| 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 | L | 34.5 | Very low | 42.8 | Very low | 223 Ų | 223 | 146.4 Ų | 146.4 | 100% | 1.168 | 79% | 0.787 | S | S | * | * | 0 | 122 | 0 | -96.6 | 151.5 | 0 | 0 | 0 | 107.8 | |||||
| 2 | S | 40.9 | Very low | 42.3 | Very low | 104 Ų | 104 | 145.3 Ų | 145.3 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | trans | 50 | 96.3 | 165.7 | 54.9 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 3 | V | 45.9 | Very low | 42.2 | Very low | 132 Ų | 132 | 146.6 Ų | 146.6 | 80% | 0.8 | 79% | 0.785 | S | S | * | * | 69.3 | 87 | 90.8 | 179.8 | 0 | 0 | 0 | 0 | 111.3 | A5 | V3-A5 HydrophobicContact CG1-CB 3.74Å; V3-A5 PolarHBondContact O-N 3.42Å | |||
| 4 | D | 44.2 | Very low | 42 | Very low | 146 Ų | 146 | 147.1 Ų | 147.1 | 78% | 0.781 | 78% | 0.78 | S | S | * | * | trans | -82.6 | 94.9 | 158.5 | -170 | 35.3 | 0 | 0 | 0 | 107.1 | ||||
| 5 | A | 51.1 | Low | 41.9 | Very low | 79 Ų | 79 | 146.9 Ų | 146.9 | 65% | 0.653 | 79% | 0.786 | S | S | * | * | trans | -111 | 80.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | V3 P7 | V3-A5 HydrophobicContact CG1-CB 3.74Å; V3-A5 PolarHBondContact O-N 3.42Å; A5-P7 WeakPolarHBondContact O-CD 3.4Å | ||
| 6 | R | 42.1 | Very low | 41.2 | Very low | 207 Ų | 207 | 145.4 Ų | 145.4 | 78% | 0.781 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 120.9 | 160.4 | -77.7 | -72.3 | -142.9 | -85.5 | 0 | 108.1 | R8 | R6-R8 PolarHBondContact O-N 3.26Š|
| 7 | P | 46.7 | Very low | 40.8 | Very low | 122 Ų | 122 | 142.6 Ų | 142.6 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 119.3 | 171.8 | 25.4 | -30.1 | 0 | 0 | 0 | 109.5 | A5 | A5-P7 WeakPolarHBondContact O-CD 3.4Š|
| 8 | R | 42 | Very low | 40.6 | Very low | 226 Ų | 226 | 140.4 Ų | 140.4 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 125.3 | 173.6 | -164.3 | -169 | -63.9 | -108.3 | 3.5 | 108 | R6 E10 | R6-R8 PolarHBondContact O-N 3.26Å; R8-E10 PolarHBondContact O-N 3.34Å |
| 9 | I | 41.5 | Very low | 40.4 | Very low | 157 Ų | 157 | 140.6 Ų | 140.6 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | trans | -66.3 | 114.3 | 174.6 | -61.6 | 180 | 0 | 0 | 0 | 107.9 | ||||
| 10 | E | 44.7 | Very low | 40.4 | Very low | 162 Ų | 162 | 141.5 Ų | 141.5 | 76% | 0.757 | 80% | 0.796 | S | S | * | * | trans | -96.3 | 93.8 | 167 | -162.5 | 65.6 | -152 | 0 | 0 | 107.6 | R8 | R8-E10 PolarHBondContact O-N 3.34Š| ||
| 11 | G | 36.7 | Very low | 40.1 | Very low | 52 Ų | 52 | 142 Ų | 142 | 54% | 0.536 | 80% | 0.797 | S | S | . | * | trans | -86.1 | 102.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | I13 | G11-I13 PolarHBondContact O-N 3.38Š| ||
| 12 | N | 37.7 | Very low | 40.1 | Very low | 134 Ų | 134 | 134.7 Ų | 134.7 | 72% | 0.717 | 78% | 0.776 | S | S | * | * | trans | -86.5 | 98.7 | 168.6 | -167.5 | 61.1 | 0 | 0 | 0 | 108.7 | ||||
| 13 | I | 40.8 | Very low | 39.6 | Very low | 162 Ų | 162 | 133.3 Ų | 133.3 | 83% | 0.831 | 78% | 0.777 | S | S | * | * | trans | -107.3 | 81.9 | 177.5 | -44.3 | 156 | 0 | 0 | 0 | 106.2 | G11 | G11-I13 PolarHBondContact O-N 3.38Š| ||
| 14 | E | 39.9 | Very low | 38.9 | Very low | 154 Ų | 154 | 135.9 Ų | 135.9 | 72% | 0.72 | 78% | 0.778 | S | S | * | * | trans | -131.1 | 70.9 | 173.2 | -154.7 | 175.3 | -159.9 | 0 | 0 | 109.6 | ||||
| 15 | V | 39.5 | Very low | 38.6 | Very low | 143 Ų | 143 | 135.4 Ų | 135.4 | 87% | 0.867 | 78% | 0.775 | S | S | * | * | trans | -137.6 | 85.8 | 144 | -174.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 16 | T | 30.6 | Very low | 38 | Very low | 124 Ų | 124 | 136.2 Ų | 136.2 | 76% | 0.761 | 78% | 0.776 | S | S | * | * | trans | -72.4 | 139.8 | 160.2 | 38.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 17 | A | 34.2 | Very low | 38.1 | Very low | 97 Ų | 97 | 133.5 Ų | 133.5 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | trans | 88.7 | 81.1 | 159.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 18 | A | 38.2 | Very low | 37.9 | Very low | 103 Ų | 103 | 136.3 Ų | 136.3 | 85% | 0.851 | 78% | 0.777 | S | S | * | * | -148.2 | 98.7 | 125.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 19 | V | 36.6 | Very low | 38.1 | Very low | 145 Ų | 145 | 134 Ų | 134 | 88% | 0.879 | 77% | 0.77 | S | S | * | * | trans | -79.3 | 113.2 | 160.1 | 172 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 20 | D | 39.7 | Very low | 38.4 | Very low | 157 Ų | 157 | 132 Ų | 132 | 84% | 0.84 | 77% | 0.765 | S | S | * | * | trans | -116.6 | 120.3 | 156.5 | -171.1 | 48.7 | 0 | 0 | 0 | 107.5 | ||||
| 21 | D | 34.1 | Very low | 38.3 | Very low | 154 Ų | 154 | 130.3 Ų | 130.3 | 82% | 0.824 | 76% | 0.76 | S | S | * | * | trans | -91.9 | 110.2 | -175.9 | -177.8 | -124.1 | 0 | 0 | 0 | 107.8 | ||||
| 22 | G | 34.1 | Very low | 39 | Very low | 69 Ų | 69 | 133.3 Ų | 133.3 | 71% | 0.711 | 76% | 0.764 | S | S | * | * | trans | -173.6 | 77 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 23 | G | 31.1 | Very low | 39.8 | Very low | 74 Ų | 74 | 134 Ų | 134 | 76% | 0.763 | 76% | 0.763 | S | S | * | * | trans | -63 | 151.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 24 | K | 31.9 | Very low | 40.3 | Very low | 187 Ų | 187 | 129.9 Ų | 129.9 | 81% | 0.813 | 75% | 0.747 | S | S | * | * | S | Bend | trans | 102.8 | 96.4 | 155.3 | -61.2 | -161.1 | 173.3 | 74.5 | 0 | 117.5 | ||
| 25 | D | 36.4 | Very low | 41.1 | Very low | 135 Ų | 135 | 127.1 Ų | 127.1 | 72% | 0.722 | 74% | 0.74 | S | S | * | * | trans | 82.9 | 43.9 | 130.4 | -48.4 | -21.3 | 0 | 0 | 0 | 118.1 | D27 | D25-D27 VanDerWaalsContact C-N 3.26Š| ||
| 26 | S | 39.4 | Very low | 41.7 | Very low | 96 Ų | 96 | 128.6 Ų | 128.6 | 67% | 0.671 | 73% | 0.73 | S | S | * | * | trans | -82 | 4.5 | 161.6 | 56.1 | 0 | 0 | 0 | 0 | 114.4 | F28 | S26-F28 PolarHBondContact O-N 3.06Š| ||
| 27 | D | 44.3 | Very low | 43 | Very low | 150 Ų | 150 | 128.7 Ų | 128.7 | 80% | 0.802 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | 13.5 | 179.6 | -69.2 | -17.3 | 0 | 0 | 0 | 114 | D25 | D25-D27 VanDerWaalsContact C-N 3.26Š|
| 28 | F | 43 | Very low | 44.2 | Very low | 182 Ų | 182 | 126.2 Ų | 126.2 | 80% | 0.798 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | 3.6 | -180 | -140.1 | -97.3 | 0 | 0 | 0 | 114.9 | S26 | S26-F28 PolarHBondContact O-N 3.06Š|
| 29 | Y | 45 | Very low | 45.3 | Very low | 177 Ų | 177 | 124 Ų | 124 | 69% | 0.694 | 67% | 0.673 | S | S | * | * | trans | -121.3 | 16.8 | -172.8 | -67.1 | -74.1 | 0 | 0 | 0 | 116.1 | L31 | Y29-L31 VanDerWaalsContact C-N 3.29Å; Y29-L31 PolarHBondContact O-N 3.44Å | ||
| 30 | T | 49.1 | Very low | 46.4 | Very low | 116 Ų | 116 | 120.4 Ų | 120.4 | 71% | 0.712 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -0.1 | 175.2 | -63.2 | 0 | 0 | 0 | 0 | 113.9 | ||
| 31 | L | 41.3 | Very low | 47.6 | Very low | 125 Ų | 125 | 118.7 Ų | 118.7 | 65% | 0.654 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | -13.7 | -177.5 | -135.7 | 78.9 | 0 | 0 | 0 | 115.2 | Y29 P34 | Y29-L31 VanDerWaalsContact C-N 3.29Å; Y29-L31 PolarHBondContact O-N 3.44Å; L31-P34 WeakPolarHBondContact O-CD 3.28Å |
| 32 | D | 53.1 | Low | 48.6 | Very low | 115 Ų | 115 | 113.5 Ų | 113.5 | 62% | 0.615 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -91.9 | -13 | -172.3 | -75.1 | -52 | 0 | 0 | 0 | 115.1 | ||
| 33 | E | 52.7 | Low | 49.8 | Very low | 150 Ų | 150 | 115.9 Ų | 115.9 | 70% | 0.701 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -61.8 | -31.1 | 179.9 | -90.8 | 177.4 | 158.3 | 0 | 0 | 116.1 | ||
| 34 | P | 51.4 | Low | 51.5 | Low | 75 Ų | 75 | 116.9 Ų | 116.9 | 49% | 0.487 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -84.7 | -34 | -174.4 | 28.2 | -30.5 | 0 | 0 | 0 | 114.4 | L31 T38 | L31-P34 WeakPolarHBondContact O-CD 3.28Å; P34-T38 VanDerWaalsContact O-CB 3.3Å; P34-T38 WeakPolarHBondContact O-CB 3.1Å; P34-T38 PolarHBondContact O-N 3.13Å; P34-T38 VanDerWaalsContact O-N 3.15Å; P34-T38 PolarHBondContact O-OG1 3.12Å |
| 35 | V | 57.8 | Low | 52.6 | Low | 96 Ų | 96 | 110.9 Ų | 110.9 | 58% | 0.582 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -76.2 | -43 | -166 | -175 | 0 | 0 | 0 | 0 | 111.7 | T38 V39 | V35-T38 WeakPolarHBondContact O-CB 3.47Å; V35-T38 PolarHBondContact O-N 2.89Å; V35-V39 WeakPolarHBondContact O-CG2 3.42Å; V35-V39 PolarHBondContact O-N 3.44Å |
| 36 | W | 51 | Low | 53.5 | Low | 174 Ų | 174 | 106.4 Ų | 106.4 | 66% | 0.659 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -71 | -42.7 | -176.8 | -172.2 | -103.2 | 0 | 0 | 0 | 111.9 | T38 V39 V40 | W36-T38 PolarHBondContact O-N 3.28Å; W36-V39 PolarHBondContact O-N 2.88Å; W36-V39 VanDerWaalsContact O-N 3.12Å; W36-V40 HydrophobicContact CD2-CG2 4.42Å; W36-V40 HydrophobicContact CG-CG2 4.35Å; W36-V40 HydrophobicContact CZ2-CG2 4.49Å; W36-V40 WeakPolarHBondContact O-CB 3.26Å; W36-V40 WeakPolarHBondContact O-CG2 3.46Å; W36-V40 PolarHBondContact O-N 3.42Å |
| 37 | E | 59.3 | Low | 54.3 | Low | 125 Ų | 125 | 109.3 Ų | 109.3 | 58% | 0.584 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -57.8 | -41.7 | 173.2 | -65.3 | -163.7 | 165.5 | 0 | 0 | 110.5 | V39 V40 E41 | E37-V39 PolarHBondContact O-N 3.24Å; E37-V40 PolarHBondContact O-N 3.22Å; E37-E41 WeakPolarHBondContact O-CB 3.12Å; E37-E41 WeakPolarHBondContact O-CG 3.35Å; E37-E41 PolarHBondContact O-N 3.24Å |
| 38 | T | 59.2 | Low | 54.7 | Low | 46 Ų | 46 | 107.6 Ų | 107.6 | 28% | 0.282 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.8 | -43 | 175 | -60.2 | 0 | 0 | 0 | 0 | 112.7 | P34 V35 W36 A42 L69 | P34-T38 VanDerWaalsContact O-CB 3.3Å; P34-T38 WeakPolarHBondContact O-CB 3.1Å; P34-T38 PolarHBondContact O-N 3.13Å; P34-T38 VanDerWaalsContact O-N 3.15Å; P34-T38 PolarHBondContact O-OG1 3.12Å; V35-T38 WeakPolarHBondContact O-CB 3.47Å; V35-T38 PolarHBondContact O-N 2.89Å; W36-T38 PolarHBondContact O-N 3.28Å; T38-A42 VanDerWaalsContact O-CB 3.22Å; T38-A42 WeakPolarHBondContact O-CB 3.33Å; T38-A42 PolarHBondContact O-N 2.73Å; T38-L69 HydrophobicContact CG2-CD1 4.04Å; T38-L69 HydrophobicContact CG2-CD2 3.53Å; T38-L69 HydrophobicContact CG2-CG 4.4Å |
| 39 | V | 61.2 | Low | 55.2 | Low | 57 Ų | 57 | 100 Ų | 100 | 35% | 0.345 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -70 | -38.9 | 178.2 | 173.5 | 0 | 0 | 0 | 0 | 111.3 | V35 W36 E37 A42 K43 | V35-V39 WeakPolarHBondContact O-CG2 3.42Å; V35-V39 PolarHBondContact O-N 3.44Å; W36-V39 PolarHBondContact O-N 2.88Å; W36-V39 VanDerWaalsContact O-N 3.12Å; E37-V39 PolarHBondContact O-N 3.24Å; V39-A42 PolarHBondContact O-N 3.33Å; V39-K43 HydrophobicContact CG1-CD 4.32Å; V39-K43 WeakPolarHBondContact O-CB 3.44Å; V39-K43 VanDerWaalsContact O-CG 3.3Å; V39-K43 WeakPolarHBondContact O-CG 3.23Å; V39-K43 PolarHBondContact O-N 3.09Å |
| 40 | V | 58.5 | Low | 55.6 | Low | 68 Ų | 68 | 96.8 Ų | 96.8 | 41% | 0.412 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.4 | -44.5 | 178.1 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | W36 E37 K43 Q44 | W36-V40 HydrophobicContact CD2-CG2 4.42Å; W36-V40 HydrophobicContact CG-CG2 4.35Å; W36-V40 HydrophobicContact CZ2-CG2 4.49Å; W36-V40 WeakPolarHBondContact O-CB 3.26Å; W36-V40 WeakPolarHBondContact O-CG2 3.46Å; W36-V40 PolarHBondContact O-N 3.42Å; E37-V40 PolarHBondContact O-N 3.22Å; V40-K43 WeakPolarHBondContact O-CB 3.37Å; V40-K43 PolarHBondContact O-N 3.11Å; V40-Q44 WeakPolarHBondContact O-CB 3.19Å; V40-Q44 PolarHBondContact O-N 3.43Å |
| 41 | E | 65.4 | Low | 55.9 | Low | 121 Ų | 121 | 99.7 Ų | 99.7 | 57% | 0.565 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63 | -44.8 | 173.8 | -74 | -167.4 | 157.9 | 0 | 0 | 111.1 | E37 K43 Q44 L45 | E37-E41 WeakPolarHBondContact O-CB 3.12Å; E37-E41 WeakPolarHBondContact O-CG 3.35Å; E37-E41 PolarHBondContact O-N 3.24Å; E41-K43 VanDerWaalsContact C-N 3.32Å; E41-K43 PolarHBondContact O-N 3.09Å; E41-Q44 PolarHBondContact O-N 2.94Å; E41-Q44 VanDerWaalsContact O-N 3.14Å; E41-L45 VanDerWaalsContact O-CB 3.31Å; E41-L45 WeakPolarHBondContact O-CB 3.46Å; E41-L45 VanDerWaalsContact O-CG 3.22Å; E41-L45 WeakPolarHBondContact O-CG 3.41Å; E41-L45 PolarHBondContact O-N 3.45Å |
| 42 | A | 56.3 | Low | 56.5 | Low | 46 Ų | 46 | 95.4 Ų | 95.4 | 38% | 0.38 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.5 | -43.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | T38 V39 F46 | T38-A42 VanDerWaalsContact O-CB 3.22Å; T38-A42 WeakPolarHBondContact O-CB 3.33Å; T38-A42 PolarHBondContact O-N 2.73Å; V39-A42 PolarHBondContact O-N 3.33Å; A42-F46 VanDerWaalsContact O-CB 3.25Å; A42-F46 WeakPolarHBondContact O-CB 3.41Å; A42-F46 PolarHBondContact O-N 2.87Å |
| 43 | K | 59.3 | Low | 56.4 | Low | 118 Ų | 118 | 102.2 Ų | 102.2 | 51% | 0.513 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.9 | -42.8 | 174.6 | -78.9 | 176.1 | -179.5 | 177.5 | 0 | 112 | V39 V40 E41 R47 | V39-K43 HydrophobicContact CG1-CD 4.32Å; V39-K43 WeakPolarHBondContact O-CB 3.44Å; V39-K43 VanDerWaalsContact O-CG 3.3Å; V39-K43 WeakPolarHBondContact O-CG 3.23Å; V39-K43 PolarHBondContact O-N 3.09Å; V40-K43 WeakPolarHBondContact O-CB 3.37Å; V40-K43 PolarHBondContact O-N 3.11Å; E41-K43 VanDerWaalsContact C-N 3.32Å; E41-K43 PolarHBondContact O-N 3.09Å; K43-R47 WeakPolarHBondContact O-CB 3.27Å; K43-R47 PolarHBondContact O-N 3.36Å |
| 44 | Q | 65.6 | Low | 56.2 | Low | 96 Ų | 96 | 103.6 Ų | 103.6 | 45% | 0.449 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.6 | -43.3 | -179.4 | -174.2 | 74.4 | -56.5 | 0 | 0 | 111.5 | V40 E41 F46 R47 H48 | V40-Q44 WeakPolarHBondContact O-CB 3.19Å; V40-Q44 PolarHBondContact O-N 3.43Å; E41-Q44 PolarHBondContact O-N 2.94Å; E41-Q44 VanDerWaalsContact O-N 3.14Å; Q44-F46 VanDerWaalsContact C-N 3.33Å; Q44-F46 PolarHBondContact O-N 3.36Å; Q44-R47 WeakPolarHBondContact O-CB 2.91Å; Q44-R47 PolarHBondContact O-N 3.14Å; Q44-H48 WeakPolarHBondContact O-CB 3.48Å; Q44-H48 PolarHBondContact O-N 3.02Å |
| 45 | L | 55.6 | Low | 56.3 | Low | 60 Ų | 60 | 104.8 Ų | 104.8 | 31% | 0.314 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.6 | -43.8 | 174.4 | -72.7 | 174.8 | 0 | 0 | 0 | 111 | E41 H48 A49 I62 A65 | E41-L45 VanDerWaalsContact O-CB 3.31Å; E41-L45 WeakPolarHBondContact O-CB 3.46Å; E41-L45 VanDerWaalsContact O-CG 3.22Å; E41-L45 WeakPolarHBondContact O-CG 3.41Å; E41-L45 PolarHBondContact O-N 3.45Å; L45-H48 PolarHBondContact O-N 3.35Å; L45-A49 WeakPolarHBondContact O-CB 3.09Å; L45-A49 PolarHBondContact O-N 3.02Å; L45-I62 HydrophobicContact CB-CG1 4.31Å; L45-I62 HydrophobicContact CD2-CG1 4.36Å; L45-A65 HydrophobicContact CD1-CB 4.04Å |
| 46 | F | 54.7 | Low | 56.1 | Low | 41 Ų | 41 | 106.5 Ų | 106.5 | 18% | 0.18 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -61.8 | -45.6 | 175.4 | -163.2 | -82.3 | 0 | 0 | 0 | 111.7 | A42 Q44 H48 A49 L50 D151 I154 | A42-F46 VanDerWaalsContact O-CB 3.25Å; A42-F46 WeakPolarHBondContact O-CB 3.41Å; A42-F46 PolarHBondContact O-N 2.87Å; Q44-F46 VanDerWaalsContact C-N 3.33Å; Q44-F46 PolarHBondContact O-N 3.36Å; F46-H48 VanDerWaalsContact C-N 3.29Å; F46-H48 PolarHBondContact O-N 3.47Å; F46-A49 PolarHBondContact O-N 3.48Å; F46-L50 HydrophobicContact CD1-CD1 4.34Å; F46-L50 HydrophobicContact CE1-CD1 3.59Å; F46-L50 HydrophobicContact CZ-CD1 4.42Å; F46-L50 WeakPolarHBondContact O-CB 3.34Å; F46-L50 PolarHBondContact O-N 3.2Å; F46-D151 HydrophobicContact CE2-CB 3.96Å; F46-D151 WeakPolarHBondContact CE2-OD1 3.48Å; F46-D151 WeakPolarHBondContact CZ-OD1 3.3Å; F46-I154 HydrophobicContact CD1-CB 4.46Å; F46-I154 HydrophobicContact CD1-CD1 3.29Å; F46-I154 HydrophobicContact CD1-CG1 4.41Å; F46-I154 HydrophobicContact CD1-CG2 4.16Å; F46-I154 HydrophobicContact CD2-CD1 3.94Å; F46-I154 HydrophobicContact CE1-CB 3.56Å; F46-I154 HydrophobicContact CE1-CD1 3.23Å; F46-I154 HydrophobicContact CE1-CG1 3.96Å; F46-I154 HydrophobicContact CE1-CG2 3.29Å; F46-I154 HydrophobicContact CE2-CD1 3.89Å; F46-I154 HydrophobicContact CG-CD1 3.66Å; F46-I154 HydrophobicContact CZ-CB 3.66Å; F46-I154 HydrophobicContact CZ-CD1 3.55Å; F46-I154 HydrophobicContact CZ-CG1 4.17Å; F46-I154 HydrophobicContact CZ-CG2 3.87Å |
| 47 | R | 57.4 | Low | 56.2 | Low | 157 Ų | 157 | 108.4 Ų | 108.4 | 59% | 0.592 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -58.8 | -41.4 | 175.4 | -168.4 | -173.6 | -59.9 | 156.7 | -6.1 | 111.6 | K43 Q44 L50 F51 | K43-R47 WeakPolarHBondContact O-CB 3.27Å; K43-R47 PolarHBondContact O-N 3.36Å; Q44-R47 WeakPolarHBondContact O-CB 2.91Å; Q44-R47 PolarHBondContact O-N 3.14Å; R47-L50 PolarHBondContact O-N 2.98Å; R47-F51 VanDerWaalsContact O-CB 3.32Å; R47-F51 WeakPolarHBondContact O-CB 3.45Å; R47-F51 PolarHBondContact O-N 2.91Å |
| 48 | H | 52.8 | Low | 55.9 | Low | 115 Ų | 115 | 103.8 Ų | 103.8 | 53% | 0.532 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.9 | -37 | 178.6 | -131.8 | -111.2 | 0 | 0 | 0 | 112.6 | Q44 L45 F46 S52 | Q44-H48 WeakPolarHBondContact O-CB 3.48Å; Q44-H48 PolarHBondContact O-N 3.02Å; L45-H48 PolarHBondContact O-N 3.35Å; F46-H48 VanDerWaalsContact C-N 3.29Å; F46-H48 PolarHBondContact O-N 3.47Å; H48-S52 VanDerWaalsContact O-CB 3.24Å; H48-S52 WeakPolarHBondContact O-CB 3.42Å; H48-S52 PolarHBondContact O-N 3.2Å; H48-S52 VanDerWaalsContact O-N 3.1Å; H48-S52 PolarHBondContact O-OG 3.15Å |
| 49 | A | 51.9 | Low | 55.5 | Low | 22 Ų | 22 | 102.9 Ų | 102.9 | 18% | 0.182 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -65.2 | -42.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L45 F46 I62 | L45-A49 WeakPolarHBondContact O-CB 3.09Å; L45-A49 PolarHBondContact O-N 3.02Å; F46-A49 PolarHBondContact O-N 3.48Å; A49-I62 HydrophobicContact CB-CD1 3.93Å |
| 50 | L | 53.2 | Low | 55 | Low | 109 Ų | 109 | 103.9 Ų | 103.9 | 57% | 0.571 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -71.7 | -34.1 | -179.6 | -156.3 | 144.1 | 0 | 0 | 0 | 112 | F46 R47 I154 | F46-L50 HydrophobicContact CD1-CD1 4.34Å; F46-L50 HydrophobicContact CE1-CD1 3.59Å; F46-L50 HydrophobicContact CZ-CD1 4.42Å; F46-L50 WeakPolarHBondContact O-CB 3.34Å; F46-L50 PolarHBondContact O-N 3.2Å; R47-L50 PolarHBondContact O-N 2.98Å; L50-I154 HydrophobicContact CD1-CG2 4.1Å |
| 51 | F | 56.8 | Low | 55.1 | Low | 178 Ų | 178 | 106.4 Ų | 106.4 | 78% | 0.781 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -77.7 | -25.3 | 178 | -167.3 | -109.2 | 0 | 0 | 0 | 113.3 | R47 | R47-F51 VanDerWaalsContact O-CB 3.32Å; R47-F51 WeakPolarHBondContact O-CB 3.45Å; R47-F51 PolarHBondContact O-N 2.91Å |
| 52 | S | 52.5 | Low | 54.8 | Low | 35 Ų | 35 | 103 Ų | 103 | 25% | 0.245 | 49% | 0.493 | C | S | . | . | trans | -97.4 | 99.6 | -175.1 | -56.5 | 0 | 0 | 0 | 0 | 111.9 | H48 K54 L55 | H48-S52 VanDerWaalsContact O-CB 3.24Å; H48-S52 WeakPolarHBondContact O-CB 3.42Å; H48-S52 PolarHBondContact O-N 3.2Å; H48-S52 VanDerWaalsContact O-N 3.1Å; H48-S52 PolarHBondContact O-OG 3.15Å; S52-K54 CarbonylContact O-C 3.59Å; S52-K54 PolarHBondContact O-N 3.18Å; S52-L55 PolarHBondContact O-N 3.41Å | ||
| 53 | R | 52 | Low | 54.6 | Low | 257 Ų | 257 | 102.8 Ų | 102.8 | 97% | 0.97 | 49% | 0.487 | S | S | * | . | S | Bend | trans | -54.9 | -11.6 | 170.6 | -74.4 | -176.1 | 176.5 | -171.2 | -0.7 | 114.7 | L55 | R53-L55 VanDerWaalsContact C-N 3.26Å; R53-L55 PolarHBondContact O-N 3.39Å |
| 54 | K | 48.8 | Very low | 54.7 | Low | 179 Ų | 179 | 105 Ų | 105 | 78% | 0.778 | 49% | 0.492 | S | S | * | . | trans | -88.5 | 63.7 | 168.5 | -74 | -177.3 | 179.9 | 174.7 | 0 | 110.6 | S52 T56 R57 | S52-K54 CarbonylContact O-C 3.59Å; S52-K54 PolarHBondContact O-N 3.18Å; K54-T56 PolarHBondContact O-N 3.08Å; K54-T56 VanDerWaalsContact O-N 3.09Å; K54-R57 PolarHBondContact O-N 2.92Å | ||
| 55 | L | 54.2 | Low | 54.4 | Low | 100 Ų | 100 | 102.2 Ų | 102.2 | 52% | 0.524 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -47.3 | -37.6 | -179.4 | -171.4 | 64.6 | 0 | 0 | 0 | 112.9 | S52 R53 R57 C59 | S52-L55 PolarHBondContact O-N 3.41Å; R53-L55 VanDerWaalsContact C-N 3.26Å; R53-L55 PolarHBondContact O-N 3.39Å; L55-R57 PolarHBondContact O-N 3.42Å; L55-C59 PolarHBondContact O-N 3.45Å; L55-C59 PolarHBondContact O-SG 3.27Å |
| 56 | T | 52.7 | Low | 54.6 | Low | 133 Ų | 133 | 101.6 Ų | 101.6 | 82% | 0.816 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -66.6 | -29.9 | -171.4 | -37.7 | 0 | 0 | 0 | 0 | 114.9 | K54 | K54-T56 PolarHBondContact O-N 3.08Å; K54-T56 VanDerWaalsContact O-N 3.09Å |
| 57 | R | 52.4 | Low | 54.7 | Low | 214 Ų | 214 | 104.3 Ų | 104.3 | 81% | 0.808 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -92 | -37.8 | -174.7 | -146.2 | 179 | -173.9 | 115.6 | -4 | 112.5 | K54 L55 C60 | K54-R57 PolarHBondContact O-N 2.92Å; L55-R57 PolarHBondContact O-N 3.42Å; R57-C60 PolarHBondContact O-N 2.92Å |
| 58 | S | 52.7 | Low | 55 | Low | 27 Ų | 27 | 100.8 Ų | 100.8 | 19% | 0.189 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -67.8 | -35.7 | 176.4 | -80.3 | 0 | 0 | 0 | 0 | 112.8 | C60 E61 I62 | S58-C60 PolarHBondContact O-N 2.75Å; S58-E61 PolarHBondContact O-N 3.22Å; S58-I62 WeakPolarHBondContact O-CG1 3.3Å; S58-I62 PolarHBondContact O-N 3.47Å |
| 59 | C | 52.3 | Low | 55.3 | Low | 28 Ų | 28 | 98.1 Ų | 98.1 | 19% | 0.189 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -56.6 | -37 | 176.4 | -70.6 | 0 | 0 | 0 | 0 | 111.8 | L55 I62 V63 W181 | L55-C59 PolarHBondContact O-N 3.45Å; L55-C59 PolarHBondContact O-SG 3.27Å; C59-I62 WeakPolarHBondContact O-CB 3.26Å; C59-I62 PolarHBondContact O-N 3.15Å; C59-V63 PolarHBondContact O-N 3.34Å; C59-W181 HydrophobicContact CB-CH2 3.78Å; C59-W181 HydrophobicContact CB-CZ2 3.66Å; C59-W181 HydrophobicContact CB-CZ3 4.34Å; C59-W181 WeakPolarHBondContact O-CZ2 3.34Å |
| 60 | C | 50.2 | Low | 55.5 | Low | 77 Ų | 77 | 97.9 Ų | 97.9 | 52% | 0.52 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.8 | -40.2 | 179.5 | -147 | 0 | 0 | 0 | 0 | 112.7 | R57 S58 V63 R64 | R57-C60 PolarHBondContact O-N 2.92Å; S58-C60 PolarHBondContact O-N 2.75Å; C60-V63 CarbonylContact O-C 3.58Å; C60-V63 WeakPolarHBondContact O-CB 3.44Å; C60-V63 PolarHBondContact O-N 3.44Å; C60-R64 PolarHBondContact O-N 3.22Å |
| 61 | E | 60.3 | Low | 55.4 | Low | 122 Ų | 122 | 101.6 Ų | 101.6 | 57% | 0.57 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -69.2 | -37.1 | 174.8 | -66.7 | -56 | 147.4 | 0 | 0 | 111.8 | S58 V63 R64 A65 | S58-E61 PolarHBondContact O-N 3.22Å; E61-V63 VanDerWaalsContact C-N 3.26Å; E61-V63 PolarHBondContact O-N 3.15Å; E61-R64 PolarHBondContact O-N 3.47Å; E61-R64 VanDerWaalsContact O-N 3.1Å; E61-A65 WeakPolarHBondContact O-CB 3.39Å; E61-A65 PolarHBondContact O-N 2.62Å |
| 62 | I | 59.5 | Low | 55.1 | Low | 48 Ų | 48 | 99.8 Ų | 99.8 | 25% | 0.246 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -61.5 | -38.2 | 170.8 | -64.4 | 168 | 0 | 0 | 0 | 110.2 | L45 A49 S58 C59 A65 Y66 | L45-I62 HydrophobicContact CB-CG1 4.31Å; L45-I62 HydrophobicContact CD2-CG1 4.36Å; A49-I62 HydrophobicContact CB-CD1 3.93Å; S58-I62 WeakPolarHBondContact O-CG1 3.3Å; S58-I62 PolarHBondContact O-N 3.47Å; C59-I62 WeakPolarHBondContact O-CB 3.26Å; C59-I62 PolarHBondContact O-N 3.15Å; I62-A65 PolarHBondContact O-N 3.15Å; I62-Y66 WeakPolarHBondContact O-CB 3.28Å; I62-Y66 PolarHBondContact O-N 3.46Å |
| 63 | V | 52.4 | Low | 55.1 | Low | 42 Ų | 42 | 101.6 Ų | 101.6 | 26% | 0.255 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.7 | -42.7 | 171.4 | 153.9 | 0 | 0 | 0 | 0 | 111.6 | C59 C60 E61 Y66 F67 W181 | C59-V63 PolarHBondContact O-N 3.34Å; C60-V63 CarbonylContact O-C 3.58Å; C60-V63 WeakPolarHBondContact O-CB 3.44Å; C60-V63 PolarHBondContact O-N 3.44Å; E61-V63 VanDerWaalsContact C-N 3.26Å; E61-V63 PolarHBondContact O-N 3.15Å; V63-Y66 PolarHBondContact O-N 3.28Å; V63-F67 WeakPolarHBondContact O-CA 3.29Å; V63-F67 WeakPolarHBondContact O-CB 3.42Å; V63-F67 PolarHBondContact O-N 3.44Å; V63-W181 HydrophobicContact CB-CZ2 3.95Å; V63-W181 HydrophobicContact CG2-CH2 4.13Å; V63-W181 HydrophobicContact CG2-CZ2 3.07Å; V63-W181 VanDerWaalsContact CG2-NE1 3.29Å |
| 64 | R | 60.2 | Low | 55.1 | Low | 166 Ų | 166 | 91.8 Ų | 91.8 | 63% | 0.626 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -62.7 | -45.2 | 177.9 | -169.1 | 174.7 | 174.5 | 96.4 | -0.2 | 110.9 | C60 E61 F67 I68 | C60-R64 PolarHBondContact O-N 3.22Å; E61-R64 PolarHBondContact O-N 3.47Å; E61-R64 VanDerWaalsContact O-N 3.1Å; R64-F67 PolarHBondContact O-N 3.47Å; R64-I68 HydrophobicContact CG-CD1 4.02Å; R64-I68 WeakPolarHBondContact O-CB 3.4Å; R64-I68 WeakPolarHBondContact O-CD1 3.18Å; R64-I68 WeakPolarHBondContact O-CG1 3.31Å; R64-I68 PolarHBondContact O-N 2.93Å |
| 65 | A | 60.1 | Low | 55.3 | Low | 37 Ų | 37 | 92.3 Ų | 92.3 | 31% | 0.306 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.9 | -47.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L45 E61 I62 F67 I68 L69 | L45-A65 HydrophobicContact CD1-CB 4.04Å; E61-A65 WeakPolarHBondContact O-CB 3.39Å; E61-A65 PolarHBondContact O-N 2.62Å; I62-A65 PolarHBondContact O-N 3.15Å; A65-F67 PolarHBondContact O-N 3.34Å; A65-I68 PolarHBondContact O-N 3.33Å; A65-L69 VanDerWaalsContact O-CB 3.28Å; A65-L69 WeakPolarHBondContact O-CB 3.24Å; A65-L69 PolarHBondContact O-N 2.91Å |
| 66 | Y | 59 | Low | 55.1 | Low | 47 Ų | 47 | 95.7 Ų | 95.7 | 18% | 0.184 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -65.4 | -39.6 | 177.8 | -171.8 | -106.2 | 0 | 0 | 0 | 112.4 | I62 V63 L69 S70 C144 P147 A185 F189 | I62-Y66 WeakPolarHBondContact O-CB 3.28Å; I62-Y66 PolarHBondContact O-N 3.46Å; V63-Y66 PolarHBondContact O-N 3.28Å; Y66-L69 PolarHBondContact O-N 3.18Å; Y66-S70 WeakPolarHBondContact O-CB 3.29Å; Y66-S70 PolarHBondContact O-N 3.27Å; Y66-C144 VanDerWaalsContact OH-CA 3.27Å; Y66-C144 WeakPolarHBondContact OH-CA 3.25Å; Y66-C144 PolarHBondContact OH-SG 3.31Å; Y66-P147 HydrophobicContact CE2-CG 4.37Å; Y66-A185 HydrophobicContact CD1-CB 3.98Å; Y66-A185 HydrophobicContact CE1-CB 3.8Å; Y66-F189 AromaticContact CD1-CE2 3.86Å; Y66-F189 HydrophobicContact CD1-CE2 3.86Å; Y66-F189 HydrophobicContact CD1-CZ 4.19Å; Y66-F189 HydrophobicContact CE1-CD2 4.45Å; Y66-F189 AromaticContact CE1-CE2 3.53Å; Y66-F189 HydrophobicContact CE1-CE2 3.53Å; Y66-F189 HydrophobicContact CE1-CZ 4.18Å |
| 67 | F | 58.2 | Low | 55.1 | Low | 98 Ų | 98 | 90.2 Ų | 90.2 | 43% | 0.43 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 175.8 | -175.4 | -99.8 | 0 | 0 | 0 | 111.6 | V63 R64 A65 R71 T188 F189 | V63-F67 WeakPolarHBondContact O-CA 3.29Å; V63-F67 WeakPolarHBondContact O-CB 3.42Å; V63-F67 PolarHBondContact O-N 3.44Å; R64-F67 PolarHBondContact O-N 3.47Å; A65-F67 PolarHBondContact O-N 3.34Å; F67-R71 VanDerWaalsContact O-CB 3.26Å; F67-R71 WeakPolarHBondContact O-CB 3.46Å; F67-R71 PolarHBondContact O-N 2.78Å; F67-T188 HydrophobicContact CE2-CG2 4.41Å; F67-F189 HydrophobicContact CD2-CE1 4.24Å; F67-F189 HydrophobicContact CD2-CZ 4.26Å |
| 68 | I | 62.3 | Low | 55.1 | Low | 83 Ų | 83 | 85.6 Ų | 85.6 | 43% | 0.426 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -69.1 | -51.4 | 176 | -69.1 | 164.7 | 0 | 0 | 0 | 110.6 | R64 A65 S70 R71 Q72 | R64-I68 HydrophobicContact CG-CD1 4.02Å; R64-I68 WeakPolarHBondContact O-CB 3.4Å; R64-I68 WeakPolarHBondContact O-CD1 3.18Å; R64-I68 WeakPolarHBondContact O-CG1 3.31Å; R64-I68 PolarHBondContact O-N 2.93Å; A65-I68 PolarHBondContact O-N 3.33Å; I68-S70 PolarHBondContact O-N 2.89Å; I68-R71 PolarHBondContact O-N 2.95Å; I68-Q72 PolarHBondContact O-N 3.41Å; I68-Q72 VanDerWaalsContact O-N 3.15Å |
| 69 | L | 59.9 | Low | 55.4 | Low | 58 Ų | 58 | 86.3 Ų | 86.3 | 30% | 0.304 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -60.4 | -47.6 | -177.4 | -177.4 | 69.2 | 0 | 0 | 0 | 111.8 | T38 A65 Y66 R71 Q72 N73 | T38-L69 HydrophobicContact CG2-CD1 4.04Å; T38-L69 HydrophobicContact CG2-CD2 3.53Å; T38-L69 HydrophobicContact CG2-CG 4.4Å; A65-L69 VanDerWaalsContact O-CB 3.28Å; A65-L69 WeakPolarHBondContact O-CB 3.24Å; A65-L69 PolarHBondContact O-N 2.91Å; Y66-L69 PolarHBondContact O-N 3.18Å; L69-R71 VanDerWaalsContact C-N 3.34Å; L69-R71 PolarHBondContact O-N 3.29Å; L69-Q72 PolarHBondContact O-N 3.37Å; L69-N73 PolarHBondContact O-N 3.26Å; L69-N73 VanDerWaalsContact O-N 3.15Å |
| 70 | S | 54.9 | Low | 55.9 | Low | 18 Ų | 18 | 88 Ų | 88 | 13% | 0.126 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -73.6 | -24.5 | -178.3 | -179.5 | 0 | 0 | 0 | 0 | 112.8 | Y66 I68 F189 | Y66-S70 WeakPolarHBondContact O-CB 3.29Å; Y66-S70 PolarHBondContact O-N 3.27Å; I68-S70 PolarHBondContact O-N 2.89Å; S70-F189 WeakPolarHBondContact OG-CE1 3.04Å; S70-F189 WeakPolarHBondContact OG-CZ 3.39Å |
| 71 | R | 51 | Low | 56.6 | Low | 187 Ų | 187 | 88.3 Ų | 88.3 | 71% | 0.706 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -71.9 | -37.9 | 173.5 | -156.3 | -175.2 | 97.1 | 132.7 | 6.3 | 111.2 | F67 I68 L69 S74 | F67-R71 VanDerWaalsContact O-CB 3.26Å; F67-R71 WeakPolarHBondContact O-CB 3.46Å; F67-R71 PolarHBondContact O-N 2.78Å; I68-R71 PolarHBondContact O-N 2.95Å; L69-R71 VanDerWaalsContact C-N 3.34Å; L69-R71 PolarHBondContact O-N 3.29Å; R71-S74 WeakPolarHBondContact O-CB 3.43Å; R71-S74 PolarHBondContact O-N 2.99Å |
| 72 | Q | 51.9 | Low | 57.1 | Low | 139 Ų | 139 | 90.1 Ų | 90.1 | 65% | 0.65 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -68 | -39.6 | 177 | -73.4 | -173.3 | -22 | 0 | 0 | 112.1 | I68 L69 S74 | I68-Q72 PolarHBondContact O-N 3.41Å; I68-Q72 VanDerWaalsContact O-N 3.15Å; L69-Q72 PolarHBondContact O-N 3.37Å; Q72-S74 PolarHBondContact O-N 3.32Å |
| 73 | N | 52.1 | Low | 57.9 | Low | 73 Ų | 73 | 88.3 Ų | 88.3 | 39% | 0.39 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -69.6 | -14.5 | 178.3 | -79.7 | 12.4 | 0 | 0 | 0 | 114.6 | L69 F75 I77 | L69-N73 PolarHBondContact O-N 3.26Å; L69-N73 VanDerWaalsContact O-N 3.15Å; N73-F75 PolarHBondContact O-N 3.23Å; N73-I77 HydrophobicContact CB-CD1 4.29Å |
| 74 | S | 51.5 | Low | 58.8 | Low | 51 Ų | 51 | 87.8 Ų | 87.8 | 36% | 0.357 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -22.5 | -176 | -152.7 | 0 | 0 | 0 | 0 | 114.1 | R71 Q72 | R71-S74 WeakPolarHBondContact O-CB 3.43Å; R71-S74 PolarHBondContact O-N 2.99Å; Q72-S74 PolarHBondContact O-N 3.32Å |
| 75 | F | 53.2 | Low | 59.8 | Low | 190 Ų | 190 | 83 Ų | 83 | 83% | 0.833 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | -28.4 | -174.5 | -169 | -103.3 | 0 | 0 | 0 | 114.4 | N73 | N73-F75 PolarHBondContact O-N 3.23Š|
| 76 | Y | 50.9 | Low | 60.8 | Low | 171 Ų | 171 | 87.2 Ų | 87.2 | 67% | 0.671 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | -16.7 | -175.2 | -173.6 | -106.1 | 0 | 0 | 0 | 114.5 | S78 | Y76-S78 VanDerWaalsContact C-N 3.25Å; Y76-S78 PolarHBondContact O-N 3.38Å |
| 77 | I | 52.6 | Low | 61.7 | Low | 19 Ų | 19 | 85.7 Ų | 85.7 | 10% | 0.097 | 42% | 0.424 | C | S | . | . | trans | -79.1 | 71.5 | 175.9 | -76.4 | 153.9 | 0 | 0 | 0 | 110.7 | N73 G79 D80 C139 Y143 | N73-I77 HydrophobicContact CB-CD1 4.29Å; I77-G79 PolarHBondContact O-N 3Å; I77-D80 HydrophobicContact CG2-CB 4.43Å; I77-C139 HydrophobicContact CG2-CB 3.75Å; I77-C139 WeakPolarHBondContact CG2-SG 3.28Å; I77-Y143 HydrophobicContact CD1-CD2 4.28Å; I77-Y143 HydrophobicContact CD1-CE2 3.44Å; I77-Y143 VanDerWaalsContact CD1-CE2 3.44Å | ||
| 78 | S | 52.5 | Low | 62.6 | Low | 116 Ų | 116 | 81.3 Ų | 81.3 | 81% | 0.811 | 41% | 0.405 | S | S | * | . | S | Bend | trans | -81.2 | 1.1 | 175.2 | -59.6 | 0 | 0 | 0 | 0 | 113.3 | Y76 | Y76-S78 VanDerWaalsContact C-N 3.25Å; Y76-S78 PolarHBondContact O-N 3.38Å |
| 79 | G | 59.3 | Low | 63.5 | Low | 43 Ų | 43 | 80.1 Ų | 80.1 | 44% | 0.443 | 40% | 0.399 | S | S | . | . | S | Bend | trans | -179.5 | 17.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | I77 L81 | I77-G79 PolarHBondContact O-N 3Å; G79-L81 PolarHBondContact O-N 3.14Å; G79-L81 VanDerWaalsContact O-N 3.12Å |
| 80 | D | 61.7 | Low | 64.5 | Low | 63 Ų | 63 | 81.3 Ų | 81.3 | 34% | 0.337 | 40% | 0.402 | S | S | . | . | trans | -90.2 | 78.5 | -170.5 | -73.9 | -30.7 | 0 | 0 | 0 | 114 | I77 W82 G83 P84 C139 | I77-D80 HydrophobicContact CG2-CB 4.43Å; D80-W82 PolarHBondContact O-N 3.12Å; D80-G83 PolarHBondContact O-N 3Å; D80-P84 WeakPolarHBondContact O-CD 3.46Å; D80-C139 PolarHBondContact O-SG 2.9Å | ||
| 81 | L | 65.2 | Low | 65.5 | Low | 84 Ų | 84 | 81.7 Ų | 81.7 | 44% | 0.44 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -17.5 | 162.7 | -78 | 78.8 | 0 | 0 | 0 | 112 | G79 G83 L85 F135 | G79-L81 PolarHBondContact O-N 3.14Å; G79-L81 VanDerWaalsContact O-N 3.12Å; L81-G83 VanDerWaalsContact C-N 3.32Å; L81-G83 PolarHBondContact O-N 3.05Å; L81-L85 WeakPolarHBondContact O-CB 3.34Å; L81-L85 PolarHBondContact O-N 3.14Å; L81-L85 VanDerWaalsContact O-N 3.15Å; L81-F135 HydrophobicContact CD1-CD1 3.73Å; L81-F135 HydrophobicContact CD1-CE1 4.02Å; L81-F135 HydrophobicContact CD1-CG 4.48Å; L81-F135 HydrophobicContact CG-CD1 4.45Å |
| 82 | W | 71.5 | Confident | 66.8 | Low | 160 Ų | 160 | 72.8 Ų | 72.8 | 61% | 0.606 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -59.2 | -38.5 | 177.2 | -64.9 | 97.8 | 0 | 0 | 0 | 112.5 | D80 L85 F86 | D80-W82 PolarHBondContact O-N 3.12Å; W82-L85 PolarHBondContact O-N 3.43Å; W82-F86 HydrophobicContact CB-CD2 4.03Å; W82-F86 HydrophobicContact CB-CE2 4.04Å; W82-F86 HydrophobicContact CD2-CE2 4.49Å; W82-F86 AromaticContact CE3-CE2 3.81Å; W82-F86 HydrophobicContact CE3-CE2 3.81Å; W82-F86 HydrophobicContact CE3-CZ 4.21Å; W82-F86 WeakPolarHBondContact O-CB 2.99Å; W82-F86 WeakPolarHBondContact O-CD2 3.39Å; W82-F86 PolarHBondContact O-N 2.87Å |
| 83 | G | 74.5 | Confident | 68 | Low | 10 Ų | 10 | 71.1 Ų | 71.1 | 10% | 0.103 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.5 | -61.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | D80 L81 L85 F86 I87 | D80-G83 PolarHBondContact O-N 3Å; L81-G83 VanDerWaalsContact C-N 3.32Å; L81-G83 PolarHBondContact O-N 3.05Å; G83-L85 PolarHBondContact O-N 3.27Å; G83-F86 PolarHBondContact O-N 2.99Å; G83-I87 WeakPolarHBondContact O-CD1 3.36Å; G83-I87 VanDerWaalsContact O-CG1 3.23Å; G83-I87 WeakPolarHBondContact O-CG1 3.45Å; G83-I87 PolarHBondContact O-N 2.83Å |
| 84 | P | 73 | Confident | 68.9 | Low | 30 Ų | 30 | 71.9 Ų | 71.9 | 20% | 0.195 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -57.2 | -35.2 | 174.7 | -26.5 | 35.6 | 0 | 0 | 0 | 113.4 | D80 C88 | D80-P84 WeakPolarHBondContact O-CD 3.46Å; P84-C88 VanDerWaalsContact O-CB 3.28Å; P84-C88 WeakPolarHBondContact O-CB 3.44Å; P84-C88 PolarHBondContact O-N 3.13Å |
| 85 | L | 79.8 | Confident | 69.6 | Low | 65 Ų | 65 | 71.6 Ų | 71.6 | 34% | 0.34 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -66.1 | -50.1 | 177.3 | -168.5 | 169.8 | 0 | 0 | 0 | 111 | L81 W82 G83 I87 C88 I89 | L81-L85 WeakPolarHBondContact O-CB 3.34Å; L81-L85 PolarHBondContact O-N 3.14Å; L81-L85 VanDerWaalsContact O-N 3.15Å; W82-L85 PolarHBondContact O-N 3.43Å; G83-L85 PolarHBondContact O-N 3.27Å; L85-I87 VanDerWaalsContact C-N 3.33Å; L85-I87 PolarHBondContact O-N 3.31Å; L85-C88 WeakPolarHBondContact O-CB 3.43Å; L85-C88 PolarHBondContact O-N 2.97Å; L85-C88 VanDerWaalsContact O-N 3.13Å; L85-I89 HydrophobicContact CD2-CD1 3.27Å; L85-I89 HydrophobicContact CD2-CG1 3.9Å; L85-I89 WeakPolarHBondContact O-CG1 3.44Å; L85-I89 PolarHBondContact O-N 3.11Å |
| 86 | F | 80.9 | Confident | 70.4 | Confident | 126 Ų | 126 | 68.9 Ų | 68.9 | 55% | 0.553 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -60.6 | -41.4 | 176.3 | -85.3 | -63.9 | 0 | 0 | 0 | 111.8 | W82 G83 C88 I89 F90 | W82-F86 HydrophobicContact CB-CD2 4.03Å; W82-F86 HydrophobicContact CB-CE2 4.04Å; W82-F86 HydrophobicContact CD2-CE2 4.49Å; W82-F86 AromaticContact CE3-CE2 3.81Å; W82-F86 HydrophobicContact CE3-CE2 3.81Å; W82-F86 HydrophobicContact CE3-CZ 4.21Å; W82-F86 WeakPolarHBondContact O-CB 2.99Å; W82-F86 WeakPolarHBondContact O-CD2 3.39Å; W82-F86 PolarHBondContact O-N 2.87Å; G83-F86 PolarHBondContact O-N 2.99Å; F86-C88 VanDerWaalsContact C-N 3.28Å; F86-C88 PolarHBondContact O-N 3.34Å; F86-I89 PolarHBondContact O-N 3.2Å; F86-F90 VanDerWaalsContact O-CB 3.23Å; F86-F90 WeakPolarHBondContact O-CB 3.17Å; F86-F90 PolarHBondContact O-N 3.43Å |
| 87 | I | 79.1 | Confident | 70.8 | Confident | 15 Ų | 15 | 64.6 Ų | 64.6 | 8% | 0.077 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -61.6 | -41.8 | 175.8 | -67.1 | 163.5 | 0 | 0 | 0 | 110.1 | G83 L85 F90 V91 G142 Y143 L145 L146 | G83-I87 WeakPolarHBondContact O-CD1 3.36Å; G83-I87 VanDerWaalsContact O-CG1 3.23Å; G83-I87 WeakPolarHBondContact O-CG1 3.45Å; G83-I87 PolarHBondContact O-N 2.83Å; L85-I87 VanDerWaalsContact C-N 3.33Å; L85-I87 PolarHBondContact O-N 3.31Å; I87-F90 PolarHBondContact O-N 3.4Å; I87-V91 HydrophobicContact CG2-CG2 4.47Å; I87-V91 WeakPolarHBondContact O-CB 3.19Å; I87-V91 VanDerWaalsContact O-CG2 3.25Å; I87-V91 WeakPolarHBondContact O-CG2 3.23Å; I87-V91 PolarHBondContact O-N 2.98Å; I87-G142 WeakPolarHBondContact CD1-O 3.23Å; I87-Y143 HydrophobicContact CD1-CD1 4.09Å; I87-Y143 HydrophobicContact CD1-CE1 4.47Å; I87-L145 HydrophobicContact CG2-CB 4.44Å; I87-L146 HydrophobicContact CD1-CB 3.96Å; I87-L146 HydrophobicContact CD1-CD1 4.21Å; I87-L146 HydrophobicContact CG1-CB 4.17Å; I87-L146 HydrophobicContact CG1-CD1 4.09Å; I87-L146 HydrophobicContact CG2-CB 4.46Å |
| 88 | C | 75.8 | Confident | 70.8 | Confident | 7 Ų | 7 | 68.6 Ų | 68.6 | 5% | 0.047 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -67.8 | -44.4 | 179.4 | -160.3 | 0 | 0 | 0 | 0 | 112.5 | P84 L85 F86 F90 V91 A92 F111 | P84-C88 VanDerWaalsContact O-CB 3.28Å; P84-C88 WeakPolarHBondContact O-CB 3.44Å; P84-C88 PolarHBondContact O-N 3.13Å; L85-C88 WeakPolarHBondContact O-CB 3.43Å; L85-C88 PolarHBondContact O-N 2.97Å; L85-C88 VanDerWaalsContact O-N 3.13Å; F86-C88 VanDerWaalsContact C-N 3.28Å; F86-C88 PolarHBondContact O-N 3.34Å; C88-F90 VanDerWaalsContact C-N 3.31Å; C88-F90 PolarHBondContact O-N 3.47Å; C88-V91 PolarHBondContact O-N 2.97Å; C88-A92 VanDerWaalsContact O-CB 3.23Å; C88-A92 WeakPolarHBondContact O-CB 2.95Å; C88-A92 PolarHBondContact O-N 3.41Å; C88-F111 HydrophobicContact CB-CD2 3.93Å; C88-F111 HydrophobicContact CB-CE2 4.29Å; C88-F111 WeakPolarHBondContact SG-CA 3.18Å; C88-F111 WeakPolarHBondContact SG-CD2 3.45Å |
| 89 | I | 81.9 | Confident | 70.8 | Confident | 58 Ų | 58 | 67.6 Ų | 67.6 | 30% | 0.297 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -58.6 | -45.9 | 171.8 | -69.7 | 178.3 | 0 | 0 | 0 | 110 | L85 F86 V91 A92 L93 F107 | L85-I89 HydrophobicContact CD2-CD1 3.27Å; L85-I89 HydrophobicContact CD2-CG1 3.9Å; L85-I89 WeakPolarHBondContact O-CG1 3.44Å; L85-I89 PolarHBondContact O-N 3.11Å; F86-I89 PolarHBondContact O-N 3.2Å; I89-V91 PolarHBondContact O-N 3.07Å; I89-A92 PolarHBondContact O-N 2.7Å; I89-L93 HydrophobicContact CG2-CD1 3.67Å; I89-L93 HydrophobicContact CG2-CG 3.99Å; I89-L93 VanDerWaalsContact O-CB 3.31Å; I89-L93 WeakPolarHBondContact O-CB 3.4Å; I89-L93 VanDerWaalsContact O-CG 3.24Å; I89-L93 WeakPolarHBondContact O-CG 3.43Å; I89-L93 PolarHBondContact O-N 2.79Å; I89-F107 HydrophobicContact CG1-CZ 4.46Å |
| 90 | F | 80.7 | Confident | 70.5 | Confident | 83 Ų | 83 | 71.4 Ų | 71.4 | 36% | 0.364 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.8 | -49.1 | 179.4 | -179.6 | -99.5 | 0 | 0 | 0 | 111.6 | F86 I87 C88 A92 L93 M94 I150 L153 | F86-F90 VanDerWaalsContact O-CB 3.23Å; F86-F90 WeakPolarHBondContact O-CB 3.17Å; F86-F90 PolarHBondContact O-N 3.43Å; I87-F90 PolarHBondContact O-N 3.4Å; C88-F90 VanDerWaalsContact C-N 3.31Å; C88-F90 PolarHBondContact O-N 3.47Å; F90-A92 VanDerWaalsContact C-N 3.31Å; F90-A92 PolarHBondContact O-N 3.39Å; F90-L93 PolarHBondContact O-N 3.27Å; F90-M94 HydrophobicContact CD1-CG 4.23Å; F90-M94 HydrophobicContact CD2-CE 4.45Å; F90-M94 HydrophobicContact CD2-CG 4.46Å; F90-M94 HydrophobicContact CE1-CG 3.88Å; F90-M94 HydrophobicContact CE2-CE 3.91Å; F90-M94 HydrophobicContact CE2-CG 4.14Å; F90-M94 HydrophobicContact CE2-SD 4.32Å; F90-M94 HydrophobicContact CZ-CE 4.3Å; F90-M94 HydrophobicContact CZ-CG 3.83Å; F90-M94 HydrophobicContact CZ-SD 4.11Å; F90-M94 WeakPolarHBondContact O-CB 3.46Å; F90-M94 WeakPolarHBondContact O-CG 2.95Å; F90-M94 PolarHBondContact O-N 3.43Å; F90-I150 HydrophobicContact CE1-CG1 4.49Å; F90-L153 HydrophobicContact CE1-CD2 4.37Å; F90-L153 HydrophobicContact CZ-CD2 4.17Å |
| 91 | V | 75.3 | Confident | 69.9 | Low | 25 Ų | 25 | 73.4 Ų | 73.4 | 15% | 0.152 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -57.3 | -47.4 | 175.7 | 169.3 | 0 | 0 | 0 | 0 | 110.6 | I87 C88 I89 M94 L95 A149 | I87-V91 HydrophobicContact CG2-CG2 4.47Å; I87-V91 WeakPolarHBondContact O-CB 3.19Å; I87-V91 VanDerWaalsContact O-CG2 3.25Å; I87-V91 WeakPolarHBondContact O-CG2 3.23Å; I87-V91 PolarHBondContact O-N 2.98Å; C88-V91 PolarHBondContact O-N 2.97Å; I89-V91 PolarHBondContact O-N 3.07Å; V91-M94 PolarHBondContact O-N 3.01Å; V91-L95 VanDerWaalsContact O-CB 3.25Å; V91-L95 WeakPolarHBondContact O-CB 3.4Å; V91-L95 PolarHBondContact O-N 2.86Å; V91-A149 HydrophobicContact CG2-CB 3.54Å |
| 92 | A | 79 | Confident | 69.4 | Low | 1 Ų | 1 | 72.5 Ų | 72.5 | 1% | 0.008 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -73.6 | -31.7 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | C88 I89 F90 L95 H96 F107 | C88-A92 VanDerWaalsContact O-CB 3.23Å; C88-A92 WeakPolarHBondContact O-CB 2.95Å; C88-A92 PolarHBondContact O-N 3.41Å; I89-A92 PolarHBondContact O-N 2.7Å; F90-A92 VanDerWaalsContact C-N 3.31Å; F90-A92 PolarHBondContact O-N 3.39Å; A92-L95 PolarHBondContact O-N 2.76Å; A92-H96 WeakPolarHBondContact O-CB 3.22Å; A92-H96 PolarHBondContact O-N 2.96Å; A92-F107 HydrophobicContact CB-CD2 3.12Å; A92-F107 HydrophobicContact CB-CE2 3.21Å; A92-F107 HydrophobicContact CB-CG 3.88Å; A92-F107 HydrophobicContact CB-CZ 4.04Å |
| 93 | L | 77.7 | Confident | 68.5 | Low | 104 Ų | 104 | 70.1 Ų | 70.1 | 55% | 0.545 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -66.9 | -46.4 | 169.1 | -74.4 | 177.7 | 0 | 0 | 0 | 111.9 | I89 F90 L95 H96 | I89-L93 HydrophobicContact CG2-CD1 3.67Å; I89-L93 HydrophobicContact CG2-CG 3.99Å; I89-L93 VanDerWaalsContact O-CB 3.31Å; I89-L93 WeakPolarHBondContact O-CB 3.4Å; I89-L93 VanDerWaalsContact O-CG 3.24Å; I89-L93 WeakPolarHBondContact O-CG 3.43Å; I89-L93 PolarHBondContact O-N 2.79Å; F90-L93 PolarHBondContact O-N 3.27Å; L93-L95 PolarHBondContact O-N 3.33Å; L93-H96 PolarHBondContact O-N 2.72Å |
| 94 | M | 70 | Confident | 67.7 | Low | 88 Ų | 88 | 75.6 Ų | 75.6 | 43% | 0.433 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.1 | -29.1 | 176.5 | -72.5 | -63.5 | 114.7 | 0 | 0 | 112 | F90 V91 L153 | F90-M94 HydrophobicContact CD1-CG 4.23Å; F90-M94 HydrophobicContact CD2-CE 4.45Å; F90-M94 HydrophobicContact CD2-CG 4.46Å; F90-M94 HydrophobicContact CE1-CG 3.88Å; F90-M94 HydrophobicContact CE2-CE 3.91Å; F90-M94 HydrophobicContact CE2-CG 4.14Å; F90-M94 HydrophobicContact CE2-SD 4.32Å; F90-M94 HydrophobicContact CZ-CE 4.3Å; F90-M94 HydrophobicContact CZ-CG 3.83Å; F90-M94 HydrophobicContact CZ-SD 4.11Å; F90-M94 WeakPolarHBondContact O-CB 3.46Å; F90-M94 WeakPolarHBondContact O-CG 2.95Å; F90-M94 PolarHBondContact O-N 3.43Å; V91-M94 PolarHBondContact O-N 3.01Å; M94-L153 HydrophobicContact CB-CD1 4.29Å; M94-L153 HydrophobicContact CG-CD1 4.3Å; M94-L153 HydrophobicContact CG-CD2 3.97Å; M94-L153 HydrophobicContact SD-CD1 3.87Å; M94-L153 HydrophobicContact SD-CD2 3.58Å; M94-L153 VanDerWaalsContact SD-CD2 3.58Å; M94-L153 HydrophobicContact SD-CG 4.39Å |
| 95 | L | 66.7 | Low | 67.2 | Low | 45 Ų | 45 | 78.5 Ų | 78.5 | 24% | 0.236 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -85.5 | -25.7 | -179.8 | -160.7 | 65.6 | 0 | 0 | 0 | 114.1 | V91 A92 L93 S97 Y220 | V91-L95 VanDerWaalsContact O-CB 3.25Å; V91-L95 WeakPolarHBondContact O-CB 3.4Å; V91-L95 PolarHBondContact O-N 2.86Å; A92-L95 PolarHBondContact O-N 2.76Å; L93-L95 PolarHBondContact O-N 3.33Å; L95-S97 PolarHBondContact O-N 2.98Å; L95-Y220 HydrophobicContact CD1-CD2 4.27Å; L95-Y220 HydrophobicContact CD1-CG 3.9Å; L95-Y220 HydrophobicContact CD2-CD1 3.66Å; L95-Y220 HydrophobicContact CD2-CD2 3.12Å; L95-Y220 HydrophobicContact CD2-CE1 3.99Å; L95-Y220 HydrophobicContact CD2-CE2 3.46Å; L95-Y220 VanDerWaalsContact CD2-CE2 3.46Å; L95-Y220 HydrophobicContact CD2-CG 3.23Å; L95-Y220 HydrophobicContact CG-CD1 4.28Å; L95-Y220 HydrophobicContact CG-CD2 4.17Å; L95-Y220 HydrophobicContact CG-CG 3.88Å |
| 96 | H | 69.9 | Low | 66.9 | Low | 133 Ų | 133 | 78 Ų | 78 | 62% | 0.616 | 46% | 0.462 | S | S | * | . | trans | -71.4 | 34.4 | 174.8 | -170.6 | 79.4 | 0 | 0 | 0 | 112.3 | A92 L93 S98 | A92-H96 WeakPolarHBondContact O-CB 3.22Å; A92-H96 PolarHBondContact O-N 2.96Å; L93-H96 PolarHBondContact O-N 2.72Å; H96-S98 PolarHBondContact O-N 3.5Å | ||
| 97 | S | 60.1 | Low | 66.7 | Low | 82 Ų | 82 | 75.3 Ų | 75.3 | 57% | 0.573 | 45% | 0.451 | S | S | * | . | trans | -62.6 | 117.5 | 173 | -152.4 | 0 | 0 | 0 | 0 | 108.4 | L95 N99 | L95-S97 PolarHBondContact O-N 2.98Å; S97-N99 PolarHBondContact O-N 3.48Å | ||
| 98 | S | 52.3 | Low | 67 | Low | 102 Ų | 102 | 77.4 Ų | 77.4 | 71% | 0.713 | 46% | 0.464 | S | S | * | . | trans | -34.4 | 85.8 | -169.3 | -61.4 | 0 | 0 | 0 | 0 | 115.1 | H96 | H96-S98 PolarHBondContact O-N 3.5Š| ||
| 99 | N | 52.4 | Low | 67.4 | Low | 96 Ų | 96 | 81.5 Ų | 81.5 | 51% | 0.513 | 48% | 0.483 | S | S | . | . | trans | -97.9 | 99.2 | 161.2 | -86.1 | -35.1 | 0 | 0 | 0 | 107.3 | S97 S101 | S97-N99 PolarHBondContact O-N 3.48Å; N99-S101 PolarHBondContact O-N 3.49Å | ||
| 100 | S | 52.6 | Low | 67.5 | Low | 122 Ų | 122 | 78.8 Ų | 78.8 | 85% | 0.853 | 47% | 0.469 | S | S | * | . | trans | -62.6 | 10.9 | -177.6 | -34.4 | 0 | 0 | 0 | 0 | 115 | ||||
| 101 | S | 50.1 | Low | 67.7 | Low | 105 Ų | 105 | 77.3 Ų | 77.3 | 73% | 0.734 | 46% | 0.462 | S | S | * | . | S | Bend | trans | -126.2 | 97.7 | -166.5 | -56.6 | 0 | 0 | 0 | 0 | 110.6 | N99 | N99-S101 PolarHBondContact O-N 3.49Š|
| 102 | G | 53.9 | Low | 68.3 | Low | 65 Ų | 65 | 81.4 Ų | 81.4 | 67% | 0.67 | 48% | 0.478 | S | S | * | . | trans | 76 | 85.1 | 158.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | Q104 | G102-Q104 PolarHBondContact O-N 3.02Š| ||
| 103 | A | 52.9 | Low | 68.8 | Low | 110 Ų | 110 | 84 Ų | 84 | 91% | 0.909 | 49% | 0.491 | S | S | * | . | trans | 20.2 | 29.7 | 136.4 | 0 | 0 | 0 | 0 | 0 | 122.1 | P105 | A103-P105 WeakPolarHBondContact O-CD 3.28Š| ||
| 104 | Q | 57.9 | Low | 69.3 | Low | 126 Ų | 126 | 79.9 Ų | 79.9 | 59% | 0.589 | 47% | 0.471 | S | S | * | . | trans | -76.9 | 125.1 | 160.6 | -81.6 | -166.3 | 59.5 | 0 | 0 | 108.1 | G102 K106 | G102-Q104 PolarHBondContact O-N 3.02Å; Q104-K106 HydrophobicContact CB-CG 3.98Å; Q104-K106 PolarHBondContact O-N 3.12Å | ||
| 105 | P | 61.6 | Low | 70.1 | Confident | 91 Ų | 91 | 82.2 Ų | 82.2 | 59% | 0.591 | 47% | 0.474 | S | S | * | . | trans | -72.8 | 59.4 | 177.1 | 31 | -34.4 | 0 | 0 | 0 | 111.2 | A103 F107 T108 E109 | A103-P105 WeakPolarHBondContact O-CD 3.28Å; P105-F107 PolarHBondContact O-N 2.9Å; P105-T108 PolarHBondContact O-N 3.36Å; P105-T108 VanDerWaalsContact O-N 3.1Å; P105-E109 PolarHBondContact O-N 3.01Å | ||
| 106 | K | 73.7 | Confident | 71.3 | Confident | 54 Ų | 54 | 83.3 Ų | 83.3 | 24% | 0.235 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -58.4 | -36.1 | -179.6 | -65.9 | 177.7 | -179.6 | 175 | 0 | 112 | Q104 A110 Y220 Y223 | Q104-K106 HydrophobicContact CB-CG 3.98Å; Q104-K106 PolarHBondContact O-N 3.12Å; K106-A110 PolarHBondContact O-N 3.39Å; K106-A110 VanDerWaalsContact O-N 3.16Å; K106-Y220 HydrophobicContact CB-CE1 4Å; K106-Y220 HydrophobicContact CD-CE1 4.47Å; K106-Y220 HydrophobicContact CG-CE1 4.25Å; K106-Y220 PolarHBondContact O-OH 3.34Å; K106-Y223 VanDerWaalsContact NZ-CD1 3.28Å |
| 107 | F | 77.9 | Confident | 72.4 | Confident | 70 Ų | 70 | 78 Ų | 78 | 31% | 0.307 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.3 | -52.4 | 174.4 | 175.2 | -86.1 | 0 | 0 | 0 | 111 | I89 A92 P105 E109 A110 F111 | I89-F107 HydrophobicContact CG1-CZ 4.46Å; A92-F107 HydrophobicContact CB-CD2 3.12Å; A92-F107 HydrophobicContact CB-CE2 3.21Å; A92-F107 HydrophobicContact CB-CG 3.88Å; A92-F107 HydrophobicContact CB-CZ 4.04Å; P105-F107 PolarHBondContact O-N 2.9Å; F107-E109 PolarHBondContact O-N 2.88Å; F107-A110 PolarHBondContact O-N 2.86Å; F107-F111 PolarHBondContact O-N 3.24Å |
| 108 | T | 84 | Confident | 73.8 | Confident | 58 Ų | 58 | 74.5 Ų | 74.5 | 36% | 0.356 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -68.2 | -37.1 | -175.5 | -53.7 | 0 | 0 | 0 | 0 | 111.6 | P105 F111 F112 | P105-T108 PolarHBondContact O-N 3.36Å; P105-T108 VanDerWaalsContact O-N 3.1Å; T108-F111 PolarHBondContact O-N 2.79Å; T108-F112 HydrophobicContact CG2-CD2 3.45Å; T108-F112 VanDerWaalsContact CG2-CD2 3.45Å; T108-F112 HydrophobicContact CG2-CE2 3.24Å; T108-F112 HydrophobicContact CG2-CZ 4.45Å; T108-F112 WeakPolarHBondContact O-CD2 3.33Å; T108-F112 PolarHBondContact O-N 2.76Å |
| 109 | E | 84.4 | Confident | 75.6 | Confident | 94 Ų | 94 | 73.8 Ų | 73.8 | 44% | 0.439 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -59.9 | -51.8 | 174.3 | -179.3 | -178.7 | 176.9 | 0 | 0 | 111.8 | P105 F107 F111 F112 I113 | P105-E109 PolarHBondContact O-N 3.01Å; F107-E109 PolarHBondContact O-N 2.88Å; E109-F111 PolarHBondContact O-N 2.89Å; E109-F112 PolarHBondContact O-N 3.41Å; E109-I113 HydrophobicContact CG-CD1 3.7Å; E109-I113 VanDerWaalsContact O-CG1 3.27Å; E109-I113 WeakPolarHBondContact O-CG1 3.35Å; E109-I113 PolarHBondContact O-N 2.96Å |
| 110 | A | 84.1 | Confident | 77.6 | Confident | 1 Ų | 1 | 72.7 Ų | 72.7 | 1% | 0.008 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -58.3 | -40.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | K106 F107 V114 L216 Y220 | K106-A110 PolarHBondContact O-N 3.39Å; K106-A110 VanDerWaalsContact O-N 3.16Å; F107-A110 PolarHBondContact O-N 2.86Å; A110-V114 WeakPolarHBondContact O-CG2 3.38Å; A110-V114 PolarHBondContact O-N 3.47Å; A110-V114 VanDerWaalsContact O-N 3.15Å; A110-L216 HydrophobicContact CB-CD2 3.99Å; A110-Y220 HydrophobicContact CB-CE2 4.06Å |
| 111 | F | 84.9 | Confident | 79.4 | Confident | 52 Ų | 52 | 67.1 Ų | 67.1 | 23% | 0.228 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.3 | -51.5 | 177.6 | 178.8 | -92.3 | 0 | 0 | 0 | 113 | C88 F107 T108 E109 I113 V114 W115 | C88-F111 HydrophobicContact CB-CD2 3.93Å; C88-F111 HydrophobicContact CB-CE2 4.29Å; C88-F111 WeakPolarHBondContact SG-CA 3.18Å; C88-F111 WeakPolarHBondContact SG-CD2 3.45Å; F107-F111 PolarHBondContact O-N 3.24Å; T108-F111 PolarHBondContact O-N 2.79Å; E109-F111 PolarHBondContact O-N 2.89Å; F111-I113 PolarHBondContact O-N 3.44Å; F111-V114 PolarHBondContact O-N 2.86Å; F111-W115 VanDerWaalsContact O-CB 3.31Å; F111-W115 WeakPolarHBondContact O-CB 3.35Å; F111-W115 PolarHBondContact O-N 3.44Å |
| 112 | F | 88.9 | Confident | 81.4 | Confident | 111 Ų | 111 | 62.1 Ų | 62.1 | 49% | 0.487 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.4 | -40.5 | -179.8 | -82 | -64.5 | 0 | 0 | 0 | 112.5 | T108 E109 W115 V116 | T108-F112 HydrophobicContact CG2-CD2 3.45Å; T108-F112 VanDerWaalsContact CG2-CD2 3.45Å; T108-F112 HydrophobicContact CG2-CE2 3.24Å; T108-F112 HydrophobicContact CG2-CZ 4.45Å; T108-F112 WeakPolarHBondContact O-CD2 3.33Å; T108-F112 PolarHBondContact O-N 2.76Å; E109-F112 PolarHBondContact O-N 3.41Å; F112-W115 PolarHBondContact O-N 3.21Å; F112-V116 VanDerWaalsContact O-CB 3.23Å; F112-V116 WeakPolarHBondContact O-CB 3.18Å; F112-V116 VanDerWaalsContact O-CG2 3.27Å; F112-V116 WeakPolarHBondContact O-CG2 3.27Å; F112-V116 PolarHBondContact O-N 3.3Å |
| 113 | I | 89.3 | Confident | 83.2 | Confident | 55 Ų | 55 | 62 Ų | 62 | 28% | 0.282 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63 | -45.9 | 179.9 | -68.4 | 167.7 | 0 | 0 | 0 | 111 | E109 F111 G117 V212 L216 | E109-I113 HydrophobicContact CG-CD1 3.7Å; E109-I113 VanDerWaalsContact O-CG1 3.27Å; E109-I113 WeakPolarHBondContact O-CG1 3.35Å; E109-I113 PolarHBondContact O-N 2.96Å; F111-I113 PolarHBondContact O-N 3.44Å; I113-G117 WeakPolarHBondContact O-CA 3.5Å; I113-G117 PolarHBondContact O-N 3.39Å; I113-V212 HydrophobicContact CG2-CG1 3.96Å; I113-L216 HydrophobicContact CD1-CD1 3.71Å |
| 114 | V | 87.6 | Confident | 85 | Confident | 18 Ų | 18 | 60.1 Ų | 60.1 | 11% | 0.109 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -67.3 | -42.7 | 179.9 | 174.1 | 0 | 0 | 0 | 0 | 110.9 | A110 F111 S118 L145 F209 V213 L216 | A110-V114 WeakPolarHBondContact O-CG2 3.38Å; A110-V114 PolarHBondContact O-N 3.47Å; A110-V114 VanDerWaalsContact O-N 3.15Å; F111-V114 PolarHBondContact O-N 2.86Å; V114-S118 VanDerWaalsContact O-CB 3.24Å; V114-S118 WeakPolarHBondContact O-CB 3.37Å; V114-S118 PolarHBondContact O-N 2.94Å; V114-S118 PolarHBondContact O-OG 3.33Å; V114-L145 HydrophobicContact CG1-CD1 3.79Å; V114-F209 HydrophobicContact CG1-CZ 4.36Å; V114-V213 HydrophobicContact CG2-CG2 4.19Å; V114-L216 HydrophobicContact CG2-CD2 4.3Å |
| 115 | W | 88 | Confident | 86.4 | Confident | 136 Ų | 136 | 54.2 Ų | 54.2 | 52% | 0.515 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -69.7 | -53.1 | -177.5 | -170.4 | 76.1 | 0 | 0 | 0 | 112.2 | F111 F112 G117 S118 F119 | F111-W115 VanDerWaalsContact O-CB 3.31Å; F111-W115 WeakPolarHBondContact O-CB 3.35Å; F111-W115 PolarHBondContact O-N 3.44Å; F112-W115 PolarHBondContact O-N 3.21Å; W115-G117 VanDerWaalsContact C-N 3.33Å; W115-G117 PolarHBondContact O-N 3.18Å; W115-S118 PolarHBondContact O-N 3.4Å; W115-F119 WeakPolarHBondContact O-CB 3.3Å; W115-F119 PolarHBondContact O-N 3.19Å |
| 116 | V | 91.3 | Very high | 87.6 | Confident | 69 Ų | 69 | 53.8 Ų | 53.8 | 42% | 0.418 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.1 | -41.2 | 178 | 176.6 | 0 | 0 | 0 | 0 | 110.4 | F112 F119 V120 | F112-V116 VanDerWaalsContact O-CB 3.23Å; F112-V116 WeakPolarHBondContact O-CB 3.18Å; F112-V116 VanDerWaalsContact O-CG2 3.27Å; F112-V116 WeakPolarHBondContact O-CG2 3.27Å; F112-V116 PolarHBondContact O-N 3.3Å; V116-F119 PolarHBondContact O-N 3.1Å; V116-V120 HydrophobicContact CG1-CG2 4.25Å; V116-V120 VanDerWaalsContact O-CG2 3.3Å; V116-V120 WeakPolarHBondContact O-CG2 3.34Å; V116-V120 PolarHBondContact O-N 3.33Å |
| 117 | G | 92.2 | Very high | 88.3 | Confident | 20 Ų | 20 | 58 Ų | 58 | 21% | 0.206 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -58 | -50.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I113 W115 F119 V120 V121 | I113-G117 WeakPolarHBondContact O-CA 3.5Å; I113-G117 PolarHBondContact O-N 3.39Å; W115-G117 VanDerWaalsContact C-N 3.33Å; W115-G117 PolarHBondContact O-N 3.18Å; G117-F119 VanDerWaalsContact C-N 3.3Å; G117-F119 PolarHBondContact O-N 3.49Å; G117-V120 PolarHBondContact O-N 3.01Å; G117-V121 VanDerWaalsContact O-CG2 3.3Å; G117-V121 WeakPolarHBondContact O-CG2 3.23Å; G117-V121 PolarHBondContact O-N 3.46Å |
| 118 | S | 90 | Very high | 88.7 | Confident | 9 Ų | 9 | 56.5 Ų | 56.5 | 6% | 0.063 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60 | -40.9 | 177.2 | -60.2 | 0 | 0 | 0 | 0 | 111.9 | V114 W115 T122 L138 F209 | V114-S118 VanDerWaalsContact O-CB 3.24Å; V114-S118 WeakPolarHBondContact O-CB 3.37Å; V114-S118 PolarHBondContact O-N 2.94Å; V114-S118 PolarHBondContact O-OG 3.33Å; W115-S118 PolarHBondContact O-N 3.4Å; S118-T122 VanDerWaalsContact O-CB 3.29Å; S118-T122 WeakPolarHBondContact O-CB 3.3Å; S118-T122 PolarHBondContact O-N 2.91Å; S118-T122 PolarHBondContact O-OG1 3.31Å; S118-L138 VanDerWaalsContact O-CD2 3.28Å; S118-L138 WeakPolarHBondContact O-CD2 3.31Å; S118-F209 WeakPolarHBondContact OG-CE2 3.21Å; S118-F209 WeakPolarHBondContact OG-CZ 3.44Å |
| 119 | F | 90.8 | Very high | 88.5 | Confident | 87 Ų | 87 | 55.8 Ų | 55.8 | 38% | 0.382 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.1 | -47.9 | 177.9 | -172.5 | -108.1 | 0 | 0 | 0 | 112.3 | W115 V116 G117 T122 L123 | W115-F119 WeakPolarHBondContact O-CB 3.3Å; W115-F119 PolarHBondContact O-N 3.19Å; V116-F119 PolarHBondContact O-N 3.1Å; G117-F119 VanDerWaalsContact C-N 3.3Å; G117-F119 PolarHBondContact O-N 3.49Å; F119-T122 PolarHBondContact O-N 3.41Å; F119-L123 HydrophobicContact CD1-CD1 3.85Å; F119-L123 HydrophobicContact CD1-CG 4.41Å; F119-L123 HydrophobicContact CE1-CD1 3.35Å; F119-L123 HydrophobicContact CE1-CG 4.12Å; F119-L123 HydrophobicContact CE2-CD1 4.49Å; F119-L123 HydrophobicContact CE2-CG 4.46Å; F119-L123 HydrophobicContact CZ-CD1 3.73Å; F119-L123 HydrophobicContact CZ-CD2 4.32Å; F119-L123 HydrophobicContact CZ-CG 4.13Å; F119-L123 WeakPolarHBondContact O-CG 3.45Å; F119-L123 PolarHBondContact O-N 3.04Å |
| 120 | V | 93.4 | Very high | 88.1 | Confident | 73 Ų | 73 | 51.6 Ų | 51.6 | 44% | 0.442 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.7 | -47.5 | 177.5 | 172 | 0 | 0 | 0 | 0 | 110.7 | V116 G117 T122 L123 N124 | V116-V120 HydrophobicContact CG1-CG2 4.25Å; V116-V120 VanDerWaalsContact O-CG2 3.3Å; V116-V120 WeakPolarHBondContact O-CG2 3.34Å; V116-V120 PolarHBondContact O-N 3.33Å; G117-V120 PolarHBondContact O-N 3.01Å; V120-T122 VanDerWaalsContact C-N 3.29Å; V120-T122 PolarHBondContact O-N 3.15Å; V120-L123 PolarHBondContact O-N 2.94Å; V120-N124 PolarHBondContact O-N 3.41Å; V120-N124 PolarHBondContact O-ND2 3.46Å |
| 121 | V | 91.7 | Very high | 88 | Confident | 5 Ų | 5 | 57.1 Ų | 57.1 | 3% | 0.03 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59.4 | -43.6 | 177.9 | 176.4 | 0 | 0 | 0 | 0 | 111.1 | G117 N124 I125 L141 P205 V206 F209 | G117-V121 VanDerWaalsContact O-CG2 3.3Å; G117-V121 WeakPolarHBondContact O-CG2 3.23Å; G117-V121 PolarHBondContact O-N 3.46Å; V121-N124 WeakPolarHBondContact O-CB 3.46Å; V121-N124 PolarHBondContact O-N 3.25Å; V121-I125 HydrophobicContact CG1-CD1 3.93Å; V121-I125 WeakPolarHBondContact O-CG1 3.36Å; V121-I125 PolarHBondContact O-N 3.33Å; V121-L141 HydrophobicContact CB-CD1 3.99Å; V121-L141 HydrophobicContact CG1-CD1 3.68Å; V121-L141 HydrophobicContact CG1-CD2 4.45Å; V121-P205 HydrophobicContact CG2-CB 4.15Å; V121-P205 VanDerWaalsContact CG2-O 3.31Å; V121-P205 WeakPolarHBondContact CG2-O 3.29Å; V121-V206 HydrophobicContact CG1-CB 4.3Å; V121-V206 HydrophobicContact CG1-CG2 3.54Å; V121-F209 HydrophobicContact CG2-CB 3.6Å; V121-F209 HydrophobicContact CG2-CD2 4.49Å; V121-F209 HydrophobicContact CG2-CG 4.08Å |
| 122 | T | 90.3 | Very high | 87.8 | Confident | 1 Ų | 1 | 56.1 Ų | 56.1 | 1% | 0.006 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.8 | -45.2 | 179.7 | -63.6 | 0 | 0 | 0 | 0 | 112.1 | S118 F119 V120 N124 I125 K126 I134 T137 L138 | S118-T122 VanDerWaalsContact O-CB 3.29Å; S118-T122 WeakPolarHBondContact O-CB 3.3Å; S118-T122 PolarHBondContact O-N 2.91Å; S118-T122 PolarHBondContact O-OG1 3.31Å; F119-T122 PolarHBondContact O-N 3.41Å; V120-T122 VanDerWaalsContact C-N 3.29Å; V120-T122 PolarHBondContact O-N 3.15Å; T122-N124 VanDerWaalsContact C-N 3.28Å; T122-N124 PolarHBondContact O-N 3.4Å; T122-I125 PolarHBondContact O-N 2.7Å; T122-K126 PolarHBondContact O-N 3.49Å; T122-I134 HydrophobicContact CG2-CB 3.88Å; T122-I134 HydrophobicContact CG2-CG1 4.29Å; T122-I134 HydrophobicContact CG2-CG2 3.45Å; T122-I134 VanDerWaalsContact CG2-CG2 3.45Å; T122-I134 WeakPolarHBondContact CG2-O 3.4Å; T122-T137 HydrophobicContact CG2-CG2 4.14Å; T122-L138 HydrophobicContact CG2-CD2 4.47Å; T122-L138 HydrophobicContact CG2-CG 3.97Å; T122-L138 WeakPolarHBondContact OG1-CD2 3.04Å; T122-L138 WeakPolarHBondContact OG1-CG 3.28Å |
| 123 | L | 91.7 | Very high | 87.5 | Confident | 61 Ų | 61 | 53 Ų | 53 | 32% | 0.319 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.1 | -41.4 | 175.9 | -74 | -178.7 | 0 | 0 | 0 | 111 | F119 V120 I125 K126 L127 I134 | F119-L123 HydrophobicContact CD1-CD1 3.85Å; F119-L123 HydrophobicContact CD1-CG 4.41Å; F119-L123 HydrophobicContact CE1-CD1 3.35Å; F119-L123 HydrophobicContact CE1-CG 4.12Å; F119-L123 HydrophobicContact CE2-CD1 4.49Å; F119-L123 HydrophobicContact CE2-CG 4.46Å; F119-L123 HydrophobicContact CZ-CD1 3.73Å; F119-L123 HydrophobicContact CZ-CD2 4.32Å; F119-L123 HydrophobicContact CZ-CG 4.13Å; F119-L123 WeakPolarHBondContact O-CG 3.45Å; F119-L123 PolarHBondContact O-N 3.04Å; V120-L123 PolarHBondContact O-N 2.94Å; L123-I125 PolarHBondContact O-N 2.64Å; L123-K126 PolarHBondContact O-N 2.92Å; L123-L127 WeakPolarHBondContact O-CB 3.22Å; L123-L127 VanDerWaalsContact O-CD1 3.26Å; L123-L127 WeakPolarHBondContact O-CD1 3.33Å; L123-L127 PolarHBondContact O-N 3.49Å; L123-I134 HydrophobicContact CD2-CD1 4.31Å |
| 124 | N | 90.9 | Very high | 87.3 | Confident | 71 Ų | 71 | 52.9 Ų | 52.9 | 38% | 0.38 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -59.7 | -45 | 175.7 | -82.5 | -83 | 0 | 0 | 0 | 112 | V120 V121 T122 K126 L127 L128 P205 | V120-N124 PolarHBondContact O-N 3.41Å; V120-N124 PolarHBondContact O-ND2 3.46Å; V121-N124 WeakPolarHBondContact O-CB 3.46Å; V121-N124 PolarHBondContact O-N 3.25Å; T122-N124 VanDerWaalsContact C-N 3.28Å; T122-N124 PolarHBondContact O-N 3.4Å; N124-K126 VanDerWaalsContact C-N 3.3Å; N124-K126 PolarHBondContact O-N 3.39Å; N124-L127 PolarHBondContact O-N 3.37Å; N124-L128 PolarHBondContact O-N 3.06Å; N124-L128 VanDerWaalsContact O-N 3.09Å; N124-P205 HydrophobicContact CB-CG 4.03Å |
| 125 | I | 87.7 | Confident | 87.1 | Confident | 2 Ų | 2 | 57.2 Ų | 57.2 | 1% | 0.01 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.9 | -41.1 | 176.5 | -69.2 | 164.3 | 0 | 0 | 0 | 110.6 | V121 T122 L123 L128 G130 T137 L190 V206 | V121-I125 HydrophobicContact CG1-CD1 3.93Å; V121-I125 WeakPolarHBondContact O-CG1 3.36Å; V121-I125 PolarHBondContact O-N 3.33Å; T122-I125 PolarHBondContact O-N 2.7Å; L123-I125 PolarHBondContact O-N 2.64Å; I125-L128 PolarHBondContact O-N 3.01Å; I125-G130 WeakPolarHBondContact O-CA 3.47Å; I125-G130 PolarHBondContact O-N 3.43Å; I125-T137 HydrophobicContact CB-CG2 4.45Å; I125-T137 HydrophobicContact CD1-CG2 3.46Å; I125-T137 VanDerWaalsContact CD1-CG2 3.46Å; I125-T137 HydrophobicContact CG2-CG2 4.44Å; I125-L190 HydrophobicContact CD1-CD1 3.89Å; I125-L190 HydrophobicContact CD1-CD2 4.47Å; I125-V206 HydrophobicContact CD1-CG2 3.92Å |
| 126 | K | 86.6 | Confident | 86.8 | Confident | 83 Ų | 83 | 53.7 Ų | 53.7 | 36% | 0.361 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -68.1 | -44.5 | -179.8 | -165.6 | 60.2 | 172.9 | 176.2 | 0 | 112.3 | T122 L123 N124 L128 G129 G130 I132 I134 | T122-K126 PolarHBondContact O-N 3.49Å; L123-K126 PolarHBondContact O-N 2.92Å; N124-K126 VanDerWaalsContact C-N 3.3Å; N124-K126 PolarHBondContact O-N 3.39Å; K126-L128 PolarHBondContact O-N 2.87Å; K126-G129 PolarHBondContact O-N 3.16Å; K126-G129 VanDerWaalsContact O-N 3.11Å; K126-G130 PolarHBondContact NZ-O 2.8Å; K126-G130 VanDerWaalsContact NZ-O 3.13Å; K126-I132 PolarHBondContact NZ-O 3.37Å; K126-I134 HydrophobicContact CB-CG1 4.1Å; K126-I134 HydrophobicContact CD-CG1 4.25Å; K126-I134 HydrophobicContact CG-CD1 4.18Å; K126-I134 HydrophobicContact CG-CG1 3.88Å |
| 127 | L | 87.9 | Confident | 86.5 | Confident | 142 Ų | 142 | 50.5 Ų | 50.5 | 74% | 0.743 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -61.5 | -32.2 | 176.9 | -96.2 | 66.8 | 0 | 0 | 0 | 112.4 | L123 N124 G129 | L123-L127 WeakPolarHBondContact O-CB 3.22Å; L123-L127 VanDerWaalsContact O-CD1 3.26Å; L123-L127 WeakPolarHBondContact O-CD1 3.33Å; L123-L127 PolarHBondContact O-N 3.49Å; N124-L127 PolarHBondContact O-N 3.37Å; L127-G129 PolarHBondContact O-N 3.43Å |
| 128 | L | 86.5 | Confident | 86.2 | Confident | 38 Ų | 38 | 50.8 Ų | 50.8 | 20% | 0.199 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.8 | -10.4 | 178.4 | -129.3 | 70.8 | 0 | 0 | 0 | 114.2 | N124 I125 K126 R198 L201 A202 | N124-L128 PolarHBondContact O-N 3.06Å; N124-L128 VanDerWaalsContact O-N 3.09Å; I125-L128 PolarHBondContact O-N 3.01Å; K126-L128 PolarHBondContact O-N 2.87Å; L128-R198 HydrophobicContact CD2-CB 3.98Å; L128-R198 HydrophobicContact CG-CB 4.44Å; L128-R198 PolarHBondContact O-NH1 2.94Å; L128-R198 VanDerWaalsContact O-NH1 3.09Å; L128-L201 HydrophobicContact CD1-CB 4.35Å; L128-L201 HydrophobicContact CD2-CB 3.79Å; L128-A202 HydrophobicContact CD2-CB 3.62Å; L128-A202 VanDerWaalsContact CD2-N 3.33Å |
| 129 | G | 80.3 | Confident | 85.9 | Confident | 44 Ų | 44 | 50.5 Ų | 50.5 | 45% | 0.454 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 100.2 | 28.3 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | K126 L127 T131 | K126-G129 PolarHBondContact O-N 3.16Å; K126-G129 VanDerWaalsContact O-N 3.11Å; L127-G129 PolarHBondContact O-N 3.43Å; G129-T131 PolarHBondContact O-N 2.78Å |
| 130 | G | 77.2 | Confident | 85.4 | Confident | 6 Ų | 6 | 47.2 Ų | 47.2 | 6% | 0.062 | 26% | 0.262 | C | S | . | . | trans | -57.3 | 126.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | I125 K126 I132 S193 | I125-G130 WeakPolarHBondContact O-CA 3.47Å; I125-G130 PolarHBondContact O-N 3.43Å; K126-G130 PolarHBondContact NZ-O 2.8Å; K126-G130 VanDerWaalsContact NZ-O 3.13Å; G130-I132 PolarHBondContact O-N 3.41Å; G130-S193 WeakPolarHBondContact CA-O 3.34Å | ||
| 131 | T | 80.2 | Confident | 85 | Confident | 117 Ų | 117 | 43.7 Ų | 43.7 | 72% | 0.718 | 24% | 0.241 | S | C | * | . | S | Bend | trans | -71.6 | -20.6 | 177 | 55.9 | 0 | 0 | 0 | 0 | 112.4 | G129 S193 | G129-T131 PolarHBondContact O-N 2.78Å; T131-S193 PolarHBondContact N-O 3.33Å; T131-S193 PolarHBondContact OG1-O 3.31Å |
| 132 | I | 81.8 | Confident | 84.6 | Confident | 31 Ų | 31 | 43.6 Ų | 43.6 | 16% | 0.159 | 24% | 0.241 | C | C | . | . | S | Bend | trans | -76.4 | 151.2 | -180 | -61.7 | -166 | 0 | 0 | 0 | 111.3 | K126 G130 Q136 T137 S193 | K126-I132 PolarHBondContact NZ-O 3.37Å; G130-I132 PolarHBondContact O-N 3.41Å; I132-Q136 HydrophobicContact CG2-CB 3.39Å; I132-Q136 HydrophobicContact CG2-CG 4.41Å; I132-T137 WeakPolarHBondContact CG2-OG1 3.23Å; I132-S193 WeakPolarHBondContact CD1-OG 3.28Å |
| 133 | S | 83.2 | Confident | 84.1 | Confident | 44 Ų | 44 | 46.6 Ų | 46.6 | 31% | 0.308 | 25% | 0.252 | S | S | . | . | trans | -71.3 | 150.6 | 172.7 | 71.4 | 0 | 0 | 0 | 0 | 111.7 | F135 Q136 T137 | S133-F135 VanDerWaalsContact C-N 3.26Å; S133-F135 PolarHBondContact O-N 2.9Å; S133-Q136 VanDerWaalsContact N-OE1 3.11Å; S133-Q136 PolarHBondContact O-N 3.34Å; S133-Q136 VanDerWaalsContact OG-CB 3.28Å; S133-Q136 WeakPolarHBondContact OG-CB 3.03Å; S133-Q136 WeakPolarHBondContact OG-CG 3.49Å; S133-Q136 PolarHBondContact OG-N 3.5Å; S133-Q136 PolarHBondContact OG-OE1 2.88Å; S133-T137 PolarHBondContact O-N 3.3Å; S133-T137 VanDerWaalsContact O-N 3.14Å; S133-T137 PolarHBondContact O-OG1 3.26Å | ||
| 134 | I | 84.6 | Confident | 83.6 | Confident | 53 Ų | 53 | 43.7 Ų | 43.7 | 27% | 0.272 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -53.9 | -46.1 | 178.7 | -67.7 | 172.9 | 0 | 0 | 0 | 110.1 | T122 L123 K126 Q136 T137 L138 | T122-I134 HydrophobicContact CG2-CB 3.88Å; T122-I134 HydrophobicContact CG2-CG1 4.29Å; T122-I134 HydrophobicContact CG2-CG2 3.45Å; T122-I134 VanDerWaalsContact CG2-CG2 3.45Å; T122-I134 WeakPolarHBondContact CG2-O 3.4Å; L123-I134 HydrophobicContact CD2-CD1 4.31Å; K126-I134 HydrophobicContact CB-CG1 4.1Å; K126-I134 HydrophobicContact CD-CG1 4.25Å; K126-I134 HydrophobicContact CG-CD1 4.18Å; K126-I134 HydrophobicContact CG-CG1 3.88Å; I134-Q136 PolarHBondContact O-N 3.2Å; I134-T137 PolarHBondContact O-N 2.84Å; I134-L138 HydrophobicContact CG2-CD1 4.18Å; I134-L138 WeakPolarHBondContact O-CG 3.39Å; I134-L138 PolarHBondContact O-N 2.93Å |
| 135 | F | 82.7 | Confident | 83.2 | Confident | 110 Ų | 110 | 40.8 Ų | 40.8 | 48% | 0.482 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -67.2 | -37.7 | -178.5 | -59.6 | -62.7 | 0 | 0 | 0 | 113.4 | L81 S133 L138 C139 | L81-F135 HydrophobicContact CD1-CD1 3.73Å; L81-F135 HydrophobicContact CD1-CE1 4.02Å; L81-F135 HydrophobicContact CD1-CG 4.48Å; L81-F135 HydrophobicContact CG-CD1 4.45Å; S133-F135 VanDerWaalsContact C-N 3.26Å; S133-F135 PolarHBondContact O-N 2.9Å; F135-L138 HydrophobicContact CD1-CD1 4.22Å; F135-L138 PolarHBondContact O-N 3.36Å; F135-C139 WeakPolarHBondContact O-CB 3.46Å; F135-C139 PolarHBondContact O-N 2.9Å; F135-C139 PolarHBondContact O-SG 3.48Å |
| 136 | Q | 82 | Confident | 82.8 | Confident | 61 Ų | 61 | 44 Ų | 44 | 29% | 0.285 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.9 | -44.5 | 175.5 | -78.5 | 168.1 | -41.3 | 0 | 0 | 111.8 | I132 S133 I134 C139 I140 | I132-Q136 HydrophobicContact CG2-CB 3.39Å; I132-Q136 HydrophobicContact CG2-CG 4.41Å; S133-Q136 VanDerWaalsContact N-OE1 3.11Å; S133-Q136 PolarHBondContact O-N 3.34Å; S133-Q136 VanDerWaalsContact OG-CB 3.28Å; S133-Q136 WeakPolarHBondContact OG-CB 3.03Å; S133-Q136 WeakPolarHBondContact OG-CG 3.49Å; S133-Q136 PolarHBondContact OG-N 3.5Å; S133-Q136 PolarHBondContact OG-OE1 2.88Å; I134-Q136 PolarHBondContact O-N 3.2Å; Q136-C139 PolarHBondContact O-N 2.77Å; Q136-I140 VanDerWaalsContact O-CG1 3.27Å; Q136-I140 WeakPolarHBondContact O-CG1 3.31Å; Q136-I140 PolarHBondContact O-N 3.48Å |
| 137 | T | 84.8 | Confident | 82.3 | Confident | 3 Ų | 3 | 42.4 Ų | 42.4 | 2% | 0.018 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64 | -41.7 | 177.2 | -61.4 | 0 | 0 | 0 | 0 | 111.7 | T122 I125 I132 S133 I134 C139 I140 L141 L190 | T122-T137 HydrophobicContact CG2-CG2 4.14Å; I125-T137 HydrophobicContact CB-CG2 4.45Å; I125-T137 HydrophobicContact CD1-CG2 3.46Å; I125-T137 VanDerWaalsContact CD1-CG2 3.46Å; I125-T137 HydrophobicContact CG2-CG2 4.44Å; I132-T137 WeakPolarHBondContact CG2-OG1 3.23Å; S133-T137 PolarHBondContact O-N 3.3Å; S133-T137 VanDerWaalsContact O-N 3.14Å; S133-T137 PolarHBondContact O-OG1 3.26Å; I134-T137 PolarHBondContact O-N 2.84Å; T137-C139 VanDerWaalsContact C-N 3.32Å; T137-C139 PolarHBondContact O-N 3.01Å; T137-I140 PolarHBondContact O-N 2.85Å; T137-L141 HydrophobicContact CG2-CD1 4.09Å; T137-L141 HydrophobicContact CG2-CG 4.48Å; T137-L141 WeakPolarHBondContact O-CB 3.38Å; T137-L141 VanDerWaalsContact O-CG 3.29Å; T137-L141 WeakPolarHBondContact O-CG 3.19Å; T137-L141 PolarHBondContact O-N 2.87Å; T137-L190 HydrophobicContact CG2-CD2 4.15Å |
| 138 | L | 86.8 | Confident | 82 | Confident | 25 Ų | 25 | 35.7 Ų | 35.7 | 13% | 0.131 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57.7 | -45.3 | 173.1 | -76.8 | 171.2 | 0 | 0 | 0 | 112.2 | S118 T122 I134 F135 L141 G142 | S118-L138 VanDerWaalsContact O-CD2 3.28Å; S118-L138 WeakPolarHBondContact O-CD2 3.31Å; T122-L138 HydrophobicContact CG2-CD2 4.47Å; T122-L138 HydrophobicContact CG2-CG 3.97Å; T122-L138 WeakPolarHBondContact OG1-CD2 3.04Å; T122-L138 WeakPolarHBondContact OG1-CG 3.28Å; I134-L138 HydrophobicContact CG2-CD1 4.18Å; I134-L138 WeakPolarHBondContact O-CG 3.39Å; I134-L138 PolarHBondContact O-N 2.93Å; F135-L138 HydrophobicContact CD1-CD1 4.22Å; F135-L138 PolarHBondContact O-N 3.36Å; L138-L141 PolarHBondContact O-N 3.05Å; L138-G142 PolarHBondContact O-N 3.48Å |
| 139 | C | 82.4 | Confident | 81.6 | Confident | 4 Ų | 4 | 34.4 Ų | 34.4 | 3% | 0.027 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.9 | -51.7 | 179.6 | -68.4 | 0 | 0 | 0 | 0 | 110.6 | I77 D80 F135 Q136 T137 L141 G142 Y143 | I77-C139 HydrophobicContact CG2-CB 3.75Å; I77-C139 WeakPolarHBondContact CG2-SG 3.28Å; D80-C139 PolarHBondContact O-SG 2.9Å; F135-C139 WeakPolarHBondContact O-CB 3.46Å; F135-C139 PolarHBondContact O-N 2.9Å; F135-C139 PolarHBondContact O-SG 3.48Å; Q136-C139 PolarHBondContact O-N 2.77Å; T137-C139 VanDerWaalsContact C-N 3.32Å; T137-C139 PolarHBondContact O-N 3.01Å; C139-L141 VanDerWaalsContact C-N 3.31Å; C139-L141 PolarHBondContact O-N 3.44Å; C139-G142 PolarHBondContact O-N 3.14Å; C139-G142 VanDerWaalsContact O-N 3.11Å; C139-Y143 HydrophobicContact CB-CD2 4.18Å; C139-Y143 HydrophobicContact CB-CE2 3.98Å; C139-Y143 WeakPolarHBondContact O-CD2 3.45Å; C139-Y143 PolarHBondContact O-N 2.79Å |
| 140 | I | 80.2 | Confident | 81.5 | Confident | 17 Ų | 17 | 34.8 Ų | 34.8 | 9% | 0.087 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -56.5 | -45.9 | 178.5 | -66.1 | 162.7 | 0 | 0 | 0 | 111 | Q136 T137 G142 Y143 C144 F189 | Q136-I140 VanDerWaalsContact O-CG1 3.27Å; Q136-I140 WeakPolarHBondContact O-CG1 3.31Å; Q136-I140 PolarHBondContact O-N 3.48Å; T137-I140 PolarHBondContact O-N 2.85Å; I140-G142 VanDerWaalsContact C-N 3.33Å; I140-G142 PolarHBondContact O-N 2.86Å; I140-Y143 PolarHBondContact O-N 3.1Å; I140-C144 WeakPolarHBondContact O-CB 3.24Å; I140-C144 PolarHBondContact O-N 2.89Å; I140-C144 PolarHBondContact O-SG 3.41Å; I140-F189 HydrophobicContact CG2-CB 4.25Å |
| 141 | L | 85.8 | Confident | 81.6 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59 | -45.3 | 177.7 | -74.5 | 171.9 | 0 | 0 | 0 | 111.5 | V121 T137 L138 C139 L145 L190 V206 Y210 | V121-L141 HydrophobicContact CB-CD1 3.99Å; V121-L141 HydrophobicContact CG1-CD1 3.68Å; V121-L141 HydrophobicContact CG1-CD2 4.45Å; T137-L141 HydrophobicContact CG2-CD1 4.09Å; T137-L141 HydrophobicContact CG2-CG 4.48Å; T137-L141 WeakPolarHBondContact O-CB 3.38Å; T137-L141 VanDerWaalsContact O-CG 3.29Å; T137-L141 WeakPolarHBondContact O-CG 3.19Å; T137-L141 PolarHBondContact O-N 2.87Å; L138-L141 PolarHBondContact O-N 3.05Å; C139-L141 VanDerWaalsContact C-N 3.31Å; C139-L141 PolarHBondContact O-N 3.44Å; L141-L145 PolarHBondContact O-N 3.2Å; L141-L190 HydrophobicContact CD2-CD1 4.27Å; L141-V206 HydrophobicContact CD2-CG1 4.15Å; L141-Y210 HydrophobicContact CD2-CE2 3.96Å; L141-Y210 PolarHBondContact O-OH 2.9Å |
| 142 | G | 84.3 | Confident | 81.4 | Confident | 3 Ų | 3 | 30 Ų | 30 | 3% | 0.031 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.1 | -45.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | I87 L138 C139 I140 C144 L145 L146 | I87-G142 WeakPolarHBondContact CD1-O 3.23Å; L138-G142 PolarHBondContact O-N 3.48Å; C139-G142 PolarHBondContact O-N 3.14Å; C139-G142 VanDerWaalsContact O-N 3.11Å; I140-G142 VanDerWaalsContact C-N 3.33Å; I140-G142 PolarHBondContact O-N 2.86Å; G142-C144 VanDerWaalsContact C-N 3.29Å; G142-C144 PolarHBondContact O-N 3.37Å; G142-L145 WeakPolarHBondContact O-CA 3.11Å; G142-L145 VanDerWaalsContact O-CB 3.28Å; G142-L145 WeakPolarHBondContact O-CB 3.42Å; G142-L145 PolarHBondContact O-N 2.77Å; G142-L146 PolarHBondContact O-N 2.74Å |
| 143 | Y | 79.6 | Confident | 81.1 | Confident | 63 Ų | 63 | 30.3 Ų | 30.3 | 25% | 0.247 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -63.2 | -35.5 | 179.1 | -76.8 | -66.8 | 0 | 0 | 0 | 112.5 | I77 I87 C139 I140 L145 L146 P147 | I77-Y143 HydrophobicContact CD1-CD2 4.28Å; I77-Y143 HydrophobicContact CD1-CE2 3.44Å; I77-Y143 VanDerWaalsContact CD1-CE2 3.44Å; I87-Y143 HydrophobicContact CD1-CD1 4.09Å; I87-Y143 HydrophobicContact CD1-CE1 4.47Å; C139-Y143 HydrophobicContact CB-CD2 4.18Å; C139-Y143 HydrophobicContact CB-CE2 3.98Å; C139-Y143 WeakPolarHBondContact O-CD2 3.45Å; C139-Y143 PolarHBondContact O-N 2.79Å; I140-Y143 PolarHBondContact O-N 3.1Å; Y143-L145 PolarHBondContact O-N 3.04Å; Y143-L146 WeakPolarHBondContact O-CB 3.48Å; Y143-L146 PolarHBondContact O-N 3.02Å; Y143-P147 WeakPolarHBondContact O-CD 3.41Å |
| 144 | C | 81.4 | Confident | 80.7 | Confident | 1 Ų | 1 | 30.2 Ų | 30.2 | 1% | 0.007 | 15% | 0.153 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -17.9 | 172.3 | -69.9 | 0 | 0 | 0 | 0 | 113.6 | Y66 I140 G142 A186 Y210 | Y66-C144 VanDerWaalsContact OH-CA 3.27Å; Y66-C144 WeakPolarHBondContact OH-CA 3.25Å; Y66-C144 PolarHBondContact OH-SG 3.31Å; I140-C144 WeakPolarHBondContact O-CB 3.24Å; I140-C144 PolarHBondContact O-N 2.89Å; I140-C144 PolarHBondContact O-SG 3.41Å; G142-C144 VanDerWaalsContact C-N 3.29Å; G142-C144 PolarHBondContact O-N 3.37Å; C144-A186 HydrophobicContact CB-CB 4.36Å; C144-Y210 HydrophobicContact CB-CE1 3.94Å; C144-Y210 WeakPolarHBondContact CB-OH 3.47Å |
| 145 | L | 81.9 | Confident | 80.2 | Confident | 9 Ų | 9 | 28.8 Ų | 28.8 | 5% | 0.047 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -82.7 | -24.1 | 174 | -64.7 | 178.6 | 0 | 0 | 0 | 113.4 | I87 V114 L141 G142 Y143 L148 A149 F209 Y210 V213 | I87-L145 HydrophobicContact CG2-CB 4.44Å; V114-L145 HydrophobicContact CG1-CD1 3.79Å; L141-L145 PolarHBondContact O-N 3.2Å; G142-L145 WeakPolarHBondContact O-CA 3.11Å; G142-L145 VanDerWaalsContact O-CB 3.28Å; G142-L145 WeakPolarHBondContact O-CB 3.42Å; G142-L145 PolarHBondContact O-N 2.77Å; Y143-L145 PolarHBondContact O-N 3.04Å; L145-L148 HydrophobicContact CD2-CD2 4.05Å; L145-L148 WeakPolarHBondContact O-CB 3.44Å; L145-L148 PolarHBondContact O-N 3.41Å; L145-A149 WeakPolarHBondContact O-CB 3.39Å; L145-A149 PolarHBondContact O-N 3.3Å; L145-F209 HydrophobicContact CD1-CE1 3.92Å; L145-F209 HydrophobicContact CD1-CZ 3.76Å; L145-F209 HydrophobicContact CD2-CE1 4.26Å; L145-F209 HydrophobicContact CG-CE1 4.31Å; L145-Y210 HydrophobicContact CD2-CD1 3.7Å; L145-Y210 HydrophobicContact CD2-CE1 3.57Å; L145-Y210 HydrophobicContact CG-CE1 4.26Å; L145-V213 HydrophobicContact CD1-CG1 4.3Å; L145-V213 HydrophobicContact CD1-CG2 4.33Å; L145-V213 HydrophobicContact CD2-CB 4.05Å; L145-V213 HydrophobicContact CD2-CG1 3.71Å; L145-V213 HydrophobicContact CD2-CG2 4.24Å |
| 146 | L | 78.3 | Confident | 79.7 | Confident | 71 Ų | 71 | 26.3 Ų | 26.3 | 37% | 0.372 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -56.5 | -55.1 | 178.5 | -177 | 158.4 | 0 | 0 | 0 | 112.5 | I87 G142 Y143 L148 A149 I150 | I87-L146 HydrophobicContact CD1-CB 3.96Å; I87-L146 HydrophobicContact CD1-CD1 4.21Å; I87-L146 HydrophobicContact CG1-CB 4.17Å; I87-L146 HydrophobicContact CG1-CD1 4.09Å; I87-L146 HydrophobicContact CG2-CB 4.46Å; G142-L146 PolarHBondContact O-N 2.74Å; Y143-L146 WeakPolarHBondContact O-CB 3.48Å; Y143-L146 PolarHBondContact O-N 3.02Å; L146-L148 PolarHBondContact O-N 3.21Å; L146-A149 PolarHBondContact O-N 3.42Å; L146-I150 HydrophobicContact CD2-CD1 3.38Å; L146-I150 HydrophobicContact CD2-CG1 4.3Å; L146-I150 HydrophobicContact CG-CD1 4.17Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 3.3Å |
| 147 | P | 77.4 | Confident | 79.2 | Confident | 49 Ų | 49 | 28.9 Ų | 28.9 | 32% | 0.318 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -64.9 | -33 | -179.7 | 25.5 | -34.1 | 0 | 0 | 0 | 111.6 | Y66 Y143 I150 D151 | Y66-P147 HydrophobicContact CE2-CG 4.37Å; Y143-P147 WeakPolarHBondContact O-CD 3.41Å; P147-I150 PolarHBondContact O-N 3.42Å; P147-D151 WeakPolarHBondContact O-CB 3.4Å; P147-D151 PolarHBondContact O-N 3.27Å |
| 148 | L | 80.8 | Confident | 78.5 | Confident | 1 Ų | 1 | 33 Ų | 33 | 1% | 0.005 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.8 | -45.3 | 175.1 | 174.9 | 60.6 | 0 | 0 | 0 | 111.7 | L145 L146 D151 V152 T178 V179 I217 | L145-L148 HydrophobicContact CD2-CD2 4.05Å; L145-L148 WeakPolarHBondContact O-CB 3.44Å; L145-L148 PolarHBondContact O-N 3.41Å; L146-L148 PolarHBondContact O-N 3.21Å; L148-D151 PolarHBondContact O-N 3.16Å; L148-V152 HydrophobicContact CD1-CG2 4.46Å; L148-V152 WeakPolarHBondContact O-CG2 3.37Å; L148-V152 PolarHBondContact O-N 2.94Å; L148-T178 HydrophobicContact CD1-CG2 4.3Å; L148-V179 HydrophobicContact CD1-CB 4.17Å; L148-V179 HydrophobicContact CD1-CG2 3.2Å; L148-V179 HydrophobicContact CD2-CG2 4Å; L148-V179 HydrophobicContact CG-CG2 4.22Å; L148-I217 HydrophobicContact CG-CD1 4.41Å |
| 149 | A | 78.4 | Confident | 77.5 | Confident | 11 Ų | 11 | 33.7 Ų | 33.7 | 9% | 0.091 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.2 | -43.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V91 L145 L146 L153 | V91-A149 HydrophobicContact CG2-CB 3.54Å; L145-A149 WeakPolarHBondContact O-CB 3.39Å; L145-A149 PolarHBondContact O-N 3.3Å; L146-A149 PolarHBondContact O-N 3.42Å; A149-L153 VanDerWaalsContact O-CB 3.26Å; A149-L153 WeakPolarHBondContact O-CB 3.15Å; A149-L153 PolarHBondContact O-N 3.25Å |
| 150 | I | 78.5 | Confident | 76.6 | Confident | 52 Ų | 52 | 39.3 Ų | 39.3 | 27% | 0.267 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -63.9 | -41.8 | 178.6 | -67.6 | 177.1 | 0 | 0 | 0 | 111 | F90 L146 P147 L153 I154 | F90-I150 HydrophobicContact CE1-CG1 4.49Å; L146-I150 HydrophobicContact CD2-CD1 3.38Å; L146-I150 HydrophobicContact CD2-CG1 4.3Å; L146-I150 HydrophobicContact CG-CD1 4.17Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 3.3Å; P147-I150 PolarHBondContact O-N 3.42Å; I150-L153 WeakPolarHBondContact O-CB 3.49Å; I150-L153 PolarHBondContact O-N 2.92Å; I150-I154 HydrophobicContact CG2-CD1 3.58Å; I150-I154 HydrophobicContact CG2-CG1 4.29Å; I150-I154 VanDerWaalsContact O-CG1 3.28Å; I150-I154 WeakPolarHBondContact O-CG1 3.36Å; I150-I154 PolarHBondContact O-N 3.35Å |
| 151 | D | 78.3 | Confident | 75.7 | Confident | 20 Ų | 20 | 43.2 Ų | 43.2 | 11% | 0.107 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.3 | -47.8 | -179.9 | -176.6 | 71.5 | 0 | 0 | 0 | 112.5 | F46 P147 L148 L153 I154 C155 T178 | F46-D151 HydrophobicContact CE2-CB 3.96Å; F46-D151 WeakPolarHBondContact CE2-OD1 3.48Å; F46-D151 WeakPolarHBondContact CZ-OD1 3.3Å; P147-D151 WeakPolarHBondContact O-CB 3.4Å; P147-D151 PolarHBondContact O-N 3.27Å; L148-D151 PolarHBondContact O-N 3.16Å; D151-L153 VanDerWaalsContact C-N 3.3Å; D151-L153 PolarHBondContact O-N 3.5Å; D151-I154 PolarHBondContact O-N 3.26Å; D151-C155 PolarHBondContact O-N 3.45Å; D151-C155 PolarHBondContact O-SG 3.18Å; D151-T178 HydrophobicContact CB-CG2 3.71Å; D151-T178 VanDerWaalsContact OD2-CB 3.22Å; D151-T178 WeakPolarHBondContact OD2-CB 3.18Å; D151-T178 PolarHBondContact OD2-OG1 3.32Å |
| 152 | V | 75.7 | Confident | 74.4 | Confident | 2 Ų | 2 | 52.6 Ų | 52.6 | 1% | 0.012 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.6 | -34.7 | 178.2 | -176 | 0 | 0 | 0 | 0 | 111.4 | L148 C155 K156 T175 I217 | L148-V152 HydrophobicContact CD1-CG2 4.46Å; L148-V152 WeakPolarHBondContact O-CG2 3.37Å; L148-V152 PolarHBondContact O-N 2.94Å; V152-C155 WeakPolarHBondContact O-CB 3.41Å; V152-C155 PolarHBondContact O-N 2.88Å; V152-K156 WeakPolarHBondContact O-CG 3.36Å; V152-K156 PolarHBondContact O-N 3.28Å; V152-T175 HydrophobicContact CG2-CG2 3.54Å; V152-I217 HydrophobicContact CB-CG2 3.77Å; V152-I217 HydrophobicContact CG1-CG2 3.45Å; V152-I217 VanDerWaalsContact CG1-CG2 3.45Å; V152-I217 HydrophobicContact CG2-CG2 4.15Å |
| 153 | L | 75.8 | Confident | 73.2 | Confident | 38 Ų | 38 | 54.2 Ų | 54.2 | 20% | 0.199 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62 | -46.3 | 173.5 | 176.1 | 64.7 | 0 | 0 | 0 | 111.6 | F90 M94 A149 I150 D151 C155 K156 L157 | F90-L153 HydrophobicContact CE1-CD2 4.37Å; F90-L153 HydrophobicContact CZ-CD2 4.17Å; M94-L153 HydrophobicContact CB-CD1 4.29Å; M94-L153 HydrophobicContact CG-CD1 4.3Å; M94-L153 HydrophobicContact CG-CD2 3.97Å; M94-L153 HydrophobicContact SD-CD1 3.87Å; M94-L153 HydrophobicContact SD-CD2 3.58Å; M94-L153 VanDerWaalsContact SD-CD2 3.58Å; M94-L153 HydrophobicContact SD-CG 4.39Å; A149-L153 VanDerWaalsContact O-CB 3.26Å; A149-L153 WeakPolarHBondContact O-CB 3.15Å; A149-L153 PolarHBondContact O-N 3.25Å; I150-L153 WeakPolarHBondContact O-CB 3.49Å; I150-L153 PolarHBondContact O-N 2.92Å; D151-L153 VanDerWaalsContact C-N 3.3Å; D151-L153 PolarHBondContact O-N 3.5Å; L153-C155 VanDerWaalsContact C-N 3.31Å; L153-C155 PolarHBondContact O-N 3.33Å; L153-K156 WeakPolarHBondContact O-CA 3.4Å; L153-K156 VanDerWaalsContact O-CB 3.28Å; L153-K156 WeakPolarHBondContact O-CB 3.31Å; L153-K156 PolarHBondContact O-N 3.06Å; L153-K156 VanDerWaalsContact O-N 3.08Å; L153-L157 HydrophobicContact CD1-CD1 4.43Å; L153-L157 HydrophobicContact CD1-CG 4.38Å; L153-L157 HydrophobicContact CG-CD1 4.24Å; L153-L157 WeakPolarHBondContact O-CG 3.22Å; L153-L157 PolarHBondContact O-N 2.9Å |
| 154 | I | 75.4 | Confident | 73 | Confident | 41 Ų | 41 | 53.6 Ų | 53.6 | 21% | 0.21 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68.2 | -37.3 | 179.3 | -62.7 | 166.6 | 0 | 0 | 0 | 110 | F46 L50 I150 D151 K156 L157 V158 | F46-I154 HydrophobicContact CD1-CB 4.46Å; F46-I154 HydrophobicContact CD1-CD1 3.29Å; F46-I154 HydrophobicContact CD1-CG1 4.41Å; F46-I154 HydrophobicContact CD1-CG2 4.16Å; F46-I154 HydrophobicContact CD2-CD1 3.94Å; F46-I154 HydrophobicContact CE1-CB 3.56Å; F46-I154 HydrophobicContact CE1-CD1 3.23Å; F46-I154 HydrophobicContact CE1-CG1 3.96Å; F46-I154 HydrophobicContact CE1-CG2 3.29Å; F46-I154 HydrophobicContact CE2-CD1 3.89Å; F46-I154 HydrophobicContact CG-CD1 3.66Å; F46-I154 HydrophobicContact CZ-CB 3.66Å; F46-I154 HydrophobicContact CZ-CD1 3.55Å; F46-I154 HydrophobicContact CZ-CG1 4.17Å; F46-I154 HydrophobicContact CZ-CG2 3.87Å; L50-I154 HydrophobicContact CD1-CG2 4.1Å; I150-I154 HydrophobicContact CG2-CD1 3.58Å; I150-I154 HydrophobicContact CG2-CG1 4.29Å; I150-I154 VanDerWaalsContact O-CG1 3.28Å; I150-I154 WeakPolarHBondContact O-CG1 3.36Å; I150-I154 PolarHBondContact O-N 3.35Å; D151-I154 PolarHBondContact O-N 3.26Å; I154-K156 PolarHBondContact O-N 3.39Å; I154-L157 PolarHBondContact O-N 3.26Å; I154-V158 HydrophobicContact CG2-CG2 3.89Å; I154-V158 WeakPolarHBondContact O-CB 3.43Å; I154-V158 VanDerWaalsContact O-CG2 3.29Å; I154-V158 WeakPolarHBondContact O-CG2 3.27Å; I154-V158 PolarHBondContact O-N 3.03Å |
| 155 | C | 73.7 | Confident | 72.8 | Confident | 24 Ų | 24 | 59.8 Ų | 59.8 | 16% | 0.162 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -58.4 | -36.7 | 170.4 | -68.2 | 0 | 0 | 0 | 0 | 112.3 | D151 V152 L153 S159 R171 | D151-C155 PolarHBondContact O-N 3.45Å; D151-C155 PolarHBondContact O-SG 3.18Å; V152-C155 WeakPolarHBondContact O-CB 3.41Å; V152-C155 PolarHBondContact O-N 2.88Å; L153-C155 VanDerWaalsContact C-N 3.31Å; L153-C155 PolarHBondContact O-N 3.33Å; C155-S159 WeakPolarHBondContact O-CB 3.46Å; C155-S159 PolarHBondContact O-N 2.8Å; C155-R171 HydrophobicContact CB-CG 3.97Å |
| 156 | K | 71.9 | Confident | 72.7 | Confident | 58 Ų | 58 | 65.6 Ų | 65.6 | 25% | 0.252 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -67.9 | -47.2 | 174.6 | -84.9 | -74.3 | -121.3 | -179.1 | 0 | 112.7 | V152 L153 I154 S159 T221 | V152-K156 WeakPolarHBondContact O-CG 3.36Å; V152-K156 PolarHBondContact O-N 3.28Å; L153-K156 WeakPolarHBondContact O-CA 3.4Å; L153-K156 VanDerWaalsContact O-CB 3.28Å; L153-K156 WeakPolarHBondContact O-CB 3.31Å; L153-K156 PolarHBondContact O-N 3.06Å; L153-K156 VanDerWaalsContact O-N 3.08Å; I154-K156 PolarHBondContact O-N 3.39Å; K156-S159 PolarHBondContact O-N 3.24Å; K156-T221 HydrophobicContact CD-CG2 3.38Å; K156-T221 VanDerWaalsContact CE-CA 3.49Å; K156-T221 VanDerWaalsContact CE-CB 3.48Å; K156-T221 VanDerWaalsContact CE-OG1 3.29Å; K156-T221 WeakPolarHBondContact CE-OG1 3.29Å; K156-T221 HydrophobicContact CG-CG2 3.88Å; K156-T221 PolarHBondContact NZ-O 3.38Å |
| 157 | L | 72.5 | Confident | 72.6 | Confident | 115 Ų | 115 | 63.9 Ų | 63.9 | 60% | 0.602 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -66.2 | -43.6 | -179.3 | -68.8 | 174.3 | 0 | 0 | 0 | 112.3 | L153 I154 S159 V160 | L153-L157 HydrophobicContact CD1-CD1 4.43Å; L153-L157 HydrophobicContact CD1-CG 4.38Å; L153-L157 HydrophobicContact CG-CD1 4.24Å; L153-L157 WeakPolarHBondContact O-CG 3.22Å; L153-L157 PolarHBondContact O-N 2.9Å; I154-L157 PolarHBondContact O-N 3.26Å; L157-S159 VanDerWaalsContact C-N 3.3Å; L157-S159 PolarHBondContact O-N 3.32Å; L157-V160 WeakPolarHBondContact O-CG2 3.37Å; L157-V160 PolarHBondContact O-N 3.16Å |
| 158 | V | 70.2 | Confident | 72.6 | Confident | 90 Ų | 90 | 63.5 Ų | 63.5 | 55% | 0.545 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -67.3 | -33.1 | 179.3 | 172.1 | 0 | 0 | 0 | 0 | 111.5 | I154 V160 | I154-V158 HydrophobicContact CG2-CG2 3.89Å; I154-V158 WeakPolarHBondContact O-CB 3.43Å; I154-V158 VanDerWaalsContact O-CG2 3.29Å; I154-V158 WeakPolarHBondContact O-CG2 3.27Å; I154-V158 PolarHBondContact O-N 3.03Å; V158-V160 PolarHBondContact O-N 2.99Å |
| 159 | S | 64.8 | Low | 72.7 | Confident | 39 Ų | 39 | 68.1 Ų | 68.1 | 27% | 0.273 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81 | 9 | -177.1 | -172.2 | 0 | 0 | 0 | 0 | 114.5 | C155 K156 L157 S161 | C155-S159 WeakPolarHBondContact O-CB 3.46Å; C155-S159 PolarHBondContact O-N 2.8Å; K156-S159 PolarHBondContact O-N 3.24Å; L157-S159 VanDerWaalsContact C-N 3.3Å; L157-S159 PolarHBondContact O-N 3.32Å; S159-S161 PolarHBondContact O-N 3.09Å |
| 160 | V | 63.3 | Low | 72.7 | Confident | 122 Ų | 122 | 71.5 Ų | 71.5 | 74% | 0.739 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62 | -21.7 | 169.2 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | L157 V158 E162 | L157-V160 WeakPolarHBondContact O-CG2 3.37Å; L157-V160 PolarHBondContact O-N 3.16Å; V158-V160 PolarHBondContact O-N 2.99Å; V160-E162 PolarHBondContact O-N 3.05Å |
| 161 | S | 62.4 | Low | 72.7 | Confident | 98 Ų | 98 | 70.1 Ų | 70.1 | 69% | 0.685 | 41% | 0.405 | S | S | * | . | S | Bend | trans | -66.9 | 118.2 | 169.5 | -163.9 | 0 | 0 | 0 | 0 | 110.5 | S159 G163 | S159-S161 PolarHBondContact O-N 3.09Å; S161-G163 PolarHBondContact O-N 3.19Å |
| 162 | E | 58.1 | Low | 72.8 | Confident | 198 Ų | 198 | 72.3 Ų | 72.3 | 93% | 0.925 | 42% | 0.416 | S | S | * | . | trans | -45.6 | 98.3 | -174.2 | -63.9 | 175.8 | 147.1 | 0 | 0 | 112.9 | V160 | V160-E162 PolarHBondContact O-N 3.05Š| ||
| 163 | G | 58.7 | Low | 73.3 | Confident | 37 Ų | 37 | 77.3 Ų | 77.3 | 38% | 0.381 | 44% | 0.442 | S | S | . | . | trans | -144 | 125 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | S161 S167 | S161-G163 PolarHBondContact O-N 3.19Å; G163-S167 VanDerWaalsContact CA-OG 3.29Å; G163-S167 WeakPolarHBondContact CA-OG 3.22Å; G163-S167 WeakPolarHBondContact O-CB 3.46Å; G163-S167 PolarHBondContact O-OG 3.21Å | ||
| 164 | G | 76.3 | Confident | 73.5 | Confident | 49 Ų | 49 | 77.9 Ų | 77.9 | 51% | 0.505 | 45% | 0.448 | S | S | . | . | trans | -68.8 | -131.4 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | I166 S167 L168 | G164-I166 PolarHBondContact O-N 3.03Å; G164-S167 PolarHBondContact O-N 3.38Å; G164-L168 PolarHBondContact O-N 3.2Å | ||
| 165 | I | 76.6 | Confident | 73.9 | Confident | 131 Ų | 131 | 76.1 Ų | 76.1 | 67% | 0.672 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -57.5 | -31.9 | -176.3 | -64.4 | 164.5 | 0 | 0 | 0 | 112 | L168 L169 | I165-L168 WeakPolarHBondContact O-CB 3.25Å; I165-L168 PolarHBondContact O-N 3.25Å; I165-L169 HydrophobicContact CG2-CD1 4.31Å; I165-L169 HydrophobicContact CG2-CG 4.34Å; I165-L169 WeakPolarHBondContact O-CG 3.42Å; I165-L169 PolarHBondContact O-N 2.83Å |
| 166 | I | 79.3 | Confident | 74.5 | Confident | 132 Ų | 132 | 79.6 Ų | 79.6 | 68% | 0.677 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -64.3 | -45.3 | -179.4 | -59.4 | 173.7 | 0 | 0 | 0 | 111.3 | G164 L168 L169 V170 | G164-I166 PolarHBondContact O-N 3.03Å; I166-L168 PolarHBondContact O-N 3.47Å; I166-L169 PolarHBondContact O-N 3.38Å; I166-V170 HydrophobicContact CG2-CG2 4.33Å; I166-V170 WeakPolarHBondContact O-CG2 3.23Å; I166-V170 PolarHBondContact O-N 2.95Å |
| 167 | S | 77.1 | Confident | 75.1 | Confident | 34 Ų | 34 | 80.3 Ų | 80.3 | 24% | 0.238 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -63.9 | -33.7 | 177.3 | -56.4 | 0 | 0 | 0 | 0 | 111.6 | G163 G164 R171 | G163-S167 VanDerWaalsContact CA-OG 3.29Å; G163-S167 WeakPolarHBondContact CA-OG 3.22Å; G163-S167 WeakPolarHBondContact O-CB 3.46Å; G163-S167 PolarHBondContact O-OG 3.21Å; G164-S167 PolarHBondContact O-N 3.38Å; S167-R171 VanDerWaalsContact O-CB 3.23Å; S167-R171 WeakPolarHBondContact O-CB 3.03Å; S167-R171 PolarHBondContact O-N 3.02Å |
| 168 | L | 75.9 | Confident | 75.5 | Confident | 41 Ų | 41 | 76.4 Ų | 76.4 | 22% | 0.215 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -65.1 | -45.5 | 173.3 | -60.9 | 178.3 | 0 | 0 | 0 | 111.8 | G164 I165 I166 R171 L172 | G164-L168 PolarHBondContact O-N 3.2Å; I165-L168 WeakPolarHBondContact O-CB 3.25Å; I165-L168 PolarHBondContact O-N 3.25Å; I166-L168 PolarHBondContact O-N 3.47Å; L168-R171 PolarHBondContact O-N 3.33Å; L168-L172 WeakPolarHBondContact O-CB 3.49Å; L168-L172 PolarHBondContact O-N 3.34Å |
| 169 | L | 83.3 | Confident | 76.2 | Confident | 98 Ų | 98 | 72.5 Ų | 72.5 | 51% | 0.513 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64.8 | -46.7 | 178.5 | -71.8 | 180 | 0 | 0 | 0 | 111.6 | I165 I166 R171 L172 L173 | I165-L169 HydrophobicContact CG2-CD1 4.31Å; I165-L169 HydrophobicContact CG2-CG 4.34Å; I165-L169 WeakPolarHBondContact O-CG 3.42Å; I165-L169 PolarHBondContact O-N 2.83Å; I166-L169 PolarHBondContact O-N 3.38Å; L169-R171 VanDerWaalsContact C-N 3.28Å; L169-R171 PolarHBondContact O-N 2.91Å; L169-L172 PolarHBondContact O-N 3.32Å; L169-L172 VanDerWaalsContact O-N 3.16Å; L169-L173 WeakPolarHBondContact O-CB 3.26Å; L169-L173 WeakPolarHBondContact O-CD1 3.26Å; L169-L173 PolarHBondContact O-N 3.45Å |
| 170 | V | 79.5 | Confident | 77.2 | Confident | 83 Ų | 83 | 73.3 Ų | 73.3 | 50% | 0.503 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -58.3 | -43.8 | 176.9 | 172.3 | 0 | 0 | 0 | 0 | 110.3 | I166 L173 T174 | I166-V170 HydrophobicContact CG2-CG2 4.33Å; I166-V170 WeakPolarHBondContact O-CG2 3.23Å; I166-V170 PolarHBondContact O-N 2.95Å; V170-L173 PolarHBondContact O-N 2.91Å; V170-T174 PolarHBondContact O-N 3.32Å; V170-T174 PolarHBondContact O-OG1 3.37Å |
| 171 | R | 77.5 | Confident | 78 | Confident | 23 Ų | 23 | 72.3 Ų | 72.3 | 9% | 0.087 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -63.1 | -42.5 | 176.1 | -179 | 178 | 72 | -160.5 | 7.8 | 112.7 | C155 S167 L168 L169 L173 T174 T175 T221 | C155-R171 HydrophobicContact CB-CG 3.97Å; S167-R171 VanDerWaalsContact O-CB 3.23Å; S167-R171 WeakPolarHBondContact O-CB 3.03Å; S167-R171 PolarHBondContact O-N 3.02Å; L168-R171 PolarHBondContact O-N 3.33Å; L169-R171 VanDerWaalsContact C-N 3.28Å; L169-R171 PolarHBondContact O-N 2.91Å; R171-L173 VanDerWaalsContact C-N 3.33Å; R171-T174 WeakPolarHBondContact CA-OG1 3.48Å; R171-T174 PolarHBondContact O-N 3.02Å; R171-T174 PolarHBondContact O-OG1 2.88Å; R171-T174 VanDerWaalsContact O-OG1 3.08Å; R171-T175 VanDerWaalsContact O-CB 3.26Å; R171-T175 WeakPolarHBondContact O-CB 3.36Å; R171-T175 PolarHBondContact O-N 3.26Å; R171-T175 PolarHBondContact O-OG1 2.67Å; R171-T221 VanDerWaalsContact NE-CG2 3.35Å |
| 172 | L | 81.9 | Confident | 79 | Confident | 65 Ų | 65 | 68 Ų | 68 | 34% | 0.34 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.8 | -43.2 | 179.1 | -170.8 | 129.8 | 0 | 0 | 0 | 110.3 | L168 L169 T175 I176 L218 | L168-L172 WeakPolarHBondContact O-CB 3.49Å; L168-L172 PolarHBondContact O-N 3.34Å; L169-L172 PolarHBondContact O-N 3.32Å; L169-L172 VanDerWaalsContact O-N 3.16Å; L172-T175 PolarHBondContact O-N 2.94Å; L172-I176 HydrophobicContact CD2-CD1 3.53Å; L172-I176 HydrophobicContact CG-CD1 4.02Å; L172-I176 WeakPolarHBondContact O-CB 3.41Å; L172-I176 WeakPolarHBondContact O-CD1 3.45Å; L172-I176 WeakPolarHBondContact O-CG1 3.44Å; L172-I176 PolarHBondContact O-N 2.73Å; L172-L218 HydrophobicContact CD1-CD1 4.22Å; L172-L218 HydrophobicContact CD1-CD2 3.58Å; L172-L218 HydrophobicContact CD1-CG 4.47Å; L172-L218 HydrophobicContact CG-CD2 4.29Å |
| 173 | L | 84.8 | Confident | 80.4 | Confident | 107 Ų | 107 | 60.3 Ų | 60.3 | 56% | 0.56 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -62.6 | -49.2 | 174.7 | -84.9 | 147.5 | 0 | 0 | 0 | 112.1 | L169 V170 R171 T175 I176 C177 | L169-L173 WeakPolarHBondContact O-CB 3.26Å; L169-L173 WeakPolarHBondContact O-CD1 3.26Å; L169-L173 PolarHBondContact O-N 3.45Å; V170-L173 PolarHBondContact O-N 2.91Å; R171-L173 VanDerWaalsContact C-N 3.33Å; L173-T175 PolarHBondContact O-N 3.48Å; L173-I176 PolarHBondContact O-N 3.3Å; L173-C177 WeakPolarHBondContact O-CB 3.28Å; L173-C177 PolarHBondContact O-N 3.35Å; L173-C177 PolarHBondContact O-SG 3.28Å |
| 174 | T | 81.5 | Confident | 81.6 | Confident | 51 Ų | 51 | 65.5 Ų | 65.5 | 31% | 0.313 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63 | -42.7 | 177.4 | 43.5 | 0 | 0 | 0 | 0 | 111.7 | V170 R171 I176 C177 T178 | V170-T174 PolarHBondContact O-N 3.32Å; V170-T174 PolarHBondContact O-OG1 3.37Å; R171-T174 WeakPolarHBondContact CA-OG1 3.48Å; R171-T174 PolarHBondContact O-N 3.02Å; R171-T174 PolarHBondContact O-OG1 2.88Å; R171-T174 VanDerWaalsContact O-OG1 3.08Å; T174-I176 PolarHBondContact O-N 2.82Å; T174-C177 WeakPolarHBondContact O-CB 3.26Å; T174-C177 PolarHBondContact O-N 3.18Å; T174-T178 PolarHBondContact O-N 3.33Å; T174-T178 PolarHBondContact O-OG1 3.23Å; T174-T178 VanDerWaalsContact O-OG1 3.07Å |
| 175 | T | 82.9 | Confident | 81.8 | Confident | 3 Ų | 3 | 63.6 Ų | 63.6 | 2% | 0.018 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.9 | -50.8 | 176.7 | -57.2 | 0 | 0 | 0 | 0 | 110.8 | V152 R171 L172 L173 C177 T178 V179 | V152-T175 HydrophobicContact CG2-CG2 3.54Å; R171-T175 VanDerWaalsContact O-CB 3.26Å; R171-T175 WeakPolarHBondContact O-CB 3.36Å; R171-T175 PolarHBondContact O-N 3.26Å; R171-T175 PolarHBondContact O-OG1 2.67Å; L172-T175 PolarHBondContact O-N 2.94Å; L173-T175 PolarHBondContact O-N 3.48Å; T175-C177 VanDerWaalsContact C-N 3.3Å; T175-C177 PolarHBondContact O-N 2.88Å; T175-T178 PolarHBondContact O-N 2.88Å; T175-V179 HydrophobicContact CG2-CG2 4.12Å; T175-V179 WeakPolarHBondContact O-CB 3.37Å; T175-V179 WeakPolarHBondContact O-CG2 3.44Å; T175-V179 PolarHBondContact O-N 3.26Å |
| 176 | I | 86 | Confident | 82.2 | Confident | 97 Ų | 97 | 57.4 Ų | 57.4 | 50% | 0.497 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.9 | -41.7 | 179.6 | -69.4 | 167 | 0 | 0 | 0 | 110.9 | L172 L173 T174 V179 A180 | L172-I176 HydrophobicContact CD2-CD1 3.53Å; L172-I176 HydrophobicContact CG-CD1 4.02Å; L172-I176 WeakPolarHBondContact O-CB 3.41Å; L172-I176 WeakPolarHBondContact O-CD1 3.45Å; L172-I176 WeakPolarHBondContact O-CG1 3.44Å; L172-I176 PolarHBondContact O-N 2.73Å; L173-I176 PolarHBondContact O-N 3.3Å; T174-I176 PolarHBondContact O-N 2.82Å; I176-V179 PolarHBondContact O-N 3.49Å; I176-A180 VanDerWaalsContact O-CB 3.28Å; I176-A180 WeakPolarHBondContact O-CB 3.49Å; I176-A180 PolarHBondContact O-N 2.86Å |
| 177 | C | 85.2 | Confident | 82.4 | Confident | 73 Ų | 73 | 52.2 Ų | 52.2 | 49% | 0.493 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -59.8 | -47.2 | 175.9 | -73 | 0 | 0 | 0 | 0 | 111.6 | L173 T174 T175 A180 W181 | L173-C177 WeakPolarHBondContact O-CB 3.28Å; L173-C177 PolarHBondContact O-N 3.35Å; L173-C177 PolarHBondContact O-SG 3.28Å; T174-C177 WeakPolarHBondContact O-CB 3.26Å; T174-C177 PolarHBondContact O-N 3.18Å; T175-C177 VanDerWaalsContact C-N 3.3Å; T175-C177 PolarHBondContact O-N 2.88Å; C177-A180 PolarHBondContact O-N 2.83Å; C177-W181 VanDerWaalsContact O-CB 3.29Å; C177-W181 WeakPolarHBondContact O-CB 3.37Å; C177-W181 PolarHBondContact O-N 2.79Å |
| 178 | T | 80.9 | Confident | 82.7 | Confident | 33 Ų | 33 | 52.8 Ų | 52.8 | 20% | 0.202 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -67.2 | -37 | 178.9 | -55 | 0 | 0 | 0 | 0 | 112.3 | L148 D151 T174 T175 W181 A182 | L148-T178 HydrophobicContact CD1-CG2 4.3Å; D151-T178 HydrophobicContact CB-CG2 3.71Å; D151-T178 VanDerWaalsContact OD2-CB 3.22Å; D151-T178 WeakPolarHBondContact OD2-CB 3.18Å; D151-T178 PolarHBondContact OD2-OG1 3.32Å; T174-T178 PolarHBondContact O-N 3.33Å; T174-T178 PolarHBondContact O-OG1 3.23Å; T174-T178 VanDerWaalsContact O-OG1 3.07Å; T175-T178 PolarHBondContact O-N 2.88Å; T178-W181 WeakPolarHBondContact O-CB 3.25Å; T178-W181 PolarHBondContact O-N 2.89Å; T178-A182 WeakPolarHBondContact O-CB 3.45Å; T178-A182 PolarHBondContact O-N 2.85Å |
| 179 | V | 84.7 | Confident | 82.8 | Confident | 9 Ų | 9 | 52.8 Ų | 52.8 | 6% | 0.055 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.5 | -49.6 | 175.4 | 175.1 | 0 | 0 | 0 | 0 | 110.9 | L148 T175 I176 W181 A182 Q183 A214 | L148-V179 HydrophobicContact CD1-CB 4.17Å; L148-V179 HydrophobicContact CD1-CG2 3.2Å; L148-V179 HydrophobicContact CD2-CG2 4Å; L148-V179 HydrophobicContact CG-CG2 4.22Å; T175-V179 HydrophobicContact CG2-CG2 4.12Å; T175-V179 WeakPolarHBondContact O-CB 3.37Å; T175-V179 WeakPolarHBondContact O-CG2 3.44Å; T175-V179 PolarHBondContact O-N 3.26Å; I176-V179 PolarHBondContact O-N 3.49Å; V179-W181 PolarHBondContact O-N 3.42Å; V179-A182 PolarHBondContact O-N 3.34Å; V179-Q183 VanDerWaalsContact O-CB 3.23Å; V179-Q183 WeakPolarHBondContact O-CB 3.5Å; V179-Q183 PolarHBondContact O-N 2.82Å; V179-A214 HydrophobicContact CB-CB 4.16Å; V179-A214 HydrophobicContact CG1-CB 3.8Å; V179-A214 HydrophobicContact CG2-CB 3.31Å |
| 180 | A | 85.9 | Confident | 82.7 | Confident | 55 Ų | 55 | 48.1 Ų | 48.1 | 46% | 0.455 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58.3 | -37.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | I176 C177 Y184 | I176-A180 VanDerWaalsContact O-CB 3.28Å; I176-A180 WeakPolarHBondContact O-CB 3.49Å; I176-A180 PolarHBondContact O-N 2.86Å; C177-A180 PolarHBondContact O-N 2.83Å; A180-Y184 WeakPolarHBondContact O-CB 3.31Å; A180-Y184 PolarHBondContact O-N 3.42Å |
| 181 | W | 80.6 | Confident | 82.7 | Confident | 101 Ų | 101 | 46.3 Ų | 46.3 | 38% | 0.383 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -67.5 | -50.8 | 175.2 | -165.8 | -97.3 | 0 | 0 | 0 | 113.3 | C59 V63 C177 T178 V179 Q183 Y184 A185 | C59-W181 HydrophobicContact CB-CH2 3.78Å; C59-W181 HydrophobicContact CB-CZ2 3.66Å; C59-W181 HydrophobicContact CB-CZ3 4.34Å; C59-W181 WeakPolarHBondContact O-CZ2 3.34Å; V63-W181 HydrophobicContact CB-CZ2 3.95Å; V63-W181 HydrophobicContact CG2-CH2 4.13Å; V63-W181 HydrophobicContact CG2-CZ2 3.07Å; V63-W181 VanDerWaalsContact CG2-NE1 3.29Å; C177-W181 VanDerWaalsContact O-CB 3.29Å; C177-W181 WeakPolarHBondContact O-CB 3.37Å; C177-W181 PolarHBondContact O-N 2.79Å; T178-W181 WeakPolarHBondContact O-CB 3.25Å; T178-W181 PolarHBondContact O-N 2.89Å; V179-W181 PolarHBondContact O-N 3.42Å; W181-Q183 VanDerWaalsContact C-N 3.28Å; W181-Q183 PolarHBondContact O-N 3.18Å; W181-Y184 WeakPolarHBondContact O-CB 3.24Å; W181-Y184 PolarHBondContact O-N 3Å; W181-Y184 VanDerWaalsContact O-N 3.16Å; W181-A185 PolarHBondContact O-N 2.86Å |
| 182 | A | 83.2 | Confident | 82.7 | Confident | 8 Ų | 8 | 48.6 Ų | 48.6 | 7% | 0.066 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61 | -39.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | T178 V179 A185 A186 | T178-A182 WeakPolarHBondContact O-CB 3.45Å; T178-A182 PolarHBondContact O-N 2.85Å; V179-A182 PolarHBondContact O-N 3.34Å; A182-A185 PolarHBondContact O-N 3.06Å; A182-A186 WeakPolarHBondContact O-CB 3.31Å; A182-A186 PolarHBondContact O-N 3.21Å |
| 183 | Q | 86.1 | Confident | 82.5 | Confident | 37 Ų | 37 | 45.6 Ų | 45.6 | 17% | 0.173 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60 | -52 | 172.8 | -178.2 | 177.2 | -73.8 | 0 | 0 | 110.3 | V179 W181 A185 A186 T187 C207 Y210 | V179-Q183 VanDerWaalsContact O-CB 3.23Å; V179-Q183 WeakPolarHBondContact O-CB 3.5Å; V179-Q183 PolarHBondContact O-N 2.82Å; W181-Q183 VanDerWaalsContact C-N 3.28Å; W181-Q183 PolarHBondContact O-N 3.18Å; Q183-A185 VanDerWaalsContact C-N 3.26Å; Q183-A185 PolarHBondContact O-N 3.21Å; Q183-A186 CarbonylContact O-C 3.59Å; Q183-A186 WeakPolarHBondContact O-CB 3.49Å; Q183-A186 PolarHBondContact O-N 3.29Å; Q183-A186 VanDerWaalsContact O-N 3.09Å; Q183-T187 HydrophobicContact CG-CG2 4.17Å; Q183-T187 WeakPolarHBondContact O-CG2 2.97Å; Q183-T187 PolarHBondContact O-N 3.39Å; Q183-C207 VanDerWaalsContact CD-SG 3.58Å; Q183-C207 PolarHBondContact NE2-SG 2.69Å; Q183-C207 VanDerWaalsContact OE1-CA 3.3Å; Q183-C207 PolarHBondContact OE1-O 2.93Å; Q183-C207 PolarHBondContact OE1-SG 2.95Å; Q183-Y210 HydrophobicContact CB-CD2 4.26Å; Q183-Y210 HydrophobicContact CB-CG 4.33Å; Q183-Y210 HydrophobicContact CG-CD2 4.23Å |
| 184 | Y | 84.6 | Confident | 82.1 | Confident | 146 Ų | 146 | 41.2 Ų | 41.2 | 57% | 0.573 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -57.5 | -39 | 177.4 | -179.6 | -95.1 | 0 | 0 | 0 | 112.7 | A180 W181 T187 T188 | A180-Y184 WeakPolarHBondContact O-CB 3.31Å; A180-Y184 PolarHBondContact O-N 3.42Å; W181-Y184 WeakPolarHBondContact O-CB 3.24Å; W181-Y184 PolarHBondContact O-N 3Å; W181-Y184 VanDerWaalsContact O-N 3.16Å; Y184-T187 PolarHBondContact O-N 2.9Å; Y184-T187 PolarHBondContact O-OG1 2.9Å; Y184-T188 WeakPolarHBondContact O-CB 3.4Å; Y184-T188 PolarHBondContact O-N 3.08Å; Y184-T188 PolarHBondContact O-OG1 3.38Å |
| 185 | A | 80.7 | Confident | 81.7 | Confident | 9 Ų | 9 | 42 Ų | 42 | 7% | 0.074 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.1 | -51 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y66 W181 A182 Q183 T187 T188 F189 | Y66-A185 HydrophobicContact CD1-CB 3.98Å; Y66-A185 HydrophobicContact CE1-CB 3.8Å; W181-A185 PolarHBondContact O-N 2.86Å; A182-A185 PolarHBondContact O-N 3.06Å; Q183-A185 VanDerWaalsContact C-N 3.26Å; Q183-A185 PolarHBondContact O-N 3.21Å; A185-T187 VanDerWaalsContact C-N 3.33Å; A185-T187 PolarHBondContact O-N 3Å; A185-T188 WeakPolarHBondContact O-CB 3.28Å; A185-T188 PolarHBondContact O-N 3.48Å; A185-F189 HydrophobicContact CB-CE2 4.26Å; A185-F189 WeakPolarHBondContact O-CD2 3.18Å; A185-F189 PolarHBondContact O-N 3.38Å |
| 186 | A | 84.3 | Confident | 81.3 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -58.3 | -41.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | C144 A182 Q183 T188 F189 L190 Y210 | C144-A186 HydrophobicContact CB-CB 4.36Å; A182-A186 WeakPolarHBondContact O-CB 3.31Å; A182-A186 PolarHBondContact O-N 3.21Å; Q183-A186 CarbonylContact O-C 3.59Å; Q183-A186 WeakPolarHBondContact O-CB 3.49Å; Q183-A186 PolarHBondContact O-N 3.29Å; Q183-A186 VanDerWaalsContact O-N 3.09Å; A186-T188 VanDerWaalsContact C-N 3.29Å; A186-T188 PolarHBondContact O-N 3.47Å; A186-F189 PolarHBondContact O-N 2.87Å; A186-L190 WeakPolarHBondContact O-CB 3.28Å; A186-L190 WeakPolarHBondContact O-CG 3.08Å; A186-L190 PolarHBondContact O-N 2.92Å; A186-Y210 HydrophobicContact CB-CE2 3.53Å; A186-Y210 WeakPolarHBondContact CB-OH 3.26Å |
| 187 | T | 84 | Confident | 80.9 | Confident | 23 Ų | 23 | 54.5 Ų | 54.5 | 14% | 0.141 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.6 | -39.3 | 175.9 | 74.5 | 0 | 0 | 0 | 0 | 111 | Q183 Y184 A185 L190 S191 L203 | Q183-T187 HydrophobicContact CG-CG2 4.17Å; Q183-T187 WeakPolarHBondContact O-CG2 2.97Å; Q183-T187 PolarHBondContact O-N 3.39Å; Y184-T187 PolarHBondContact O-N 2.9Å; Y184-T187 PolarHBondContact O-OG1 2.9Å; A185-T187 VanDerWaalsContact C-N 3.33Å; A185-T187 PolarHBondContact O-N 3Å; T187-L190 PolarHBondContact O-N 3.28Å; T187-S191 WeakPolarHBondContact O-CA 3.49Å; T187-S191 WeakPolarHBondContact O-CB 3.22Å; T187-S191 PolarHBondContact O-N 3.2Å; T187-L203 HydrophobicContact CG2-CD1 3.08Å; T187-L203 HydrophobicContact CG2-CD2 4.4Å; T187-L203 HydrophobicContact CG2-CG 4.29Å |
| 188 | T | 82.3 | Confident | 80.6 | Confident | 47 Ų | 47 | 57.2 Ų | 57.2 | 29% | 0.288 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -66.4 | -43 | 179.7 | -58.5 | 0 | 0 | 0 | 0 | 110.7 | F67 Y184 A185 A186 S191 | F67-T188 HydrophobicContact CE2-CG2 4.41Å; Y184-T188 WeakPolarHBondContact O-CB 3.4Å; Y184-T188 PolarHBondContact O-N 3.08Å; Y184-T188 PolarHBondContact O-OG1 3.38Å; A185-T188 WeakPolarHBondContact O-CB 3.28Å; A185-T188 PolarHBondContact O-N 3.48Å; A186-T188 VanDerWaalsContact C-N 3.29Å; A186-T188 PolarHBondContact O-N 3.47Å; T188-S191 PolarHBondContact O-N 2.67Å; T188-S191 PolarHBondContact O-OG 2.89Å |
| 189 | F | 79.8 | Confident | 80.6 | Confident | 40 Ų | 40 | 58.8 Ų | 58.8 | 18% | 0.175 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.1 | -42.6 | 174.8 | -70.3 | -68.7 | 0 | 0 | 0 | 112.6 | Y66 F67 S70 I140 A185 A186 S191 | Y66-F189 AromaticContact CD1-CE2 3.86Å; Y66-F189 HydrophobicContact CD1-CE2 3.86Å; Y66-F189 HydrophobicContact CD1-CZ 4.19Å; Y66-F189 HydrophobicContact CE1-CD2 4.45Å; Y66-F189 AromaticContact CE1-CE2 3.53Å; Y66-F189 HydrophobicContact CE1-CE2 3.53Å; Y66-F189 HydrophobicContact CE1-CZ 4.18Å; F67-F189 HydrophobicContact CD2-CE1 4.24Å; F67-F189 HydrophobicContact CD2-CZ 4.26Å; S70-F189 WeakPolarHBondContact OG-CE1 3.04Å; S70-F189 WeakPolarHBondContact OG-CZ 3.39Å; I140-F189 HydrophobicContact CG2-CB 4.25Å; A185-F189 HydrophobicContact CB-CE2 4.26Å; A185-F189 WeakPolarHBondContact O-CD2 3.18Å; A185-F189 PolarHBondContact O-N 3.38Å; A186-F189 PolarHBondContact O-N 2.87Å; F189-S191 VanDerWaalsContact C-N 3.33Å |
| 190 | L | 80.7 | Confident | 80.6 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -79.3 | -16.6 | -179.4 | -64.5 | 174 | 0 | 0 | 0 | 113 | I125 T137 L141 A186 T187 G192 S193 Y194 V206 | I125-L190 HydrophobicContact CD1-CD1 3.89Å; I125-L190 HydrophobicContact CD1-CD2 4.47Å; T137-L190 HydrophobicContact CG2-CD2 4.15Å; L141-L190 HydrophobicContact CD2-CD1 4.27Å; A186-L190 WeakPolarHBondContact O-CB 3.28Å; A186-L190 WeakPolarHBondContact O-CG 3.08Å; A186-L190 PolarHBondContact O-N 2.92Å; T187-L190 PolarHBondContact O-N 3.28Å; L190-G192 PolarHBondContact O-N 3.43Å; L190-G192 VanDerWaalsContact O-N 3.14Å; L190-S193 WeakPolarHBondContact CA-OG 3.28Å; L190-S193 VanDerWaalsContact O-CB 3.23Å; L190-S193 WeakPolarHBondContact O-CB 3.29Å; L190-S193 PolarHBondContact O-N 3.14Å; L190-S193 PolarHBondContact O-OG 2.91Å; L190-S193 VanDerWaalsContact O-OG 3.12Å; L190-Y194 HydrophobicContact CB-CE1 3.78Å; L190-Y194 WeakPolarHBondContact O-CD1 3.46Å; L190-Y194 WeakPolarHBondContact O-CE1 3.44Å; L190-V206 HydrophobicContact CD1-CG1 4.29Å; L190-V206 HydrophobicContact CD1-CG2 3.95Å |
| 191 | S | 79.2 | Confident | 80.6 | Confident | 46 Ų | 46 | 64.4 Ų | 64.4 | 32% | 0.322 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -25.9 | -176.4 | 70.1 | 0 | 0 | 0 | 0 | 113.9 | T187 T188 F189 | T187-S191 WeakPolarHBondContact O-CA 3.49Å; T187-S191 WeakPolarHBondContact O-CB 3.22Å; T187-S191 PolarHBondContact O-N 3.2Å; T188-S191 PolarHBondContact O-N 2.67Å; T188-S191 PolarHBondContact O-OG 2.89Å; F189-S191 VanDerWaalsContact C-N 3.33Å |
| 192 | G | 78.4 | Confident | 80.9 | Confident | 70 Ų | 70 | 59.7 Ų | 59.7 | 72% | 0.722 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.1 | -7.4 | 175 | 0 | 0 | 0 | 0 | 0 | 114.4 | L190 | L190-G192 PolarHBondContact O-N 3.43Å; L190-G192 VanDerWaalsContact O-N 3.14Å |
| 193 | S | 75.9 | Confident | 81.1 | Confident | 3 Ų | 3 | 62.1 Ų | 62.1 | 2% | 0.021 | 33% | 0.331 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | -20.5 | -174.3 | -44 | 0 | 0 | 0 | 0 | 113.7 | G130 T131 I132 L190 | G130-S193 WeakPolarHBondContact CA-O 3.34Å; T131-S193 PolarHBondContact N-O 3.33Å; T131-S193 PolarHBondContact OG1-O 3.31Å; I132-S193 WeakPolarHBondContact CD1-OG 3.28Å; L190-S193 WeakPolarHBondContact CA-OG 3.28Å; L190-S193 VanDerWaalsContact O-CB 3.23Å; L190-S193 WeakPolarHBondContact O-CB 3.29Å; L190-S193 PolarHBondContact O-N 3.14Å; L190-S193 PolarHBondContact O-OG 2.91Å; L190-S193 VanDerWaalsContact O-OG 3.12Å |
| 194 | Y | 77 | Confident | 81.4 | Confident | 15 Ų | 15 | 68.7 Ų | 68.7 | 6% | 0.059 | 36% | 0.356 | C | S | . | . | S | Bend | trans | -131.8 | 151.2 | -175.4 | 39.6 | -108.7 | 0 | 0 | 0 | 111.5 | L190 K199 A202 | L190-Y194 HydrophobicContact CB-CE1 3.78Å; L190-Y194 WeakPolarHBondContact O-CD1 3.46Å; L190-Y194 WeakPolarHBondContact O-CE1 3.44Å; Y194-K199 HydrophobicContact CD2-CB 4.24Å; Y194-K199 HydrophobicContact CD2-CG 3.75Å; Y194-K199 HydrophobicContact CE2-CB 3.85Å; Y194-K199 HydrophobicContact CE2-CG 3.61Å; Y194-A202 HydrophobicContact CD1-CB 3.59Å; Y194-A202 HydrophobicContact CD2-CB 4.23Å; Y194-A202 HydrophobicContact CE1-CB 3.51Å; Y194-A202 HydrophobicContact CE2-CB 4.2Å; Y194-A202 HydrophobicContact CG-CB 3.96Å |
| 195 | P | 72.9 | Confident | 81.7 | Confident | 66 Ų | 66 | 62.7 Ų | 62.7 | 43% | 0.429 | 34% | 0.335 | S | S | . | . | trans | -62.5 | 142 | -179.3 | 24.1 | -33.4 | 0 | 0 | 0 | 111.9 | K197 R198 | P195-K197 PolarHBondContact O-N 3.34Å; P195-R198 HydrophobicContact CG-CB 4.48Å; P195-R198 HydrophobicContact CG-CG 4.46Å; P195-R198 PolarHBondContact O-N 3.01Å | ||
| 196 | E | 74.7 | Confident | 82.2 | Confident | 152 Ų | 152 | 62.3 Ų | 62.3 | 71% | 0.71 | 33% | 0.331 | S | S | * | . | G | 310 helix | trans | -55.4 | -33.9 | -171.7 | -57.7 | -142.8 | 136.5 | 0 | 0 | 114.3 | R198 K199 | E196-R198 PolarHBondContact O-N 3.48Å; E196-R198 VanDerWaalsContact O-N 3.14Å; E196-K199 HydrophobicContact CB-CD 4.3Å; E196-K199 WeakPolarHBondContact O-CG 3.46Å; E196-K199 PolarHBondContact O-N 3.39Å; E196-K199 IonicContact OE1-NZ 4Å; E196-K199 PolarHBondContact OE1-NZ 3.26Å; E196-K199 IonicContact OE2-NZ 2.64Å |
| 197 | K | 78.7 | Confident | 82.5 | Confident | 212 Ų | 212 | 64.2 Ų | 64.2 | 92% | 0.922 | 35% | 0.345 | S | S | * | . | G | 310 helix | trans | -64.2 | -16 | 178.4 | -68.4 | -175.1 | 177.2 | -176.8 | 0 | 114 | P195 | P195-K197 PolarHBondContact O-N 3.34Š|
| 198 | R | 78.3 | Confident | 82.8 | Confident | 130 Ų | 130 | 69.1 Ų | 69.1 | 49% | 0.491 | 36% | 0.364 | S | S | . | . | G | 310 helix | trans | -119 | 9.6 | -176.5 | -59.9 | -176.5 | -177.5 | 177.4 | -2 | 113.7 | L128 P195 E196 G200 L201 A202 | L128-R198 HydrophobicContact CD2-CB 3.98Å; L128-R198 HydrophobicContact CG-CB 4.44Å; L128-R198 PolarHBondContact O-NH1 2.94Å; L128-R198 VanDerWaalsContact O-NH1 3.09Å; P195-R198 HydrophobicContact CG-CB 4.48Å; P195-R198 HydrophobicContact CG-CG 4.46Å; P195-R198 PolarHBondContact O-N 3.01Å; E196-R198 PolarHBondContact O-N 3.48Å; E196-R198 VanDerWaalsContact O-N 3.14Å; R198-G200 VanDerWaalsContact C-N 3.32Å; R198-G200 PolarHBondContact O-N 2.81Å; R198-L201 PolarHBondContact O-N 3.1Å; R198-A202 PolarHBondContact O-N 3.32Å |
| 199 | K | 80.7 | Confident | 83.3 | Confident | 66 Ų | 66 | 67.2 Ų | 67.2 | 29% | 0.287 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -55.4 | -44.4 | -177.9 | -65.3 | -179.8 | 164.9 | 171.3 | 0 | 112.6 | Y194 E196 L201 A202 L203 | Y194-K199 HydrophobicContact CD2-CB 4.24Å; Y194-K199 HydrophobicContact CD2-CG 3.75Å; Y194-K199 HydrophobicContact CE2-CB 3.85Å; Y194-K199 HydrophobicContact CE2-CG 3.61Å; E196-K199 HydrophobicContact CB-CD 4.3Å; E196-K199 WeakPolarHBondContact O-CG 3.46Å; E196-K199 PolarHBondContact O-N 3.39Å; E196-K199 IonicContact OE1-NZ 4Å; E196-K199 PolarHBondContact OE1-NZ 3.26Å; E196-K199 IonicContact OE2-NZ 2.64Å; K199-L201 VanDerWaalsContact C-N 3.34Å; K199-L201 PolarHBondContact O-N 3.29Å; K199-A202 PolarHBondContact O-N 2.92Å; K199-L203 WeakPolarHBondContact O-CB 3.43Å; K199-L203 PolarHBondContact O-N 3.31Å |
| 200 | G | 84.3 | Confident | 83.7 | Confident | 60 Ų | 60 | 65.3 Ų | 65.3 | 62% | 0.619 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -62.7 | -37.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | R198 L203 Y204 | R198-G200 VanDerWaalsContact C-N 3.32Å; R198-G200 PolarHBondContact O-N 2.81Å; G200-L203 PolarHBondContact O-N 3.05Å; G200-Y204 PolarHBondContact O-N 3.4Å |
| 201 | L | 86.9 | Confident | 84.2 | Confident | 122 Ų | 122 | 69 Ų | 69 | 64% | 0.639 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -71.6 | -37.9 | 178.8 | -70.1 | 172.1 | 0 | 0 | 0 | 111.9 | L128 R198 K199 L203 P205 | L128-L201 HydrophobicContact CD1-CB 4.35Å; L128-L201 HydrophobicContact CD2-CB 3.79Å; R198-L201 PolarHBondContact O-N 3.1Å; K199-L201 VanDerWaalsContact C-N 3.34Å; K199-L201 PolarHBondContact O-N 3.29Å; L201-L203 VanDerWaalsContact C-N 3.34Å; L201-P205 WeakPolarHBondContact O-CD 3.42Å |
| 202 | A | 86.3 | Confident | 84.7 | Confident | 1 Ų | 1 | 69.1 Ų | 69.1 | 1% | 0.008 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -69.6 | -35.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L128 Y194 R198 K199 P205 V206 | L128-A202 HydrophobicContact CD2-CB 3.62Å; L128-A202 VanDerWaalsContact CD2-N 3.33Å; Y194-A202 HydrophobicContact CD1-CB 3.59Å; Y194-A202 HydrophobicContact CD2-CB 4.23Å; Y194-A202 HydrophobicContact CE1-CB 3.51Å; Y194-A202 HydrophobicContact CE2-CB 4.2Å; Y194-A202 HydrophobicContact CG-CB 3.96Å; R198-A202 PolarHBondContact O-N 3.32Å; K199-A202 PolarHBondContact O-N 2.92Å; A202-P205 WeakPolarHBondContact O-CD 3.32Å; A202-P205 WeakPolarHBondContact O-CG 3.43Å; A202-V206 WeakPolarHBondContact O-CG2 3.19Å |
| 203 | L | 87.9 | Confident | 85.2 | Confident | 59 Ų | 59 | 66.1 Ų | 66.1 | 31% | 0.309 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -75.4 | -30.5 | -172 | -172.8 | 65.9 | 0 | 0 | 0 | 113.8 | T187 K199 G200 L201 V206 C207 | T187-L203 HydrophobicContact CG2-CD1 3.08Å; T187-L203 HydrophobicContact CG2-CD2 4.4Å; T187-L203 HydrophobicContact CG2-CG 4.29Å; K199-L203 WeakPolarHBondContact O-CB 3.43Å; K199-L203 PolarHBondContact O-N 3.31Å; G200-L203 PolarHBondContact O-N 3.05Å; L201-L203 VanDerWaalsContact C-N 3.34Å; L203-V206 HydrophobicContact CD1-CB 4.48Å; L203-V206 PolarHBondContact O-N 3.19Å; L203-C207 WeakPolarHBondContact O-CB 3.5Å; L203-C207 PolarHBondContact O-N 3.48Å |
| 204 | Y | 90.8 | Very high | 85.7 | Confident | 176 Ų | 176 | 66.6 Ų | 66.6 | 69% | 0.69 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -52.2 | -56.1 | -178.9 | -178.4 | -99.6 | 0 | 0 | 0 | 113.6 | G200 V206 C207 F208 | G200-Y204 PolarHBondContact O-N 3.4Å; Y204-V206 VanDerWaalsContact C-N 3.33Å; Y204-V206 PolarHBondContact O-N 2.72Å; Y204-C207 PolarHBondContact O-N 3.18Å; Y204-F208 WeakPolarHBondContact O-CB 3.49Å; Y204-F208 PolarHBondContact O-N 2.94Å |
| 205 | P | 91.7 | Very high | 86.2 | Confident | 20 Ų | 20 | 74.3 Ų | 74.3 | 13% | 0.13 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -66.9 | -31.5 | 178.7 | 25.9 | -34.7 | 0 | 0 | 0 | 113.1 | V121 N124 L201 A202 F209 | V121-P205 HydrophobicContact CG2-CB 4.15Å; V121-P205 VanDerWaalsContact CG2-O 3.31Å; V121-P205 WeakPolarHBondContact CG2-O 3.29Å; N124-P205 HydrophobicContact CB-CG 4.03Å; L201-P205 WeakPolarHBondContact O-CD 3.42Å; A202-P205 WeakPolarHBondContact O-CD 3.32Å; A202-P205 WeakPolarHBondContact O-CG 3.43Å; P205-F209 WeakPolarHBondContact O-CB 3.38Å; P205-F209 PolarHBondContact O-N 3.45Å |
| 206 | V | 90.7 | Very high | 86.8 | Confident | 0 Ų | 0 | 71.8 Ų | 71.8 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.5 | -50.2 | 176 | 178.3 | 0 | 0 | 0 | 0 | 110.6 | V121 I125 L141 L190 A202 L203 Y204 F208 F209 Y210 | V121-V206 HydrophobicContact CG1-CB 4.3Å; V121-V206 HydrophobicContact CG1-CG2 3.54Å; I125-V206 HydrophobicContact CD1-CG2 3.92Å; L141-V206 HydrophobicContact CD2-CG1 4.15Å; L190-V206 HydrophobicContact CD1-CG1 4.29Å; L190-V206 HydrophobicContact CD1-CG2 3.95Å; A202-V206 WeakPolarHBondContact O-CG2 3.19Å; L203-V206 HydrophobicContact CD1-CB 4.48Å; L203-V206 PolarHBondContact O-N 3.19Å; Y204-V206 VanDerWaalsContact C-N 3.33Å; Y204-V206 PolarHBondContact O-N 2.72Å; V206-F208 PolarHBondContact O-N 3.49Å; V206-F209 PolarHBondContact O-N 3.07Å; V206-Y210 HydrophobicContact CG1-CD2 3.99Å; V206-Y210 HydrophobicContact CG1-CE2 3.72Å; V206-Y210 WeakPolarHBondContact O-CD2 3.24Å; V206-Y210 PolarHBondContact O-N 3.08Å |
| 207 | C | 90.9 | Very high | 87.1 | Confident | 41 Ų | 41 | 65.4 Ų | 65.4 | 28% | 0.277 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.3 | -48.5 | 177.8 | 178.3 | 0 | 0 | 0 | 0 | 111.1 | Q183 L203 Y204 F209 Y210 V211 | Q183-C207 VanDerWaalsContact CD-SG 3.58Å; Q183-C207 PolarHBondContact NE2-SG 2.69Å; Q183-C207 VanDerWaalsContact OE1-CA 3.3Å; Q183-C207 PolarHBondContact OE1-O 2.93Å; Q183-C207 PolarHBondContact OE1-SG 2.95Å; L203-C207 WeakPolarHBondContact O-CB 3.5Å; L203-C207 PolarHBondContact O-N 3.48Å; Y204-C207 PolarHBondContact O-N 3.18Å; C207-F209 VanDerWaalsContact C-N 3.29Å; C207-F209 PolarHBondContact O-N 3.25Å; C207-Y210 PolarHBondContact O-N 3.21Å; C207-V211 WeakPolarHBondContact O-CG2 3.32Å; C207-V211 PolarHBondContact O-N 3.4Å |
| 208 | F | 91 | Very high | 87.1 | Confident | 126 Ų | 126 | 56.6 Ų | 56.6 | 55% | 0.553 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -56.8 | -43.3 | 177.8 | -175.7 | -100 | 0 | 0 | 0 | 112.1 | Y204 V206 V211 V212 | Y204-F208 WeakPolarHBondContact O-CB 3.49Å; Y204-F208 PolarHBondContact O-N 2.94Å; V206-F208 PolarHBondContact O-N 3.49Å; F208-V211 PolarHBondContact O-N 2.86Å; F208-V212 HydrophobicContact CD1-CG2 4.04Å; F208-V212 HydrophobicContact CE1-CG2 3.64Å; F208-V212 HydrophobicContact CE2-CG2 4.24Å; F208-V212 HydrophobicContact CZ-CG2 3.75Å; F208-V212 VanDerWaalsContact O-CG2 3.31Å; F208-V212 WeakPolarHBondContact O-CG2 3.41Å; F208-V212 PolarHBondContact O-N 3.48Å |
| 209 | F | 91.7 | Very high | 87.3 | Confident | 7 Ų | 7 | 52.6 Ų | 52.6 | 3% | 0.031 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.5 | -48.1 | 177.8 | 172.6 | -104.4 | 0 | 0 | 0 | 113.2 | V114 S118 V121 L145 P205 V206 C207 V211 V212 V213 | V114-F209 HydrophobicContact CG1-CZ 4.36Å; S118-F209 WeakPolarHBondContact OG-CE2 3.21Å; S118-F209 WeakPolarHBondContact OG-CZ 3.44Å; V121-F209 HydrophobicContact CG2-CB 3.6Å; V121-F209 HydrophobicContact CG2-CD2 4.49Å; V121-F209 HydrophobicContact CG2-CG 4.08Å; L145-F209 HydrophobicContact CD1-CE1 3.92Å; L145-F209 HydrophobicContact CD1-CZ 3.76Å; L145-F209 HydrophobicContact CD2-CE1 4.26Å; L145-F209 HydrophobicContact CG-CE1 4.31Å; P205-F209 WeakPolarHBondContact O-CB 3.38Å; P205-F209 PolarHBondContact O-N 3.45Å; V206-F209 PolarHBondContact O-N 3.07Å; C207-F209 VanDerWaalsContact C-N 3.29Å; C207-F209 PolarHBondContact O-N 3.25Å; F209-V211 VanDerWaalsContact C-N 3.32Å; F209-V211 PolarHBondContact O-N 3.48Å; F209-V212 PolarHBondContact O-N 2.87Å; F209-V213 HydrophobicContact CD2-CG2 4.22Å; F209-V213 HydrophobicContact CE1-CG2 4.26Å; F209-V213 HydrophobicContact CE2-CG2 3.79Å; F209-V213 HydrophobicContact CZ-CG2 3.81Å; F209-V213 WeakPolarHBondContact O-CG2 3.14Å; F209-V213 PolarHBondContact O-N 3.31Å |
| 210 | Y | 89.4 | Confident | 87.1 | Confident | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64 | -37.7 | 177.8 | -77.4 | -73 | 0 | 0 | 0 | 112.5 | L141 C144 L145 Q183 A186 V206 C207 V213 A214 | L141-Y210 HydrophobicContact CD2-CE2 3.96Å; L141-Y210 PolarHBondContact O-OH 2.9Å; C144-Y210 HydrophobicContact CB-CE1 3.94Å; C144-Y210 WeakPolarHBondContact CB-OH 3.47Å; L145-Y210 HydrophobicContact CD2-CD1 3.7Å; L145-Y210 HydrophobicContact CD2-CE1 3.57Å; L145-Y210 HydrophobicContact CG-CE1 4.26Å; Q183-Y210 HydrophobicContact CB-CD2 4.26Å; Q183-Y210 HydrophobicContact CB-CG 4.33Å; Q183-Y210 HydrophobicContact CG-CD2 4.23Å; A186-Y210 HydrophobicContact CB-CE2 3.53Å; A186-Y210 WeakPolarHBondContact CB-OH 3.26Å; V206-Y210 HydrophobicContact CG1-CD2 3.99Å; V206-Y210 HydrophobicContact CG1-CE2 3.72Å; V206-Y210 WeakPolarHBondContact O-CD2 3.24Å; V206-Y210 PolarHBondContact O-N 3.08Å; C207-Y210 PolarHBondContact O-N 3.21Å; Y210-V213 PolarHBondContact O-N 3.26Å; Y210-A214 VanDerWaalsContact O-CB 3.26Å; Y210-A214 WeakPolarHBondContact O-CB 3.29Å; Y210-A214 PolarHBondContact O-N 2.96Å |
| 211 | V | 90.9 | Very high | 86.5 | Confident | 78 Ų | 78 | 48.3 Ų | 48.3 | 47% | 0.473 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -64 | -43.2 | 175.2 | 172.9 | 0 | 0 | 0 | 0 | 111.1 | C207 F208 F209 A214 W215 | C207-V211 WeakPolarHBondContact O-CG2 3.32Å; C207-V211 PolarHBondContact O-N 3.4Å; F208-V211 PolarHBondContact O-N 2.86Å; F209-V211 VanDerWaalsContact C-N 3.32Å; F209-V211 PolarHBondContact O-N 3.48Å; V211-A214 WeakPolarHBondContact O-CB 3.48Å; V211-A214 PolarHBondContact O-N 3.26Å; V211-W215 VanDerWaalsContact O-CB 3.31Å; V211-W215 WeakPolarHBondContact O-CB 3.45Å; V211-W215 PolarHBondContact O-N 3Å |
| 212 | V | 90.5 | Very high | 85.6 | Confident | 48 Ų | 48 | 48.6 Ų | 48.6 | 29% | 0.291 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.7 | -43.9 | 176.7 | 169.7 | 0 | 0 | 0 | 0 | 111.1 | I113 F208 F209 W215 L216 | I113-V212 HydrophobicContact CG2-CG1 3.96Å; F208-V212 HydrophobicContact CD1-CG2 4.04Å; F208-V212 HydrophobicContact CE1-CG2 3.64Å; F208-V212 HydrophobicContact CE2-CG2 4.24Å; F208-V212 HydrophobicContact CZ-CG2 3.75Å; F208-V212 VanDerWaalsContact O-CG2 3.31Å; F208-V212 WeakPolarHBondContact O-CG2 3.41Å; F208-V212 PolarHBondContact O-N 3.48Å; F209-V212 PolarHBondContact O-N 2.87Å; V212-W215 PolarHBondContact O-N 3.46Å; V212-L216 VanDerWaalsContact O-CB 3.24Å; V212-L216 WeakPolarHBondContact O-CB 3.35Å; V212-L216 PolarHBondContact O-N 3.09Å |
| 213 | V | 87.7 | Confident | 84.6 | Confident | 6 Ų | 6 | 55 Ų | 55 | 4% | 0.036 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.9 | -40 | 178.2 | 178.2 | 0 | 0 | 0 | 0 | 111.5 | V114 L145 F209 Y210 W215 L216 I217 | V114-V213 HydrophobicContact CG2-CG2 4.19Å; L145-V213 HydrophobicContact CD1-CG1 4.3Å; L145-V213 HydrophobicContact CD1-CG2 4.33Å; L145-V213 HydrophobicContact CD2-CB 4.05Å; L145-V213 HydrophobicContact CD2-CG1 3.71Å; L145-V213 HydrophobicContact CD2-CG2 4.24Å; F209-V213 HydrophobicContact CD2-CG2 4.22Å; F209-V213 HydrophobicContact CE1-CG2 4.26Å; F209-V213 HydrophobicContact CE2-CG2 3.79Å; F209-V213 HydrophobicContact CZ-CG2 3.81Å; F209-V213 WeakPolarHBondContact O-CG2 3.14Å; F209-V213 PolarHBondContact O-N 3.31Å; Y210-V213 PolarHBondContact O-N 3.26Å; V213-W215 PolarHBondContact O-N 3.44Å; V213-L216 WeakPolarHBondContact O-CB 3.4Å; V213-L216 PolarHBondContact O-N 3.23Å; V213-I217 HydrophobicContact CG1-CD1 3.9Å; V213-I217 HydrophobicContact CG1-CG1 4.41Å; V213-I217 VanDerWaalsContact O-CG1 3.26Å; V213-I217 WeakPolarHBondContact O-CG1 3.45Å; V213-I217 PolarHBondContact O-N 3.18Å |
| 214 | A | 86.9 | Confident | 82.9 | Confident | 13 Ų | 13 | 54.8 Ų | 54.8 | 11% | 0.107 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58.7 | -47.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V179 Y210 V211 L216 I217 L218 | V179-A214 HydrophobicContact CB-CB 4.16Å; V179-A214 HydrophobicContact CG1-CB 3.8Å; V179-A214 HydrophobicContact CG2-CB 3.31Å; Y210-A214 VanDerWaalsContact O-CB 3.26Å; Y210-A214 WeakPolarHBondContact O-CB 3.29Å; Y210-A214 PolarHBondContact O-N 2.96Å; V211-A214 WeakPolarHBondContact O-CB 3.48Å; V211-A214 PolarHBondContact O-N 3.26Å; A214-L216 VanDerWaalsContact C-N 3.35Å; A214-I217 PolarHBondContact O-N 3.41Å; A214-L218 VanDerWaalsContact O-CB 3.28Å; A214-L218 WeakPolarHBondContact O-CB 3.35Å; A214-L218 PolarHBondContact O-N 3.35Å |
| 215 | W | 87.1 | Confident | 80.8 | Confident | 178 Ų | 178 | 56.8 Ų | 56.8 | 67% | 0.674 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -61.7 | -44.4 | 177.8 | -177 | -93.9 | 0 | 0 | 0 | 111.6 | V211 V212 V213 L218 S219 | V211-W215 VanDerWaalsContact O-CB 3.31Å; V211-W215 WeakPolarHBondContact O-CB 3.45Å; V211-W215 PolarHBondContact O-N 3Å; V212-W215 PolarHBondContact O-N 3.46Å; V213-W215 PolarHBondContact O-N 3.44Å; W215-L218 PolarHBondContact O-N 3.26Å; W215-S219 VanDerWaalsContact O-CB 3.28Å; W215-S219 WeakPolarHBondContact O-CB 3.23Å; W215-S219 PolarHBondContact O-N 3.48Å; W215-S219 PolarHBondContact O-OG 3.46Å |
| 216 | L | 85.8 | Confident | 80.2 | Confident | 13 Ų | 13 | 58.6 Ų | 58.6 | 7% | 0.068 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -53.7 | -58.1 | 175.6 | -176.4 | 85.4 | 0 | 0 | 0 | 109.7 | A110 I113 V114 V212 V213 A214 L218 S219 Y220 | A110-L216 HydrophobicContact CB-CD2 3.99Å; I113-L216 HydrophobicContact CD1-CD1 3.71Å; V114-L216 HydrophobicContact CG2-CD2 4.3Å; V212-L216 VanDerWaalsContact O-CB 3.24Å; V212-L216 WeakPolarHBondContact O-CB 3.35Å; V212-L216 PolarHBondContact O-N 3.09Å; V213-L216 WeakPolarHBondContact O-CB 3.4Å; V213-L216 PolarHBondContact O-N 3.23Å; A214-L216 VanDerWaalsContact C-N 3.35Å; L216-L218 VanDerWaalsContact C-N 3.29Å; L216-L218 PolarHBondContact O-N 3.45Å; L216-S219 PolarHBondContact O-N 2.9Å; L216-S219 PolarHBondContact O-OG 2.89Å; L216-Y220 HydrophobicContact CD1-CD2 4.3Å; L216-Y220 HydrophobicContact CD1-CE2 3.45Å; L216-Y220 VanDerWaalsContact CD1-CE2 3.45Å; L216-Y220 HydrophobicContact CD2-CE2 4.16Å; L216-Y220 HydrophobicContact CG-CD2 3.93Å; L216-Y220 HydrophobicContact CG-CE2 3.45Å; L216-Y220 VanDerWaalsContact CG-CE2 3.45Å; L216-Y220 WeakPolarHBondContact O-CD2 3.5Å; L216-Y220 PolarHBondContact O-N 2.96Å |
| 217 | I | 80 | Confident | 79.7 | Confident | 17 Ų | 17 | 61.7 Ų | 61.7 | 9% | 0.087 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.8 | -41.4 | -179.3 | -60.9 | 165 | 0 | 0 | 0 | 111.2 | L148 V152 V213 A214 T221 | L148-I217 HydrophobicContact CG-CD1 4.41Å; V152-I217 HydrophobicContact CB-CG2 3.77Å; V152-I217 HydrophobicContact CG1-CG2 3.45Å; V152-I217 VanDerWaalsContact CG1-CG2 3.45Å; V152-I217 HydrophobicContact CG2-CG2 4.15Å; V213-I217 HydrophobicContact CG1-CD1 3.9Å; V213-I217 HydrophobicContact CG1-CG1 4.41Å; V213-I217 VanDerWaalsContact O-CG1 3.26Å; V213-I217 WeakPolarHBondContact O-CG1 3.45Å; V213-I217 PolarHBondContact O-N 3.18Å; A214-I217 PolarHBondContact O-N 3.41Å; I217-T221 WeakPolarHBondContact O-CB 3.45Å; I217-T221 PolarHBondContact O-N 2.89Å; I217-T221 PolarHBondContact O-OG1 3.24Å |
| 218 | L | 80.7 | Confident | 79.1 | Confident | 28 Ų | 28 | 62.8 Ų | 62.8 | 15% | 0.147 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -65.6 | -43.5 | 178.9 | -179.8 | 67 | 0 | 0 | 0 | 112.6 | L172 A214 W215 L216 T221 H222 | L172-L218 HydrophobicContact CD1-CD1 4.22Å; L172-L218 HydrophobicContact CD1-CD2 3.58Å; L172-L218 HydrophobicContact CD1-CG 4.47Å; L172-L218 HydrophobicContact CG-CD2 4.29Å; A214-L218 VanDerWaalsContact O-CB 3.28Å; A214-L218 WeakPolarHBondContact O-CB 3.35Å; A214-L218 PolarHBondContact O-N 3.35Å; W215-L218 PolarHBondContact O-N 3.26Å; L216-L218 VanDerWaalsContact C-N 3.29Å; L216-L218 PolarHBondContact O-N 3.45Å; L218-T221 CarbonylContact O-C 3.57Å; L218-T221 VanDerWaalsContact O-CB 3.32Å; L218-T221 WeakPolarHBondContact O-CB 3.35Å; L218-T221 PolarHBondContact O-N 3.37Å; L218-H222 PolarHBondContact O-N 3.25Å |
| 219 | S | 82.4 | Confident | 78.4 | Confident | 46 Ų | 46 | 59.1 Ų | 59.1 | 32% | 0.322 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.8 | -44 | -178.4 | 70 | 0 | 0 | 0 | 0 | 111.5 | W215 L216 T221 H222 Y223 | W215-S219 VanDerWaalsContact O-CB 3.28Å; W215-S219 WeakPolarHBondContact O-CB 3.23Å; W215-S219 PolarHBondContact O-N 3.48Å; W215-S219 PolarHBondContact O-OG 3.46Å; L216-S219 PolarHBondContact O-N 2.9Å; L216-S219 PolarHBondContact O-OG 2.89Å; S219-T221 VanDerWaalsContact C-N 3.3Å; S219-T221 PolarHBondContact O-N 3.16Å; S219-H222 WeakPolarHBondContact O-CB 3.36Å; S219-H222 PolarHBondContact O-N 3Å; S219-Y223 PolarHBondContact O-N 3.28Å |
| 220 | Y | 75.7 | Confident | 77.5 | Confident | 26 Ų | 26 | 62.4 Ų | 62.4 | 10% | 0.102 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -67.2 | -35.5 | 175 | -70.7 | -64.1 | 0 | 0 | 0 | 112.7 | L95 K106 A110 L216 H222 Y223 S224 | L95-Y220 HydrophobicContact CD1-CD2 4.27Å; L95-Y220 HydrophobicContact CD1-CG 3.9Å; L95-Y220 HydrophobicContact CD2-CD1 3.66Å; L95-Y220 HydrophobicContact CD2-CD2 3.12Å; L95-Y220 HydrophobicContact CD2-CE1 3.99Å; L95-Y220 HydrophobicContact CD2-CE2 3.46Å; L95-Y220 VanDerWaalsContact CD2-CE2 3.46Å; L95-Y220 HydrophobicContact CD2-CG 3.23Å; L95-Y220 HydrophobicContact CG-CD1 4.28Å; L95-Y220 HydrophobicContact CG-CD2 4.17Å; L95-Y220 HydrophobicContact CG-CG 3.88Å; K106-Y220 HydrophobicContact CB-CE1 4Å; K106-Y220 HydrophobicContact CD-CE1 4.47Å; K106-Y220 HydrophobicContact CG-CE1 4.25Å; K106-Y220 PolarHBondContact O-OH 3.34Å; A110-Y220 HydrophobicContact CB-CE2 4.06Å; L216-Y220 HydrophobicContact CD1-CD2 4.3Å; L216-Y220 HydrophobicContact CD1-CE2 3.45Å; L216-Y220 VanDerWaalsContact CD1-CE2 3.45Å; L216-Y220 HydrophobicContact CD2-CE2 4.16Å; L216-Y220 HydrophobicContact CG-CD2 3.93Å; L216-Y220 HydrophobicContact CG-CE2 3.45Å; L216-Y220 VanDerWaalsContact CG-CE2 3.45Å; L216-Y220 WeakPolarHBondContact O-CD2 3.5Å; L216-Y220 PolarHBondContact O-N 2.96Å; Y220-H222 VanDerWaalsContact C-N 3.26Å; Y220-H222 PolarHBondContact O-N 2.9Å; Y220-Y223 PolarHBondContact O-N 3.25Å; Y220-S224 PolarHBondContact O-N 3.29Å |
| 221 | T | 71.1 | Confident | 76.7 | Confident | 9 Ų | 9 | 66.5 Ų | 66.5 | 6% | 0.055 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.4 | -31.9 | 174.7 | -73.4 | 0 | 0 | 0 | 0 | 112 | K156 R171 I217 L218 S219 | K156-T221 HydrophobicContact CD-CG2 3.38Å; K156-T221 VanDerWaalsContact CE-CA 3.49Å; K156-T221 VanDerWaalsContact CE-CB 3.48Å; K156-T221 VanDerWaalsContact CE-OG1 3.29Å; K156-T221 WeakPolarHBondContact CE-OG1 3.29Å; K156-T221 HydrophobicContact CG-CG2 3.88Å; K156-T221 PolarHBondContact NZ-O 3.38Å; R171-T221 VanDerWaalsContact NE-CG2 3.35Å; I217-T221 WeakPolarHBondContact O-CB 3.45Å; I217-T221 PolarHBondContact O-N 2.89Å; I217-T221 PolarHBondContact O-OG1 3.24Å; L218-T221 CarbonylContact O-C 3.57Å; L218-T221 VanDerWaalsContact O-CB 3.32Å; L218-T221 WeakPolarHBondContact O-CB 3.35Å; L218-T221 PolarHBondContact O-N 3.37Å; S219-T221 VanDerWaalsContact C-N 3.3Å; S219-T221 PolarHBondContact O-N 3.16Å |
| 222 | H | 69 | Low | 75.7 | Confident | 128 Ų | 128 | 65.7 Ų | 65.7 | 59% | 0.593 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -75.5 | -39.3 | 173.4 | -174.7 | -89.1 | 0 | 0 | 0 | 112.7 | L218 S219 Y220 S224 | L218-H222 PolarHBondContact O-N 3.25Å; S219-H222 WeakPolarHBondContact O-CB 3.36Å; S219-H222 PolarHBondContact O-N 3Å; Y220-H222 VanDerWaalsContact C-N 3.26Å; Y220-H222 PolarHBondContact O-N 2.9Å; H222-S224 PolarHBondContact O-N 2.92Å |
| 223 | Y | 63.9 | Low | 74.6 | Confident | 136 Ų | 136 | 67.1 Ų | 67.1 | 53% | 0.533 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -67.2 | -20.3 | -179.2 | -167.7 | -86 | 0 | 0 | 0 | 114.1 | K106 S219 Y220 K225 | K106-Y223 VanDerWaalsContact NZ-CD1 3.28Å; S219-Y223 PolarHBondContact O-N 3.28Å; Y220-Y223 PolarHBondContact O-N 3.25Å; Y223-K225 PolarHBondContact O-N 3.18Å |
| 224 | S | 53.8 | Low | 73.5 | Confident | 55 Ų | 55 | 72.2 Ų | 72.2 | 39% | 0.385 | 34% | 0.335 | S | S | . | . | trans | -72 | 23.5 | -178.8 | -176.7 | 0 | 0 | 0 | 0 | 115 | Y220 H222 | Y220-S224 PolarHBondContact O-N 3.29Å; H222-S224 PolarHBondContact O-N 2.92Å | ||
| 225 | K | 45.7 | Very low | 72.3 | Confident | 217 Ų | 217 | 77.5 Ų | 77.5 | 94% | 0.943 | 36% | 0.355 | S | S | * | . | trans | -111.4 | 0 | 168.5 | -77 | -171.9 | 176.2 | -179.2 | 0 | 108.7 | Y223 | Y223-K225 PolarHBondContact O-N 3.18Š|
Retrieved 225 of 225 residues in 126.8 ms
(Link to these results)