å; E219-H222 VanDerWaalsContact O-CB 3.3Å; E219-H222 WeakPolarHBondContact O-CB 3.27Å; E219-H222 PolarHBondContact O-N 3.13Å; L220-H222 PolarHBondContact O-N 3.3Å; H222-S225 WeakPolarHBondContact O-CB 3.35Å; H222-S225 PolarHBondContact O-N 3.37Å; H222-V226 PolarHBondContact O-N 3.38Å |
| 223 | V | 65.2 | Low | 64.9 | Low | 4 Ų | 4 | 84 Ų | 84 | 2% | 0.024 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 174.6 | -176.4 | 0 | 0 | 0 | 0 | 111.1 | I218 E219 L220 V226 I227 V245 M248 I249 | I218-V223 HydrophobicContact CG2-CG2 3.72Å; E219-V223 PolarHBondContact O-N 3.47Å; L220-V223 PolarHBondContact O-N 3.2Å; L220-V223 VanDerWaalsContact O-N 3.14Å; V223-V226 PolarHBondContact O-N 2.97Å; V223-I227 PolarHBondContact O-N 3.3Å; V223-V245 HydrophobicContact CG1-CG1 3.58Å; V223-M248 HydrophobicContact CB-CE 4.2Å; V223-M248 HydrophobicContact CG1-CE 3.54Å; V223-M248 HydrophobicContact CG2-CE 3.58Å; V223-I249 HydrophobicContact CG1-CG1 4.32Å |
| 224 | L | 67.8 | Low | 64.4 | Low | 88 Ų | 88 | 86.3 Ų | 86.3 | 46% | 0.461 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 174.6 | -72.9 | 171.4 | 0 | 0 | 0 | 111.8 | L220 V226 I227 E228 | L220-L224 HydrophobicContact CD1-CG 4.49Å; L220-L224 HydrophobicContact CG-CD1 4.16Å; L220-L224 HydrophobicContact CG-CG 4.49Å; L220-L224 WeakPolarHBondContact O-CG 3.5Å; L220-L224 PolarHBondContact O-N 3.45Å; L224-V226 VanDerWaalsContact C-N 3.27Å; L224-V226 PolarHBondContact O-N 3.38Å; L224-I227 HydrophobicContact CD2-CD1 4.26Å; L224-I227 WeakPolarHBondContact O-CB 3.36Å; L224-I227 PolarHBondContact O-N 3.42Å; L224-I227 VanDerWaalsContact O-N 3.08Å; L224-E228 PolarHBondContact O-N 2.94Å |
| 225 | S | 65.5 | Low | 64.6 | Low | 51 Ų | 51 | 80 Ų | 80 | 36% | 0.357 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -58.8 | -39.2 | 175.1 | -59.3 | 0 | 0 | 0 | 0 | 111.9 | N221 H222 E228 L229 | N221-S225 WeakPolarHBondContact O-CB 3.4Å; N221-S225 PolarHBondContact O-N 2.94Å; N221-S225 PolarHBondContact O-OG 2.85Å; H222-S225 WeakPolarHBondContact O-CB 3.35Å; H222-S225 PolarHBondContact O-N 3.37Å; S225-E228 PolarHBondContact O-N 2.88Å; S225-L229 WeakPolarHBondContact O-CB 3.2Å; S225-L229 WeakPolarHBondContact O-CG 3.05Å; S225-L229 PolarHBondContact O-N 3.38Å |
| 226 | V | 63.6 | Low | 64.1 | Low | 47 Ų | 47 | 85.9 Ų | 85.9 | 29% | 0.285 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.1 | -40.4 | 174.1 | 171.6 | 0 | 0 | 0 | 0 | 111.6 | V209 L210 H222 V223 L224 E228 L229 L230 | V209-V226 HydrophobicContact CG1-CG2 4.26Å; L210-V226 HydrophobicContact CD2-CB 4.38Å; L210-V226 HydrophobicContact CD2-CG2 3.43Å; L210-V226 VanDerWaalsContact CD2-CG2 3.43Å; L210-V226 HydrophobicContact CG-CG2 4.03Å; H222-V226 PolarHBondContact O-N 3.38Å; V223-V226 PolarHBondContact O-N 2.97Å; L224-V226 VanDerWaalsContact C-N 3.27Å; L224-V226 PolarHBondContact O-N 3.38Å; V226-E228 VanDerWaalsContact C-N 3.31Å; V226-E228 PolarHBondContact O-N 3.43Å; V226-L229 PolarHBondContact O-N 2.92Å; V226-L230 WeakPolarHBondContact O-CB 3.31Å; V226-L230 PolarHBondContact O-N 2.91Å |
| 227 | I | 65.9 | Low | 64.1 | Low | 66 Ų | 66 | 85.9 Ų | 85.9 | 34% | 0.338 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.7 | -42.3 | 175.1 | -67 | 162 | 0 | 0 | 0 | 110.9 | V223 L224 L230 G231 V245 | V223-I227 PolarHBondContact O-N 3.3Å; L224-I227 HydrophobicContact CD2-CD1 4.26Å; L224-I227 WeakPolarHBondContact O-CB 3.36Å; L224-I227 PolarHBondContact O-N 3.42Å; L224-I227 VanDerWaalsContact O-N 3.08Å; I227-L230 PolarHBondContact O-N 2.99Å; I227-G231 PolarHBondContact O-N 2.69Å; I227-V245 HydrophobicContact CD1-CG1 3.59Å; I227-V245 HydrophobicContact CG1-CG1 4Å |
| 228 | E | 69.9 | Low | 64.2 | Low | 153 Ų | 153 | 81.6 Ų | 81.6 | 72% | 0.715 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -65.5 | -46.8 | 178.9 | -172.1 | 172.6 | -170.5 | 0 | 0 | 111.6 | L224 S225 V226 L230 G231 S232 | L224-E228 PolarHBondContact O-N 2.94Å; S225-E228 PolarHBondContact O-N 2.88Å; V226-E228 VanDerWaalsContact C-N 3.31Å; V226-E228 PolarHBondContact O-N 3.43Å; E228-L230 VanDerWaalsContact C-N 3.31Å; E228-L230 PolarHBondContact O-N 3.14Å; E228-G231 PolarHBondContact O-N 2.86Å; E228-S232 WeakPolarHBondContact O-CB 3.48Å; E228-S232 PolarHBondContact O-N 2.86Å |
| 229 | L | 63.9 | Low | 64.6 | Low | 99 Ų | 99 | 83.4 Ų | 83.4 | 52% | 0.518 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -58.9 | -44.5 | 174.4 | -73.7 | 170.7 | 0 | 0 | 0 | 111.3 | V209 S225 V226 G231 S232 E233 | V209-L229 HydrophobicContact CG1-CD1 4.35Å; S225-L229 WeakPolarHBondContact O-CB 3.2Å; S225-L229 WeakPolarHBondContact O-CG 3.05Å; S225-L229 PolarHBondContact O-N 3.38Å; V226-L229 PolarHBondContact O-N 2.92Å; L229-G231 PolarHBondContact O-N 3.4Å; L229-S232 PolarHBondContact O-N 3.22Å; L229-S232 PolarHBondContact O-OG 3.02Å; L229-E233 PolarHBondContact O-N 2.95Å; L229-E233 VanDerWaalsContact O-N 3.12Å |
| 230 | L | 62.1 | Low | 64.8 | Low | 51 Ų | 51 | 86.5 Ų | 86.5 | 27% | 0.267 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -70.7 | -33 | -177.7 | -155.7 | 58.2 | 0 | 0 | 0 | 112.2 | V226 I227 E228 V235 L237 | V226-L230 WeakPolarHBondContact O-CB 3.31Å; V226-L230 PolarHBondContact O-N 2.91Å; I227-L230 PolarHBondContact O-N 2.99Å; E228-L230 VanDerWaalsContact C-N 3.31Å; E228-L230 PolarHBondContact O-N 3.14Å; L230-V235 HydrophobicContact CD1-CB 3.63Å; L230-V235 HydrophobicContact CD1-CG1 3.78Å; L230-V235 HydrophobicContact CD1-CG2 3.53Å; L230-V235 HydrophobicContact CG-CB 3.8Å; L230-V235 HydrophobicContact CG-CG1 4.04Å; L230-V235 HydrophobicContact CG-CG2 4.22Å; L230-V235 WeakPolarHBondContact O-CB 3.49Å; L230-V235 PolarHBondContact O-N 3.34Å; L230-L237 HydrophobicContact CD2-CD1 3.87Å; L230-L237 HydrophobicContact CD2-CD2 3.38Å; L230-L237 HydrophobicContact CD2-CG 4.1Å; L230-L237 HydrophobicContact CG-CD1 4.3Å; L230-L237 HydrophobicContact CG-CD2 3.97Å; L230-L237 HydrophobicContact CG-CG 4.4Å |
| 231 | G | 64.3 | Low | 64.6 | Low | 52 Ų | 52 | 88.6 Ų | 88.6 | 54% | 0.536 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.7 | -39.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | I227 E228 L229 E233 N234 | I227-G231 PolarHBondContact O-N 2.69Å; E228-G231 PolarHBondContact O-N 2.86Å; L229-G231 PolarHBondContact O-N 3.4Å; G231-E233 VanDerWaalsContact C-N 3.33Å; G231-E233 PolarHBondContact O-N 3.43Å; G231-N234 PolarHBondContact O-N 3.17Å |
| 232 | S | 65.1 | Low | 64.5 | Low | 89 Ų | 89 | 88.4 Ų | 88.4 | 62% | 0.622 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -67 | -32.7 | 178.4 | 78.2 | 0 | 0 | 0 | 0 | 113 | E228 L229 N234 | E228-S232 WeakPolarHBondContact O-CB 3.48Å; E228-S232 PolarHBondContact O-N 2.86Å; L229-S232 PolarHBondContact O-N 3.22Å; L229-S232 PolarHBondContact O-OG 3.02Å; S232-N234 VanDerWaalsContact C-N 3.25Å; S232-N234 PolarHBondContact O-N 2.72Å |
| 233 | E | 64 | Low | 64.7 | Low | 151 Ų | 151 | 89.8 Ų | 89.8 | 71% | 0.706 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | 12.3 | -178.1 | -158.8 | 171.9 | -164.2 | 0 | 0 | 113.2 | L229 G231 V235 | L229-E233 PolarHBondContact O-N 2.95Å; L229-E233 VanDerWaalsContact O-N 3.12Å; G231-E233 VanDerWaalsContact C-N 3.33Å; G231-E233 PolarHBondContact O-N 3.43Å; E233-V235 HydrophobicContact CB-CG2 4.17Å; E233-V235 PolarHBondContact O-N 3.4Å |
| 234 | N | 56.8 | Low | 64.5 | Low | 147 Ų | 147 | 94.5 Ų | 94.5 | 79% | 0.786 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.2 | 35.5 | -177.4 | -73.9 | -55.6 | 0 | 0 | 0 | 113.4 | G231 S232 K236 | G231-N234 PolarHBondContact O-N 3.17Å; S232-N234 VanDerWaalsContact C-N 3.25Å; S232-N234 PolarHBondContact O-N 2.72Å; N234-K236 PolarHBondContact O-N 3.19Å |
| 235 | V | 60.2 | Low | 64.3 | Low | 62 Ų | 62 | 92.1 Ų | 92.1 | 38% | 0.376 | 50% | 0.501 | S | S | . | . | trans | -77.3 | 119.3 | 176.7 | -178.7 | 0 | 0 | 0 | 0 | 109.3 | L230 E233 L237 | L230-V235 HydrophobicContact CD1-CB 3.63Å; L230-V235 HydrophobicContact CD1-CG1 3.78Å; L230-V235 HydrophobicContact CD1-CG2 3.53Å; L230-V235 HydrophobicContact CG-CB 3.8Å; L230-V235 HydrophobicContact CG-CG1 4.04Å; L230-V235 HydrophobicContact CG-CG2 4.22Å; L230-V235 WeakPolarHBondContact O-CB 3.49Å; L230-V235 PolarHBondContact O-N 3.34Å; E233-V235 HydrophobicContact CB-CG2 4.17Å; E233-V235 PolarHBondContact O-N 3.4Å; V235-L237 HydrophobicContact CG1-CD2 4.09Å; V235-L237 PolarHBondContact O-N 2.73Å | ||
| 236 | K | 63.3 | Low | 64.3 | Low | 202 Ų | 202 | 94.4 Ų | 94.4 | 88% | 0.878 | 51% | 0.508 | S | S | * | . | trans | -73.3 | 96.2 | 174.2 | -68.8 | -179.3 | -179.4 | 177.9 | 0 | 109.2 | N234 | N234-K236 PolarHBondContact O-N 3.19Š| ||
| 237 | L | 61 | Low | 64.3 | Low | 62 Ų | 62 | 97.5 Ų | 97.5 | 33% | 0.325 | 52% | 0.52 | S | S | . | . | trans | -77.7 | 128.9 | 171.5 | -58.6 | 171.3 | 0 | 0 | 0 | 110.2 | L230 V235 E241 I242 | L230-L237 HydrophobicContact CD2-CD1 3.87Å; L230-L237 HydrophobicContact CD2-CD2 3.38Å; L230-L237 HydrophobicContact CD2-CG 4.1Å; L230-L237 HydrophobicContact CG-CD1 4.3Å; L230-L237 HydrophobicContact CG-CD2 3.97Å; L230-L237 HydrophobicContact CG-CG 4.4Å; V235-L237 HydrophobicContact CG1-CD2 4.09Å; V235-L237 PolarHBondContact O-N 2.73Å; L237-E241 HydrophobicContact CD2-CB 4.45Å; L237-I242 HydrophobicContact CB-CD1 4.35Å; L237-I242 HydrophobicContact CB-CG1 3.99Å | ||
| 238 | S | 66.2 | Low | 64.1 | Low | 57 Ų | 57 | 98.2 Ų | 98.2 | 40% | 0.399 | 52% | 0.523 | S | S | . | . | trans | -70.9 | 152.4 | 168.9 | 68.8 | 0 | 0 | 0 | 0 | 110.3 | K240 E241 I242 | S238-K240 PolarHBondContact O-N 2.71Å; S238-E241 VanDerWaalsContact CB-OE2 3.3Å; S238-E241 WeakPolarHBondContact CB-OE2 3.46Å; S238-E241 PolarHBondContact N-OE2 3.5Å; S238-E241 PolarHBondContact O-N 3.27Å; S238-E241 VanDerWaalsContact OG-CD 3.26Å; S238-E241 WeakPolarHBondContact OG-CG 3.27Å; S238-E241 PolarHBondContact OG-N 2.73Å; S238-E241 PolarHBondContact OG-OE2 3.34Å; S238-I242 PolarHBondContact O-N 2.94Å; S238-I242 VanDerWaalsContact O-N 3.16Å | ||
| 239 | S | 71.7 | Confident | 63.6 | Low | 103 Ų | 103 | 92.4 Ų | 92.4 | 72% | 0.72 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -53.5 | -28 | 177.4 | 173.7 | 0 | 0 | 0 | 0 | 113.1 | A243 | S239-A243 WeakPolarHBondContact O-CB 3.45Å; S239-A243 PolarHBondContact O-N 3.16Å |
| 240 | K | 68.8 | Low | 63.4 | Low | 155 Ų | 155 | 92 Ų | 92 | 67% | 0.674 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -73.7 | -35.7 | 177 | -170.5 | 176.3 | -177.5 | 176.3 | 0 | 113.2 | S238 R244 | S238-K240 PolarHBondContact O-N 2.71Å; K240-R244 PolarHBondContact O-N 2.86Å; K240-R244 VanDerWaalsContact O-N 3.11Å |
| 241 | E | 61.2 | Low | 63.2 | Low | 96 Ų | 96 | 94 Ų | 94 | 45% | 0.449 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69.3 | -40.7 | 175.5 | -72.2 | 154.6 | 151 | 0 | 0 | 110.1 | L237 S238 R244 V245 | L237-E241 HydrophobicContact CD2-CB 4.45Å; S238-E241 VanDerWaalsContact CB-OE2 3.3Å; S238-E241 WeakPolarHBondContact CB-OE2 3.46Å; S238-E241 PolarHBondContact N-OE2 3.5Å; S238-E241 PolarHBondContact O-N 3.27Å; S238-E241 VanDerWaalsContact OG-CD 3.26Å; S238-E241 WeakPolarHBondContact OG-CG 3.27Å; S238-E241 PolarHBondContact OG-N 2.73Å; S238-E241 PolarHBondContact OG-OE2 3.34Å; E241-R244 PolarHBondContact O-N 2.84Å; E241-V245 WeakPolarHBondContact O-CG2 3.05Å; E241-V245 PolarHBondContact O-N 3.47Å |
| 242 | I | 66 | Low | 62.9 | Low | 95 Ų | 95 | 93.4 Ų | 93.4 | 49% | 0.487 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.1 | -45.8 | 173.4 | -60.1 | 172.4 | 0 | 0 | 0 | 110.8 | L237 S238 R244 V245 L246 | L237-I242 HydrophobicContact CB-CD1 4.35Å; L237-I242 HydrophobicContact CB-CG1 3.99Å; S238-I242 PolarHBondContact O-N 2.94Å; S238-I242 VanDerWaalsContact O-N 3.16Å; I242-R244 VanDerWaalsContact C-N 3.3Å; I242-R244 PolarHBondContact O-N 2.97Å; I242-V245 PolarHBondContact O-N 3.28Å; I242-L246 PolarHBondContact O-N 3.22Å |
| 243 | A | 65.9 | Low | 62.2 | Low | 56 Ų | 56 | 94.9 Ų | 94.9 | 46% | 0.463 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.3 | -36.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | S239 L246 E247 | S239-A243 WeakPolarHBondContact O-CB 3.45Å; S239-A243 PolarHBondContact O-N 3.16Å; A243-L246 PolarHBondContact O-N 3.34Å; A243-E247 PolarHBondContact O-N 3.47Å |
| 244 | R | 62.2 | Low | 61.5 | Low | 102 Ų | 102 | 93.1 Ų | 93.1 | 39% | 0.385 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -68.7 | -38.7 | 174.6 | -92.4 | -168.8 | -177.3 | 169.3 | -1.1 | 113.1 | K240 E241 I242 L246 E247 M248 | K240-R244 PolarHBondContact O-N 2.86Å; K240-R244 VanDerWaalsContact O-N 3.11Å; E241-R244 PolarHBondContact O-N 2.84Å; I242-R244 VanDerWaalsContact C-N 3.3Å; I242-R244 PolarHBondContact O-N 2.97Å; R244-L246 VanDerWaalsContact C-N 3.27Å; R244-E247 PolarHBondContact O-N 3.01Å; R244-M248 PolarHBondContact O-N 2.74Å |
| 245 | V | 62.1 | Low | 61.2 | Low | 38 Ų | 38 | 89.2 Ų | 89.2 | 23% | 0.23 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 176.2 | 179.3 | 0 | 0 | 0 | 0 | 108.9 | V223 I227 E241 I242 E247 M248 I249 | V223-V245 HydrophobicContact CG1-CG1 3.58Å; I227-V245 HydrophobicContact CD1-CG1 3.59Å; I227-V245 HydrophobicContact CG1-CG1 4Å; E241-V245 WeakPolarHBondContact O-CG2 3.05Å; E241-V245 PolarHBondContact O-N 3.47Å; I242-V245 PolarHBondContact O-N 3.28Å; V245-E247 PolarHBondContact O-N 2.92Å; V245-M248 WeakPolarHBondContact O-CB 3.34Å; V245-M248 PolarHBondContact O-N 2.66Å; V245-I249 HydrophobicContact CG1-CD1 4.36Å; V245-I249 VanDerWaalsContact O-CG1 3.31Å; V245-I249 WeakPolarHBondContact O-CG1 3.43Å; V245-I249 PolarHBondContact O-N 2.78Å; V245-I249 VanDerWaalsContact O-N 3.07Å |
| 246 | L | 65.6 | Low | 60.8 | Low | 99 Ų | 99 | 93.2 Ų | 93.2 | 52% | 0.518 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62 | -41.7 | 174.2 | -164.5 | 67.8 | 0 | 0 | 0 | 112.7 | I242 A243 R244 M248 I249 D250 | I242-L246 PolarHBondContact O-N 3.22Å; A243-L246 PolarHBondContact O-N 3.34Å; R244-L246 VanDerWaalsContact C-N 3.27Å; L246-M248 VanDerWaalsContact C-N 3.28Å; L246-M248 PolarHBondContact O-N 2.89Å; L246-I249 WeakPolarHBondContact O-CB 3.13Å; L246-I249 PolarHBondContact O-N 2.73Å; L246-I249 VanDerWaalsContact O-N 3.16Å; L246-D250 PolarHBondContact O-N 3.17Å |
| 247 | E | 64.5 | Low | 59.9 | Low | 112 Ų | 112 | 90.9 Ų | 90.9 | 52% | 0.523 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.8 | -35.3 | 174.4 | -175.9 | -176.8 | -172.7 | 0 | 0 | 112.4 | A243 R244 V245 D250 N251 | A243-E247 PolarHBondContact O-N 3.47Å; R244-E247 PolarHBondContact O-N 3.01Å; V245-E247 PolarHBondContact O-N 2.92Å; E247-D250 PolarHBondContact O-N 3.41Å; E247-N251 WeakPolarHBondContact O-CB 3.42Å; E247-N251 VanDerWaalsContact O-CG 3.26Å; E247-N251 PolarHBondContact O-N 2.91Å; E247-N251 PolarHBondContact O-ND2 3.27Å |
| 248 | M | 60.7 | Low | 59.1 | Low | 82 Ų | 82 | 94.1 Ų | 94.1 | 40% | 0.404 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -67.7 | -37.7 | 175.5 | -167 | 166.5 | 60.7 | 0 | 0 | 111.6 | V223 R244 V245 L246 E252 | V223-M248 HydrophobicContact CB-CE 4.2Å; V223-M248 HydrophobicContact CG1-CE 3.54Å; V223-M248 HydrophobicContact CG2-CE 3.58Å; R244-M248 PolarHBondContact O-N 2.74Å; V245-M248 WeakPolarHBondContact O-CB 3.34Å; V245-M248 PolarHBondContact O-N 2.66Å; L246-M248 VanDerWaalsContact C-N 3.28Å; L246-M248 PolarHBondContact O-N 2.89Å; M248-E252 PolarHBondContact O-N 3.04Å; M248-E252 VanDerWaalsContact O-N 3.17Å |
| 249 | I | 60.3 | Low | 58 | Low | 31 Ų | 31 | 95.3 Ų | 95.3 | 16% | 0.159 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -64.7 | -45.5 | 173.1 | -63 | 170.9 | 0 | 0 | 0 | 110.8 | L220 V223 V245 L246 N251 E252 H253 | L220-I249 HydrophobicContact CD1-CB 4.03Å; L220-I249 HydrophobicContact CD1-CD1 4.08Å; L220-I249 HydrophobicContact CD1-CG1 3.52Å; L220-I249 HydrophobicContact CD1-CG2 3.63Å; V223-I249 HydrophobicContact CG1-CG1 4.32Å; V245-I249 HydrophobicContact CG1-CD1 4.36Å; V245-I249 VanDerWaalsContact O-CG1 3.31Å; V245-I249 WeakPolarHBondContact O-CG1 3.43Å; V245-I249 PolarHBondContact O-N 2.78Å; V245-I249 VanDerWaalsContact O-N 3.07Å; L246-I249 WeakPolarHBondContact O-CB 3.13Å; L246-I249 PolarHBondContact O-N 2.73Å; L246-I249 VanDerWaalsContact O-N 3.16Å; I249-N251 VanDerWaalsContact C-N 3.33Å; I249-N251 PolarHBondContact O-N 3.02Å; I249-E252 WeakPolarHBondContact O-CB 3.32Å; I249-E252 PolarHBondContact O-N 2.93Å; I249-H253 PolarHBondContact O-N 3.48Å |
| 250 | D | 58.9 | Low | 57 | Low | 90 Ų | 90 | 95.4 Ų | 95.4 | 48% | 0.481 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.1 | -38.7 | 179.3 | -72.1 | -19.3 | 0 | 0 | 0 | 111.7 | L246 E247 E252 H253 L254 | L246-D250 PolarHBondContact O-N 3.17Å; E247-D250 PolarHBondContact O-N 3.41Å; D250-E252 VanDerWaalsContact C-N 3.31Å; D250-E252 PolarHBondContact O-N 3.27Å; D250-H253 PolarHBondContact O-N 3.13Å; D250-L254 WeakPolarHBondContact O-CG 3.33Å; D250-L254 PolarHBondContact O-N 3.46Å; D250-L254 VanDerWaalsContact O-N 3.13Å |
| 251 | N | 59.5 | Low | 56.2 | Low | 94 Ų | 94 | 93.9 Ų | 93.9 | 50% | 0.503 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.1 | -32.9 | 175.7 | -75.7 | -29.2 | 0 | 0 | 0 | 112.7 | E247 I249 A255 | E247-N251 WeakPolarHBondContact O-CB 3.42Å; E247-N251 VanDerWaalsContact O-CG 3.26Å; E247-N251 PolarHBondContact O-N 2.91Å; E247-N251 PolarHBondContact O-ND2 3.27Å; I249-N251 VanDerWaalsContact C-N 3.33Å; I249-N251 PolarHBondContact O-N 3.02Å; N251-A255 PolarHBondContact O-N 2.84Å |
| 252 | E | 56.6 | Low | 55.6 | Low | 39 Ų | 39 | 95.1 Ų | 95.1 | 18% | 0.182 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -69.9 | -42.1 | 173 | -177.6 | -179.6 | -171.7 | 0 | 0 | 111.6 | E219 L220 M248 I249 D250 L254 A255 E256 | E219-E252 WeakPolarHBondContact CA-OE1 3.46Å; L220-E252 WeakPolarHBondContact CA-OE2 3.4Å; L220-E252 WeakPolarHBondContact CB-OE1 3.4Å; L220-E252 WeakPolarHBondContact CB-OE2 3.29Å; L220-E252 PolarHBondContact N-OE1 2.88Å; L220-E252 PolarHBondContact N-OE2 3.26Å; M248-E252 PolarHBondContact O-N 3.04Å; M248-E252 VanDerWaalsContact O-N 3.17Å; I249-E252 WeakPolarHBondContact O-CB 3.32Å; I249-E252 PolarHBondContact O-N 2.93Å; D250-E252 VanDerWaalsContact C-N 3.31Å; D250-E252 PolarHBondContact O-N 3.27Å; E252-L254 PolarHBondContact O-N 2.83Å; E252-A255 WeakPolarHBondContact O-CA 3.39Å; E252-A255 WeakPolarHBondContact O-CB 3.5Å; E252-A255 PolarHBondContact O-N 3.49Å; E252-E256 PolarHBondContact O-N 3.04Å |
| 253 | H | 50.4 | Low | 54.8 | Low | 119 Ų | 119 | 97.5 Ų | 97.5 | 55% | 0.551 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.1 | -32.2 | 177.1 | -133 | -51.8 | 0 | 0 | 0 | 112.2 | I249 D250 A255 | I249-H253 PolarHBondContact O-N 3.48Å; D250-H253 PolarHBondContact O-N 3.13Å; H253-A255 VanDerWaalsContact C-N 3.35Å |
| 254 | L | 50.5 | Low | 54.1 | Low | 114 Ų | 114 | 101.6 Ų | 101.6 | 60% | 0.597 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -71.9 | -24.9 | 172.4 | -70.1 | 168.3 | 0 | 0 | 0 | 113.4 | D250 E252 | D250-L254 WeakPolarHBondContact O-CG 3.33Å; D250-L254 PolarHBondContact O-N 3.46Å; D250-L254 VanDerWaalsContact O-N 3.13Å; E252-L254 PolarHBondContact O-N 2.83Å |
| 255 | A | 50.1 | Low | 53.5 | Low | 65 Ų | 65 | 99.7 Ų | 99.7 | 54% | 0.537 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -76.5 | -27.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | N251 E252 H253 E257 | N251-A255 PolarHBondContact O-N 2.84Å; E252-A255 WeakPolarHBondContact O-CA 3.39Å; E252-A255 WeakPolarHBondContact O-CB 3.5Å; E252-A255 PolarHBondContact O-N 3.49Å; H253-A255 VanDerWaalsContact C-N 3.35Å; A255-E257 VanDerWaalsContact C-N 3.33Å |
| 256 | E | 51.9 | Low | 52.7 | Low | 146 Ų | 146 | 102.6 Ų | 102.6 | 68% | 0.682 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -73.7 | -20.5 | 175.9 | -68.8 | -165.8 | 162.2 | 0 | 0 | 113.6 | E252 I258 | E252-E256 PolarHBondContact O-N 3.04Å; E256-I258 PolarHBondContact O-N 3.13Å; E256-I258 VanDerWaalsContact O-N 3.14Å |
| 257 | E | 44.8 | Very low | 52 | Low | 153 Ų | 153 | 105.7 Ų | 105.7 | 72% | 0.715 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | 10.2 | -178.5 | -92.6 | -166.8 | 177.8 | 0 | 0 | 114.9 | A255 P259 | A255-E257 VanDerWaalsContact C-N 3.33Å; E257-P259 WeakPolarHBondContact O-CD 3.49Å |
| 258 | I | 43 | Very low | 51.4 | Low | 131 Ų | 131 | 106.4 Ų | 106.4 | 67% | 0.672 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -76.6 | 104.5 | 169.4 | -53.4 | 178.5 | 0 | 0 | 0 | 108 | E256 T260 | E256-I258 PolarHBondContact O-N 3.13Å; E256-I258 VanDerWaalsContact O-N 3.14Å; I258-T260 PolarHBondContact O-N 2.88Å; I258-T260 VanDerWaalsContact O-N 3.16Å |
| 259 | P | 42.9 | Very low | 50.8 | Low | 81 Ų | 81 | 111.4 Ų | 111.4 | 53% | 0.526 | 57% | 0.571 | S | S | . | * | trans | -69 | 121 | -175.6 | -9.4 | 28 | 0 | 0 | 0 | 108 | E257 E261 D262 | E257-P259 WeakPolarHBondContact O-CD 3.49Å; P259-E261 PolarHBondContact O-N 2.8Å; P259-D262 PolarHBondContact O-N 3.24Å | ||
| 260 | T | 52.2 | Low | 50.4 | Low | 105 Ų | 105 | 116.4 Ų | 116.4 | 64% | 0.644 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | 1.2 | 178.7 | 50.6 | 0 | 0 | 0 | 0 | 114.6 | I258 | I258-T260 PolarHBondContact O-N 2.88Å; I258-T260 VanDerWaalsContact O-N 3.16Å |
| 261 | E | 52 | Low | 50 | Low | 123 Ų | 123 | 119.8 Ų | 119.8 | 58% | 0.575 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | -29.1 | 174.7 | -73.2 | -73.7 | 106.2 | 0 | 0 | 112.6 | P259 L263 K264 | P259-E261 PolarHBondContact O-N 2.8Å; E261-L263 PolarHBondContact O-N 2.96Å; E261-K264 PolarHBondContact O-N 2.85Å; E261-K264 VanDerWaalsContact O-N 3.17Å; E261-K264 IonicContact OE1-NZ 3.18Å; E261-K264 PolarHBondContact OE1-NZ 2.87Å |
| 262 | D | 47.3 | Very low | 49.6 | Very low | 123 Ų | 123 | 119.4 Ų | 119.4 | 66% | 0.658 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -70.9 | -19.3 | 178.2 | -75.2 | -25.3 | 0 | 0 | 0 | 112.9 | P259 K264 | P259-D262 PolarHBondContact O-N 3.24Å; D262-K264 VanDerWaalsContact C-N 3.33Å; D262-K264 PolarHBondContact O-N 3.47Å |
| 263 | L | 50 | Low | 49.1 | Very low | 145 Ų | 145 | 122 Ų | 122 | 76% | 0.759 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -78.4 | -13.5 | 174.9 | -72.1 | 171 | 0 | 0 | 0 | 113.7 | E261 | E261-L263 PolarHBondContact O-N 2.96Å |
| 264 | K | 51.3 | Low | 49.2 | Very low | 142 Ų | 142 | 122.1 Ų | 122.1 | 62% | 0.617 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -89.9 | -24 | 175.7 | -69 | 179 | -165.3 | 150.7 | 0 | 113.1 | E261 D262 D266 | E261-K264 PolarHBondContact O-N 2.85Å; E261-K264 VanDerWaalsContact O-N 3.17Å; E261-K264 IonicContact OE1-NZ 3.18Å; E261-K264 PolarHBondContact OE1-NZ 2.87Å; D262-K264 VanDerWaalsContact C-N 3.33Å; D262-K264 PolarHBondContact O-N 3.47Å; K264-D266 PolarHBondContact O-N 3.42Å |
| 265 | A | 49.8 | Very low | 49.2 | Very low | 61 Ų | 61 | 123.6 Ų | 123.6 | 50% | 0.504 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -67.3 | -36.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | K267 N268 | A265-K267 VanDerWaalsContact C-N 3.34Å; A265-K267 PolarHBondContact O-N 3.41Å; A265-N268 PolarHBondContact O-N 3.42Å |
| 266 | D | 45.4 | Very low | 49.2 | Very low | 100 Ų | 100 | 129 Ų | 129 | 54% | 0.535 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -76.4 | -19.1 | -177.2 | -96.3 | -17.8 | 0 | 0 | 0 | 114.3 | K264 N268 | K264-D266 PolarHBondContact O-N 3.42Å; D266-N268 VanDerWaalsContact C-N 3.29Å; D266-N268 PolarHBondContact O-N 3.5Å |
| 267 | K | 49.8 | Very low | 48.7 | Very low | 163 Ų | 163 | 127.1 Ų | 127.1 | 71% | 0.709 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -74.1 | -21.6 | 176.3 | -151.2 | 169.8 | -172.4 | 168.8 | 0 | 112.8 | A265 | A265-K267 VanDerWaalsContact C-N 3.34Å; A265-K267 PolarHBondContact O-N 3.41Å |
| 268 | N | 51.5 | Low | 48.6 | Very low | 127 Ų | 127 | 128.9 Ų | 128.9 | 68% | 0.679 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -92.2 | -25 | -179.8 | -124.1 | 33.6 | 0 | 0 | 0 | 113.9 | A265 D266 L270 | A265-N268 PolarHBondContact O-N 3.42Å; D266-N268 VanDerWaalsContact C-N 3.29Å; D266-N268 PolarHBondContact O-N 3.5Å; N268-L270 VanDerWaalsContact C-N 3.33Å |
| 269 | R | 48.3 | Very low | 48.6 | Very low | 188 Ų | 188 | 129.3 Ų | 129.3 | 71% | 0.709 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -71.4 | -26.9 | 174.3 | -79.8 | 179.7 | 73.2 | -150.7 | 6.1 | 113.3 | ||
| 270 | L | 51.6 | Low | 48.7 | Very low | 135 Ų | 135 | 132.1 Ų | 132.1 | 71% | 0.707 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -83 | -18 | 179.4 | -72.4 | 165 | 0 | 0 | 0 | 113.8 | N268 | N268-L270 VanDerWaalsContact C-N 3.33Å |
| 271 | K | 51.4 | Low | 48 | Very low | 162 Ų | 162 | 133 Ų | 133 | 70% | 0.704 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -82.3 | -29.3 | 175 | -80.7 | -170.4 | 176.7 | -175.5 | 0 | 113.9 | ||
| 272 | S | 51.2 | Low | 47.6 | Very low | 86 Ų | 86 | 140.8 Ų | 140.8 | 60% | 0.601 | 74% | 0.744 | S | S | * | * | H | α-helix | trans | -80 | -16.7 | -179.9 | 61.1 | 0 | 0 | 0 | 0 | 114.1 | V274 | S272-V274 PolarHBondContact O-N 3.49Å |
| 273 | S | 46.7 | Very low | 47.6 | Very low | 92 Ų | 92 | 141.7 Ų | 141.7 | 64% | 0.643 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | -8.1 | -179 | -164.3 | 0 | 0 | 0 | 0 | 114.6 | ||
| 274 | V | 51.5 | Low | 47.5 | Very low | 122 Ų | 122 | 141.5 Ų | 141.5 | 74% | 0.739 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -90.8 | -17.6 | 179.4 | 178 | 0 | 0 | 0 | 0 | 112.5 | S272 | S272-V274 PolarHBondContact O-N 3.49Š|
| 275 | D | 51 | Low | 47.2 | Very low | 146 Ų | 146 | 141.4 Ų | 141.4 | 78% | 0.781 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | 16.4 | -170.4 | -130.3 | -3.3 | 0 | 0 | 0 | 114.8 | ||
| 276 | H | 49 | Very low | 47.1 | Very low | 177 Ų | 177 | 146.2 Ų | 146.2 | 82% | 0.819 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.4 | 14.7 | -177.7 | -111.1 | 52.5 | 0 | 0 | 0 | 116.1 | ||
| 277 | S | 42.5 | Very low | 47.2 | Very low | 107 Ų | 107 | 149.1 Ų | 149.1 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -119.6 | 18.2 | -178.4 | -57.2 | 0 | 0 | 0 | 0 | 115.7 | ||
| 278 | Q | 42.3 | Very low | 47 | Very low | 190 Ų | 190 | 148.1 Ų | 148.1 | 89% | 0.888 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -127.7 | 42.9 | 176.2 | -69.6 | -141.6 | 56.9 | 0 | 0 | 114.9 | ||
| 279 | V | 42.9 | Very low | 46.7 | Very low | 140 Ų | 140 | 149.6 Ų | 149.6 | 85% | 0.848 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -150.2 | 68.3 | 163.8 | -167.5 | 0 | 0 | 0 | 0 | 111.7 | ||
| 280 | T | 45.2 | Very low | 46.6 | Very low | 141 Ų | 141 | 146.7 Ų | 146.7 | 87% | 0.865 | 80% | 0.804 | S | S | * | * | trans | -158.3 | 67.9 | 155.6 | 47.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 281 | S | 37.5 | Very low | 46.2 | Very low | 124 Ų | 124 | 147.7 Ų | 147.7 | 87% | 0.867 | 81% | 0.812 | S | S | * | * | trans | -147.4 | 78 | 159.9 | -85.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 282 | K | 42.8 | Very low | 45.7 | Very low | 285 Ų | 285 | 146.4 Ų | 146.4 | 100% | 1.239 | 82% | 0.822 | S | S | * | * | trans | -164.8 | 0 | 152.5 | -116.2 | 176.2 | -178.8 | 179.5 | 0 | 109.5 |
Retrieved 282 of 282 residues in 172.7 ms
(Link to these results)