| 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 | 51.4 | Low | 52.5 | Low | 239 Ų | 239 | 178.8 Ų | 178.8 | 100% | 1.177 | 87% | 0.873 | S | S | * | * | 0 | 172.2 | 0 | -73.4 | 176.1 | 75.9 | 0 | 0 | 109.6 | |||||
| 2 | L | 48 | Very low | 51.8 | Low | 159 Ų | 159 | 172 Ų | 172 | 83% | 0.832 | 87% | 0.867 | S | S | * | * | trans | -66 | 145.6 | -169.1 | -62.3 | 70.1 | 0 | 0 | 0 | 113.2 | ||||
| 3 | S | 49.2 | Very low | 51.6 | Low | 122 Ų | 122 | 164.8 Ų | 164.8 | 85% | 0.853 | 86% | 0.862 | S | S | * | * | -177.4 | 150.7 | 101.2 | -80.5 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 4 | R | 49.4 | Very low | 50.9 | Low | 247 Ų | 247 | 164.9 Ų | 164.9 | 93% | 0.932 | 86% | 0.864 | S | S | * | * | trans | -114.7 | 148.6 | -174.7 | -62.9 | 165 | 160.9 | 178.8 | -7.2 | 110.7 | ||||
| 5 | S | 57 | Low | 50.7 | Low | 110 Ų | 110 | 160.1 Ų | 160.1 | 77% | 0.769 | 85% | 0.85 | S | S | * | * | trans | -163 | 124.8 | 143.6 | -131.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 6 | R | 57.7 | Low | 50.5 | Low | 220 Ų | 220 | 159.8 Ų | 159.8 | 83% | 0.83 | 86% | 0.855 | S | S | * | * | 49.6 | 131.1 | 66.8 | -75.7 | -174.2 | 174.1 | -174.1 | -0.1 | 111.4 | |||||
| 7 | R | 53.8 | Low | 50.4 | Low | 224 Ų | 224 | 155.8 Ų | 155.8 | 85% | 0.845 | 84% | 0.838 | S | S | * | * | cis | -133.1 | 179.6 | -2.6 | -84.8 | 161.6 | 164.6 | 158.5 | -7.4 | 105.9 | ||||
| 8 | R | 58.1 | Low | 50.4 | Low | 226 Ų | 226 | 151 Ų | 151 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | cis | -153.7 | 171.1 | 10.5 | -149.5 | 174.4 | -176.8 | 161 | -1.5 | 107.7 | ||||
| 9 | K | 51.9 | Low | 50.3 | Low | 210 Ų | 210 | 155.5 Ų | 155.5 | 91% | 0.913 | 82% | 0.821 | S | S | * | * | trans | -128.6 | 129.9 | 151.2 | -109.8 | -176.2 | 177.1 | -177.9 | 0 | 107.7 | ||||
| 10 | G | 49.4 | Very low | 50.3 | Low | 74 Ų | 74 | 157.6 Ų | 157.6 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | trans | -110.5 | 113 | -174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 11 | T | 52.3 | Low | 50.2 | Low | 136 Ų | 136 | 155.2 Ų | 155.2 | 83% | 0.834 | 80% | 0.802 | S | S | * | * | trans | -17.8 | 129.3 | 162.4 | -53.2 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 12 | A | 43.9 | Very low | 50.1 | Low | 97 Ų | 97 | 152 Ų | 152 | 80% | 0.802 | 78% | 0.782 | S | S | * | * | trans | 32.6 | 136.8 | 138.1 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 13 | G | 48.8 | Very low | 50.1 | Low | 78 Ų | 78 | 151.5 Ų | 151.5 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -162 | 92.7 | 160.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 14 | N | 41.9 | Very low | 50.3 | Low | 167 Ų | 167 | 152 Ų | 152 | 89% | 0.893 | 77% | 0.766 | S | S | * | * | trans | -66.7 | 137.5 | 170.2 | -70.6 | -5.7 | 0 | 0 | 0 | 109.5 | ||||
| 15 | S | 47.8 | Very low | 50.4 | Low | 92 Ų | 92 | 143.1 Ų | 143.1 | 64% | 0.643 | 75% | 0.745 | S | S | * | * | trans | -161.5 | 118.9 | 135.6 | -154.5 | 0 | 0 | 0 | 0 | 111.8 | V17 | S15-V17 VanDerWaalsContact C-N 3.29Å; S15-V17 PolarHBondContact O-N 3.24Å; S15-V17 WeakPolarHBondContact OG-CB 3.45Å; S15-V17 WeakPolarHBondContact OG-CG2 3.34Å | ||
| 16 | V | 47 | Very low | 50.1 | Low | 155 Ų | 155 | 144.4 Ų | 144.4 | 94% | 0.939 | 74% | 0.739 | S | S | * | * | trans | -91.6 | 71.2 | 168.6 | 174.3 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 17 | V | 48.9 | Very low | 49.8 | Very low | 93 Ų | 93 | 137.4 Ų | 137.4 | 56% | 0.564 | 73% | 0.728 | S | S | * | * | trans | -155.9 | 122.9 | -176.6 | 174 | 0 | 0 | 0 | 0 | 105 | S15 | S15-V17 VanDerWaalsContact C-N 3.29Å; S15-V17 PolarHBondContact O-N 3.24Å; S15-V17 WeakPolarHBondContact OG-CB 3.45Å; S15-V17 WeakPolarHBondContact OG-CG2 3.34Å | ||
| 18 | T | 51.9 | Low | 49.7 | Very low | 69 Ų | 69 | 133.2 Ų | 133.2 | 42% | 0.423 | 72% | 0.722 | S | S | . | * | cis | -163.6 | 106.6 | 3.1 | 18.7 | 0 | 0 | 0 | 0 | 107.8 | R20 E21 | T18-R20 PolarHBondContact O-N 3.13Å; T18-R20 VanDerWaalsContact O-N 3.13Å; T18-E21 VanDerWaalsContact CB-OE2 3.29Å; T18-E21 WeakPolarHBondContact CB-OE2 3.29Å; T18-E21 HydrophobicContact CG2-CG 3.95Å; T18-E21 WeakPolarHBondContact CG2-OE2 3.48Å; T18-E21 PolarHBondContact OG1-OE2 3.3Å | ||
| 19 | Y | 47.1 | Very low | 49.5 | Very low | 236 Ų | 236 | 131.4 Ų | 131.4 | 93% | 0.925 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | -8.9 | 171.4 | -81.2 | -81.4 | 0 | 0 | 0 | 113.2 | ||
| 20 | R | 50.3 | Low | 49.5 | Very low | 198 Ų | 198 | 130.2 Ų | 130.2 | 75% | 0.747 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | -16.2 | -177.8 | -146.4 | 172.7 | -169.5 | 156.4 | 3.3 | 115 | T18 M24 | T18-R20 PolarHBondContact O-N 3.13Å; T18-R20 VanDerWaalsContact O-N 3.13Å; R20-M24 WeakPolarHBondContact O-CE 3.5Å |
| 21 | E | 48.7 | Very low | 49.5 | Very low | 108 Ų | 108 | 133.2 Ų | 133.2 | 51% | 0.505 | 71% | 0.709 | S | S | . | * | H | α-helix | trans | -83.5 | -28.3 | 172.5 | -75.3 | -178.3 | 117.8 | 0 | 0 | 111.9 | T18 E23 M24 A25 | T18-E21 VanDerWaalsContact CB-OE2 3.29Å; T18-E21 WeakPolarHBondContact CB-OE2 3.29Å; T18-E21 HydrophobicContact CG2-CG 3.95Å; T18-E21 WeakPolarHBondContact CG2-OE2 3.48Å; T18-E21 PolarHBondContact OG1-OE2 3.3Å; E21-E23 PolarHBondContact O-N 2.54Å; E21-M24 HydrophobicContact CG-CE 4.42Å; E21-M24 PolarHBondContact O-N 3.18Å; E21-A25 PolarHBondContact O-N 3.23Å |
| 22 | K | 49.6 | Very low | 49.4 | Very low | 171 Ų | 171 | 130.5 Ų | 130.5 | 74% | 0.743 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -67.2 | -19.1 | 177.4 | -139.8 | 178 | -175.7 | -174.2 | 0 | 113.4 | ||
| 23 | E | 48.5 | Very low | 49.8 | Very low | 149 Ų | 149 | 129.2 Ų | 129.2 | 70% | 0.696 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -89.7 | -27.1 | 176.2 | -155 | 177.2 | 172.5 | 0 | 0 | 112.4 | E21 | E21-E23 PolarHBondContact O-N 2.54Å |
| 24 | M | 52 | Low | 50 | Low | 132 Ų | 132 | 133 Ų | 133 | 65% | 0.65 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -80.7 | -22.4 | 175 | -69.1 | -172.7 | -72.3 | 0 | 0 | 113.2 | R20 E21 E26 | R20-M24 WeakPolarHBondContact O-CE 3.5Å; E21-M24 HydrophobicContact CG-CE 4.42Å; E21-M24 PolarHBondContact O-N 3.18Å; M24-E26 VanDerWaalsContact C-N 3.35Å |
| 25 | A | 53.1 | Low | 50.5 | Low | 60 Ų | 60 | 127.5 Ų | 127.5 | 50% | 0.496 | 68% | 0.677 | S | S | . | * | S | Bend | trans | -81.2 | -7.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | E21 | E21-A25 PolarHBondContact O-N 3.23Š|
| 26 | E | 48.7 | Very low | 51.1 | Low | 137 Ų | 137 | 128.1 Ų | 128.1 | 64% | 0.64 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -95.9 | -20.3 | 179 | -152.1 | 76.8 | -123.5 | 0 | 0 | 112.1 | M24 R29 | M24-E26 VanDerWaalsContact C-N 3.35Å; E26-R29 IonicContact OE1-NH1 3.5Å; E26-R29 PolarHBondContact OE1-NH1 3.5Å |
| 27 | A | 51.9 | Low | 51.9 | Low | 73 Ų | 73 | 125.1 Ų | 125.1 | 60% | 0.603 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -78.7 | -26.5 | -174.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 28 | D | 51.4 | Low | 53 | Low | 136 Ų | 136 | 125.8 Ų | 125.8 | 73% | 0.727 | 65% | 0.652 | S | S | * | * | G | 310 helix | trans | -85.7 | -12.2 | -169.7 | -158.9 | 44.2 | 0 | 0 | 0 | 114.3 | K30 | D28-K30 VanDerWaalsContact C-N 3.3Å; D28-K30 PolarHBondContact O-N 3.37Å |
| 29 | R | 54 | Low | 54.1 | Low | 189 Ų | 189 | 129.2 Ų | 129.2 | 71% | 0.713 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -79.9 | -3.6 | -179.8 | -65 | -160.6 | -166.1 | 96.3 | 7.6 | 114.9 | E26 | E26-R29 IonicContact OE1-NH1 3.5Å; E26-R29 PolarHBondContact OE1-NH1 3.5Å |
| 30 | K | 51.6 | Low | 55.5 | Low | 184 Ų | 184 | 121.7 Ų | 121.7 | 80% | 0.8 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -87.8 | -8.1 | -167.9 | -144.2 | 178.7 | 180 | -175.2 | 0 | 115.5 | D28 | D28-K30 VanDerWaalsContact C-N 3.3Å; D28-K30 PolarHBondContact O-N 3.37Å |
| 31 | N | 51.1 | Low | 56.9 | Low | 138 Ų | 138 | 116.7 Ų | 116.7 | 74% | 0.738 | 63% | 0.629 | S | S | * | * | G | 310 helix | trans | -103.7 | 6.4 | -172.1 | -59.5 | -29.6 | 0 | 0 | 0 | 114.4 | ||
| 32 | G | 50 | Low | 58.4 | Low | 78 Ų | 78 | 118.3 Ų | 118.3 | 80% | 0.804 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -97.2 | -1 | -174.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 33 | A | 52.6 | Low | 59.9 | Low | 70 Ų | 70 | 113 Ų | 113 | 58% | 0.579 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -107.2 | -12.9 | -166.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | N37 | A33-N37 PolarHBondContact O-ND2 3.49Š|
| 34 | E | 51.8 | Low | 61.6 | Low | 157 Ų | 157 | 109.8 Ų | 109.8 | 73% | 0.734 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -87.7 | -25.6 | -172.8 | -69.9 | -175.3 | 141.1 | 0 | 0 | 114.2 | N36 N37 | E34-N36 PolarHBondContact O-N 3.26Å; E34-N37 PolarHBondContact O-N 3.31Å |
| 35 | G | 53.4 | Low | 63.3 | Low | 53 Ų | 53 | 108 Ų | 108 | 55% | 0.546 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.5 | -38.6 | -176 | 0 | 0 | 0 | 0 | 0 | 114.8 | N37 | G35-N37 PolarHBondContact O-N 3.43Å |
| 36 | N | 60.1 | Low | 64.8 | Low | 105 Ų | 105 | 110.9 Ų | 110.9 | 56% | 0.561 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -67.1 | -33.7 | -177 | -173.3 | 14.1 | 0 | 0 | 0 | 112.7 | E34 N38 E39 V40 | E34-N36 PolarHBondContact O-N 3.26Å; N36-N38 VanDerWaalsContact C-N 3.28Å; N36-N38 PolarHBondContact O-N 3.44Å; N36-E39 PolarHBondContact O-N 3.25Å; N36-V40 WeakPolarHBondContact O-CG2 3.35Å; N36-V40 PolarHBondContact O-N 2.97Å; N36-V40 VanDerWaalsContact O-N 3.09Å |
| 37 | N | 63.8 | Low | 66.7 | Low | 91 Ų | 91 | 109.2 Ų | 109.2 | 49% | 0.487 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.1 | -34.6 | -175.1 | -60 | -41.4 | 0 | 0 | 0 | 111.9 | A33 E34 G35 I41 | A33-N37 PolarHBondContact O-ND2 3.49Å; E34-N37 PolarHBondContact O-N 3.31Å; G35-N37 PolarHBondContact O-N 3.43Å; N37-I41 WeakPolarHBondContact O-CB 3.17Å; N37-I41 WeakPolarHBondContact O-CD1 3.41Å; N37-I41 WeakPolarHBondContact O-CG1 3.42Å; N37-I41 PolarHBondContact O-N 3.45Å |
| 38 | N | 72.2 | Confident | 68.1 | Low | 108 Ų | 108 | 109.3 Ų | 109.3 | 58% | 0.578 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -68.4 | -44.1 | 178.4 | -68 | -17.2 | 0 | 0 | 0 | 111.7 | N36 V40 I41 E42 | N36-N38 VanDerWaalsContact C-N 3.28Å; N36-N38 PolarHBondContact O-N 3.44Å; N38-V40 VanDerWaalsContact C-N 3.34Å; N38-V40 PolarHBondContact O-N 3.23Å; N38-I41 PolarHBondContact O-N 3.45Å; N38-E42 PolarHBondContact O-N 3.09Å |
| 39 | E | 75 | Confident | 69.7 | Low | 141 Ų | 141 | 107.1 Ų | 107.1 | 66% | 0.659 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61.7 | -40.9 | 175.8 | -66.9 | -175.5 | 173.6 | 0 | 0 | 111.8 | N36 E42 A43 | N36-E39 PolarHBondContact O-N 3.25Å; E39-E42 PolarHBondContact O-N 3.32Å; E39-A43 VanDerWaalsContact O-CB 3.31Å; E39-A43 WeakPolarHBondContact O-CB 3.44Å; E39-A43 PolarHBondContact O-N 3.04Å |
| 40 | V | 75.1 | Confident | 71.2 | Confident | 77 Ų | 77 | 103 Ų | 103 | 47% | 0.467 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.8 | -42.2 | 175.6 | 173.9 | 0 | 0 | 0 | 0 | 111.4 | N36 N38 A43 V44 | N36-V40 WeakPolarHBondContact O-CG2 3.35Å; N36-V40 PolarHBondContact O-N 2.97Å; N36-V40 VanDerWaalsContact O-N 3.09Å; N38-V40 VanDerWaalsContact C-N 3.34Å; N38-V40 PolarHBondContact O-N 3.23Å; V40-A43 PolarHBondContact O-N 2.88Å; V40-V44 VanDerWaalsContact O-CG2 3.31Å; V40-V44 WeakPolarHBondContact O-CG2 3.2Å; V40-V44 PolarHBondContact O-N 2.94Å |
| 41 | I | 79.9 | Confident | 72.5 | Confident | 93 Ų | 93 | 98.3 Ų | 98.3 | 48% | 0.477 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.6 | -43.9 | 176.8 | -70.9 | 163.5 | 0 | 0 | 0 | 110.9 | N37 N38 V44 N45 | N37-I41 WeakPolarHBondContact O-CB 3.17Å; N37-I41 WeakPolarHBondContact O-CD1 3.41Å; N37-I41 WeakPolarHBondContact O-CG1 3.42Å; N37-I41 PolarHBondContact O-N 3.45Å; N38-I41 PolarHBondContact O-N 3.45Å; I41-V44 PolarHBondContact O-N 3.19Å; I41-N45 WeakPolarHBondContact O-CB 3.43Å; I41-N45 VanDerWaalsContact O-CG 3.23Å; I41-N45 PolarHBondContact O-N 3.13Å; I41-N45 PolarHBondContact O-ND2 2.88Å |
| 42 | E | 81.2 | Confident | 74 | Confident | 142 Ų | 142 | 95.6 Ų | 95.6 | 66% | 0.664 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.8 | -43.4 | 175.2 | -74.9 | -169 | 170.9 | 0 | 0 | 112.1 | N38 E39 V44 N45 H46 | N38-E42 PolarHBondContact O-N 3.09Å; E39-E42 PolarHBondContact O-N 3.32Å; E42-V44 PolarHBondContact O-N 3.3Å; E42-N45 PolarHBondContact O-N 3.31Å; E42-H46 WeakPolarHBondContact O-CB 3.36Å; E42-H46 PolarHBondContact O-N 2.83Å |
| 43 | A | 81.6 | Confident | 75.6 | Confident | 61 Ų | 61 | 94.5 Ų | 94.5 | 50% | 0.504 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.6 | -41.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | E39 V40 H46 L47 | E39-A43 VanDerWaalsContact O-CB 3.31Å; E39-A43 WeakPolarHBondContact O-CB 3.44Å; E39-A43 PolarHBondContact O-N 3.04Å; V40-A43 PolarHBondContact O-N 2.88Å; A43-H46 PolarHBondContact O-N 3.24Å; A43-L47 WeakPolarHBondContact O-CB 3.17Å; A43-L47 PolarHBondContact O-N 3.45Å |
| 44 | V | 83.9 | Confident | 76.9 | Confident | 81 Ų | 81 | 95.7 Ų | 95.7 | 49% | 0.491 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.5 | -44.3 | 175.4 | 169.2 | 0 | 0 | 0 | 0 | 111.4 | V40 I41 E42 H46 L47 T48 | V40-V44 VanDerWaalsContact O-CG2 3.31Å; V40-V44 WeakPolarHBondContact O-CG2 3.2Å; V40-V44 PolarHBondContact O-N 2.94Å; I41-V44 PolarHBondContact O-N 3.19Å; E42-V44 PolarHBondContact O-N 3.3Å; V44-H46 PolarHBondContact O-N 3.15Å; V44-L47 PolarHBondContact O-N 2.93Å; V44-T48 WeakPolarHBondContact O-CB 3.31Å; V44-T48 PolarHBondContact O-N 2.86Å; V44-T48 PolarHBondContact O-OG1 2.95Å |
| 45 | N | 86 | Confident | 78.4 | Confident | 94 Ų | 94 | 94.2 Ų | 94.2 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.2 | -41.4 | 177.1 | -73.3 | -26.1 | 0 | 0 | 0 | 111.8 | I41 E42 T48 T49 | I41-N45 WeakPolarHBondContact O-CB 3.43Å; I41-N45 VanDerWaalsContact O-CG 3.23Å; I41-N45 PolarHBondContact O-N 3.13Å; I41-N45 PolarHBondContact O-ND2 2.88Å; E42-N45 PolarHBondContact O-N 3.31Å; N45-T48 PolarHBondContact O-N 3.37Å; N45-T49 WeakPolarHBondContact O-CB 3.27Å; N45-T49 PolarHBondContact O-N 3.49Å; N45-T49 PolarHBondContact O-OG1 3.42Å |
| 46 | H | 86.2 | Confident | 79.7 | Confident | 121 Ų | 121 | 95.3 Ų | 95.3 | 56% | 0.56 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.5 | -41.3 | 176.9 | -176.4 | -120 | 0 | 0 | 0 | 112.2 | E42 A43 V44 T49 Q50 | E42-H46 WeakPolarHBondContact O-CB 3.36Å; E42-H46 PolarHBondContact O-N 2.83Å; A43-H46 PolarHBondContact O-N 3.24Å; V44-H46 PolarHBondContact O-N 3.15Å; H46-T49 PolarHBondContact O-N 2.99Å; H46-Q50 PolarHBondContact CE1-NE2 2.95Å; H46-Q50 PolarHBondContact ND1-NE2 3.3Å; H46-Q50 PolarHBondContact O-N 2.76Å |
| 47 | L | 87 | Confident | 80.7 | Confident | 102 Ų | 102 | 94.3 Ų | 94.3 | 53% | 0.534 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.6 | -43.6 | 175.1 | 180 | 60.2 | 0 | 0 | 0 | 111.8 | A43 V44 T49 Q50 L51 | A43-L47 WeakPolarHBondContact O-CB 3.17Å; A43-L47 PolarHBondContact O-N 3.45Å; V44-L47 PolarHBondContact O-N 2.93Å; L47-T49 VanDerWaalsContact C-N 3.33Å; L47-T49 PolarHBondContact O-N 3.46Å; L47-Q50 PolarHBondContact O-N 2.85Å; L47-L51 HydrophobicContact CD1-CD1 4.32Å; L47-L51 HydrophobicContact CG-CD1 4.16Å; L47-L51 PolarHBondContact O-N 2.9Å |
| 48 | T | 81.8 | Confident | 81.7 | Confident | 75 Ų | 75 | 95.1 Ų | 95.1 | 46% | 0.46 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 175.6 | -58.5 | 0 | 0 | 0 | 0 | 110.5 | V44 N45 Q50 L51 T52 | V44-T48 WeakPolarHBondContact O-CB 3.31Å; V44-T48 PolarHBondContact O-N 2.86Å; V44-T48 PolarHBondContact O-OG1 2.95Å; N45-T48 PolarHBondContact O-N 3.37Å; T48-Q50 PolarHBondContact O-N 2.9Å; T48-L51 PolarHBondContact O-N 3.49Å; T48-T52 PolarHBondContact O-N 2.97Å; T48-T52 PolarHBondContact O-OG1 3.26Å |
| 49 | T | 86.3 | Confident | 82.2 | Confident | 90 Ų | 90 | 93.7 Ų | 93.7 | 55% | 0.552 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61 | -45.4 | 177.2 | -56.7 | 0 | 0 | 0 | 0 | 112.1 | N45 H46 L47 T52 A53 | N45-T49 WeakPolarHBondContact O-CB 3.27Å; N45-T49 PolarHBondContact O-N 3.49Å; N45-T49 PolarHBondContact O-OG1 3.42Å; H46-T49 PolarHBondContact O-N 2.99Å; L47-T49 VanDerWaalsContact C-N 3.33Å; L47-T49 PolarHBondContact O-N 3.46Å; T49-T52 PolarHBondContact O-N 3.06Å; T49-A53 WeakPolarHBondContact O-CB 3.45Å; T49-A53 PolarHBondContact O-N 3.41Å |
| 50 | Q | 84 | Confident | 82.4 | Confident | 101 Ų | 101 | 90.9 Ų | 90.9 | 47% | 0.472 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.3 | -43.1 | 176.6 | -79.8 | -175.4 | 79.3 | 0 | 0 | 112.7 | H46 L47 T48 A53 T54 | H46-Q50 PolarHBondContact CE1-NE2 2.95Å; H46-Q50 PolarHBondContact ND1-NE2 3.3Å; H46-Q50 PolarHBondContact O-N 2.76Å; L47-Q50 PolarHBondContact O-N 2.85Å; T48-Q50 PolarHBondContact O-N 2.9Å; Q50-A53 PolarHBondContact O-N 3.21Å; Q50-T54 WeakPolarHBondContact O-CB 3.34Å; Q50-T54 PolarHBondContact O-N 3.05Å; Q50-T54 PolarHBondContact O-OG1 3.08Å |
| 51 | L | 79.4 | Confident | 82.7 | Confident | 86 Ų | 86 | 88.7 Ų | 88.7 | 45% | 0.45 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61 | -49.2 | 175.6 | -79.7 | 165.6 | 0 | 0 | 0 | 110.8 | L47 T48 A53 T54 F55 | L47-L51 HydrophobicContact CD1-CD1 4.32Å; L47-L51 HydrophobicContact CG-CD1 4.16Å; L47-L51 PolarHBondContact O-N 2.9Å; T48-L51 PolarHBondContact O-N 3.49Å; L51-A53 PolarHBondContact O-N 3.34Å; L51-T54 PolarHBondContact O-N 3.27Å; L51-F55 HydrophobicContact CD2-CE2 4.21Å; L51-F55 WeakPolarHBondContact O-CD2 3.32Å; L51-F55 PolarHBondContact O-N 3.27Å |
| 52 | T | 83.5 | Confident | 82.7 | Confident | 81 Ų | 81 | 89.6 Ų | 89.6 | 50% | 0.497 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -57.7 | -47.6 | 178.1 | -56.8 | 0 | 0 | 0 | 0 | 111.8 | T48 T49 T54 F55 T56 | T48-T52 PolarHBondContact O-N 2.97Å; T48-T52 PolarHBondContact O-OG1 3.26Å; T49-T52 PolarHBondContact O-N 3.06Å; T52-T54 VanDerWaalsContact C-N 3.31Å; T52-T54 PolarHBondContact O-N 3.4Å; T52-F55 PolarHBondContact O-N 3.32Å; T52-T56 HydrophobicContact CG2-CG2 4.48Å; T52-T56 WeakPolarHBondContact O-CG2 3.39Å; T52-T56 PolarHBondContact O-N 2.89Å; T52-T56 PolarHBondContact O-OG1 3.29Å; T52-T56 VanDerWaalsContact O-OG1 3.13Å |
| 53 | A | 82.4 | Confident | 82.6 | Confident | 55 Ų | 55 | 90.2 Ų | 90.2 | 46% | 0.455 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.5 | -34.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | T49 Q50 L51 T56 S57 | T49-A53 WeakPolarHBondContact O-CB 3.45Å; T49-A53 PolarHBondContact O-N 3.41Å; Q50-A53 PolarHBondContact O-N 3.21Å; L51-A53 PolarHBondContact O-N 3.34Å; A53-T56 PolarHBondContact O-OG1 3.33Å; A53-S57 VanDerWaalsContact O-CB 3.31Å; A53-S57 WeakPolarHBondContact O-CB 3.2Å; A53-S57 PolarHBondContact O-N 3.02Å |
| 54 | T | 81.1 | Confident | 82.6 | Confident | 96 Ų | 96 | 94.4 Ų | 94.4 | 59% | 0.589 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -69.7 | -44.7 | 176.6 | -55.6 | 0 | 0 | 0 | 0 | 111 | Q50 L51 T52 L58 | Q50-T54 WeakPolarHBondContact O-CB 3.34Å; Q50-T54 PolarHBondContact O-N 3.05Å; Q50-T54 PolarHBondContact O-OG1 3.08Å; L51-T54 PolarHBondContact O-N 3.27Å; T52-T54 VanDerWaalsContact C-N 3.31Å; T52-T54 PolarHBondContact O-N 3.4Å; T54-L58 WeakPolarHBondContact O-CB 3.37Å; T54-L58 PolarHBondContact O-N 2.91Å |
| 55 | F | 81.8 | Confident | 82.3 | Confident | 125 Ų | 125 | 97 Ų | 97 | 55% | 0.548 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66 | -42.1 | 177.5 | -80 | -63.1 | 0 | 0 | 0 | 113 | L51 T52 L58 I59 | L51-F55 HydrophobicContact CD2-CE2 4.21Å; L51-F55 WeakPolarHBondContact O-CD2 3.32Å; L51-F55 PolarHBondContact O-N 3.27Å; T52-F55 PolarHBondContact O-N 3.32Å; F55-L58 PolarHBondContact O-N 3.44Å; F55-I59 VanDerWaalsContact O-CG1 3.28Å; F55-I59 WeakPolarHBondContact O-CG1 3.4Å; F55-I59 PolarHBondContact O-N 2.91Å |
| 56 | T | 80.6 | Confident | 81.7 | Confident | 76 Ų | 76 | 98.6 Ų | 98.6 | 47% | 0.466 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.2 | -42.2 | 177.8 | 52.5 | 0 | 0 | 0 | 0 | 111.8 | T52 A53 L58 I59 D60 | T52-T56 HydrophobicContact CG2-CG2 4.48Å; T52-T56 WeakPolarHBondContact O-CG2 3.39Å; T52-T56 PolarHBondContact O-N 2.89Å; T52-T56 PolarHBondContact O-OG1 3.29Å; T52-T56 VanDerWaalsContact O-OG1 3.13Å; A53-T56 PolarHBondContact O-OG1 3.33Å; T56-L58 PolarHBondContact O-N 2.94Å; T56-I59 PolarHBondContact O-N 2.77Å; T56-D60 PolarHBondContact O-N 3.29Å |
| 57 | S | 83 | Confident | 81.3 | Confident | 85 Ų | 85 | 97.5 Ų | 97.5 | 59% | 0.594 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.5 | -43.4 | 174.2 | -172.8 | 0 | 0 | 0 | 0 | 112.3 | A53 D60 G61 | A53-S57 VanDerWaalsContact O-CB 3.31Å; A53-S57 WeakPolarHBondContact O-CB 3.2Å; A53-S57 PolarHBondContact O-N 3.02Å; S57-D60 PolarHBondContact O-N 3.06Å; S57-G61 PolarHBondContact O-N 3Å |
| 58 | L | 83.5 | Confident | 80.6 | Confident | 107 Ų | 107 | 95 Ų | 95 | 56% | 0.56 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.7 | -46.8 | 175.9 | -169 | 89.4 | 0 | 0 | 0 | 111.9 | T54 F55 T56 G61 L62 | T54-L58 WeakPolarHBondContact O-CB 3.37Å; T54-L58 PolarHBondContact O-N 2.91Å; F55-L58 PolarHBondContact O-N 3.44Å; T56-L58 PolarHBondContact O-N 2.94Å; L58-G61 PolarHBondContact O-N 3.15Å; L58-L62 HydrophobicContact CD2-CD1 4.49Å; L58-L62 HydrophobicContact CG-CD1 4.42Å; L58-L62 WeakPolarHBondContact O-CG 3.31Å; L58-L62 PolarHBondContact O-N 3.43Å |
| 59 | I | 82.1 | Confident | 80 | Confident | 79 Ų | 79 | 94.3 Ų | 94.3 | 41% | 0.405 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -42.3 | -179.9 | -70.1 | 165.2 | 0 | 0 | 0 | 111 | F55 T56 G61 L62 R63 | F55-I59 VanDerWaalsContact O-CG1 3.28Å; F55-I59 WeakPolarHBondContact O-CG1 3.4Å; F55-I59 PolarHBondContact O-N 2.91Å; T56-I59 PolarHBondContact O-N 2.77Å; I59-G61 VanDerWaalsContact C-N 3.34Å; I59-L62 PolarHBondContact O-N 3.19Å; I59-R63 WeakPolarHBondContact O-CB 3.31Å; I59-R63 VanDerWaalsContact O-CG 3.28Å; I59-R63 WeakPolarHBondContact O-CG 3.27Å; I59-R63 PolarHBondContact O-N 2.95Å |
| 60 | D | 80.7 | Confident | 78.6 | Confident | 81 Ų | 81 | 100.2 Ų | 100.2 | 43% | 0.433 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -69 | -32.2 | 176.6 | -86.2 | -0.8 | 0 | 0 | 0 | 112.6 | T56 S57 R63 K64 | T56-D60 PolarHBondContact O-N 3.29Å; S57-D60 PolarHBondContact O-N 3.06Å; D60-R63 IonicContact OD1-NH1 3.76Å; D60-K64 VanDerWaalsContact O-CG 3.3Å; D60-K64 WeakPolarHBondContact O-CG 3.32Å; D60-K64 PolarHBondContact O-N 3.28Å; D60-K64 VanDerWaalsContact O-N 3.08Å |
| 61 | G | 81.6 | Confident | 77.4 | Confident | 32 Ų | 32 | 99.2 Ų | 99.2 | 33% | 0.33 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.2 | -54.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S57 L58 I59 R63 K64 E65 | S57-G61 PolarHBondContact O-N 3Å; L58-G61 PolarHBondContact O-N 3.15Å; I59-G61 VanDerWaalsContact C-N 3.34Å; G61-R63 VanDerWaalsContact C-N 3.29Å; G61-R63 PolarHBondContact O-N 2.93Å; G61-K64 PolarHBondContact O-N 3.09Å; G61-K64 VanDerWaalsContact O-N 3.11Å; G61-E65 PolarHBondContact O-N 3.48Å |
| 62 | L | 78.4 | Confident | 76.2 | Confident | 111 Ų | 111 | 103.2 Ų | 103.2 | 58% | 0.581 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -60.5 | -36 | 178.6 | -68.4 | 172.3 | 0 | 0 | 0 | 112.7 | L58 I59 L66 | L58-L62 HydrophobicContact CD2-CD1 4.49Å; L58-L62 HydrophobicContact CG-CD1 4.42Å; L58-L62 WeakPolarHBondContact O-CG 3.31Å; L58-L62 PolarHBondContact O-N 3.43Å; I59-L62 PolarHBondContact O-N 3.19Å; L62-L66 WeakPolarHBondContact O-CB 3.23Å; L62-L66 PolarHBondContact O-N 3.37Å |
| 63 | R | 80.8 | Confident | 74.7 | Confident | 155 Ų | 155 | 104.5 Ų | 104.5 | 59% | 0.585 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.6 | -40.3 | 174.3 | -77.3 | 171.2 | 170.8 | 179.5 | -4 | 112.6 | I59 D60 G61 L66 V67 | I59-R63 WeakPolarHBondContact O-CB 3.31Å; I59-R63 VanDerWaalsContact O-CG 3.28Å; I59-R63 WeakPolarHBondContact O-CG 3.27Å; I59-R63 PolarHBondContact O-N 2.95Å; D60-R63 IonicContact OD1-NH1 3.76Å; G61-R63 VanDerWaalsContact C-N 3.29Å; G61-R63 PolarHBondContact O-N 2.93Å; R63-L66 PolarHBondContact O-N 2.92Å; R63-V67 WeakPolarHBondContact O-CG2 3.4Å; R63-V67 PolarHBondContact O-N 2.87Å; R63-V67 VanDerWaalsContact O-N 3.11Å |
| 64 | K | 81.6 | Confident | 73 | Confident | 150 Ų | 150 | 112.9 Ų | 112.9 | 65% | 0.652 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65 | -46.3 | 176 | -74 | 168 | -176.6 | 173.7 | 0 | 111.1 | D60 G61 L66 V67 A68 | D60-K64 VanDerWaalsContact O-CG 3.3Å; D60-K64 WeakPolarHBondContact O-CG 3.32Å; D60-K64 PolarHBondContact O-N 3.28Å; D60-K64 VanDerWaalsContact O-N 3.08Å; G61-K64 PolarHBondContact O-N 3.09Å; G61-K64 VanDerWaalsContact O-N 3.11Å; K64-L66 PolarHBondContact O-N 3.27Å; K64-V67 PolarHBondContact O-N 3.23Å; K64-A68 WeakPolarHBondContact O-CB 3.36Å; K64-A68 PolarHBondContact O-N 2.88Å |
| 65 | E | 75.8 | Confident | 71.3 | Confident | 135 Ų | 135 | 117 Ų | 117 | 63% | 0.631 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -59.3 | -44.4 | 175.6 | -69.4 | -62.3 | 108 | 0 | 0 | 112 | G61 V67 A68 A69 | G61-E65 PolarHBondContact O-N 3.48Å; E65-V67 VanDerWaalsContact C-N 3.32Å; E65-V67 PolarHBondContact O-N 3.3Å; E65-A68 PolarHBondContact O-N 3.32Å; E65-A69 WeakPolarHBondContact O-CB 3.34Å; E65-A69 PolarHBondContact O-N 3.04Å |
| 66 | L | 74.2 | Confident | 69.7 | Low | 128 Ų | 128 | 118.6 Ų | 118.6 | 67% | 0.67 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -62.9 | -36.5 | 177.9 | -174.6 | 64.6 | 0 | 0 | 0 | 112.7 | L62 R63 K64 R70 | L62-L66 WeakPolarHBondContact O-CB 3.23Å; L62-L66 PolarHBondContact O-N 3.37Å; R63-L66 PolarHBondContact O-N 2.92Å; K64-L66 PolarHBondContact O-N 3.27Å; L66-R70 VanDerWaalsContact O-CB 3.28Å; L66-R70 WeakPolarHBondContact O-CB 3.35Å; L66-R70 PolarHBondContact O-N 3.43Å |
| 67 | V | 77.5 | Confident | 68.6 | Low | 97 Ų | 97 | 120.2 Ų | 120.2 | 59% | 0.588 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -73.1 | -37.7 | 175.1 | 172 | 0 | 0 | 0 | 0 | 111.6 | R63 K64 E65 S71 | R63-V67 WeakPolarHBondContact O-CG2 3.4Å; R63-V67 PolarHBondContact O-N 2.87Å; R63-V67 VanDerWaalsContact O-N 3.11Å; K64-V67 PolarHBondContact O-N 3.23Å; E65-V67 VanDerWaalsContact C-N 3.32Å; E65-V67 PolarHBondContact O-N 3.3Å; V67-S71 PolarHBondContact O-N 3.49Å; V67-S71 VanDerWaalsContact O-N 3.13Å; V67-S71 PolarHBondContact O-OG 3.32Å |
| 68 | A | 72.7 | Confident | 66.7 | Low | 49 Ų | 49 | 122.1 Ų | 122.1 | 41% | 0.405 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -64.3 | -52.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | K64 E65 R70 S71 E72 | K64-A68 WeakPolarHBondContact O-CB 3.36Å; K64-A68 PolarHBondContact O-N 2.88Å; E65-A68 PolarHBondContact O-N 3.32Å; A68-R70 VanDerWaalsContact C-N 3.28Å; A68-R70 PolarHBondContact O-N 2.92Å; A68-S71 WeakPolarHBondContact O-CA 3.44Å; A68-S71 WeakPolarHBondContact O-CB 3.11Å; A68-S71 PolarHBondContact O-N 2.98Å; A68-E72 PolarHBondContact O-N 2.94Å |
| 69 | A | 69.2 | Low | 65 | Low | 61 Ų | 61 | 126.2 Ų | 126.2 | 50% | 0.504 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -58.8 | -37.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | E65 S71 S73 | E65-A69 WeakPolarHBondContact O-CB 3.34Å; E65-A69 PolarHBondContact O-N 3.04Å; A69-S71 VanDerWaalsContact C-N 3.28Å; A69-S71 PolarHBondContact O-N 2.97Å; A69-S73 PolarHBondContact O-N 2.98Å |
| 70 | R | 56.9 | Low | 63.3 | Low | 215 Ų | 215 | 130.3 Ų | 130.3 | 81% | 0.811 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -69.5 | -24.2 | 174.7 | -170.1 | 172.2 | -173.6 | 172.2 | 3.8 | 113.3 | L66 A68 | L66-R70 VanDerWaalsContact O-CB 3.28Å; L66-R70 WeakPolarHBondContact O-CB 3.35Å; L66-R70 PolarHBondContact O-N 3.43Å; A68-R70 VanDerWaalsContact C-N 3.28Å; A68-R70 PolarHBondContact O-N 2.92Å |
| 71 | S | 58.1 | Low | 62 | Low | 80 Ų | 80 | 133.3 Ų | 133.3 | 56% | 0.559 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -81.9 | -41.3 | 176 | -56.3 | 0 | 0 | 0 | 0 | 111.4 | V67 A68 A69 S73 R74 | V67-S71 PolarHBondContact O-N 3.49Å; V67-S71 VanDerWaalsContact O-N 3.13Å; V67-S71 PolarHBondContact O-OG 3.32Å; A68-S71 WeakPolarHBondContact O-CA 3.44Å; A68-S71 WeakPolarHBondContact O-CB 3.11Å; A68-S71 PolarHBondContact O-N 2.98Å; A69-S71 VanDerWaalsContact C-N 3.28Å; A69-S71 PolarHBondContact O-N 2.97Å; S71-S73 VanDerWaalsContact C-N 3.31Å; S71-S73 PolarHBondContact O-N 2.93Å; S71-R74 PolarHBondContact O-N 3.38Å |
| 72 | E | 55.6 | Low | 60.2 | Low | 169 Ų | 169 | 137.9 Ų | 137.9 | 79% | 0.79 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -64.2 | -33.5 | 179.8 | -162.8 | 168.3 | 106.3 | 0 | 0 | 112.6 | A68 R74 | A68-E72 PolarHBondContact O-N 2.94Å; E72-R74 PolarHBondContact O-N 3.47Å |
| 73 | S | 50.4 | Low | 58.9 | Low | 108 Ų | 108 | 138.8 Ų | 138.8 | 76% | 0.755 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | 3.3 | 179 | -168.2 | 0 | 0 | 0 | 0 | 115.6 | A69 S71 | A69-S73 PolarHBondContact O-N 2.98Å; S71-S73 VanDerWaalsContact C-N 3.31Å; S71-S73 PolarHBondContact O-N 2.93Å |
| 74 | R | 48.3 | Very low | 57 | Low | 231 Ų | 231 | 136 Ų | 136 | 87% | 0.872 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | -2.7 | -176.3 | -166.7 | 167 | 171.9 | 177 | -3.2 | 114.6 | S71 E72 | S71-R74 PolarHBondContact O-N 3.38Å; E72-R74 PolarHBondContact O-N 3.47Å |
| 75 | E | 43.7 | Very low | 55.4 | Low | 182 Ų | 182 | 135 Ų | 135 | 85% | 0.85 | 72% | 0.72 | S | S | * | * | trans | -100.8 | 82.6 | -179.1 | -160.5 | 170 | 121.4 | 0 | 0 | 112.6 | ||||
| 76 | L | 50.2 | Low | 53.9 | Low | 160 Ų | 160 | 133.1 Ų | 133.1 | 84% | 0.838 | 72% | 0.722 | S | S | * | * | trans | -125.6 | 125.2 | 165.5 | -80.9 | 171.8 | 0 | 0 | 0 | 110 | ||||
| 77 | P | 56.2 | Low | 52.5 | Low | 110 Ų | 110 | 133.5 Ų | 133.5 | 71% | 0.714 | 72% | 0.724 | S | S | * | * | trans | -78 | 147.1 | -172.5 | 30.7 | -35.3 | 0 | 0 | 0 | 112.6 | K79 | P77-K79 PolarHBondContact O-N 3.46Š| ||
| 78 | P | 42.6 | Very low | 50.9 | Low | 125 Ų | 125 | 134.8 Ų | 134.8 | 81% | 0.812 | 73% | 0.733 | S | S | * | * | trans | -75.4 | 107.4 | 179.2 | 30.7 | -33.2 | 0 | 0 | 0 | 110.6 | Q80 | P78-Q80 PolarHBondContact O-N 3.34Š| ||
| 79 | K | 49.2 | Very low | 49.9 | Very low | 193 Ų | 193 | 139.6 Ų | 139.6 | 84% | 0.839 | 75% | 0.75 | S | S | * | * | trans | -79.2 | 106.2 | 166.5 | -99.4 | -169.4 | 171.4 | -174.7 | 0 | 110.3 | P77 N81 | P77-K79 PolarHBondContact O-N 3.46Å; K79-N81 PolarHBondContact O-N 2.94Å | ||
| 80 | Q | 45.9 | Very low | 48.9 | Very low | 164 Ų | 164 | 143.8 Ų | 143.8 | 77% | 0.766 | 76% | 0.764 | S | S | * | * | trans | -57.8 | 121.3 | 162 | -76.2 | 169.6 | -117 | 0 | 0 | 110.1 | P78 | P78-Q80 PolarHBondContact O-N 3.34Š| ||
| 81 | N | 52.4 | Low | 48.2 | Very low | 145 Ų | 145 | 137.8 Ų | 137.8 | 78% | 0.775 | 76% | 0.76 | S | S | * | * | trans | -122.5 | 87.3 | 164.2 | -65 | -2.5 | 0 | 0 | 0 | 107.2 | K79 | K79-N81 PolarHBondContact O-N 2.94Š| ||
| 82 | D | 43.8 | Very low | 47.6 | Very low | 128 Ų | 128 | 141.4 Ų | 141.4 | 68% | 0.684 | 77% | 0.768 | S | S | * | * | trans | -64.4 | 146.3 | 170.9 | -66.8 | -69.5 | 0 | 0 | 0 | 110.9 | ||||
| 83 | T | 50.9 | Low | 47.6 | Very low | 129 Ų | 129 | 138.5 Ų | 138.5 | 79% | 0.791 | 76% | 0.764 | S | S | * | * | trans | 138.7 | 125.7 | 139.4 | -58.8 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 84 | S | 41.1 | Very low | 47.8 | Very low | 97 Ų | 97 | 139.4 Ų | 139.4 | 68% | 0.678 | 77% | 0.768 | S | S | * | * | trans | 75.5 | 102.5 | 156.9 | -73.6 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 85 | V | 48 | Very low | 47.6 | Very low | 130 Ų | 130 | 132.5 Ų | 132.5 | 79% | 0.788 | 76% | 0.755 | S | S | * | * | 20.9 | 134.1 | 121.4 | -63.3 | 0 | 0 | 0 | 0 | 118 | |||||
| 86 | S | 45.1 | Very low | 47.7 | Very low | 95 Ų | 95 | 129.8 Ų | 129.8 | 66% | 0.664 | 75% | 0.751 | S | S | * | * | -177.2 | 159.8 | 53.4 | -147.7 | 0 | 0 | 0 | 0 | 113 | |||||
| 87 | N | 45.5 | Very low | 47.6 | Very low | 135 Ų | 135 | 128.6 Ų | 128.6 | 72% | 0.722 | 75% | 0.75 | S | S | * | * | trans | 75.6 | 116.6 | 163.8 | -46.4 | -13.2 | 0 | 0 | 0 | 115.4 | ||||
| 88 | T | 43 | Very low | 47 | Very low | 125 Ų | 125 | 128.6 Ų | 128.6 | 77% | 0.767 | 75% | 0.747 | S | S | * | * | 60.1 | 111.6 | 60 | -45.4 | 0 | 0 | 0 | 0 | 109.2 | |||||
| 89 | I | 51.8 | Low | 47.2 | Very low | 150 Ų | 150 | 127.3 Ų | 127.3 | 77% | 0.769 | 75% | 0.747 | S | S | * | * | cis | -149.2 | 152 | 25.6 | -1.9 | -172.9 | 0 | 0 | 0 | 105.9 | ||||
| 90 | D | 47.3 | Very low | 47.3 | Very low | 148 Ų | 148 | 124.2 Ų | 124.2 | 79% | 0.791 | 74% | 0.744 | S | S | * | * | 174.4 | -175.3 | 76.1 | -152.2 | -79 | 0 | 0 | 0 | 108.4 | |||||
| 91 | A | 42.5 | Very low | 48.1 | Very low | 89 Ų | 89 | 118.8 Ų | 118.8 | 74% | 0.736 | 73% | 0.733 | S | S | * | * | trans | -83.3 | 131.9 | -161.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 92 | Q | 46.7 | Very low | 49.5 | Very low | 157 Ų | 157 | 115.4 Ų | 115.4 | 73% | 0.734 | 72% | 0.715 | S | S | * | * | trans | -154.2 | 132 | 146 | -160 | 174.9 | -42.9 | 0 | 0 | 111.3 | ||||
| 93 | P | 55.2 | Low | 51.4 | Low | 107 Ų | 107 | 111.9 Ų | 111.9 | 70% | 0.695 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 144.1 | 168.4 | 29.2 | -33.9 | 0 | 0 | 0 | 110 | S95 | P93-S95 PolarHBondContact O-N 3.07Å; P93-S95 VanDerWaalsContact O-N 3.1Å |
| 94 | P | 54.1 | Low | 53.2 | Low | 128 Ų | 128 | 106 Ų | 106 | 83% | 0.831 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 117.7 | -179.8 | 25.4 | -33.3 | 0 | 0 | 0 | 109.9 | T96 | P94-T96 PolarHBondContact O-N 3.26Š|
| 95 | S | 44.4 | Very low | 55.5 | Low | 86 Ų | 86 | 105.7 Ų | 105.7 | 60% | 0.601 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -53 | 124.3 | 179.5 | -64 | 0 | 0 | 0 | 0 | 110.8 | P93 V97 | P93-S95 PolarHBondContact O-N 3.07Å; P93-S95 VanDerWaalsContact O-N 3.1Å; S95-V97 PolarHBondContact O-N 3.37Å |
| 96 | T | 45.3 | Very low | 57.4 | Low | 125 Ų | 125 | 101.4 Ų | 101.4 | 77% | 0.767 | 62% | 0.622 | S | S | * | * | trans | -53 | 110 | 158.2 | -58.2 | 0 | 0 | 0 | 0 | 107.3 | P94 V98 | P94-T96 PolarHBondContact O-N 3.26Å; T96-V98 HydrophobicContact CG2-CG2 4.39Å; T96-V98 PolarHBondContact O-N 3.27Å | ||
| 97 | V | 48.3 | Very low | 59.5 | Low | 135 Ų | 135 | 97.1 Ų | 97.1 | 82% | 0.818 | 59% | 0.591 | S | S | * | * | trans | -69.5 | 80.1 | 171.9 | -79.3 | 0 | 0 | 0 | 0 | 108.6 | S95 A99 | S95-V97 PolarHBondContact O-N 3.37Å; V97-A99 PolarHBondContact O-N 3.38Å | ||
| 98 | V | 44.9 | Very low | 61.3 | Low | 110 Ų | 110 | 95.5 Ų | 95.5 | 67% | 0.667 | 59% | 0.591 | S | S | * | * | trans | -60.6 | 110.1 | 159.4 | -154.3 | 0 | 0 | 0 | 0 | 104.7 | T96 T100 | T96-V98 HydrophobicContact CG2-CG2 4.39Å; T96-V98 PolarHBondContact O-N 3.27Å; V98-T100 PolarHBondContact O-N 2.78Å; V98-T100 PolarHBondContact O-OG1 3.11Å | ||
| 99 | A | 45.2 | Very low | 63 | Low | 97 Ų | 97 | 91.4 Ų | 91.4 | 80% | 0.802 | 57% | 0.573 | S | S | * | * | trans | -72.1 | 77 | 175.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | V97 G101 | V97-A99 PolarHBondContact O-N 3.38Å; A99-G101 PolarHBondContact O-N 3.2Å | ||
| 100 | T | 51.1 | Low | 64.3 | Low | 128 Ų | 128 | 84.3 Ų | 84.3 | 79% | 0.785 | 54% | 0.537 | S | S | * | . | trans | -76 | 48.7 | 174.9 | -34.8 | 0 | 0 | 0 | 0 | 109.8 | V98 | V98-T100 PolarHBondContact O-N 2.78Å; V98-T100 PolarHBondContact O-OG1 3.11Å | ||
| 101 | G | 64.3 | Low | 65.1 | Low | 51 Ų | 51 | 81.8 Ų | 81.8 | 53% | 0.526 | 52% | 0.523 | S | S | . | . | trans | -71.5 | 130.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | A99 D105 | A99-G101 PolarHBondContact O-N 3.2Å; G101-D105 WeakPolarHBondContact CA-OD2 3.29Å | ||
| 102 | N | 80.1 | Confident | 65.8 | Low | 73 Ų | 73 | 85.9 Ų | 85.9 | 39% | 0.39 | 53% | 0.529 | S | S | . | . | trans | -66.3 | 141.7 | 170.5 | -164.8 | -38.1 | 0 | 0 | 0 | 108.2 | D104 D105 | N102-D104 PolarHBondContact O-N 2.9Å; N102-D104 PolarHBondContact OD1-N 3.24Å; N102-D104 PolarHBondContact OD1-OD1 2.93Å; N102-D105 WeakPolarHBondContact CB-OD1 3.35Å; N102-D105 PolarHBondContact N-OD2 3.13Å; N102-D105 WeakPolarHBondContact O-CB 3.42Å; N102-D105 PolarHBondContact O-N 2.88Å | ||
| 103 | V | 85.3 | Confident | 66.2 | Low | 55 Ų | 55 | 80.8 Ų | 80.8 | 33% | 0.333 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -17 | 176.7 | 63.5 | 0 | 0 | 0 | 0 | 112.5 | W106 D145 I148 | V103-W106 PolarHBondContact O-NE1 2.8Å; V103-D145 HydrophobicContact CG1-CB 3.7Å; V103-I148 HydrophobicContact CG1-CG2 3.76Å; V103-I148 HydrophobicContact CG2-CG2 4.21Å |
| 104 | D | 88.6 | Confident | 66.1 | Low | 6 Ų | 6 | 81.7 Ų | 81.7 | 3% | 0.032 | 52% | 0.515 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105 | 3.9 | 177.1 | 75 | 18.7 | 0 | 0 | 0 | 116.4 | N102 W106 I107 W144 I148 K199 | N102-D104 PolarHBondContact O-N 2.9Å; N102-D104 PolarHBondContact OD1-N 3.24Å; N102-D104 PolarHBondContact OD1-OD1 2.93Å; D104-W106 PolarHBondContact O-N 3.41Å; D104-I107 HydrophobicContact CB-CD1 3.76Å; D104-I107 HydrophobicContact CB-CG1 4.35Å; D104-I107 WeakPolarHBondContact O-CB 3.34Å; D104-I107 VanDerWaalsContact O-CG1 3.31Å; D104-I107 WeakPolarHBondContact O-CG1 3.22Å; D104-I107 PolarHBondContact O-N 3.26Å; D104-W144 HydrophobicContact CB-CZ2 4.37Å; D104-W144 PolarHBondContact OD2-NE1 3.21Å; D104-I148 HydrophobicContact CB-CG1 4.21Å; D104-I148 HydrophobicContact CB-CG2 4.11Å; D104-K199 IonicContact OD1-NZ 2.74Å; D104-K199 PolarHBondContact OD1-NZ 3.41Å; D104-K199 WeakPolarHBondContact OD2-CD 3.28Å; D104-K199 WeakPolarHBondContact OD2-CE 3.38Å; D104-K199 IonicContact OD2-NZ 2.82Å; D104-K199 PolarHBondContact OD2-NZ 3.18Å |
| 105 | D | 88.2 | Confident | 66.1 | Low | 89 Ų | 89 | 78.8 Ų | 78.8 | 48% | 0.476 | 49% | 0.493 | S | S | . | . | G | 310 helix | trans | -54 | -33.3 | -179.7 | -80.3 | -22.1 | 0 | 0 | 0 | 112.6 | G101 N102 I107 S108 | G101-D105 WeakPolarHBondContact CA-OD2 3.29Å; N102-D105 WeakPolarHBondContact CB-OD1 3.35Å; N102-D105 PolarHBondContact N-OD2 3.13Å; N102-D105 WeakPolarHBondContact O-CB 3.42Å; N102-D105 PolarHBondContact O-N 2.88Å; D105-I107 PolarHBondContact O-N 3.15Å; D105-S108 WeakPolarHBondContact O-CB 3.46Å; D105-S108 PolarHBondContact O-N 3.36Å; D105-S108 PolarHBondContact O-OG 2.89Å |
| 106 | W | 89.3 | Confident | 66.5 | Low | 40 Ų | 40 | 79.8 Ų | 79.8 | 15% | 0.152 | 49% | 0.49 | C | S | . | . | G | 310 helix | trans | -61.8 | -25.1 | 179.6 | 67.2 | -86.4 | 0 | 0 | 0 | 114 | V103 D104 S108 G109 V110 I148 F151 K152 H156 Y191 L195 | V103-W106 PolarHBondContact O-NE1 2.8Å; D104-W106 PolarHBondContact O-N 3.41Å; W106-S108 PolarHBondContact O-N 3.01Å; W106-G109 PolarHBondContact O-N 2.9Å; W106-V110 HydrophobicContact CE3-CG2 3.6Å; W106-V110 HydrophobicContact CZ3-CG2 3.56Å; W106-I148 HydrophobicContact CH2-CD1 4.27Å; W106-I148 HydrophobicContact CZ2-CD1 3.57Å; W106-I148 HydrophobicContact CZ2-CG1 3.79Å; W106-F151 HydrophobicContact CH2-CD1 4.46Å; W106-K152 HydrophobicContact CD2-CD 4.06Å; W106-K152 HydrophobicContact CD2-CG 3.88Å; W106-K152 HydrophobicContact CE3-CG 4.42Å; W106-K152 HydrophobicContact CG-CD 3.86Å; W106-K152 HydrophobicContact CG-CG 4.23Å; W106-K152 HydrophobicContact CH2-CB 4.42Å; W106-K152 HydrophobicContact CH2-CG 4.42Å; W106-K152 HydrophobicContact CZ2-CB 3.66Å; W106-K152 HydrophobicContact CZ2-CG 3.87Å; W106-H156 AromaticContact CE3-CD2 3.48Å; W106-H156 VanDerWaalsContact CE3-CD2 3.48Å; W106-H156 AromaticContact CE3-CG 3.93Å; W106-H156 AromaticContact CE3-NE2 3.56Å; W106-H156 HydrophobicContact CH2-CB 3.9Å; W106-H156 AromaticContact CH2-CG 3.86Å; W106-H156 HydrophobicContact CZ3-CB 3.94Å; W106-H156 AromaticContact CZ3-CD2 3.42Å; W106-H156 VanDerWaalsContact CZ3-CD2 3.42Å; W106-H156 WeakPolarHBondContact CZ3-CD2 2.97Å; W106-H156 AromaticContact CZ3-CE1 3.74Å; W106-H156 AromaticContact CZ3-CG 3.36Å; W106-H156 AromaticContact CZ3-ND1 3.58Å; W106-H156 AromaticContact CZ3-NE2 3.66Å; W106-Y191 WeakPolarHBondContact CH2-OH 3.36Å; W106-L195 HydrophobicContact CH2-CD1 3.47Å; W106-L195 VanDerWaalsContact CH2-CD1 3.47Å; W106-L195 HydrophobicContact CZ2-CD1 4.35Å; W106-L195 HydrophobicContact CZ3-CD1 3.77Å |
| 107 | I | 87.9 | Confident | 66.7 | Low | 5 Ų | 5 | 78.7 Ų | 78.7 | 3% | 0.026 | 49% | 0.488 | C | S | . | . | G | 310 helix | trans | -58.2 | -35 | 179.4 | -61.8 | 176.1 | 0 | 0 | 0 | 110.5 | D104 D105 G109 V110 W144 I148 L195 R196 | D104-I107 HydrophobicContact CB-CD1 3.76Å; D104-I107 HydrophobicContact CB-CG1 4.35Å; D104-I107 WeakPolarHBondContact O-CB 3.34Å; D104-I107 VanDerWaalsContact O-CG1 3.31Å; D104-I107 WeakPolarHBondContact O-CG1 3.22Å; D104-I107 PolarHBondContact O-N 3.26Å; D105-I107 PolarHBondContact O-N 3.15Å; I107-G109 PolarHBondContact O-N 2.83Å; I107-V110 WeakPolarHBondContact O-CB 3.43Å; I107-V110 WeakPolarHBondContact O-CG2 3.37Å; I107-V110 PolarHBondContact O-N 2.8Å; I107-W144 HydrophobicContact CD1-CH2 4.2Å; I107-W144 HydrophobicContact CD1-CZ2 3.67Å; I107-I148 HydrophobicContact CD1-CD1 3.95Å; I107-I148 HydrophobicContact CD1-CG1 4.04Å; I107-I148 HydrophobicContact CG1-CD1 4.48Å; I107-L195 HydrophobicContact CD1-CB 4.11Å; I107-L195 HydrophobicContact CG1-CB 4.33Å; I107-L195 HydrophobicContact CG1-CD1 4.25Å; I107-L195 HydrophobicContact CG2-CB 3.8Å; I107-R196 HydrophobicContact CG2-CG 3.72Å |
| 108 | S | 82.9 | Confident | 67 | Low | 101 Ų | 101 | 75.4 Ų | 75.4 | 71% | 0.706 | 47% | 0.47 | S | S | * | . | G | 310 helix | trans | -63.2 | -24.5 | 178.9 | -52.9 | 0 | 0 | 0 | 0 | 113.3 | D105 W106 | D105-S108 WeakPolarHBondContact O-CB 3.46Å; D105-S108 PolarHBondContact O-N 3.36Å; D105-S108 PolarHBondContact O-OG 2.89Å; W106-S108 PolarHBondContact O-N 3.01Å |
| 109 | G | 79.4 | Confident | 67.4 | Low | 39 Ų | 39 | 75.8 Ų | 75.8 | 40% | 0.402 | 48% | 0.475 | S | S | . | . | G | 310 helix | trans | -95.6 | -5.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115 | W106 I107 D111 M112 | W106-G109 PolarHBondContact O-N 2.9Å; I107-G109 PolarHBondContact O-N 2.83Å; G109-D111 VanDerWaalsContact C-N 3.27Å; G109-D111 PolarHBondContact O-N 3.46Å; G109-M112 WeakPolarHBondContact O-CB 3.38Å; G109-M112 PolarHBondContact O-N 2.86Å; G109-M112 VanDerWaalsContact O-N 3.17Å |
| 110 | V | 78.6 | Confident | 67.9 | Low | 1 Ų | 1 | 73.5 Ų | 73.5 | 1% | 0.006 | 45% | 0.451 | C | S | . | . | G | 310 helix | trans | -59.3 | -36.7 | -171.1 | 167.4 | 0 | 0 | 0 | 0 | 113 | W106 I107 M112 S113 Y191 | W106-V110 HydrophobicContact CE3-CG2 3.6Å; W106-V110 HydrophobicContact CZ3-CG2 3.56Å; I107-V110 WeakPolarHBondContact O-CB 3.43Å; I107-V110 WeakPolarHBondContact O-CG2 3.37Å; I107-V110 PolarHBondContact O-N 2.8Å; V110-M112 PolarHBondContact O-N 2.92Å; V110-M112 VanDerWaalsContact O-N 3.08Å; V110-S113 WeakPolarHBondContact O-CB 3.44Å; V110-S113 PolarHBondContact O-N 3.11Å; V110-S113 VanDerWaalsContact O-N 3.09Å; V110-Y191 HydrophobicContact CG1-CD1 3.26Å; V110-Y191 HydrophobicContact CG1-CE1 3.48Å; V110-Y191 VanDerWaalsContact CG1-CE1 3.48Å; V110-Y191 HydrophobicContact CG1-CG 4.32Å; V110-Y191 HydrophobicContact CG2-CE1 4.24Å |
| 111 | D | 65.7 | Low | 68.1 | Low | 95 Ų | 95 | 71.2 Ų | 71.2 | 51% | 0.508 | 44% | 0.438 | S | S | . | . | G | 310 helix | trans | -70.1 | -5.5 | -175.6 | -59 | -35.3 | 0 | 0 | 0 | 113.3 | G109 R196 | G109-D111 VanDerWaalsContact C-N 3.27Å; G109-D111 PolarHBondContact O-N 3.46Å; D111-R196 IonicContact OD1-NH2 2.66Å; D111-R196 IonicContact OD2-CZ 2.68Å; D111-R196 VanDerWaalsContact OD2-CZ 3.27Å; D111-R196 IonicContact OD2-NH1 2.73Å; D111-R196 PolarHBondContact OD2-NH1 3.18Å; D111-R196 IonicContact OD2-NH2 3.27Å; D111-R196 PolarHBondContact OD2-NH2 2.85Å |
| 112 | M | 56.4 | Low | 67.6 | Low | 175 Ų | 175 | 72.9 Ų | 72.9 | 86% | 0.862 | 45% | 0.448 | S | S | * | . | G | 310 helix | trans | -93.7 | -8.1 | 173.6 | -63.4 | -74.4 | 176.9 | 0 | 0 | 113.9 | G109 V110 | G109-M112 WeakPolarHBondContact O-CB 3.38Å; G109-M112 PolarHBondContact O-N 2.86Å; G109-M112 VanDerWaalsContact O-N 3.17Å; V110-M112 PolarHBondContact O-N 2.92Å; V110-M112 VanDerWaalsContact O-N 3.08Å |
| 113 | S | 54.6 | Low | 66.5 | Low | 50 Ų | 50 | 72.5 Ų | 72.5 | 35% | 0.35 | 45% | 0.45 | S | S | . | . | S | Bend | trans | -83 | 119.7 | -172.8 | -65.3 | 0 | 0 | 0 | 0 | 112.6 | V110 N115 | V110-S113 WeakPolarHBondContact O-CB 3.44Å; V110-S113 PolarHBondContact O-N 3.11Å; V110-S113 VanDerWaalsContact O-N 3.09Å; S113-N115 PolarHBondContact O-N 3.25Å |
| 114 | T | 53.5 | Low | 65.4 | Low | 127 Ų | 127 | 72.9 Ų | 72.9 | 78% | 0.779 | 45% | 0.446 | S | S | * | . | trans | -62.5 | 120 | 179.1 | 29.4 | 0 | 0 | 0 | 0 | 112.5 | I116 | T114-I116 PolarHBondContact O-N 3.15Å; T114-I116 VanDerWaalsContact O-N 3.1Å | ||
| 115 | N | 54.3 | Low | 64 | Low | 67 Ų | 67 | 74.8 Ų | 74.8 | 36% | 0.358 | 46% | 0.456 | S | S | . | . | trans | -75.2 | 94.5 | -177.5 | -170.7 | 5.7 | 0 | 0 | 0 | 110.9 | S113 S117 S161 N162 | S113-N115 PolarHBondContact O-N 3.25Å; N115-S117 PolarHBondContact O-N 3.36Å; N115-S161 WeakPolarHBondContact OD1-CA 3.44Å; N115-S161 WeakPolarHBondContact OD1-CB 3.4Å; N115-S161 PolarHBondContact OD1-OG 2.77Å; N115-N162 PolarHBondContact OD1-N 3.07Å | ||
| 116 | I | 53.2 | Low | 62.6 | Low | 107 Ų | 107 | 73.5 Ų | 73.5 | 55% | 0.549 | 46% | 0.458 | S | S | . | . | trans | -84.3 | 103.5 | 173.8 | -53 | 176.7 | 0 | 0 | 0 | 108.4 | T114 S118 P160 | T114-I116 PolarHBondContact O-N 3.15Å; T114-I116 VanDerWaalsContact O-N 3.1Å; I116-S118 VanDerWaalsContact C-N 3.32Å; I116-S118 PolarHBondContact O-N 2.97Å; I116-P160 HydrophobicContact CB-CB 4.37Å | ||
| 117 | S | 49.2 | Very low | 61.1 | Low | 102 Ų | 102 | 77.1 Ų | 77.1 | 71% | 0.713 | 48% | 0.48 | S | S | * | . | trans | -76.9 | 72.9 | -177.1 | 177.5 | 0 | 0 | 0 | 0 | 113 | N115 | N115-S117 PolarHBondContact O-N 3.36Š| ||
| 118 | S | 53.4 | Low | 59.6 | Low | 65 Ų | 65 | 80.4 Ų | 80.4 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | trans | -98.9 | 123.4 | 164.5 | -69 | 0 | 0 | 0 | 0 | 109.8 | I116 V120 Q164 | I116-S118 VanDerWaalsContact C-N 3.32Å; I116-S118 PolarHBondContact O-N 2.97Å; S118-V120 PolarHBondContact O-N 3.37Å; S118-Q164 PolarHBondContact O-NE2 2.92Å; S118-Q164 PolarHBondContact O-OE1 3.31Å | ||
| 119 | P | 55.1 | Low | 57.8 | Low | 119 Ų | 119 | 78.6 Ų | 78.6 | 77% | 0.773 | 49% | 0.485 | S | S | * | . | trans | -68 | 112.3 | -179 | 26.8 | -33.5 | 0 | 0 | 0 | 112 | ||||
| 120 | V | 54.8 | Low | 56.2 | Low | 48 Ų | 48 | 82 Ų | 82 | 29% | 0.291 | 50% | 0.5 | S | S | . | . | trans | -80 | 120.9 | 168.9 | 173.8 | 0 | 0 | 0 | 0 | 108.4 | S118 W124 Q164 | S118-V120 PolarHBondContact O-N 3.37Å; V120-W124 HydrophobicContact CG1-CB 3.5Å; V120-W124 VanDerWaalsContact CG1-CB 3.5Å; V120-W124 HydrophobicContact CG1-CD2 3.98Å; V120-W124 HydrophobicContact CG1-CE3 4.31Å; V120-W124 HydrophobicContact CG1-CG 3.65Å; V120-Q164 HydrophobicContact CB-CG 4.45Å; V120-Q164 VanDerWaalsContact CG2-OE1 3.23Å | ||
| 121 | P | 55.4 | Low | 54.7 | Low | 80 Ų | 80 | 86.1 Ų | 86.1 | 52% | 0.519 | 53% | 0.534 | S | S | . | . | trans | -69.1 | 148.1 | 177.9 | 28.9 | -34.3 | 0 | 0 | 0 | 110.9 | S123 W124 | P121-S123 PolarHBondContact O-N 3.34Å; P121-W124 VanDerWaalsContact O-CB 3.27Å; P121-W124 WeakPolarHBondContact O-CB 3.24Å; P121-W124 PolarHBondContact O-N 2.98Å | ||
| 122 | A | 53 | Low | 54.2 | Low | 87 Ų | 87 | 83.9 Ų | 83.9 | 72% | 0.719 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -20.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | W124 L125 | A122-W124 PolarHBondContact O-N 3.17Å; A122-L125 PolarHBondContact O-N 3.13Å |
| 123 | S | 58.5 | Low | 54.4 | Low | 64 Ų | 64 | 85 Ų | 85 | 45% | 0.448 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -58.4 | -30.9 | 171.2 | 58.2 | 0 | 0 | 0 | 0 | 112.9 | P121 L125 A126 D127 | P121-S123 PolarHBondContact O-N 3.34Å; S123-L125 PolarHBondContact O-N 2.95Å; S123-A126 CarbonylContact O-C 3.45Å; S123-A126 WeakPolarHBondContact O-CA 3.41Å; S123-A126 WeakPolarHBondContact O-CB 3.34Å; S123-A126 PolarHBondContact O-N 3.18Å; S123-D127 PolarHBondContact O-N 2.98Å |
| 124 | W | 62.3 | Low | 54.9 | Low | 63 Ų | 63 | 84.3 Ų | 84.3 | 24% | 0.239 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -58 | -38.1 | 179.3 | -167.1 | 85.7 | 0 | 0 | 0 | 111.7 | V120 P121 A122 D127 F128 A158 V159 | V120-W124 HydrophobicContact CG1-CB 3.5Å; V120-W124 VanDerWaalsContact CG1-CB 3.5Å; V120-W124 HydrophobicContact CG1-CD2 3.98Å; V120-W124 HydrophobicContact CG1-CE3 4.31Å; V120-W124 HydrophobicContact CG1-CG 3.65Å; P121-W124 VanDerWaalsContact O-CB 3.27Å; P121-W124 WeakPolarHBondContact O-CB 3.24Å; P121-W124 PolarHBondContact O-N 2.98Å; A122-W124 PolarHBondContact O-N 3.17Å; W124-D127 PolarHBondContact O-N 3.17Å; W124-F128 HydrophobicContact CD2-CD2 4.11Å; W124-F128 AromaticContact CD2-CE2 3.98Å; W124-F128 HydrophobicContact CD2-CE2 3.98Å; W124-F128 AromaticContact CE2-CE2 3.48Å; W124-F128 VanDerWaalsContact CE2-CE2 3.48Å; W124-F128 HydrophobicContact CE3-CD2 4.13Å; W124-F128 HydrophobicContact CE3-CE2 4.28Å; W124-F128 HydrophobicContact CH2-CD2 4.16Å; W124-F128 AromaticContact CH2-CE2 3.69Å; W124-F128 HydrophobicContact CH2-CE2 3.69Å; W124-F128 HydrophobicContact CH2-CZ 4.05Å; W124-F128 HydrophobicContact CZ2-CD2 4.15Å; W124-F128 AromaticContact CZ2-CE2 3.35Å; W124-F128 HydrophobicContact CZ2-CE2 3.35Å; W124-F128 AromaticContact CZ2-CZ 3.82Å; W124-F128 HydrophobicContact CZ2-CZ 3.82Å; W124-F128 HydrophobicContact CZ3-CD2 4.15Å; W124-F128 HydrophobicContact CZ3-CE2 4.14Å; W124-F128 AromaticContact NE1-CE2 3.95Å; W124-F128 WeakPolarHBondContact O-CD2 3.41Å; W124-F128 PolarHBondContact O-N 3.43Å; W124-A158 HydrophobicContact CH2-CB 3.95Å; W124-A158 HydrophobicContact CZ2-CB 3.99Å; W124-V159 HydrophobicContact CE3-CG2 4.38Å; W124-V159 HydrophobicContact CH2-CG2 3.62Å; W124-V159 HydrophobicContact CZ2-CG2 4.36Å; W124-V159 HydrophobicContact CZ3-CG2 3.63Å |
| 125 | L | 57.9 | Low | 55.8 | Low | 46 Ų | 46 | 85.1 Ų | 85.1 | 24% | 0.241 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -69.1 | -34.5 | 172.8 | -71.1 | 174.8 | 0 | 0 | 0 | 112.8 | A122 S123 D127 F128 A129 V168 | A122-L125 PolarHBondContact O-N 3.13Å; S123-L125 PolarHBondContact O-N 2.95Å; L125-D127 VanDerWaalsContact C-N 3.27Å; L125-D127 PolarHBondContact O-N 3.33Å; L125-F128 PolarHBondContact O-N 2.93Å; L125-A129 VanDerWaalsContact O-CB 3.31Å; L125-A129 WeakPolarHBondContact O-CB 3.43Å; L125-A129 PolarHBondContact O-N 3.4Å; L125-V168 HydrophobicContact CD1-CG2 4.18Å; L125-V168 HydrophobicContact CD2-CB 4.29Å; L125-V168 HydrophobicContact CD2-CG1 3.69Å; L125-V168 HydrophobicContact CD2-CG2 3.75Å; L125-V168 HydrophobicContact CG-CG2 4.34Å |
| 126 | A | 59.8 | Low | 57.3 | Low | 63 Ų | 63 | 87.5 Ų | 87.5 | 52% | 0.521 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -70.8 | -21.8 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | S123 P130 | S123-A126 CarbonylContact O-C 3.45Å; S123-A126 WeakPolarHBondContact O-CA 3.41Å; S123-A126 WeakPolarHBondContact O-CB 3.34Å; S123-A126 PolarHBondContact O-N 3.18Å; A126-P130 WeakPolarHBondContact O-CD 3.25Å |
| 127 | D | 58.2 | Low | 59 | Low | 116 Ų | 116 | 82.7 Ų | 82.7 | 62% | 0.62 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -79.6 | -30.5 | 173.2 | -62.9 | -40.4 | 0 | 0 | 0 | 112.1 | S123 W124 L125 P130 | S123-D127 PolarHBondContact O-N 2.98Å; W124-D127 PolarHBondContact O-N 3.17Å; L125-D127 VanDerWaalsContact C-N 3.27Å; L125-D127 PolarHBondContact O-N 3.33Å; D127-P130 WeakPolarHBondContact O-CD 3.44Å |
| 128 | F | 55.1 | Low | 60.8 | Low | 74 Ų | 74 | 81.7 Ų | 81.7 | 33% | 0.325 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -81.7 | -33.5 | 172.4 | -84 | -95.7 | 0 | 0 | 0 | 113.3 | W124 L125 A131 V132 L154 | W124-F128 HydrophobicContact CD2-CD2 4.11Å; W124-F128 AromaticContact CD2-CE2 3.98Å; W124-F128 HydrophobicContact CD2-CE2 3.98Å; W124-F128 AromaticContact CE2-CE2 3.48Å; W124-F128 VanDerWaalsContact CE2-CE2 3.48Å; W124-F128 HydrophobicContact CE3-CD2 4.13Å; W124-F128 HydrophobicContact CE3-CE2 4.28Å; W124-F128 HydrophobicContact CH2-CD2 4.16Å; W124-F128 AromaticContact CH2-CE2 3.69Å; W124-F128 HydrophobicContact CH2-CE2 3.69Å; W124-F128 HydrophobicContact CH2-CZ 4.05Å; W124-F128 HydrophobicContact CZ2-CD2 4.15Å; W124-F128 AromaticContact CZ2-CE2 3.35Å; W124-F128 HydrophobicContact CZ2-CE2 3.35Å; W124-F128 AromaticContact CZ2-CZ 3.82Å; W124-F128 HydrophobicContact CZ2-CZ 3.82Å; W124-F128 HydrophobicContact CZ3-CD2 4.15Å; W124-F128 HydrophobicContact CZ3-CE2 4.14Å; W124-F128 AromaticContact NE1-CE2 3.95Å; W124-F128 WeakPolarHBondContact O-CD2 3.41Å; W124-F128 PolarHBondContact O-N 3.43Å; L125-F128 PolarHBondContact O-N 2.93Å; F128-A131 PolarHBondContact O-N 3.47Å; F128-A131 VanDerWaalsContact O-N 3.13Å; F128-V132 HydrophobicContact CD1-CG2 4.29Å; F128-V132 PolarHBondContact O-N 2.76Å; F128-L154 HydrophobicContact CE1-CD2 4.34Å |
| 129 | A | 44.8 | Very low | 62.4 | Low | 62 Ų | 62 | 79.2 Ų | 79.2 | 51% | 0.512 | 47% | 0.466 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.8 | -32.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 117 | L125 | L125-A129 VanDerWaalsContact O-CB 3.31Å; L125-A129 WeakPolarHBondContact O-CB 3.43Å; L125-A129 PolarHBondContact O-N 3.4Å |
| 130 | P | 47 | Very low | 64 | Low | 111 Ų | 111 | 75.8 Ų | 75.8 | 72% | 0.721 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -29.6 | 178.9 | -14.7 | 31.1 | 0 | 0 | 0 | 112.9 | A126 D127 | A126-P130 WeakPolarHBondContact O-CD 3.25Å; D127-P130 WeakPolarHBondContact O-CD 3.44Å |
| 131 | A | 47.3 | Very low | 65.6 | Low | 87 Ų | 87 | 77.9 Ų | 77.9 | 72% | 0.719 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.7 | -29 | -173.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F128 | F128-A131 PolarHBondContact O-N 3.47Å; F128-A131 VanDerWaalsContact O-N 3.13Å |
| 132 | V | 54.1 | Low | 67.1 | Low | 48 Ų | 48 | 81.1 Ų | 81.1 | 29% | 0.291 | 47% | 0.468 | S | S | . | . | trans | -128.2 | 98 | -179.8 | -162.1 | 0 | 0 | 0 | 0 | 110.7 | F128 I134 L154 | F128-V132 HydrophobicContact CD1-CG2 4.29Å; F128-V132 PolarHBondContact O-N 2.76Å; V132-I134 HydrophobicContact CG1-CG1 3.79Å; V132-I134 PolarHBondContact O-N 3.36Å; V132-L154 HydrophobicContact CG1-CD1 3.6Å; V132-L154 HydrophobicContact CG2-CD2 4.31Å | ||
| 133 | K | 60.7 | Low | 68.9 | Low | 199 Ų | 199 | 80.8 Ų | 80.8 | 87% | 0.865 | 45% | 0.452 | S | S | * | . | trans | -70.9 | 82.6 | 160.6 | -67.2 | -178.3 | -179.3 | 179.6 | 0 | 108.5 | E135 | K133-E135 PolarHBondContact O-N 2.54Å; K133-E135 VanDerWaalsContact O-N 3.15Å | ||
| 134 | I | 65.8 | Low | 70.4 | Confident | 36 Ų | 36 | 78.4 Ų | 78.4 | 19% | 0.185 | 43% | 0.433 | C | S | . | . | trans | -66.6 | 112.2 | 160.8 | -51.1 | 176.9 | 0 | 0 | 0 | 105.5 | V132 F147 L154 V155 L172 | V132-I134 HydrophobicContact CG1-CG1 3.79Å; V132-I134 PolarHBondContact O-N 3.36Å; I134-F147 HydrophobicContact CG2-CD2 4.46Å; I134-F147 HydrophobicContact CG2-CE2 4.42Å; I134-L154 HydrophobicContact CD1-CB 4.36Å; I134-L154 HydrophobicContact CD1-CD1 3.72Å; I134-L154 HydrophobicContact CG1-CD1 3.82Å; I134-V155 HydrophobicContact CD1-CG2 4.45Å; I134-L172 HydrophobicContact CB-CD1 4.45Å; I134-L172 HydrophobicContact CB-CD2 3.75Å; I134-L172 HydrophobicContact CD1-CD1 3.96Å; I134-L172 HydrophobicContact CD1-CD2 4.4Å; I134-L172 HydrophobicContact CG2-CD1 3.98Å; I134-L172 HydrophobicContact CG2-CD2 3.87Å; I134-L172 HydrophobicContact CG2-CG 4.43Å | ||
| 135 | E | 72.8 | Confident | 71.7 | Confident | 143 Ų | 143 | 79.7 Ų | 79.7 | 67% | 0.668 | 45% | 0.445 | S | S | * | . | trans | -61.2 | 145.4 | 177.1 | -172.3 | 164.8 | -169.4 | 0 | 0 | 110.1 | K133 F137 | K133-E135 PolarHBondContact O-N 2.54Å; K133-E135 VanDerWaalsContact O-N 3.15Å; E135-F137 PolarHBondContact O-N 3.27Å | ||
| 136 | Q | 85.2 | Confident | 73.2 | Confident | 117 Ų | 117 | 83.8 Ų | 83.8 | 55% | 0.547 | 46% | 0.464 | S | S | . | . | trans | -68.3 | 124 | 175.5 | -75 | -174.5 | -17.3 | 0 | 0 | 109.1 | D138 L172 | Q136-D138 PolarHBondContact O-N 2.68Å; Q136-L172 CarbonylContact C-O 3.47Å; Q136-L172 VanDerWaalsContact CA-O 3.27Å; Q136-L172 WeakPolarHBondContact CA-O 3.31Å | ||
| 137 | F | 87.9 | Confident | 74.6 | Confident | 6 Ų | 6 | 81.3 Ų | 81.3 | 3% | 0.026 | 44% | 0.441 | C | S | . | . | B | Isolated β-bridge | trans | -68.9 | 114.9 | 173.1 | -170 | -122.4 | 0 | 0 | 0 | 109.2 | E135 G139 N140 H143 W144 F147 L172 L173 S174 L177 L198 | E135-F137 PolarHBondContact O-N 3.27Å; F137-G139 VanDerWaalsContact C-N 3.35Å; F137-N140 WeakPolarHBondContact CE2-O 3.26Å; F137-H143 HydrophobicContact CD2-CB 4.34Å; F137-H143 HydrophobicContact CE2-CB 4.17Å; F137-W144 AromaticContact CE1-CE3 3.89Å; F137-W144 HydrophobicContact CE1-CE3 3.89Å; F137-W144 HydrophobicContact CE1-CZ3 4.23Å; F137-W144 HydrophobicContact CE2-CB 4.4Å; F137-W144 HydrophobicContact CE2-CE3 4.36Å; F137-W144 HydrophobicContact CZ-CB 4.35Å; F137-W144 AromaticContact CZ-CE3 3.74Å; F137-W144 HydrophobicContact CZ-CE3 3.74Å; F137-F147 HydrophobicContact CB-CD1 3.98Å; F137-F147 HydrophobicContact CB-CD2 3.69Å; F137-F147 HydrophobicContact CB-CE1 4.09Å; F137-F147 HydrophobicContact CB-CE2 3.81Å; F137-F147 HydrophobicContact CB-CG 3.77Å; F137-F147 HydrophobicContact CB-CZ 4.01Å; F137-F147 HydrophobicContact CD1-CD1 4.12Å; F137-F147 HydrophobicContact CD1-CE1 4.28Å; F137-F147 HydrophobicContact CD2-CB 3.84Å; F137-F147 HydrophobicContact CD2-CD1 4.1Å; F137-F147 AromaticContact CD2-CG 3.89Å; F137-F147 HydrophobicContact CD2-CG 3.89Å; F137-F147 HydrophobicContact CE2-CB 4.43Å; F137-F147 HydrophobicContact CG-CB 4.32Å; F137-F147 AromaticContact CG-CD1 3.8Å; F137-F147 HydrophobicContact CG-CD1 3.8Å; F137-F147 HydrophobicContact CG-CD2 4.3Å; F137-F147 HydrophobicContact CG-CE1 4.19Å; F137-F147 AromaticContact CG-CG 3.85Å; F137-F147 HydrophobicContact CG-CG 3.85Å; F137-L172 PolarHBondContact N-O 2.82Å; F137-L173 HydrophobicContact CB-CD2 4.12Å; F137-L173 HydrophobicContact CD1-CD2 4.22Å; F137-S174 PolarHBondContact O-N 3.27Å; F137-L177 HydrophobicContact CD1-CD2 3.54Å; F137-L177 HydrophobicContact CE1-CD2 3.99Å; F137-L177 HydrophobicContact CG-CD2 4.39Å; F137-L177 WeakPolarHBondContact O-CD2 3.3Å; F137-L198 HydrophobicContact CD1-CD1 3.99Å; F137-L198 HydrophobicContact CD1-CD2 4.1Å; F137-L198 HydrophobicContact CD1-CG 4.03Å; F137-L198 HydrophobicContact CE1-CD1 4.02Å; F137-L198 HydrophobicContact CE1-CD2 4.38Å; F137-L198 HydrophobicContact CE1-CG 3.89Å |
| 138 | D | 87.4 | Confident | 76.2 | Confident | 82 Ų | 82 | 75.8 Ų | 75.8 | 44% | 0.439 | 41% | 0.412 | S | S | . | . | trans | -78.8 | -20.6 | 178.7 | 57.4 | -11.7 | 0 | 0 | 0 | 112.7 | Q136 N140 H143 | Q136-D138 PolarHBondContact O-N 2.68Å; D138-N140 WeakPolarHBondContact OD1-CB 3.26Å; D138-N140 PolarHBondContact OD1-N 3.4Å; D138-N140 WeakPolarHBondContact OD2-CB 3.43Å; D138-H143 IonicContact OD1-ND1 3.53Å; D138-H143 IonicContact OD2-ND1 3.73Å | ||
| 139 | G | 88.4 | Confident | 77.8 | Confident | 12 Ų | 12 | 73.2 Ų | 73.2 | 12% | 0.124 | 41% | 0.407 | C | S | . | . | S | Bend | trans | 105.1 | 2.3 | -172.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | F137 P141 | F137-G139 VanDerWaalsContact C-N 3.35Å; G139-P141 VanDerWaalsContact O-CD 3.27Å; G139-P141 WeakPolarHBondContact O-CD 3.36Å |
| 140 | N | 87.7 | Confident | 79.9 | Confident | 48 Ų | 48 | 73.5 Ų | 73.5 | 26% | 0.257 | 40% | 0.399 | S | S | . | . | trans | -71.6 | 119.2 | 179.5 | -178.6 | -4.7 | 0 | 0 | 0 | 110.7 | F137 D138 L142 H143 W144 | F137-N140 WeakPolarHBondContact CE2-O 3.26Å; D138-N140 WeakPolarHBondContact OD1-CB 3.26Å; D138-N140 PolarHBondContact OD1-N 3.4Å; D138-N140 WeakPolarHBondContact OD2-CB 3.43Å; N140-L142 PolarHBondContact O-N 3.18Å; N140-L142 VanDerWaalsContact O-N 3.08Å; N140-L142 WeakPolarHBondContact OD1-CB 3.21Å; N140-L142 PolarHBondContact OD1-N 3.22Å; N140-H143 PolarHBondContact ND2-CE1 3.05Å; N140-H143 PolarHBondContact O-N 2.86Å; N140-W144 PolarHBondContact O-N 3.25Å | ||
| 141 | P | 87.9 | Confident | 81.9 | Confident | 91 Ų | 91 | 68.2 Ų | 68.2 | 59% | 0.591 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -59.1 | -25.1 | 179.7 | -26.4 | 36.6 | 0 | 0 | 0 | 113.9 | G139 H143 W144 | G139-P141 VanDerWaalsContact O-CD 3.27Å; G139-P141 WeakPolarHBondContact O-CD 3.36Å; P141-H143 PolarHBondContact O-N 3.49Å; P141-W144 WeakPolarHBondContact O-CB 3.42Å; P141-W144 PolarHBondContact O-N 3.35Å |
| 142 | L | 88.2 | Confident | 83.9 | Confident | 149 Ų | 149 | 66.9 Ų | 66.9 | 78% | 0.78 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -66.4 | -23 | 175 | -61.6 | 175.7 | 0 | 0 | 0 | 113.2 | N140 | N140-L142 PolarHBondContact O-N 3.18Å; N140-L142 VanDerWaalsContact O-N 3.08Å; N140-L142 WeakPolarHBondContact OD1-CB 3.21Å; N140-L142 PolarHBondContact OD1-N 3.22Å |
| 143 | H | 89.3 | Confident | 85.4 | Confident | 79 Ų | 79 | 67.8 Ų | 67.8 | 37% | 0.366 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -97.3 | -9.2 | 178.8 | -59.2 | 162.7 | 0 | 0 | 0 | 112.5 | F137 D138 N140 P141 D145 M146 F147 | F137-H143 HydrophobicContact CD2-CB 4.34Å; F137-H143 HydrophobicContact CE2-CB 4.17Å; D138-H143 IonicContact OD1-ND1 3.53Å; D138-H143 IonicContact OD2-ND1 3.73Å; N140-H143 PolarHBondContact ND2-CE1 3.05Å; N140-H143 PolarHBondContact O-N 2.86Å; P141-H143 PolarHBondContact O-N 3.49Å; H143-D145 PolarHBondContact O-N 3.15Å; H143-M146 PolarHBondContact O-N 3.38Å; H143-F147 WeakPolarHBondContact O-CB 3.25Å; H143-F147 PolarHBondContact O-N 3.45Å |
| 144 | W | 91.5 | Very high | 86.5 | Confident | 14 Ų | 14 | 60 Ų | 60 | 5% | 0.053 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -55.1 | -52.7 | -175.7 | 175.2 | -110.8 | 0 | 0 | 0 | 112.4 | D104 I107 F137 N140 P141 M146 F147 I148 L198 K199 | D104-W144 HydrophobicContact CB-CZ2 4.37Å; D104-W144 PolarHBondContact OD2-NE1 3.21Å; I107-W144 HydrophobicContact CD1-CH2 4.2Å; I107-W144 HydrophobicContact CD1-CZ2 3.67Å; F137-W144 AromaticContact CE1-CE3 3.89Å; F137-W144 HydrophobicContact CE1-CE3 3.89Å; F137-W144 HydrophobicContact CE1-CZ3 4.23Å; F137-W144 HydrophobicContact CE2-CB 4.4Å; F137-W144 HydrophobicContact CE2-CE3 4.36Å; F137-W144 HydrophobicContact CZ-CB 4.35Å; F137-W144 AromaticContact CZ-CE3 3.74Å; F137-W144 HydrophobicContact CZ-CE3 3.74Å; N140-W144 PolarHBondContact O-N 3.25Å; P141-W144 WeakPolarHBondContact O-CB 3.42Å; P141-W144 PolarHBondContact O-N 3.35Å; W144-M146 VanDerWaalsContact C-N 3.29Å; W144-M146 PolarHBondContact O-N 2.87Å; W144-F147 HydrophobicContact CE3-CD1 4.25Å; W144-F147 HydrophobicContact CZ3-CD1 4.17Å; W144-F147 HydrophobicContact CZ3-CE1 4.47Å; W144-F147 PolarHBondContact O-N 3.48Å; W144-F147 VanDerWaalsContact O-N 3.15Å; W144-I148 HydrophobicContact CD2-CB 4.38Å; W144-I148 HydrophobicContact CH2-CB 4.45Å; W144-I148 HydrophobicContact CH2-CD1 3.79Å; W144-I148 HydrophobicContact CH2-CG1 4.2Å; W144-I148 HydrophobicContact CZ2-CB 4.19Å; W144-I148 HydrophobicContact CZ2-CD1 4Å; W144-I148 HydrophobicContact CZ2-CG1 3.92Å; W144-I148 HydrophobicContact CZ3-CD1 4.39Å; W144-I148 WeakPolarHBondContact O-CB 3.42Å; W144-I148 VanDerWaalsContact O-CG2 3.25Å; W144-I148 WeakPolarHBondContact O-CG2 3.46Å; W144-I148 PolarHBondContact O-N 3.19Å; W144-L198 HydrophobicContact CH2-CB 4.29Å; W144-L198 HydrophobicContact CH2-CD2 4.46Å; W144-L198 HydrophobicContact CH2-CG 4.42Å; W144-L198 HydrophobicContact CZ3-CB 4.1Å; W144-L198 HydrophobicContact CZ3-CD2 3.83Å; W144-L198 HydrophobicContact CZ3-CG 3.76Å; W144-K199 HydrophobicContact CH2-CB 4.03Å; W144-K199 HydrophobicContact CZ2-CB 3.62Å; W144-K199 HydrophobicContact CZ2-CD 4.34Å; W144-K199 HydrophobicContact CZ2-CG 4.02Å |
| 145 | D | 89.9 | Confident | 87.5 | Confident | 91 Ų | 91 | 58.4 Ų | 58.4 | 49% | 0.487 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.5 | -39.9 | -176 | -71.9 | -4.7 | 0 | 0 | 0 | 112.6 | V103 H143 G149 | V103-D145 HydrophobicContact CG1-CB 3.7Å; H143-D145 PolarHBondContact O-N 3.15Å; D145-G149 PolarHBondContact O-N 3.49Å; D145-G149 VanDerWaalsContact O-N 3.13Å |
| 146 | M | 88.4 | Confident | 88.3 | Confident | 131 Ų | 131 | 52.5 Ų | 52.5 | 65% | 0.645 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -71 | -45 | 176.8 | -172.2 | -178.5 | -60.1 | 0 | 0 | 111.3 | H143 W144 N150 | H143-M146 PolarHBondContact O-N 3.38Å; W144-M146 VanDerWaalsContact C-N 3.29Å; W144-M146 PolarHBondContact O-N 2.87Å; M146-N150 WeakPolarHBondContact O-CB 3.25Å; M146-N150 VanDerWaalsContact O-CG 3.25Å; M146-N150 PolarHBondContact O-N 3.4Å; M146-N150 VanDerWaalsContact O-N 3.09Å; M146-N150 PolarHBondContact O-ND2 3.03Å |
| 147 | F | 90.3 | Very high | 88.3 | Confident | 11 Ų | 11 | 51.5 Ų | 51.5 | 5% | 0.048 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.7 | -51.3 | 178.3 | 173.5 | -108.1 | 0 | 0 | 0 | 111.5 | I134 F137 H143 W144 N150 F151 L169 L172 L173 L198 | I134-F147 HydrophobicContact CG2-CD2 4.46Å; I134-F147 HydrophobicContact CG2-CE2 4.42Å; F137-F147 HydrophobicContact CB-CD1 3.98Å; F137-F147 HydrophobicContact CB-CD2 3.69Å; F137-F147 HydrophobicContact CB-CE1 4.09Å; F137-F147 HydrophobicContact CB-CE2 3.81Å; F137-F147 HydrophobicContact CB-CG 3.77Å; F137-F147 HydrophobicContact CB-CZ 4.01Å; F137-F147 HydrophobicContact CD1-CD1 4.12Å; F137-F147 HydrophobicContact CD1-CE1 4.28Å; F137-F147 HydrophobicContact CD2-CB 3.84Å; F137-F147 HydrophobicContact CD2-CD1 4.1Å; F137-F147 AromaticContact CD2-CG 3.89Å; F137-F147 HydrophobicContact CD2-CG 3.89Å; F137-F147 HydrophobicContact CE2-CB 4.43Å; F137-F147 HydrophobicContact CG-CB 4.32Å; F137-F147 AromaticContact CG-CD1 3.8Å; F137-F147 HydrophobicContact CG-CD1 3.8Å; F137-F147 HydrophobicContact CG-CD2 4.3Å; F137-F147 HydrophobicContact CG-CE1 4.19Å; F137-F147 AromaticContact CG-CG 3.85Å; F137-F147 HydrophobicContact CG-CG 3.85Å; H143-F147 WeakPolarHBondContact O-CB 3.25Å; H143-F147 PolarHBondContact O-N 3.45Å; W144-F147 HydrophobicContact CE3-CD1 4.25Å; W144-F147 HydrophobicContact CZ3-CD1 4.17Å; W144-F147 HydrophobicContact CZ3-CE1 4.47Å; W144-F147 PolarHBondContact O-N 3.48Å; W144-F147 VanDerWaalsContact O-N 3.15Å; F147-N150 PolarHBondContact O-N 2.87Å; F147-F151 HydrophobicContact CZ-CB 4.46Å; F147-F151 HydrophobicContact CZ-CD2 4.36Å; F147-F151 HydrophobicContact CZ-CG 4.5Å; F147-F151 WeakPolarHBondContact O-CB 3.42Å; F147-F151 PolarHBondContact O-N 2.63Å; F147-L169 HydrophobicContact CE1-CD1 4.12Å; F147-L169 HydrophobicContact CZ-CD1 3.79Å; F147-L172 HydrophobicContact CE2-CB 3.97Å; F147-L172 HydrophobicContact CE2-CD1 4.45Å; F147-L172 HydrophobicContact CZ-CB 4.34Å; F147-L173 HydrophobicContact CE1-CD2 4.49Å; F147-L173 HydrophobicContact CZ-CD2 4.17Å; F147-L198 HydrophobicContact CE1-CD2 3.85Å |
| 148 | I | 91.4 | Very high | 88 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -71.4 | -34 | -174.8 | -161.4 | 63 | 0 | 0 | 0 | 112.2 | V103 D104 W106 I107 W144 K152 L195 | V103-I148 HydrophobicContact CG1-CG2 3.76Å; V103-I148 HydrophobicContact CG2-CG2 4.21Å; D104-I148 HydrophobicContact CB-CG1 4.21Å; D104-I148 HydrophobicContact CB-CG2 4.11Å; W106-I148 HydrophobicContact CH2-CD1 4.27Å; W106-I148 HydrophobicContact CZ2-CD1 3.57Å; W106-I148 HydrophobicContact CZ2-CG1 3.79Å; I107-I148 HydrophobicContact CD1-CD1 3.95Å; I107-I148 HydrophobicContact CD1-CG1 4.04Å; I107-I148 HydrophobicContact CG1-CD1 4.48Å; W144-I148 HydrophobicContact CD2-CB 4.38Å; W144-I148 HydrophobicContact CH2-CB 4.45Å; W144-I148 HydrophobicContact CH2-CD1 3.79Å; W144-I148 HydrophobicContact CH2-CG1 4.2Å; W144-I148 HydrophobicContact CZ2-CB 4.19Å; W144-I148 HydrophobicContact CZ2-CD1 4Å; W144-I148 HydrophobicContact CZ2-CG1 3.92Å; W144-I148 HydrophobicContact CZ3-CD1 4.39Å; W144-I148 WeakPolarHBondContact O-CB 3.42Å; W144-I148 VanDerWaalsContact O-CG2 3.25Å; W144-I148 WeakPolarHBondContact O-CG2 3.46Å; W144-I148 PolarHBondContact O-N 3.19Å; I148-K152 VanDerWaalsContact O-CB 3.26Å; I148-K152 WeakPolarHBondContact O-CB 3.35Å; I148-K152 PolarHBondContact O-N 3.11Å; I148-L195 HydrophobicContact CD1-CD2 4.03Å |
| 149 | G | 89 | Confident | 87.7 | Confident | 21 Ų | 21 | 49.9 Ų | 49.9 | 22% | 0.216 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -66.1 | -43.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113 | D145 S153 | D145-G149 PolarHBondContact O-N 3.49Å; D145-G149 VanDerWaalsContact O-N 3.13Å; G149-S153 PolarHBondContact O-N 3.24Å; G149-S153 VanDerWaalsContact O-N 3.15Å; G149-S153 PolarHBondContact O-OG 2.8Å |
| 150 | N | 87.5 | Confident | 87.1 | Confident | 67 Ų | 67 | 51.5 Ų | 51.5 | 36% | 0.358 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.9 | -48.4 | 173.4 | -73.5 | -19.9 | 0 | 0 | 0 | 110.9 | M146 F147 K152 S153 L154 | M146-N150 WeakPolarHBondContact O-CB 3.25Å; M146-N150 VanDerWaalsContact O-CG 3.25Å; M146-N150 PolarHBondContact O-N 3.4Å; M146-N150 VanDerWaalsContact O-N 3.09Å; M146-N150 PolarHBondContact O-ND2 3.03Å; F147-N150 PolarHBondContact O-N 2.87Å; N150-K152 VanDerWaalsContact C-N 3.31Å; N150-K152 PolarHBondContact O-N 2.98Å; N150-S153 PolarHBondContact O-N 3.04Å; N150-S153 PolarHBondContact O-OG 3.06Å; N150-L154 HydrophobicContact CB-CD1 4.21Å; N150-L154 VanDerWaalsContact O-CB 3.25Å; N150-L154 WeakPolarHBondContact O-CB 3.45Å; N150-L154 WeakPolarHBondContact O-CD1 3.19Å; N150-L154 WeakPolarHBondContact O-CG 3.4Å; N150-L154 PolarHBondContact O-N 3.17Å |
| 151 | F | 89.2 | Confident | 86.8 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.6 | -38.1 | 179.1 | -173.6 | -97 | 0 | 0 | 0 | 112.1 | W106 F147 V155 H156 V168 L169 L172 Y191 L195 | W106-F151 HydrophobicContact CH2-CD1 4.46Å; F147-F151 HydrophobicContact CZ-CB 4.46Å; F147-F151 HydrophobicContact CZ-CD2 4.36Å; F147-F151 HydrophobicContact CZ-CG 4.5Å; F147-F151 WeakPolarHBondContact O-CB 3.42Å; F147-F151 PolarHBondContact O-N 2.63Å; F151-V155 HydrophobicContact CD2-CB 3.92Å; F151-V155 HydrophobicContact CD2-CG1 4.4Å; F151-V155 HydrophobicContact CD2-CG2 3.72Å; F151-V155 HydrophobicContact CE1-CB 4.41Å; F151-V155 HydrophobicContact CE1-CG1 4.48Å; F151-V155 HydrophobicContact CE2-CB 3.74Å; F151-V155 HydrophobicContact CE2-CG1 3.71Å; F151-V155 HydrophobicContact CE2-CG2 3.79Å; F151-V155 HydrophobicContact CG-CB 4.33Å; F151-V155 HydrophobicContact CG-CG2 4.43Å; F151-V155 HydrophobicContact CZ-CB 3.99Å; F151-V155 HydrophobicContact CZ-CG1 3.75Å; F151-V155 WeakPolarHBondContact O-CA 3.27Å; F151-V155 VanDerWaalsContact O-CB 3.25Å; F151-V155 WeakPolarHBondContact O-CB 3.28Å; F151-V155 PolarHBondContact O-N 3.22Å; F151-H156 PolarHBondContact O-N 3Å; F151-V168 HydrophobicContact CE2-CB 4.49Å; F151-V168 HydrophobicContact CE2-CG1 4.29Å; F151-L169 HydrophobicContact CD2-CD1 4.48Å; F151-L169 HydrophobicContact CE2-CB 4.04Å; F151-L169 HydrophobicContact CE2-CD1 4.07Å; F151-L169 HydrophobicContact CZ-CB 3.88Å; F151-L169 HydrophobicContact CZ-CD1 4.09Å; F151-L169 HydrophobicContact CZ-CG 4.47Å; F151-L172 HydrophobicContact CD2-CD1 3.69Å; F151-L172 HydrophobicContact CE2-CD1 3.97Å; F151-Y191 AromaticContact CE1-CE2 3.88Å; F151-Y191 HydrophobicContact CE1-CE2 3.88Å; F151-Y191 WeakPolarHBondContact CE1-OH 3.2Å; F151-Y191 HydrophobicContact CZ-CE2 4.24Å; F151-L195 HydrophobicContact CD1-CD2 4.44Å; F151-L195 HydrophobicContact CE1-CD2 4.19Å |
| 152 | K | 90.2 | Very high | 86.7 | Confident | 59 Ų | 59 | 45.6 Ų | 45.6 | 26% | 0.257 | 25% | 0.253 | S | S | . | . | I | π-helix | trans | -61.5 | -57 | 175.1 | -169 | -158.7 | -176.9 | -60 | 0 | 111.2 | W106 I148 N150 L154 H156 D157 | W106-K152 HydrophobicContact CD2-CD 4.06Å; W106-K152 HydrophobicContact CD2-CG 3.88Å; W106-K152 HydrophobicContact CE3-CG 4.42Å; W106-K152 HydrophobicContact CG-CD 3.86Å; W106-K152 HydrophobicContact CG-CG 4.23Å; W106-K152 HydrophobicContact CH2-CB 4.42Å; W106-K152 HydrophobicContact CH2-CG 4.42Å; W106-K152 HydrophobicContact CZ2-CB 3.66Å; W106-K152 HydrophobicContact CZ2-CG 3.87Å; I148-K152 VanDerWaalsContact O-CB 3.26Å; I148-K152 WeakPolarHBondContact O-CB 3.35Å; I148-K152 PolarHBondContact O-N 3.11Å; N150-K152 VanDerWaalsContact C-N 3.31Å; N150-K152 PolarHBondContact O-N 2.98Å; K152-L154 VanDerWaalsContact C-N 3.31Å; K152-L154 PolarHBondContact O-N 2.95Å; K152-H156 HydrophobicContact CG-CB 4.2Å; K152-H156 WeakPolarHBondContact O-CB 3.15Å; K152-H156 PolarHBondContact O-N 3.02Å; K152-D157 IonicContact NZ-OD1 2.86Å; K152-D157 PolarHBondContact NZ-OD1 3.42Å; K152-D157 IonicContact NZ-OD2 3.94Å; K152-D157 PolarHBondContact NZ-OD2 2.75Å; K152-D157 PolarHBondContact O-N 2.92Å |
| 153 | S | 84.8 | Confident | 86.4 | Confident | 68 Ų | 68 | 40 Ų | 40 | 48% | 0.476 | 23% | 0.227 | S | C | . | . | I | π-helix | trans | -67.2 | -29.2 | -173.4 | 53.5 | 0 | 0 | 0 | 0 | 113.8 | G149 N150 | G149-S153 PolarHBondContact O-N 3.24Å; G149-S153 VanDerWaalsContact O-N 3.15Å; G149-S153 PolarHBondContact O-OG 2.8Å; N150-S153 PolarHBondContact O-N 3.04Å; N150-S153 PolarHBondContact O-OG 3.06Å |
| 154 | L | 84.7 | Confident | 86 | Confident | 35 Ų | 35 | 37.7 Ų | 37.7 | 18% | 0.183 | 22% | 0.216 | C | C | . | . | I | π-helix | trans | -100.3 | -29.8 | -175.6 | -60 | 165.7 | 0 | 0 | 0 | 113.9 | F128 V132 I134 N150 K152 A158 | F128-L154 HydrophobicContact CE1-CD2 4.34Å; V132-L154 HydrophobicContact CG1-CD1 3.6Å; V132-L154 HydrophobicContact CG2-CD2 4.31Å; I134-L154 HydrophobicContact CD1-CB 4.36Å; I134-L154 HydrophobicContact CD1-CD1 3.72Å; I134-L154 HydrophobicContact CG1-CD1 3.82Å; N150-L154 HydrophobicContact CB-CD1 4.21Å; N150-L154 VanDerWaalsContact O-CB 3.25Å; N150-L154 WeakPolarHBondContact O-CB 3.45Å; N150-L154 WeakPolarHBondContact O-CD1 3.19Å; N150-L154 WeakPolarHBondContact O-CG 3.4Å; N150-L154 PolarHBondContact O-N 3.17Å; K152-L154 VanDerWaalsContact C-N 3.31Å; K152-L154 PolarHBondContact O-N 2.95Å; L154-A158 WeakPolarHBondContact O-CB 3.31Å |
| 155 | V | 86.8 | Confident | 85.8 | Confident | 3 Ų | 3 | 38 Ų | 38 | 2% | 0.018 | 22% | 0.217 | C | C | . | . | I | π-helix | trans | -119.5 | -53.2 | -172.2 | -170.9 | 0 | 0 | 0 | 0 | 111.4 | I134 F151 A158 V159 R165 V168 | I134-V155 HydrophobicContact CD1-CG2 4.45Å; F151-V155 HydrophobicContact CD2-CB 3.92Å; F151-V155 HydrophobicContact CD2-CG1 4.4Å; F151-V155 HydrophobicContact CD2-CG2 3.72Å; F151-V155 HydrophobicContact CE1-CB 4.41Å; F151-V155 HydrophobicContact CE1-CG1 4.48Å; F151-V155 HydrophobicContact CE2-CB 3.74Å; F151-V155 HydrophobicContact CE2-CG1 3.71Å; F151-V155 HydrophobicContact CE2-CG2 3.79Å; F151-V155 HydrophobicContact CG-CB 4.33Å; F151-V155 HydrophobicContact CG-CG2 4.43Å; F151-V155 HydrophobicContact CZ-CB 3.99Å; F151-V155 HydrophobicContact CZ-CG1 3.75Å; F151-V155 WeakPolarHBondContact O-CA 3.27Å; F151-V155 VanDerWaalsContact O-CB 3.25Å; F151-V155 WeakPolarHBondContact O-CB 3.28Å; F151-V155 PolarHBondContact O-N 3.22Å; V155-A158 PolarHBondContact O-N 3.31Å; V155-V159 HydrophobicContact CG1-CG2 4.04Å; V155-V159 WeakPolarHBondContact O-CB 3.19Å; V155-V159 WeakPolarHBondContact O-CG2 3.36Å; V155-V159 PolarHBondContact O-N 3.27Å; V155-R165 HydrophobicContact CG1-CG 4.42Å; V155-V168 HydrophobicContact CG1-CB 3.8Å; V155-V168 HydrophobicContact CG1-CG1 3.89Å; V155-V168 HydrophobicContact CG1-CG2 3.93Å; V155-V168 HydrophobicContact CG2-CG1 3.76Å |
| 156 | H | 88.2 | Confident | 85.7 | Confident | 18 Ų | 18 | 33.7 Ų | 33.7 | 8% | 0.083 | 19% | 0.194 | C | C | . | . | I | π-helix | trans | -62.8 | -49.6 | -177.7 | -176.9 | 57.8 | 0 | 0 | 0 | 111.8 | W106 F151 K152 A158 R165 Y191 | W106-H156 AromaticContact CE3-CD2 3.48Å; W106-H156 VanDerWaalsContact CE3-CD2 3.48Å; W106-H156 AromaticContact CE3-CG 3.93Å; W106-H156 AromaticContact CE3-NE2 3.56Å; W106-H156 HydrophobicContact CH2-CB 3.9Å; W106-H156 AromaticContact CH2-CG 3.86Å; W106-H156 HydrophobicContact CZ3-CB 3.94Å; W106-H156 AromaticContact CZ3-CD2 3.42Å; W106-H156 VanDerWaalsContact CZ3-CD2 3.42Å; W106-H156 WeakPolarHBondContact CZ3-CD2 2.97Å; W106-H156 AromaticContact CZ3-CE1 3.74Å; W106-H156 AromaticContact CZ3-CG 3.36Å; W106-H156 AromaticContact CZ3-ND1 3.58Å; W106-H156 AromaticContact CZ3-NE2 3.66Å; F151-H156 PolarHBondContact O-N 3Å; K152-H156 HydrophobicContact CG-CB 4.2Å; K152-H156 WeakPolarHBondContact O-CB 3.15Å; K152-H156 PolarHBondContact O-N 3.02Å; H156-A158 VanDerWaalsContact C-N 3.3Å; H156-A158 PolarHBondContact O-N 3.34Å; H156-R165 VanDerWaalsContact ND1-CZ 3.32Å; H156-R165 PolarHBondContact ND1-NE 2.66Å; H156-R165 PolarHBondContact O-NE 3.13Å; H156-R165 PolarHBondContact O-NH2 2.73Å; H156-Y191 AromaticContact CE1-CE1 3.99Å; H156-Y191 AromaticContact ND1-CE1 3.53Å; H156-Y191 AromaticContact ND1-CZ 3.8Å; H156-Y191 PolarHBondContact ND1-OH 3.23Å |
| 157 | D | 85.3 | Confident | 85.5 | Confident | 96 Ų | 96 | 29.6 Ų | 29.6 | 51% | 0.513 | 18% | 0.181 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -19.2 | -174.6 | -64.3 | -13.9 | 0 | 0 | 0 | 112.6 | K152 | K152-D157 IonicContact NZ-OD1 2.86Å; K152-D157 PolarHBondContact NZ-OD1 3.42Å; K152-D157 IonicContact NZ-OD2 3.94Å; K152-D157 PolarHBondContact NZ-OD2 2.75Å; K152-D157 PolarHBondContact O-N 2.92Å |
| 158 | A | 82.1 | Confident | 85.3 | Confident | 52 Ų | 52 | 29.5 Ų | 29.5 | 43% | 0.43 | 18% | 0.181 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -102.6 | -32.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | W124 L154 V155 H156 | W124-A158 HydrophobicContact CH2-CB 3.95Å; W124-A158 HydrophobicContact CZ2-CB 3.99Å; L154-A158 WeakPolarHBondContact O-CB 3.31Å; V155-A158 PolarHBondContact O-N 3.31Å; H156-A158 VanDerWaalsContact C-N 3.3Å; H156-A158 PolarHBondContact O-N 3.34Å |
| 159 | V | 81.4 | Confident | 85.2 | Confident | 2 Ų | 2 | 29.5 Ų | 29.5 | 1% | 0.012 | 18% | 0.181 | C | C | . | . | trans | -97.6 | 121.3 | -176.7 | -179.8 | 0 | 0 | 0 | 0 | 109.6 | W124 V155 Q164 R165 | W124-V159 HydrophobicContact CE3-CG2 4.38Å; W124-V159 HydrophobicContact CH2-CG2 3.62Å; W124-V159 HydrophobicContact CZ2-CG2 4.36Å; W124-V159 HydrophobicContact CZ3-CG2 3.63Å; V155-V159 HydrophobicContact CG1-CG2 4.04Å; V155-V159 WeakPolarHBondContact O-CB 3.19Å; V155-V159 WeakPolarHBondContact O-CG2 3.36Å; V155-V159 PolarHBondContact O-N 3.27Å; V159-Q164 HydrophobicContact CG1-CB 3.44Å; V159-Q164 VanDerWaalsContact CG1-CB 3.44Å; V159-Q164 HydrophobicContact CG1-CG 4.49Å; V159-R165 HydrophobicContact CB-CG 4Å; V159-R165 HydrophobicContact CG1-CG 4.02Å; V159-R165 PolarHBondContact O-NE 3.47Å; V159-R165 PolarHBondContact O-NH2 3.2Å; V159-R165 VanDerWaalsContact O-NH2 3.07Å | ||
| 160 | P | 76.4 | Confident | 85 | Confident | 47 Ų | 47 | 33.7 Ų | 33.7 | 31% | 0.305 | 19% | 0.19 | S | C | . | . | trans | -80.9 | -21.4 | -172.4 | 30.9 | -35.8 | 0 | 0 | 0 | 114.8 | I116 | I116-P160 HydrophobicContact CB-CB 4.37Š| ||
| 161 | S | 81 | Confident | 85 | Confident | 1 Ų | 1 | 35.7 Ų | 35.7 | 1% | 0.007 | 20% | 0.197 | C | C | . | . | trans | -104.2 | 131.8 | -177.8 | -173.1 | 0 | 0 | 0 | 0 | 113.3 | N115 S163 Q164 R165 | N115-S161 WeakPolarHBondContact OD1-CA 3.44Å; N115-S161 WeakPolarHBondContact OD1-CB 3.4Å; N115-S161 PolarHBondContact OD1-OG 2.77Å; S161-S163 PolarHBondContact O-N 3.49Å; S161-S163 PolarHBondContact OG-N 3.46Å; S161-S163 PolarHBondContact OG-OG 2.74Å; S161-Q164 PolarHBondContact O-N 2.84Å; S161-Q164 VanDerWaalsContact O-N 3.13Å; S161-R165 WeakPolarHBondContact O-CG 3.38Å; S161-R165 PolarHBondContact O-N 2.96Å | ||
| 162 | N | 85.4 | Confident | 84.9 | Confident | 13 Ų | 13 | 36.7 Ų | 36.7 | 7% | 0.07 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.5 | -35.7 | 175 | -74.8 | -9.1 | 0 | 0 | 0 | 112.8 | N115 Q164 R165 I166 Y191 | N115-N162 PolarHBondContact OD1-N 3.07Å; N162-Q164 VanDerWaalsContact C-N 3.28Å; N162-Q164 PolarHBondContact O-N 3.19Å; N162-R165 PolarHBondContact O-N 3.25Å; N162-R165 PolarHBondContact OD1-NH1 2.9Å; N162-I166 PolarHBondContact O-N 2.96Å; N162-Y191 HydrophobicContact CB-CD1 4.35Å; N162-Y191 HydrophobicContact CB-CG 4.27Å; N162-Y191 VanDerWaalsContact OD1-CD1 3.29Å; N162-Y191 WeakPolarHBondContact OD1-CD1 3.34Å |
| 163 | S | 81.2 | Confident | 84.9 | Confident | 33 Ų | 33 | 34 Ų | 34 | 23% | 0.231 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -57.8 | -40.6 | 175.9 | 66.5 | 0 | 0 | 0 | 0 | 112.8 | S161 A167 | S161-S163 PolarHBondContact O-N 3.49Å; S161-S163 PolarHBondContact OG-N 3.46Å; S161-S163 PolarHBondContact OG-OG 2.74Å; S163-A167 PolarHBondContact O-N 2.75Å; S163-A167 VanDerWaalsContact O-N 3.11Å |
| 164 | Q | 82.1 | Confident | 85 | Confident | 29 Ų | 29 | 31.7 Ų | 31.7 | 14% | 0.136 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -77.6 | -42.8 | 178.8 | -69.8 | 155 | 4.4 | 0 | 0 | 111.1 | S118 V120 V159 S161 N162 I166 A167 V168 | S118-Q164 PolarHBondContact O-NE2 2.92Å; S118-Q164 PolarHBondContact O-OE1 3.31Å; V120-Q164 HydrophobicContact CB-CG 4.45Å; V120-Q164 VanDerWaalsContact CG2-OE1 3.23Å; V159-Q164 HydrophobicContact CG1-CB 3.44Å; V159-Q164 VanDerWaalsContact CG1-CB 3.44Å; V159-Q164 HydrophobicContact CG1-CG 4.49Å; S161-Q164 PolarHBondContact O-N 2.84Å; S161-Q164 VanDerWaalsContact O-N 3.13Å; N162-Q164 VanDerWaalsContact C-N 3.28Å; N162-Q164 PolarHBondContact O-N 3.19Å; Q164-I166 PolarHBondContact O-N 3.4Å; Q164-A167 CarbonylContact O-C 3.56Å; Q164-A167 WeakPolarHBondContact O-CA 3.46Å; Q164-A167 WeakPolarHBondContact O-CB 3.42Å; Q164-A167 PolarHBondContact O-N 2.74Å; Q164-V168 WeakPolarHBondContact O-CG2 3.31Å; Q164-V168 PolarHBondContact O-N 3.45Å |
| 165 | R | 87.5 | Confident | 85.1 | Confident | 21 Ų | 21 | 34 Ų | 34 | 8% | 0.079 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -53.1 | -42 | 173.3 | -65.4 | 171.2 | 177.9 | 162.2 | -7.2 | 111 | V155 H156 V159 S161 N162 V168 L169 Y191 | V155-R165 HydrophobicContact CG1-CG 4.42Å; H156-R165 VanDerWaalsContact ND1-CZ 3.32Å; H156-R165 PolarHBondContact ND1-NE 2.66Å; H156-R165 PolarHBondContact O-NE 3.13Å; H156-R165 PolarHBondContact O-NH2 2.73Å; V159-R165 HydrophobicContact CB-CG 4Å; V159-R165 HydrophobicContact CG1-CG 4.02Å; V159-R165 PolarHBondContact O-NE 3.47Å; V159-R165 PolarHBondContact O-NH2 3.2Å; V159-R165 VanDerWaalsContact O-NH2 3.07Å; S161-R165 WeakPolarHBondContact O-CG 3.38Å; S161-R165 PolarHBondContact O-N 2.96Å; N162-R165 PolarHBondContact O-N 3.25Å; N162-R165 PolarHBondContact OD1-NH1 2.9Å; R165-V168 PolarHBondContact O-N 2.96Å; R165-L169 VanDerWaalsContact O-CB 3.31Å; R165-L169 WeakPolarHBondContact O-CB 3.43Å; R165-L169 PolarHBondContact O-N 3.05Å; R165-Y191 HydrophobicContact CB-CD2 3.8Å; R165-Y191 HydrophobicContact CB-CE1 4.38Å; R165-Y191 HydrophobicContact CB-CE2 3.54Å; R165-Y191 HydrophobicContact CB-CG 4.3Å; R165-Y191 VanDerWaalsContact CD-CE1 3.5Å; R165-Y191 HydrophobicContact CG-CE2 4.42Å |
| 166 | I | 86.9 | Confident | 85.1 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65 | -42.9 | 171.9 | -72.5 | 166.9 | 0 | 0 | 0 | 112.3 | N162 Q164 V168 L169 R170 L185 N187 L188 Y191 | N162-I166 PolarHBondContact O-N 2.96Å; Q164-I166 PolarHBondContact O-N 3.4Å; I166-V168 VanDerWaalsContact C-N 3.3Å; I166-V168 PolarHBondContact O-N 3.47Å; I166-L169 PolarHBondContact O-N 3.03Å; I166-R170 HydrophobicContact CG2-CG 4.24Å; I166-R170 WeakPolarHBondContact O-CB 3.4Å; I166-R170 VanDerWaalsContact O-CG 3.26Å; I166-R170 WeakPolarHBondContact O-CG 3.2Å; I166-R170 PolarHBondContact O-N 2.79Å; I166-L185 HydrophobicContact CG2-CD2 4.38Å; I166-N187 WeakPolarHBondContact CD1-O 3.38Å; I166-L188 HydrophobicContact CB-CD2 4.35Å; I166-L188 WeakPolarHBondContact CD1-O 3.44Å; I166-L188 HydrophobicContact CG2-CD2 4.03Å; I166-Y191 HydrophobicContact CG1-CD2 3.95Å; I166-Y191 HydrophobicContact CG1-CG 4.4Å |
| 167 | A | 84.9 | Confident | 85.1 | Confident | 45 Ų | 45 | 41.4 Ų | 41.4 | 37% | 0.372 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.5 | -35.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | S163 Q164 Q171 | S163-A167 PolarHBondContact O-N 2.75Å; S163-A167 VanDerWaalsContact O-N 3.11Å; Q164-A167 CarbonylContact O-C 3.56Å; Q164-A167 WeakPolarHBondContact O-CA 3.46Å; Q164-A167 WeakPolarHBondContact O-CB 3.42Å; Q164-A167 PolarHBondContact O-N 2.74Å; A167-Q171 PolarHBondContact O-NE2 3.25Å |
| 168 | V | 85.5 | Confident | 85.1 | Confident | 9 Ų | 9 | 41.8 Ų | 41.8 | 6% | 0.055 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -69.4 | -50.2 | 170.8 | -174.8 | 0 | 0 | 0 | 0 | 110.5 | L125 F151 V155 Q164 R165 I166 R170 Q171 L172 | L125-V168 HydrophobicContact CD1-CG2 4.18Å; L125-V168 HydrophobicContact CD2-CB 4.29Å; L125-V168 HydrophobicContact CD2-CG1 3.69Å; L125-V168 HydrophobicContact CD2-CG2 3.75Å; L125-V168 HydrophobicContact CG-CG2 4.34Å; F151-V168 HydrophobicContact CE2-CB 4.49Å; F151-V168 HydrophobicContact CE2-CG1 4.29Å; V155-V168 HydrophobicContact CG1-CB 3.8Å; V155-V168 HydrophobicContact CG1-CG1 3.89Å; V155-V168 HydrophobicContact CG1-CG2 3.93Å; V155-V168 HydrophobicContact CG2-CG1 3.76Å; Q164-V168 WeakPolarHBondContact O-CG2 3.31Å; Q164-V168 PolarHBondContact O-N 3.45Å; R165-V168 PolarHBondContact O-N 2.96Å; I166-V168 VanDerWaalsContact C-N 3.3Å; I166-V168 PolarHBondContact O-N 3.47Å; V168-R170 VanDerWaalsContact C-N 3.27Å; V168-R170 PolarHBondContact O-N 3.43Å; V168-Q171 WeakPolarHBondContact O-CB 3.44Å; V168-Q171 PolarHBondContact O-N 3.21Å; V168-L172 HydrophobicContact CG1-CD1 3.79Å; V168-L172 HydrophobicContact CG1-CG 4.33Å; V168-L172 PolarHBondContact O-N 3.25Å |
| 169 | L | 88.7 | Confident | 85.3 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -50.7 | -47.8 | 178.6 | -174.9 | 59 | 0 | 0 | 0 | 111.2 | F147 F151 R165 I166 Q171 L172 L173 L185 A194 L195 L198 | F147-L169 HydrophobicContact CE1-CD1 4.12Å; F147-L169 HydrophobicContact CZ-CD1 3.79Å; F151-L169 HydrophobicContact CD2-CD1 4.48Å; F151-L169 HydrophobicContact CE2-CB 4.04Å; F151-L169 HydrophobicContact CE2-CD1 4.07Å; F151-L169 HydrophobicContact CZ-CB 3.88Å; F151-L169 HydrophobicContact CZ-CD1 4.09Å; F151-L169 HydrophobicContact CZ-CG 4.47Å; R165-L169 VanDerWaalsContact O-CB 3.31Å; R165-L169 WeakPolarHBondContact O-CB 3.43Å; R165-L169 PolarHBondContact O-N 3.05Å; I166-L169 PolarHBondContact O-N 3.03Å; L169-Q171 PolarHBondContact O-N 3.28Å; L169-L172 PolarHBondContact O-N 3.24Å; L169-L173 HydrophobicContact CD1-CD2 3.98Å; L169-L173 HydrophobicContact CD1-CG 4.48Å; L169-L173 WeakPolarHBondContact O-CG 3.28Å; L169-L173 PolarHBondContact O-N 3.35Å; L169-L185 HydrophobicContact CD2-CD2 3.85Å; L169-L185 HydrophobicContact CG-CD2 4.25Å; L169-A194 HydrophobicContact CD2-CB 4.48Å; L169-L195 HydrophobicContact CD1-CD2 4.36Å; L169-L195 HydrophobicContact CD2-CD2 3.93Å; L169-L198 HydrophobicContact CD1-CD2 3.99Å |
| 170 | R | 86.5 | Confident | 85.4 | Confident | 110 Ų | 110 | 46.4 Ų | 46.4 | 42% | 0.415 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60 | -15.7 | 177.4 | -74 | 173 | 68.5 | 145.5 | -1.4 | 115.9 | I166 V168 R178 L185 | I166-R170 HydrophobicContact CG2-CG 4.24Å; I166-R170 WeakPolarHBondContact O-CB 3.4Å; I166-R170 VanDerWaalsContact O-CG 3.26Å; I166-R170 WeakPolarHBondContact O-CG 3.2Å; I166-R170 PolarHBondContact O-N 2.79Å; V168-R170 VanDerWaalsContact C-N 3.27Å; V168-R170 PolarHBondContact O-N 3.43Å; R170-R178 WeakPolarHBondContact O-CD 3.5Å; R170-R178 PolarHBondContact O-NH1 2.84Å; R170-L185 HydrophobicContact CG-CB 4.09Å; R170-L185 HydrophobicContact CG-CD1 4.04Å; R170-L185 HydrophobicContact CG-CD2 4.09Å; R170-L185 HydrophobicContact CG-CG 4.31Å; R170-L185 PolarHBondContact NH1-O 3.29Å |
| 171 | Q | 85.8 | Confident | 85.7 | Confident | 108 Ų | 108 | 44.6 Ų | 44.6 | 51% | 0.505 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -96.1 | -21.5 | 174.8 | -69.5 | 170.3 | 78.6 | 0 | 0 | 112.3 | A167 V168 L169 | A167-Q171 PolarHBondContact O-NE2 3.25Å; V168-Q171 WeakPolarHBondContact O-CB 3.44Å; V168-Q171 PolarHBondContact O-N 3.21Å; L169-Q171 PolarHBondContact O-N 3.28Å |
| 172 | L | 88.4 | Confident | 85.8 | Confident | 22 Ų | 22 | 46.7 Ų | 46.7 | 12% | 0.115 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -95.3 | -3.2 | -179.6 | -60.4 | 175.3 | 0 | 0 | 0 | 113.6 | I134 Q136 F137 F147 F151 V168 L169 | I134-L172 HydrophobicContact CB-CD1 4.45Å; I134-L172 HydrophobicContact CB-CD2 3.75Å; I134-L172 HydrophobicContact CD1-CD1 3.96Å; I134-L172 HydrophobicContact CD1-CD2 4.4Å; I134-L172 HydrophobicContact CG2-CD1 3.98Å; I134-L172 HydrophobicContact CG2-CD2 3.87Å; I134-L172 HydrophobicContact CG2-CG 4.43Å; Q136-L172 CarbonylContact C-O 3.47Å; Q136-L172 VanDerWaalsContact CA-O 3.27Å; Q136-L172 WeakPolarHBondContact CA-O 3.31Å; F137-L172 PolarHBondContact N-O 2.82Å; F147-L172 HydrophobicContact CE2-CB 3.97Å; F147-L172 HydrophobicContact CE2-CD1 4.45Å; F147-L172 HydrophobicContact CZ-CB 4.34Å; F151-L172 HydrophobicContact CD2-CD1 3.69Å; F151-L172 HydrophobicContact CE2-CD1 3.97Å; V168-L172 HydrophobicContact CG1-CD1 3.79Å; V168-L172 HydrophobicContact CG1-CG 4.33Å; V168-L172 PolarHBondContact O-N 3.25Å; L169-L172 PolarHBondContact O-N 3.24Å |
| 173 | L | 89 | Confident | 85.6 | Confident | 2 Ų | 2 | 50.5 Ų | 50.5 | 1% | 0.01 | 29% | 0.285 | C | S | . | . | B | Isolated β-bridge | trans | -93.6 | 148 | 171.3 | -54.8 | -170.5 | 0 | 0 | 0 | 111.2 | F137 F147 L169 L177 R178 V181 L185 L198 | F137-L173 HydrophobicContact CB-CD2 4.12Å; F137-L173 HydrophobicContact CD1-CD2 4.22Å; F147-L173 HydrophobicContact CE1-CD2 4.49Å; F147-L173 HydrophobicContact CZ-CD2 4.17Å; L169-L173 HydrophobicContact CD1-CD2 3.98Å; L169-L173 HydrophobicContact CD1-CG 4.48Å; L169-L173 WeakPolarHBondContact O-CG 3.28Å; L169-L173 PolarHBondContact O-N 3.35Å; L173-L177 HydrophobicContact CB-CD2 4.45Å; L173-L177 HydrophobicContact CD1-CG 4.4Å; L173-L177 HydrophobicContact CD2-CD2 4.2Å; L173-R178 HydrophobicContact CB-CB 4.18Å; L173-V181 HydrophobicContact CD1-CG2 3.83Å; L173-L185 HydrophobicContact CD1-CD1 3.76Å; L173-L198 HydrophobicContact CD1-CD1 3.98Å; L173-L198 HydrophobicContact CD2-CD1 3.95Å; L173-L198 HydrophobicContact CD2-CD2 3.65Å; L173-L198 HydrophobicContact CD2-CG 4.46Å |
| 174 | S | 87 | Confident | 85.4 | Confident | 20 Ų | 20 | 49.9 Ų | 49.9 | 14% | 0.14 | 28% | 0.281 | C | S | . | . | trans | -57.3 | 152 | 167.8 | 78.9 | 0 | 0 | 0 | 0 | 111.2 | F137 E176 L177 R178 | F137-S174 PolarHBondContact O-N 3.27Å; S174-E176 PolarHBondContact O-N 3.07Å; S174-L177 PolarHBondContact O-N 3.13Å; S174-L177 WeakPolarHBondContact OG-CB 3.44Å; S174-L177 PolarHBondContact OG-N 3.22Å; S174-R178 VanDerWaalsContact O-CB 3.29Å; S174-R178 WeakPolarHBondContact O-CB 3.41Å; S174-R178 PolarHBondContact O-N 3.5Å | ||
| 175 | P | 86.2 | Confident | 85.4 | Confident | 84 Ų | 84 | 48.6 Ų | 48.6 | 55% | 0.545 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57.8 | -35.2 | -179.4 | -26.7 | 35.8 | 0 | 0 | 0 | 113.9 | A179 | P175-A179 PolarHBondContact O-N 3.49Å |
| 176 | E | 87.5 | Confident | 84.8 | Confident | 169 Ų | 169 | 51.6 Ų | 51.6 | 79% | 0.79 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -71.5 | -49.3 | 179.4 | -60.9 | -176.8 | 174.4 | 0 | 0 | 111.3 | S174 R178 A179 S180 | S174-E176 PolarHBondContact O-N 3.07Å; E176-R178 VanDerWaalsContact C-N 3.32Å; E176-R178 PolarHBondContact O-N 3.19Å; E176-A179 WeakPolarHBondContact O-CB 3.4Å; E176-A179 PolarHBondContact O-N 3.3Å; E176-S180 PolarHBondContact O-N 3.49Å |
| 177 | L | 87.4 | Confident | 84.3 | Confident | 6 Ų | 6 | 54.8 Ų | 54.8 | 3% | 0.031 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 177.7 | -176.2 | 58.5 | 0 | 0 | 0 | 111.4 | F137 L173 S174 A179 S180 V181 L198 V201 | F137-L177 HydrophobicContact CD1-CD2 3.54Å; F137-L177 HydrophobicContact CE1-CD2 3.99Å; F137-L177 HydrophobicContact CG-CD2 4.39Å; F137-L177 WeakPolarHBondContact O-CD2 3.3Å; L173-L177 HydrophobicContact CB-CD2 4.45Å; L173-L177 HydrophobicContact CD1-CG 4.4Å; L173-L177 HydrophobicContact CD2-CD2 4.2Å; S174-L177 PolarHBondContact O-N 3.13Å; S174-L177 WeakPolarHBondContact OG-CB 3.44Å; S174-L177 PolarHBondContact OG-N 3.22Å; L177-A179 PolarHBondContact O-N 2.78Å; L177-S180 WeakPolarHBondContact O-CB 3.42Å; L177-S180 PolarHBondContact O-N 3.06Å; L177-V181 VanDerWaalsContact O-CG2 3.23Å; L177-V181 WeakPolarHBondContact O-CG2 3.47Å; L177-V181 PolarHBondContact O-N 2.96Å; L177-L198 HydrophobicContact CD1-CD1 4.01Å; L177-L198 HydrophobicContact CD2-CD1 3.63Å; L177-L198 HydrophobicContact CG-CD1 3.85Å; L177-V201 HydrophobicContact CD1-CB 3.97Å; L177-V201 HydrophobicContact CD1-CG1 3.65Å; L177-V201 HydrophobicContact CD1-CG2 3.91Å |
| 178 | R | 86.6 | Confident | 83.6 | Confident | 105 Ų | 105 | 56.6 Ų | 56.6 | 40% | 0.396 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.6 | -29.7 | 175.4 | -173.3 | 174.1 | 68.4 | -168.5 | -2.6 | 113.4 | R170 L173 S174 E176 A182 L185 | R170-R178 WeakPolarHBondContact O-CD 3.5Å; R170-R178 PolarHBondContact O-NH1 2.84Å; L173-R178 HydrophobicContact CB-CB 4.18Å; S174-R178 VanDerWaalsContact O-CB 3.29Å; S174-R178 WeakPolarHBondContact O-CB 3.41Å; S174-R178 PolarHBondContact O-N 3.5Å; E176-R178 VanDerWaalsContact C-N 3.32Å; E176-R178 PolarHBondContact O-N 3.19Å; R178-A182 WeakPolarHBondContact O-CA 3.46Å; R178-A182 WeakPolarHBondContact O-CB 3.45Å; R178-A182 PolarHBondContact O-N 3.38Å; R178-L185 HydrophobicContact CG-CD1 4.16Å |
| 179 | A | 85.1 | Confident | 82.9 | Confident | 69 Ų | 69 | 61.3 Ų | 61.3 | 57% | 0.57 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -75.7 | -39.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | P175 E176 L177 A182 | P175-A179 PolarHBondContact O-N 3.49Å; E176-A179 WeakPolarHBondContact O-CB 3.4Å; E176-A179 PolarHBondContact O-N 3.3Å; L177-A179 PolarHBondContact O-N 2.78Å; A179-A182 VanDerWaalsContact O-CB 3.24Å; A179-A182 WeakPolarHBondContact O-CB 3.15Å; A179-A182 PolarHBondContact O-N 3.23Å |
| 180 | S | 84.3 | Confident | 82.5 | Confident | 82 Ų | 82 | 65 Ų | 65 | 57% | 0.573 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -59.8 | -53 | 176.1 | -170.3 | 0 | 0 | 0 | 0 | 112.2 | E176 L177 A182 | E176-S180 PolarHBondContact O-N 3.49Å; L177-S180 WeakPolarHBondContact O-CB 3.42Å; L177-S180 PolarHBondContact O-N 3.06Å; S180-A182 VanDerWaalsContact C-N 3.29Å; S180-A182 PolarHBondContact O-N 3.11Å |
| 181 | V | 82.7 | Confident | 82.5 | Confident | 9 Ų | 9 | 59.8 Ų | 59.8 | 6% | 0.055 | 34% | 0.342 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.4 | 17 | 179.1 | -63.8 | 0 | 0 | 0 | 0 | 113.8 | L173 L177 S184 L185 L198 V201 | L173-V181 HydrophobicContact CD1-CG2 3.83Å; L177-V181 VanDerWaalsContact O-CG2 3.23Å; L177-V181 WeakPolarHBondContact O-CG2 3.47Å; L177-V181 PolarHBondContact O-N 2.96Å; V181-S184 PolarHBondContact O-N 2.73Å; V181-L185 HydrophobicContact CB-CD1 4.46Å; V181-L185 HydrophobicContact CG2-CD1 3.53Å; V181-L185 HydrophobicContact CG2-CG 4.11Å; V181-L185 WeakPolarHBondContact O-CG 3.29Å; V181-L185 PolarHBondContact O-N 2.94Å; V181-L185 VanDerWaalsContact O-N 3.11Å; V181-L198 HydrophobicContact CG2-CD1 4.39Å; V181-V201 HydrophobicContact CG1-CG2 4.02Å |
| 182 | A | 82.7 | Confident | 82.6 | Confident | 44 Ų | 44 | 54.6 Ų | 54.6 | 36% | 0.364 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.7 | -38.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115 | R178 A179 S180 S184 L185 S186 | R178-A182 WeakPolarHBondContact O-CA 3.46Å; R178-A182 WeakPolarHBondContact O-CB 3.45Å; R178-A182 PolarHBondContact O-N 3.38Å; A179-A182 VanDerWaalsContact O-CB 3.24Å; A179-A182 WeakPolarHBondContact O-CB 3.15Å; A179-A182 PolarHBondContact O-N 3.23Å; S180-A182 VanDerWaalsContact C-N 3.29Å; S180-A182 PolarHBondContact O-N 3.11Å; A182-S184 PolarHBondContact O-N 2.96Å; A182-L185 PolarHBondContact O-N 2.88Å; A182-S186 PolarHBondContact O-N 3.08Å; A182-S186 VanDerWaalsContact O-N 3.11Å |
| 183 | P | 80.8 | Confident | 82.5 | Confident | 94 Ų | 94 | 56.4 Ų | 56.4 | 61% | 0.61 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.5 | -45.8 | 176.9 | -24.8 | 35.8 | 0 | 0 | 0 | 112.3 | S186 | P183-S186 WeakPolarHBondContact O-CB 3.5Å; P183-S186 PolarHBondContact O-N 3.46Å; P183-S186 PolarHBondContact O-OG 3.5Å |
| 184 | S | 77.6 | Confident | 82.5 | Confident | 19 Ų | 19 | 56.4 Ų | 56.4 | 13% | 0.133 | 33% | 0.326 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | -32.1 | -178.5 | -43.5 | 0 | 0 | 0 | 0 | 112.5 | V181 A182 S186 D197 | V181-S184 PolarHBondContact O-N 2.73Å; A182-S184 PolarHBondContact O-N 2.96Å; S184-S186 VanDerWaalsContact C-N 3.27Å; S184-S186 PolarHBondContact O-N 3.02Å; S184-D197 WeakPolarHBondContact CB-OD2 3.48Å; S184-D197 PolarHBondContact OG-OD2 3.04Å |
| 185 | L | 81.6 | Confident | 82.7 | Confident | 3 Ų | 3 | 55.5 Ų | 55.5 | 2% | 0.016 | 32% | 0.32 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | -2.1 | 173.9 | -63.3 | 172.5 | 0 | 0 | 0 | 114.2 | I166 L169 R170 L173 R178 V181 A182 A194 | I166-L185 HydrophobicContact CG2-CD2 4.38Å; L169-L185 HydrophobicContact CD2-CD2 3.85Å; L169-L185 HydrophobicContact CG-CD2 4.25Å; R170-L185 HydrophobicContact CG-CB 4.09Å; R170-L185 HydrophobicContact CG-CD1 4.04Å; R170-L185 HydrophobicContact CG-CD2 4.09Å; R170-L185 HydrophobicContact CG-CG 4.31Å; R170-L185 PolarHBondContact NH1-O 3.29Å; L173-L185 HydrophobicContact CD1-CD1 3.76Å; R178-L185 HydrophobicContact CG-CD1 4.16Å; V181-L185 HydrophobicContact CB-CD1 4.46Å; V181-L185 HydrophobicContact CG2-CD1 3.53Å; V181-L185 HydrophobicContact CG2-CG 4.11Å; V181-L185 WeakPolarHBondContact O-CG 3.29Å; V181-L185 PolarHBondContact O-N 2.94Å; V181-L185 VanDerWaalsContact O-N 3.11Å; A182-L185 PolarHBondContact O-N 2.88Å; L185-A194 HydrophobicContact CD2-CB 3.99Å |
| 186 | S | 75.5 | Confident | 82.8 | Confident | 83 Ų | 83 | 55.2 Ų | 55.2 | 58% | 0.58 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | -31.6 | 179 | 77.4 | 0 | 0 | 0 | 0 | 113 | A182 P183 S184 | A182-S186 PolarHBondContact O-N 3.08Å; A182-S186 VanDerWaalsContact O-N 3.11Å; P183-S186 WeakPolarHBondContact O-CB 3.5Å; P183-S186 PolarHBondContact O-N 3.46Å; P183-S186 PolarHBondContact O-OG 3.5Å; S184-S186 VanDerWaalsContact C-N 3.27Å; S184-S186 PolarHBondContact O-N 3.02Å |
| 187 | N | 75.6 | Confident | 82.7 | Confident | 68 Ų | 68 | 48.8 Ų | 48.8 | 36% | 0.364 | 28% | 0.279 | S | S | . | . | trans | -96.1 | 112 | 178.8 | -173.1 | -9.7 | 0 | 0 | 0 | 110.7 | I166 D189 M190 | I166-N187 WeakPolarHBondContact CD1-O 3.38Å; N187-D189 PolarHBondContact O-N 3.11Å; N187-D189 PolarHBondContact OD1-N 3.32Å; N187-D189 VanDerWaalsContact OD1-N 3.13Å; N187-M190 HydrophobicContact CB-CB 4.06Å; N187-M190 HydrophobicContact CB-CG 3.89Å; N187-M190 HydrophobicContact CB-SD 3.76Å; N187-M190 WeakPolarHBondContact ND2-CG 3.41Å; N187-M190 PolarHBondContact ND2-SD 3.1Å; N187-M190 PolarHBondContact O-N 2.86Å | ||
| 188 | L | 70.6 | Confident | 82.7 | Confident | 82 Ų | 82 | 48.5 Ų | 48.5 | 43% | 0.429 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.1 | -15.8 | -175.1 | -64 | 176.6 | 0 | 0 | 0 | 114.2 | I166 | I166-L188 HydrophobicContact CB-CD2 4.35Å; I166-L188 WeakPolarHBondContact CD1-O 3.44Å; I166-L188 HydrophobicContact CG2-CD2 4.03Å |
| 189 | D | 71.2 | Confident | 82.6 | Confident | 109 Ų | 109 | 48.2 Ų | 48.2 | 58% | 0.583 | 28% | 0.279 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.1 | -13.9 | 175.4 | -63.1 | -54.8 | 0 | 0 | 0 | 112.8 | N187 Y191 | N187-D189 PolarHBondContact O-N 3.11Å; N187-D189 PolarHBondContact OD1-N 3.32Å; N187-D189 VanDerWaalsContact OD1-N 3.13Å; D189-Y191 VanDerWaalsContact C-N 3.29Å; D189-Y191 PolarHBondContact O-N 3.01Å |
| 190 | M | 79.9 | Confident | 82.3 | Confident | 77 Ų | 77 | 51.4 Ų | 51.4 | 38% | 0.379 | 29% | 0.285 | S | S | . | . | trans | -90.8 | 31.9 | -177.2 | -70.4 | -178.9 | 67 | 0 | 0 | 113.8 | N187 G192 Q193 A194 | N187-M190 HydrophobicContact CB-CB 4.06Å; N187-M190 HydrophobicContact CB-CG 3.89Å; N187-M190 HydrophobicContact CB-SD 3.76Å; N187-M190 WeakPolarHBondContact ND2-CG 3.41Å; N187-M190 PolarHBondContact ND2-SD 3.1Å; N187-M190 PolarHBondContact O-N 2.86Å; M190-G192 PolarHBondContact O-N 3.09Å; M190-Q193 HydrophobicContact CB-CB 4.22Å; M190-Q193 HydrophobicContact CE-CB 3.96Å; M190-Q193 HydrophobicContact CE-CG 3.85Å; M190-Q193 WeakPolarHBondContact O-CB 3.34Å; M190-Q193 PolarHBondContact O-N 3.08Å; M190-A194 PolarHBondContact O-N 3.3Å | ||
| 191 | Y | 87.5 | Confident | 81.5 | Confident | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -58.1 | -42.4 | -176.8 | 166.4 | -113.9 | 0 | 0 | 0 | 113.4 | W106 V110 F151 H156 N162 R165 I166 D189 Q193 A194 L195 | W106-Y191 WeakPolarHBondContact CH2-OH 3.36Å; V110-Y191 HydrophobicContact CG1-CD1 3.26Å; V110-Y191 HydrophobicContact CG1-CE1 3.48Å; V110-Y191 VanDerWaalsContact CG1-CE1 3.48Å; V110-Y191 HydrophobicContact CG1-CG 4.32Å; V110-Y191 HydrophobicContact CG2-CE1 4.24Å; F151-Y191 AromaticContact CE1-CE2 3.88Å; F151-Y191 HydrophobicContact CE1-CE2 3.88Å; F151-Y191 WeakPolarHBondContact CE1-OH 3.2Å; F151-Y191 HydrophobicContact CZ-CE2 4.24Å; H156-Y191 AromaticContact CE1-CE1 3.99Å; H156-Y191 AromaticContact ND1-CE1 3.53Å; H156-Y191 AromaticContact ND1-CZ 3.8Å; H156-Y191 PolarHBondContact ND1-OH 3.23Å; N162-Y191 HydrophobicContact CB-CD1 4.35Å; N162-Y191 HydrophobicContact CB-CG 4.27Å; N162-Y191 VanDerWaalsContact OD1-CD1 3.29Å; N162-Y191 WeakPolarHBondContact OD1-CD1 3.34Å; R165-Y191 HydrophobicContact CB-CD2 3.8Å; R165-Y191 HydrophobicContact CB-CE1 4.38Å; R165-Y191 HydrophobicContact CB-CE2 3.54Å; R165-Y191 HydrophobicContact CB-CG 4.3Å; R165-Y191 VanDerWaalsContact CD-CE1 3.5Å; R165-Y191 HydrophobicContact CG-CE2 4.42Å; I166-Y191 HydrophobicContact CG1-CD2 3.95Å; I166-Y191 HydrophobicContact CG1-CG 4.4Å; D189-Y191 VanDerWaalsContact C-N 3.29Å; D189-Y191 PolarHBondContact O-N 3.01Å; Y191-Q193 VanDerWaalsContact C-N 3.32Å; Y191-Q193 PolarHBondContact O-N 3.17Å; Y191-A194 PolarHBondContact O-N 3.1Å; Y191-L195 HydrophobicContact CD2-CD1 4.39Å; Y191-L195 HydrophobicContact CD2-CG 4.43Å; Y191-L195 HydrophobicContact CE1-CD1 4.09Å; Y191-L195 HydrophobicContact CE2-CD1 3.69Å; Y191-L195 HydrophobicContact CE2-CD2 4.38Å; Y191-L195 HydrophobicContact CE2-CG 3.99Å; Y191-L195 PolarHBondContact O-N 3.34Å |
| 192 | G | 87.8 | Confident | 81.4 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.2 | -39.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | M190 L195 R196 | M190-G192 PolarHBondContact O-N 3.09Å; G192-L195 PolarHBondContact O-N 2.77Å; G192-R196 WeakPolarHBondContact O-CG 3.44Å; G192-R196 PolarHBondContact O-N 3.13Å; G192-R196 VanDerWaalsContact O-N 3.15Å |
| 193 | Q | 85.9 | Confident | 81.4 | Confident | 60 Ų | 60 | 54.2 Ų | 54.2 | 28% | 0.28 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -68.9 | -43 | 176.5 | -168 | 59.1 | 37.9 | 0 | 0 | 112.3 | M190 Y191 L195 R196 D197 | M190-Q193 HydrophobicContact CB-CB 4.22Å; M190-Q193 HydrophobicContact CE-CB 3.96Å; M190-Q193 HydrophobicContact CE-CG 3.85Å; M190-Q193 WeakPolarHBondContact O-CB 3.34Å; M190-Q193 PolarHBondContact O-N 3.08Å; Y191-Q193 VanDerWaalsContact C-N 3.32Å; Y191-Q193 PolarHBondContact O-N 3.17Å; Q193-L195 PolarHBondContact O-N 2.91Å; Q193-R196 PolarHBondContact O-N 3.27Å; Q193-D197 PolarHBondContact NE2-OD1 3.22Å; Q193-D197 VanDerWaalsContact O-CG 3.24Å; Q193-D197 PolarHBondContact O-N 2.94Å |
| 194 | A | 88.1 | Confident | 81.4 | Confident | 2 Ų | 2 | 52 Ų | 52 | 2% | 0.017 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.6 | -34.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L169 L185 M190 Y191 L198 | L169-A194 HydrophobicContact CD2-CB 4.48Å; L185-A194 HydrophobicContact CD2-CB 3.99Å; M190-A194 PolarHBondContact O-N 3.3Å; Y191-A194 PolarHBondContact O-N 3.1Å; A194-L198 WeakPolarHBondContact O-CB 3.5Å; A194-L198 PolarHBondContact O-N 3.34Å |
| 195 | L | 91.2 | Very high | 81.6 | Confident | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -72.8 | -38.4 | 173.2 | -69.6 | 178.4 | 0 | 0 | 0 | 113 | W106 I107 I148 F151 L169 Y191 G192 Q193 L198 K199 | W106-L195 HydrophobicContact CH2-CD1 3.47Å; W106-L195 VanDerWaalsContact CH2-CD1 3.47Å; W106-L195 HydrophobicContact CZ2-CD1 4.35Å; W106-L195 HydrophobicContact CZ3-CD1 3.77Å; I107-L195 HydrophobicContact CD1-CB 4.11Å; I107-L195 HydrophobicContact CG1-CB 4.33Å; I107-L195 HydrophobicContact CG1-CD1 4.25Å; I107-L195 HydrophobicContact CG2-CB 3.8Å; I148-L195 HydrophobicContact CD1-CD2 4.03Å; F151-L195 HydrophobicContact CD1-CD2 4.44Å; F151-L195 HydrophobicContact CE1-CD2 4.19Å; L169-L195 HydrophobicContact CD1-CD2 4.36Å; L169-L195 HydrophobicContact CD2-CD2 3.93Å; Y191-L195 HydrophobicContact CD2-CD1 4.39Å; Y191-L195 HydrophobicContact CD2-CG 4.43Å; Y191-L195 HydrophobicContact CE1-CD1 4.09Å; Y191-L195 HydrophobicContact CE2-CD1 3.69Å; Y191-L195 HydrophobicContact CE2-CD2 4.38Å; Y191-L195 HydrophobicContact CE2-CG 3.99Å; Y191-L195 PolarHBondContact O-N 3.34Å; G192-L195 PolarHBondContact O-N 2.77Å; Q193-L195 PolarHBondContact O-N 2.91Å; L195-L198 PolarHBondContact O-N 3.28Å; L195-K199 PolarHBondContact O-N 3.43Å |
| 196 | R | 88.5 | Confident | 81.6 | Confident | 78 Ų | 78 | 57.1 Ų | 57.1 | 29% | 0.294 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | 174.8 | -72 | -176.2 | -69.1 | -101.9 | 10 | 112.1 | I107 D111 G192 Q193 L198 K199 | I107-R196 HydrophobicContact CG2-CG 3.72Å; D111-R196 IonicContact OD1-NH2 2.66Å; D111-R196 IonicContact OD2-CZ 2.68Å; D111-R196 VanDerWaalsContact OD2-CZ 3.27Å; D111-R196 IonicContact OD2-NH1 2.73Å; D111-R196 PolarHBondContact OD2-NH1 3.18Å; D111-R196 IonicContact OD2-NH2 3.27Å; D111-R196 PolarHBondContact OD2-NH2 2.85Å; G192-R196 WeakPolarHBondContact O-CG 3.44Å; G192-R196 PolarHBondContact O-N 3.13Å; G192-R196 VanDerWaalsContact O-N 3.15Å; Q193-R196 PolarHBondContact O-N 3.27Å; R196-L198 VanDerWaalsContact C-N 3.3Å; R196-L198 PolarHBondContact O-N 3.39Å; R196-K199 PolarHBondContact O-N 3.35Å |
| 197 | D | 85.9 | Confident | 82 | Confident | 34 Ų | 34 | 55.4 Ų | 55.4 | 18% | 0.182 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -69.2 | -30.2 | 177.9 | -62.5 | -21.2 | 0 | 0 | 0 | 111.7 | S184 Q193 I200 V201 | S184-D197 WeakPolarHBondContact CB-OD2 3.48Å; S184-D197 PolarHBondContact OG-OD2 3.04Å; Q193-D197 PolarHBondContact NE2-OD1 3.22Å; Q193-D197 VanDerWaalsContact O-CG 3.24Å; Q193-D197 PolarHBondContact O-N 2.94Å; D197-I200 WeakPolarHBondContact O-CG1 3.35Å; D197-V201 WeakPolarHBondContact O-CG2 3.42Å |
| 198 | L | 87.8 | Confident | 82.5 | Confident | 1 Ų | 1 | 54.5 Ų | 54.5 | 1% | 0.005 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -73.2 | -29.7 | 177.2 | -167.7 | 64.1 | 0 | 0 | 0 | 113.3 | F137 W144 F147 L169 L173 L177 V181 A194 L195 R196 I200 | F137-L198 HydrophobicContact CD1-CD1 3.99Å; F137-L198 HydrophobicContact CD1-CD2 4.1Å; F137-L198 HydrophobicContact CD1-CG 4.03Å; F137-L198 HydrophobicContact CE1-CD1 4.02Å; F137-L198 HydrophobicContact CE1-CD2 4.38Å; F137-L198 HydrophobicContact CE1-CG 3.89Å; W144-L198 HydrophobicContact CH2-CB 4.29Å; W144-L198 HydrophobicContact CH2-CD2 4.46Å; W144-L198 HydrophobicContact CH2-CG 4.42Å; W144-L198 HydrophobicContact CZ3-CB 4.1Å; W144-L198 HydrophobicContact CZ3-CD2 3.83Å; W144-L198 HydrophobicContact CZ3-CG 3.76Å; F147-L198 HydrophobicContact CE1-CD2 3.85Å; L169-L198 HydrophobicContact CD1-CD2 3.99Å; L173-L198 HydrophobicContact CD1-CD1 3.98Å; L173-L198 HydrophobicContact CD2-CD1 3.95Å; L173-L198 HydrophobicContact CD2-CD2 3.65Å; L173-L198 HydrophobicContact CD2-CG 4.46Å; L177-L198 HydrophobicContact CD1-CD1 4.01Å; L177-L198 HydrophobicContact CD2-CD1 3.63Å; L177-L198 HydrophobicContact CG-CD1 3.85Å; V181-L198 HydrophobicContact CG2-CD1 4.39Å; A194-L198 WeakPolarHBondContact O-CB 3.5Å; A194-L198 PolarHBondContact O-N 3.34Å; L195-L198 PolarHBondContact O-N 3.28Å; R196-L198 VanDerWaalsContact C-N 3.3Å; R196-L198 PolarHBondContact O-N 3.39Å; L198-I200 PolarHBondContact O-N 3.3Å |
| 199 | K | 85 | Confident | 83.4 | Confident | 98 Ų | 98 | 52.4 Ų | 52.4 | 43% | 0.426 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.1 | -20.8 | 177.3 | -178.7 | 173.3 | 176.2 | 164.2 | 0 | 113.5 | D104 W144 L195 R196 | D104-K199 IonicContact OD1-NZ 2.74Å; D104-K199 PolarHBondContact OD1-NZ 3.41Å; D104-K199 WeakPolarHBondContact OD2-CD 3.28Å; D104-K199 WeakPolarHBondContact OD2-CE 3.38Å; D104-K199 IonicContact OD2-NZ 2.82Å; D104-K199 PolarHBondContact OD2-NZ 3.18Å; W144-K199 HydrophobicContact CH2-CB 4.03Å; W144-K199 HydrophobicContact CZ2-CB 3.62Å; W144-K199 HydrophobicContact CZ2-CD 4.34Å; W144-K199 HydrophobicContact CZ2-CG 4.02Å; L195-K199 PolarHBondContact O-N 3.43Å; R196-K199 PolarHBondContact O-N 3.35Å |
| 200 | I | 77.1 | Confident | 84.4 | Confident | 136 Ų | 136 | 47.7 Ų | 47.7 | 70% | 0.697 | 23% | 0.234 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -109.4 | 8.6 | -170.5 | 63.1 | 166.6 | 0 | 0 | 0 | 114.3 | D197 L198 | D197-I200 WeakPolarHBondContact O-CG1 3.35Å; L198-I200 PolarHBondContact O-N 3.3Å |
| 201 | V | 68.4 | Low | 84.8 | Confident | 86 Ų | 86 | 45 Ų | 45 | 52% | 0.521 | 22% | 0.22 | S | C | . | . | trans | -83.1 | 0 | 173.6 | -171.4 | 0 | 0 | 0 | 0 | 110.5 | L177 V181 D197 | L177-V201 HydrophobicContact CD1-CB 3.97Å; L177-V201 HydrophobicContact CD1-CG1 3.65Å; L177-V201 HydrophobicContact CD1-CG2 3.91Å; V181-V201 HydrophobicContact CG1-CG2 4.02Å; D197-V201 WeakPolarHBondContact O-CG2 3.42Å |
Retrieved 201 of 201 residues in 216.6 ms
(Link to these results)