| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.1 | Very low | 62 | Low | 246 Ų | 246 | 127.7 Ų | 127.7 | 100% | 1.212 | 66% | 0.659 | S | S | * | * | 0 | 98.4 | 0 | -137.4 | 168.9 | -168.5 | 0 | 0 | 105.8 | |||||
| 2 | E | 54.1 | Low | 62.2 | Low | 155 Ų | 155 | 122.9 Ų | 122.9 | 72% | 0.724 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 134.4 | -179.4 | -158.3 | 174.7 | 143.4 | 0 | 0 | 108.5 | R8 | E2-R8 IonicContact OE1-NH2 3.37Å; E2-R8 PolarHBondContact OE1-NH2 3.36Å |
| 3 | P | 60.5 | Low | 62.1 | Low | 81 Ų | 81 | 128.7 Ų | 128.7 | 53% | 0.526 | 65% | 0.653 | S | S | . | * | P | Polyproline II helix | trans | -66.1 | 140.3 | -176.8 | 23.8 | -31.5 | 0 | 0 | 0 | 110.9 | ||
| 4 | P | 62.4 | Low | 62 | Low | 101 Ų | 101 | 129.1 Ų | 129.1 | 66% | 0.656 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 142.4 | -175.2 | 21.8 | -31.2 | 0 | 0 | 0 | 112.3 | A6 Y7 | P4-A6 PolarHBondContact O-N 3.12Å; P4-Y7 PolarHBondContact O-N 2.65Å |
| 5 | E | 69.1 | Low | 61.9 | Low | 153 Ų | 153 | 125.1 Ų | 125.1 | 72% | 0.715 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -50.9 | -27 | -172.9 | -65.7 | -172.1 | 146.2 | 0 | 0 | 114.8 | Y7 R8 T9 | E5-Y7 PolarHBondContact O-N 3.22Å; E5-R8 WeakPolarHBondContact O-CB 3.46Å; E5-R8 PolarHBondContact O-N 3.02Å; E5-T9 PolarHBondContact O-N 3.11Å |
| 6 | A | 65.8 | Low | 61.5 | Low | 75 Ų | 75 | 124.4 Ų | 124.4 | 62% | 0.62 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -58.1 | -29.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | P4 T9 | P4-A6 PolarHBondContact O-N 3.12Å; A6-T9 PolarHBondContact O-OG1 3.11Å; A6-T9 VanDerWaalsContact O-OG1 3.12Å |
| 7 | Y | 62.5 | Low | 61.3 | Low | 165 Ų | 165 | 124.2 Ų | 124.2 | 65% | 0.647 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -76 | -30.3 | 177.1 | -169.7 | -101.3 | 0 | 0 | 0 | 112.3 | P4 E5 K11 | P4-Y7 PolarHBondContact O-N 2.65Å; E5-Y7 PolarHBondContact O-N 3.22Å; Y7-K11 PolarHBondContact O-N 3.17Å |
| 8 | R | 61.8 | Low | 61 | Low | 145 Ų | 145 | 124.6 Ų | 124.6 | 55% | 0.547 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -71.5 | -38 | -179.6 | -123.8 | -175 | -75.3 | 178.1 | -8.4 | 111.5 | E2 E5 S12 | E2-R8 IonicContact OE1-NH2 3.37Å; E2-R8 PolarHBondContact OE1-NH2 3.36Å; E5-R8 WeakPolarHBondContact O-CB 3.46Å; E5-R8 PolarHBondContact O-N 3.02Å; R8-S12 PolarHBondContact O-N 3.14Å |
| 9 | T | 67.8 | Low | 60.5 | Low | 92 Ų | 92 | 125 Ų | 125 | 56% | 0.564 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -72.9 | -35.8 | 179.5 | 48 | 0 | 0 | 0 | 0 | 113 | E5 A6 S12 R13 | E5-T9 PolarHBondContact O-N 3.11Å; A6-T9 PolarHBondContact O-OG1 3.11Å; A6-T9 VanDerWaalsContact O-OG1 3.12Å; T9-S12 PolarHBondContact O-N 2.82Å; T9-R13 PolarHBondContact O-N 3.06Å; T9-R13 VanDerWaalsContact O-N 3.15Å |
| 10 | A | 63.7 | Low | 60.1 | Low | 53 Ų | 53 | 127.7 Ų | 127.7 | 44% | 0.438 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -62.4 | -46.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S12 R13 E14 | A10-S12 PolarHBondContact O-N 3.04Å; A10-R13 PolarHBondContact O-N 3.37Å; A10-E14 PolarHBondContact O-N 3.46Å; A10-E14 VanDerWaalsContact O-N 3.15Å |
| 11 | K | 67.4 | Low | 59.7 | Low | 139 Ų | 139 | 129.9 Ų | 129.9 | 60% | 0.604 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -67.7 | -33.4 | -179.5 | -168.2 | 162.5 | -173.2 | 169.8 | 0 | 113.4 | Y7 S15 | Y7-K11 PolarHBondContact O-N 3.17Å; K11-S15 PolarHBondContact O-N 3.05Å |
| 12 | S | 64 | Low | 59.7 | Low | 70 Ų | 70 | 121.9 Ų | 121.9 | 49% | 0.49 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -67.1 | -37.6 | 174.4 | -176.4 | 0 | 0 | 0 | 0 | 111.9 | R8 T9 A10 S15 Q16 | R8-S12 PolarHBondContact O-N 3.14Å; T9-S12 PolarHBondContact O-N 2.82Å; A10-S12 PolarHBondContact O-N 3.04Å; S12-S15 PolarHBondContact O-N 3.3Å; S12-S15 PolarHBondContact O-OG 3.34Å; S12-Q16 PolarHBondContact O-N 2.92Å; S12-Q16 VanDerWaalsContact O-N 3.17Å |
| 13 | R | 61.8 | Low | 59 | Low | 198 Ų | 198 | 122 Ų | 122 | 75% | 0.747 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -66.4 | -41.5 | 175.6 | -88.7 | -176.6 | 161.2 | -176.9 | -4.9 | 113.1 | T9 A10 Q16 L17 | T9-R13 PolarHBondContact O-N 3.06Å; T9-R13 VanDerWaalsContact O-N 3.15Å; A10-R13 PolarHBondContact O-N 3.37Å; R13-Q16 PolarHBondContact O-N 3.37Å; R13-L17 PolarHBondContact O-N 3.12Å; R13-L17 VanDerWaalsContact O-N 3.07Å |
| 14 | E | 59.7 | Low | 58.1 | Low | 135 Ų | 135 | 124.8 Ų | 124.8 | 63% | 0.631 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -61.8 | -43.4 | 175.4 | -70.1 | -173.5 | 133.7 | 0 | 0 | 111.3 | A10 Q16 L17 D18 | A10-E14 PolarHBondContact O-N 3.46Å; A10-E14 VanDerWaalsContact O-N 3.15Å; E14-Q16 VanDerWaalsContact C-N 3.28Å; E14-Q16 PolarHBondContact O-N 3.26Å; E14-L17 PolarHBondContact O-N 3.32Å; E14-L17 VanDerWaalsContact O-N 3.16Å; E14-D18 PolarHBondContact O-N 3.12Å; E14-D18 VanDerWaalsContact O-N 3.08Å |
| 15 | S | 61.4 | Low | 56.7 | Low | 68 Ų | 68 | 123.3 Ų | 123.3 | 48% | 0.476 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -66.1 | -26.9 | 178 | 69.1 | 0 | 0 | 0 | 0 | 114.6 | K11 S12 | K11-S15 PolarHBondContact O-N 3.05Å; S12-S15 PolarHBondContact O-N 3.3Å; S12-S15 PolarHBondContact O-OG 3.34Å |
| 16 | Q | 55.5 | Low | 55.3 | Low | 114 Ų | 114 | 128.2 Ų | 128.2 | 53% | 0.533 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -79 | -31.7 | 175.4 | -79.1 | -80.3 | -53.9 | 0 | 0 | 111.9 | S12 R13 E14 | S12-Q16 PolarHBondContact O-N 2.92Å; S12-Q16 VanDerWaalsContact O-N 3.17Å; R13-Q16 PolarHBondContact O-N 3.37Å; E14-Q16 VanDerWaalsContact C-N 3.28Å; E14-Q16 PolarHBondContact O-N 3.26Å |
| 17 | L | 57.4 | Low | 53.7 | Low | 121 Ų | 121 | 133.7 Ų | 133.7 | 63% | 0.634 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -69.2 | -44.2 | 175.7 | -125.4 | 89.2 | 0 | 0 | 0 | 111.1 | R13 E14 L19 F20 | R13-L17 PolarHBondContact O-N 3.12Å; R13-L17 VanDerWaalsContact O-N 3.07Å; E14-L17 PolarHBondContact O-N 3.32Å; E14-L17 VanDerWaalsContact O-N 3.16Å; L17-L19 PolarHBondContact O-N 3.5Å; L17-F20 PolarHBondContact O-N 3.12Å; L17-F20 VanDerWaalsContact O-N 3.08Å |
| 18 | D | 56.4 | Low | 52.4 | Low | 132 Ų | 132 | 131 Ų | 131 | 71% | 0.706 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -64.8 | -27 | -179.5 | -70.8 | -23.2 | 0 | 0 | 0 | 112.9 | E14 | E14-D18 PolarHBondContact O-N 3.12Å; E14-D18 VanDerWaalsContact O-N 3.08Å |
| 19 | L | 52.2 | Low | 51.2 | Low | 132 Ų | 132 | 131.1 Ų | 131.1 | 69% | 0.691 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -77.5 | -22.5 | 177 | -153.4 | 80.4 | 0 | 0 | 0 | 112.7 | L17 | L17-L19 PolarHBondContact O-N 3.5Å |
| 20 | F | 51.8 | Low | 49.7 | Very low | 178 Ų | 178 | 135 Ų | 135 | 78% | 0.781 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -88.4 | -10.8 | -175.4 | -114.5 | -85.4 | 0 | 0 | 0 | 114 | L17 A22 | L17-F20 PolarHBondContact O-N 3.12Å; L17-F20 VanDerWaalsContact O-N 3.08Å; F20-A22 VanDerWaalsContact C-N 3.33Å |
| 21 | E | 50.4 | Low | 48.3 | Very low | 174 Ų | 174 | 142 Ų | 142 | 81% | 0.813 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 20.2 | 179.7 | -138.5 | 154.8 | 158.1 | 0 | 0 | 113.4 | ||
| 22 | A | 47.8 | Very low | 47.2 | Very low | 78 Ų | 78 | 139.6 Ų | 139.6 | 65% | 0.645 | 71% | 0.711 | S | S | * | * | trans | -88.3 | 112.5 | 170.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F20 | F20-A22 VanDerWaalsContact C-N 3.33Š| ||
| 23 | E | 39.7 | Very low | 46.5 | Very low | 158 Ų | 158 | 144.9 Ų | 144.9 | 74% | 0.738 | 73% | 0.728 | S | S | * | * | trans | 84.4 | 115.7 | 159.9 | -58.6 | -140.1 | 123.1 | 0 | 0 | 120.4 | ||||
| 24 | P | 41.5 | Very low | 46 | Very low | 139 Ų | 139 | 137.7 Ų | 137.7 | 90% | 0.903 | 71% | 0.706 | S | S | * | * | -101.7 | 114.6 | 128.3 | 3.2 | 15.5 | 0 | 0 | 0 | 109.6 | |||||
| 25 | S | 32.5 | Very low | 46.1 | Very low | 71 Ų | 71 | 133.1 Ų | 133.1 | 50% | 0.497 | 69% | 0.689 | S | S | . | * | trans | -101.9 | 82.5 | -175.4 | 48.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 26 | W | 39.6 | Very low | 46.5 | Very low | 255 Ų | 255 | 135 Ų | 135 | 97% | 0.966 | 70% | 0.7 | S | S | * | * | trans | -140 | 130.3 | 157.3 | -72.2 | 92.2 | 0 | 0 | 0 | 112.3 | ||||
| 27 | K | 32.2 | Very low | 47.4 | Very low | 190 Ų | 190 | 134.4 Ų | 134.4 | 83% | 0.826 | 70% | 0.701 | S | S | * | * | trans | -73.1 | 152.8 | -164.2 | -75.5 | 169.8 | 164.7 | 171.6 | 0 | 114.2 | ||||
| 28 | S | 36.8 | Very low | 48.3 | Very low | 108 Ų | 108 | 133.8 Ų | 133.8 | 76% | 0.755 | 69% | 0.694 | S | S | * | * | trans | 57.4 | 100.6 | 137 | 67.1 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 29 | N | 35.2 | Very low | 49.4 | Very low | 149 Ų | 149 | 132 Ų | 132 | 80% | 0.797 | 69% | 0.685 | S | S | * | * | S | Bend | -148.8 | 123 | 118.9 | -134.3 | -6 | 0 | 0 | 0 | 110.1 | |||
| 30 | Q | 36 | Very low | 51 | Low | 174 Ų | 174 | 131.6 Ų | 131.6 | 81% | 0.813 | 68% | 0.678 | S | S | * | * | trans | 34.7 | 84.9 | 168.8 | -70.9 | 179 | -30.4 | 0 | 0 | 116.2 | S32 | Q30-S32 PolarHBondContact O-N 3.21Š| ||
| 31 | K | 35.2 | Very low | 52.6 | Low | 198 Ų | 198 | 127.5 Ų | 127.5 | 86% | 0.861 | 66% | 0.664 | S | S | * | * | trans | -67.6 | 84.6 | 141.9 | -163.2 | 170.2 | -169.8 | 176.2 | 0 | 105.2 | E33 | K31-E33 PolarHBondContact O-N 3.14Å; K31-E33 VanDerWaalsContact O-N 3.11Å | ||
| 32 | S | 45 | Very low | 54.3 | Low | 89 Ų | 89 | 122.9 Ų | 122.9 | 62% | 0.622 | 65% | 0.648 | S | S | * | * | trans | -44.2 | 120.8 | 155.7 | 37.7 | 0 | 0 | 0 | 0 | 105.3 | Q30 P34 | Q30-S32 PolarHBondContact O-N 3.21Å; S32-P34 WeakPolarHBondContact O-CD 3.49Å | ||
| 33 | E | 48.2 | Very low | 56.1 | Low | 182 Ų | 182 | 124.3 Ų | 124.3 | 85% | 0.85 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -47 | 121.2 | 167.9 | -77.5 | -177.8 | 130.1 | 0 | 0 | 105.9 | K31 S35 | K31-E33 PolarHBondContact O-N 3.14Å; K31-E33 VanDerWaalsContact O-N 3.11Å; E33-S35 PolarHBondContact O-N 2.8Å |
| 34 | P | 52.3 | Low | 58.4 | Low | 46 Ų | 46 | 120 Ų | 120 | 30% | 0.299 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -54.7 | 121.3 | 176.8 | 20.5 | -29.4 | 0 | 0 | 0 | 105.4 | S32 E38 | S32-P34 WeakPolarHBondContact O-CD 3.49Å; P34-E38 VanDerWaalsContact CA-OE2 3.26Å; P34-E38 WeakPolarHBondContact CA-OE2 3.44Å; P34-E38 HydrophobicContact CB-CB 3.93Å; P34-E38 VanDerWaalsContact CB-OE2 3.23Å; P34-E38 WeakPolarHBondContact CB-OE2 3.02Å |
| 35 | S | 60.2 | Low | 60.5 | Low | 39 Ų | 39 | 117.9 Ų | 117.9 | 27% | 0.273 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -52.5 | 150.9 | -176.8 | 59.7 | 0 | 0 | 0 | 0 | 108.5 | E33 D37 E38 N39 | E33-S35 PolarHBondContact O-N 2.8Å; S35-D37 WeakPolarHBondContact CB-OD1 3.39Å; S35-D37 VanDerWaalsContact CB-OD2 3.3Å; S35-D37 WeakPolarHBondContact CB-OD2 3.42Å; S35-D37 CarbonylContact O-C 3.56Å; S35-D37 PolarHBondContact O-N 2.86Å; S35-D37 PolarHBondContact OG-OD2 2.75Å; S35-E38 PolarHBondContact O-N 3.08Å; S35-E38 PolarHBondContact OG-N 3.48Å; S35-N39 PolarHBondContact O-N 3.22Å |
| 36 | P | 70.1 | Confident | 63.1 | Low | 109 Ų | 109 | 121.2 Ų | 121.2 | 71% | 0.708 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -46.9 | -33.8 | 179.1 | -27 | 33.6 | 0 | 0 | 0 | 112.6 | F40 | P36-F40 VanDerWaalsContact O-CB 3.29Å; P36-F40 WeakPolarHBondContact O-CB 3.33Å; P36-F40 PolarHBondContact O-N 2.72Å |
| 37 | D | 74.6 | Confident | 65.5 | Low | 100 Ų | 100 | 114.1 Ų | 114.1 | 54% | 0.535 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -64 | -41.8 | 173.2 | 21.3 | -54.2 | 0 | 0 | 0 | 114.3 | S35 F40 N41 | S35-D37 WeakPolarHBondContact CB-OD1 3.39Å; S35-D37 VanDerWaalsContact CB-OD2 3.3Å; S35-D37 WeakPolarHBondContact CB-OD2 3.42Å; S35-D37 CarbonylContact O-C 3.56Å; S35-D37 PolarHBondContact O-N 2.86Å; S35-D37 PolarHBondContact OG-OD2 2.75Å; D37-F40 PolarHBondContact O-N 2.95Å; D37-N41 WeakPolarHBondContact O-CB 3.5Å; D37-N41 PolarHBondContact O-N 3.03Å; D37-N41 PolarHBondContact O-ND2 3.24Å; D37-N41 VanDerWaalsContact O-ND2 3.14Å |
| 38 | E | 75.7 | Confident | 68.3 | Low | 108 Ų | 108 | 109.7 Ų | 109.7 | 51% | 0.505 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.5 | -45.8 | 172.4 | -78.2 | -169.6 | 160.1 | 0 | 0 | 112.1 | P34 S35 F40 N41 V42 | P34-E38 VanDerWaalsContact CA-OE2 3.26Å; P34-E38 WeakPolarHBondContact CA-OE2 3.44Å; P34-E38 HydrophobicContact CB-CB 3.93Å; P34-E38 VanDerWaalsContact CB-OE2 3.23Å; P34-E38 WeakPolarHBondContact CB-OE2 3.02Å; S35-E38 PolarHBondContact O-N 3.08Å; S35-E38 PolarHBondContact OG-N 3.48Å; E38-F40 VanDerWaalsContact C-N 3.29Å; E38-F40 PolarHBondContact O-N 3.43Å; E38-N41 PolarHBondContact O-N 3.39Å; E38-V42 VanDerWaalsContact O-CG2 3.31Å; E38-V42 WeakPolarHBondContact O-CG2 3.31Å; E38-V42 PolarHBondContact O-N 3.11Å |
| 39 | N | 81.1 | Confident | 70.7 | Confident | 94 Ų | 94 | 111.5 Ų | 111.5 | 50% | 0.503 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.3 | -39.2 | 177.4 | -81.8 | -29.7 | 0 | 0 | 0 | 111.6 | S35 H43 | S35-N39 PolarHBondContact O-N 3.22Å; N39-H43 WeakPolarHBondContact O-CB 3.45Å; N39-H43 PolarHBondContact O-N 3.09Å |
| 40 | F | 84.9 | Confident | 73.4 | Confident | 124 Ų | 124 | 109.2 Ų | 109.2 | 54% | 0.544 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -64.7 | -45.5 | 174.8 | -177.8 | -108.3 | 0 | 0 | 0 | 111.9 | P36 D37 E38 V42 H43 L44 | P36-F40 VanDerWaalsContact O-CB 3.29Å; P36-F40 WeakPolarHBondContact O-CB 3.33Å; P36-F40 PolarHBondContact O-N 2.72Å; D37-F40 PolarHBondContact O-N 2.95Å; E38-F40 VanDerWaalsContact C-N 3.29Å; E38-F40 PolarHBondContact O-N 3.43Å; F40-V42 PolarHBondContact O-N 3.44Å; F40-H43 PolarHBondContact O-N 3.38Å; F40-L44 HydrophobicContact CD1-CD1 3.75Å; F40-L44 HydrophobicContact CD1-CG 4.3Å; F40-L44 HydrophobicContact CE1-CD1 3.24Å; F40-L44 HydrophobicContact CE1-CG 3.98Å; F40-L44 HydrophobicContact CE2-CD1 4.34Å; F40-L44 HydrophobicContact CE2-CD2 4.45Å; F40-L44 HydrophobicContact CE2-CG 4.23Å; F40-L44 HydrophobicContact CG-CD1 4.5Å; F40-L44 HydrophobicContact CZ-CD1 3.58Å; F40-L44 HydrophobicContact CZ-CD2 4.19Å; F40-L44 HydrophobicContact CZ-CG 3.94Å; F40-L44 WeakPolarHBondContact O-CB 3.49Å; F40-L44 WeakPolarHBondContact O-CG 3.44Å; F40-L44 PolarHBondContact O-N 3.16Å |
| 41 | N | 85.5 | Confident | 75.9 | Confident | 92 Ų | 92 | 103.6 Ų | 103.6 | 49% | 0.492 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 177 | -73.8 | -27 | 0 | 0 | 0 | 112.4 | D37 E38 L44 T45 | D37-N41 WeakPolarHBondContact O-CB 3.5Å; D37-N41 PolarHBondContact O-N 3.03Å; D37-N41 PolarHBondContact O-ND2 3.24Å; D37-N41 VanDerWaalsContact O-ND2 3.14Å; E38-N41 PolarHBondContact O-N 3.39Å; N41-L44 PolarHBondContact O-N 3.45Å; N41-T45 VanDerWaalsContact O-CB 3.31Å; N41-T45 WeakPolarHBondContact O-CB 3.4Å; N41-T45 PolarHBondContact O-N 2.92Å; N41-T45 PolarHBondContact O-OG1 3.49Å |
| 42 | V | 85.5 | Confident | 78.1 | Confident | 78 Ų | 78 | 96.1 Ų | 96.1 | 47% | 0.473 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 176 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | E38 F40 T45 K46 | E38-V42 VanDerWaalsContact O-CG2 3.31Å; E38-V42 WeakPolarHBondContact O-CG2 3.31Å; E38-V42 PolarHBondContact O-N 3.11Å; F40-V42 PolarHBondContact O-N 3.44Å; V42-T45 PolarHBondContact O-N 3.31Å; V42-K46 HydrophobicContact CG1-CD 4.47Å; V42-K46 WeakPolarHBondContact O-CG 3.22Å; V42-K46 PolarHBondContact O-N 2.83Å |
| 43 | H | 86.7 | Confident | 80.1 | Confident | 108 Ų | 108 | 93.3 Ų | 93.3 | 50% | 0.5 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.8 | -44.9 | 176.7 | -172.6 | 77.1 | 0 | 0 | 0 | 112 | N39 F40 T45 K46 M47 | N39-H43 WeakPolarHBondContact O-CB 3.45Å; N39-H43 PolarHBondContact O-N 3.09Å; F40-H43 PolarHBondContact O-N 3.38Å; H43-T45 VanDerWaalsContact C-N 3.34Å; H43-T45 PolarHBondContact O-N 2.85Å; H43-K46 PolarHBondContact O-N 3.37Å; H43-M47 WeakPolarHBondContact NE2-CE 3.43Å; H43-M47 WeakPolarHBondContact O-CB 3.36Å; H43-M47 PolarHBondContact O-N 2.59Å |
| 44 | L | 87.2 | Confident | 81.9 | Confident | 67 Ų | 67 | 89.8 Ų | 89.8 | 35% | 0.351 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.4 | -44.2 | 172.9 | -77.6 | -177.5 | 0 | 0 | 0 | 111.4 | F40 N41 K46 M47 V48 | F40-L44 HydrophobicContact CD1-CD1 3.75Å; F40-L44 HydrophobicContact CD1-CG 4.3Å; F40-L44 HydrophobicContact CE1-CD1 3.24Å; F40-L44 HydrophobicContact CE1-CG 3.98Å; F40-L44 HydrophobicContact CE2-CD1 4.34Å; F40-L44 HydrophobicContact CE2-CD2 4.45Å; F40-L44 HydrophobicContact CE2-CG 4.23Å; F40-L44 HydrophobicContact CG-CD1 4.5Å; F40-L44 HydrophobicContact CZ-CD1 3.58Å; F40-L44 HydrophobicContact CZ-CD2 4.19Å; F40-L44 HydrophobicContact CZ-CG 3.94Å; F40-L44 WeakPolarHBondContact O-CB 3.49Å; F40-L44 WeakPolarHBondContact O-CG 3.44Å; F40-L44 PolarHBondContact O-N 3.16Å; N41-L44 PolarHBondContact O-N 3.45Å; L44-K46 PolarHBondContact O-N 3.42Å; L44-M47 PolarHBondContact O-N 2.98Å; L44-V48 WeakPolarHBondContact O-CB 3.37Å; L44-V48 VanDerWaalsContact O-CG2 3.24Å; L44-V48 WeakPolarHBondContact O-CG2 3.22Å; L44-V48 PolarHBondContact O-N 2.84Å |
| 45 | T | 86.1 | Confident | 83.4 | Confident | 94 Ų | 94 | 94.4 Ų | 94.4 | 58% | 0.577 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.7 | -42.5 | 178.7 | -55.9 | 0 | 0 | 0 | 0 | 111.1 | N41 V42 H43 V48 F49 | N41-T45 VanDerWaalsContact O-CB 3.31Å; N41-T45 WeakPolarHBondContact O-CB 3.4Å; N41-T45 PolarHBondContact O-N 2.92Å; N41-T45 PolarHBondContact O-OG1 3.49Å; V42-T45 PolarHBondContact O-N 3.31Å; H43-T45 VanDerWaalsContact C-N 3.34Å; H43-T45 PolarHBondContact O-N 2.85Å; T45-V48 PolarHBondContact O-N 3.41Å; T45-F49 WeakPolarHBondContact O-CB 3.41Å; T45-F49 PolarHBondContact O-N 3.08Å |
| 46 | K | 87.9 | Confident | 84.2 | Confident | 142 Ų | 142 | 97.5 Ų | 97.5 | 62% | 0.617 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.8 | -43.2 | 173.4 | -76.6 | -179.6 | -179.6 | 179.7 | 0 | 111.6 | V42 H43 L44 F49 E50 | V42-K46 HydrophobicContact CG1-CD 4.47Å; V42-K46 WeakPolarHBondContact O-CG 3.22Å; V42-K46 PolarHBondContact O-N 2.83Å; H43-K46 PolarHBondContact O-N 3.37Å; L44-K46 PolarHBondContact O-N 3.42Å; K46-F49 PolarHBondContact O-N 2.85Å; K46-E50 VanDerWaalsContact O-CB 3.24Å; K46-E50 WeakPolarHBondContact O-CB 3.45Å; K46-E50 PolarHBondContact O-N 3.37Å |
| 47 | M | 89.7 | Confident | 84.6 | Confident | 105 Ų | 105 | 101.3 Ų | 101.3 | 52% | 0.517 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.4 | -43.9 | 178.9 | -170.7 | -179.3 | -64.8 | 0 | 0 | 112.1 | H43 L44 E50 A51 | H43-M47 WeakPolarHBondContact NE2-CE 3.43Å; H43-M47 WeakPolarHBondContact O-CB 3.36Å; H43-M47 PolarHBondContact O-N 2.59Å; L44-M47 PolarHBondContact O-N 2.98Å; M47-E50 PolarHBondContact O-N 2.89Å; M47-A51 WeakPolarHBondContact O-CB 3.16Å; M47-A51 PolarHBondContact O-N 2.86Å |
| 48 | V | 90.1 | Very high | 84.6 | Confident | 97 Ų | 97 | 105 Ų | 105 | 59% | 0.588 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66 | -38.6 | 175.5 | 171.7 | 0 | 0 | 0 | 0 | 110.6 | L44 T45 S52 | L44-V48 WeakPolarHBondContact O-CB 3.37Å; L44-V48 VanDerWaalsContact O-CG2 3.24Å; L44-V48 WeakPolarHBondContact O-CG2 3.22Å; L44-V48 PolarHBondContact O-N 2.84Å; T45-V48 PolarHBondContact O-N 3.41Å; V48-S52 WeakPolarHBondContact O-CB 3.13Å; V48-S52 PolarHBondContact O-N 3.47Å; V48-S52 PolarHBondContact O-OG 2.99Å |
| 49 | F | 88.3 | Confident | 84.2 | Confident | 146 Ų | 146 | 102 Ų | 102 | 64% | 0.64 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -68.8 | -40.1 | 174.8 | -174.7 | -98.1 | 0 | 0 | 0 | 112.1 | T45 K46 S52 S53 | T45-F49 WeakPolarHBondContact O-CB 3.41Å; T45-F49 PolarHBondContact O-N 3.08Å; K46-F49 PolarHBondContact O-N 2.85Å; F49-S52 VanDerWaalsContact CA-OG 3.3Å; F49-S52 WeakPolarHBondContact CA-OG 3.25Å; F49-S52 PolarHBondContact O-OG 2.81Å; F49-S52 VanDerWaalsContact O-OG 3.07Å; F49-S53 WeakPolarHBondContact O-CB 3.49Å; F49-S53 PolarHBondContact O-N 3.49Å; F49-S53 PolarHBondContact O-OG 2.97Å |
| 50 | E | 91.1 | Very high | 83.6 | Confident | 101 Ų | 101 | 101 Ų | 101 | 47% | 0.472 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -71.1 | -40.9 | 176.7 | -162.8 | -174.5 | 152 | 0 | 0 | 111.5 | K46 M47 S53 K54 | K46-E50 VanDerWaalsContact O-CB 3.24Å; K46-E50 WeakPolarHBondContact O-CB 3.45Å; K46-E50 PolarHBondContact O-N 3.37Å; M47-E50 PolarHBondContact O-N 2.89Å; E50-S53 WeakPolarHBondContact CA-OG 3.3Å; E50-S53 PolarHBondContact O-OG 2.76Å; E50-S53 VanDerWaalsContact O-OG 3.05Å; E50-K54 HydrophobicContact CG-CD 4.35Å; E50-K54 VanDerWaalsContact O-CB 3.25Å; E50-K54 WeakPolarHBondContact O-CB 3.42Å; E50-K54 VanDerWaalsContact O-CG 3.31Å; E50-K54 WeakPolarHBondContact O-CG 3.02Å; E50-K54 PolarHBondContact O-N 3.4Å; E50-K54 WeakPolarHBondContact OE1-CE 3.29Å; E50-K54 IonicContact OE1-NZ 3.64Å; E50-K54 PolarHBondContact OE1-NZ 2.86Å |
| 51 | A | 88.8 | Confident | 82.9 | Confident | 56 Ų | 56 | 98.4 Ų | 98.4 | 46% | 0.463 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.6 | -46.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | M47 K54 Q55 | M47-A51 WeakPolarHBondContact O-CB 3.16Å; M47-A51 PolarHBondContact O-N 2.86Å; A51-K54 PolarHBondContact O-N 3.49Å; A51-Q55 WeakPolarHBondContact O-CB 3.25Å; A51-Q55 PolarHBondContact O-N 3.41Å |
| 52 | S | 81.6 | Confident | 81.8 | Confident | 41 Ų | 41 | 98.9 Ų | 98.9 | 29% | 0.287 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.4 | -41 | 176.4 | 60 | 0 | 0 | 0 | 0 | 112 | V48 F49 K54 Q55 I56 | V48-S52 WeakPolarHBondContact O-CB 3.13Å; V48-S52 PolarHBondContact O-N 3.47Å; V48-S52 PolarHBondContact O-OG 2.99Å; F49-S52 VanDerWaalsContact CA-OG 3.3Å; F49-S52 WeakPolarHBondContact CA-OG 3.25Å; F49-S52 PolarHBondContact O-OG 2.81Å; F49-S52 VanDerWaalsContact O-OG 3.07Å; S52-K54 PolarHBondContact O-N 2.67Å; S52-Q55 CarbonylContact O-C 3.5Å; S52-Q55 PolarHBondContact O-N 2.95Å; S52-Q55 VanDerWaalsContact O-N 3.16Å; S52-I56 WeakPolarHBondContact O-CB 3.46Å; S52-I56 VanDerWaalsContact O-CG1 3.25Å; S52-I56 WeakPolarHBondContact O-CG1 3.45Å; S52-I56 PolarHBondContact O-N 2.97Å |
| 53 | S | 86.7 | Confident | 80.1 | Confident | 31 Ų | 31 | 104.3 Ų | 104.3 | 22% | 0.217 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -68 | -34.6 | 175.9 | 63.3 | 0 | 0 | 0 | 0 | 112.3 | F49 E50 R57 | F49-S53 WeakPolarHBondContact O-CB 3.49Å; F49-S53 PolarHBondContact O-N 3.49Å; F49-S53 PolarHBondContact O-OG 2.97Å; E50-S53 WeakPolarHBondContact CA-OG 3.3Å; E50-S53 PolarHBondContact O-OG 2.76Å; E50-S53 VanDerWaalsContact O-OG 3.05Å; S53-R57 VanDerWaalsContact O-CB 3.23Å; S53-R57 WeakPolarHBondContact O-CB 3.27Å; S53-R57 VanDerWaalsContact O-CG 3.24Å; S53-R57 WeakPolarHBondContact O-CG 3.36Å; S53-R57 PolarHBondContact O-N 3.38Å |
| 54 | K | 86.9 | Confident | 78.6 | Confident | 107 Ų | 107 | 103 Ų | 103 | 47% | 0.465 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.2 | -40 | 168.9 | -80.9 | 170.7 | 172.5 | 163.6 | 0 | 111.2 | E50 A51 S52 R57 R58 | E50-K54 HydrophobicContact CG-CD 4.35Å; E50-K54 VanDerWaalsContact O-CB 3.25Å; E50-K54 WeakPolarHBondContact O-CB 3.42Å; E50-K54 VanDerWaalsContact O-CG 3.31Å; E50-K54 WeakPolarHBondContact O-CG 3.02Å; E50-K54 PolarHBondContact O-N 3.4Å; E50-K54 WeakPolarHBondContact OE1-CE 3.29Å; E50-K54 IonicContact OE1-NZ 3.64Å; E50-K54 PolarHBondContact OE1-NZ 2.86Å; A51-K54 PolarHBondContact O-N 3.49Å; S52-K54 PolarHBondContact O-N 2.67Å; K54-R57 PolarHBondContact O-N 2.61Å; K54-R58 WeakPolarHBondContact O-CB 3.47Å; K54-R58 VanDerWaalsContact O-CG 3.29Å; K54-R58 WeakPolarHBondContact O-CG 3.24Å; K54-R58 PolarHBondContact O-N 2.99Å |
| 55 | Q | 81.7 | Confident | 77.1 | Confident | 144 Ų | 144 | 104.5 Ų | 104.5 | 67% | 0.673 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -69.5 | -41 | 177.2 | -168.9 | 171.5 | 13.6 | 0 | 0 | 112.2 | A51 S52 R58 A59 | A51-Q55 WeakPolarHBondContact O-CB 3.25Å; A51-Q55 PolarHBondContact O-N 3.41Å; S52-Q55 CarbonylContact O-C 3.5Å; S52-Q55 PolarHBondContact O-N 2.95Å; S52-Q55 VanDerWaalsContact O-N 3.16Å; Q55-R58 PolarHBondContact O-N 3.21Å; Q55-A59 VanDerWaalsContact O-CB 3.31Å; Q55-A59 WeakPolarHBondContact O-CB 3.02Å; Q55-A59 PolarHBondContact O-N 3.42Å |
| 56 | I | 78.3 | Confident | 75.8 | Confident | 103 Ų | 103 | 104.8 Ų | 104.8 | 53% | 0.528 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.7 | -45 | 172.3 | -68.7 | 165.4 | 0 | 0 | 0 | 109.2 | S52 R58 A59 V60 | S52-I56 WeakPolarHBondContact O-CB 3.46Å; S52-I56 VanDerWaalsContact O-CG1 3.25Å; S52-I56 WeakPolarHBondContact O-CG1 3.45Å; S52-I56 PolarHBondContact O-N 2.97Å; I56-R58 VanDerWaalsContact C-N 3.32Å; I56-R58 PolarHBondContact O-N 3.39Å; I56-A59 CarbonylContact O-C 3.56Å; I56-A59 PolarHBondContact O-N 2.91Å; I56-V60 HydrophobicContact CG2-CG2 3.83Å; I56-V60 WeakPolarHBondContact O-CA 3.08Å; I56-V60 WeakPolarHBondContact O-CB 3.06Å; I56-V60 WeakPolarHBondContact O-CG2 3.24Å; I56-V60 PolarHBondContact O-N 2.96Å |
| 57 | R | 78.3 | Confident | 74.5 | Confident | 190 Ų | 190 | 102.6 Ų | 102.6 | 72% | 0.717 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.5 | -34 | 176.1 | -78.2 | 179.6 | -176 | -90.9 | 1.8 | 112.4 | S53 K54 S61 | S53-R57 VanDerWaalsContact O-CB 3.23Å; S53-R57 WeakPolarHBondContact O-CB 3.27Å; S53-R57 VanDerWaalsContact O-CG 3.24Å; S53-R57 WeakPolarHBondContact O-CG 3.36Å; S53-R57 PolarHBondContact O-N 3.38Å; K54-R57 PolarHBondContact O-N 2.61Å; R57-S61 WeakPolarHBondContact O-CA 3.31Å; R57-S61 WeakPolarHBondContact O-CB 3.19Å; R57-S61 PolarHBondContact O-N 2.81Å; R57-S61 PolarHBondContact O-OG 3.28Å |
| 58 | R | 74.6 | Confident | 72.9 | Confident | 177 Ų | 177 | 102.3 Ų | 102.3 | 67% | 0.668 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -68.4 | -49.7 | 172.9 | -77.5 | -178.5 | -167.4 | 166.2 | 3.6 | 110.8 | K54 Q55 I56 S61 T62 | K54-R58 WeakPolarHBondContact O-CB 3.47Å; K54-R58 VanDerWaalsContact O-CG 3.29Å; K54-R58 WeakPolarHBondContact O-CG 3.24Å; K54-R58 PolarHBondContact O-N 2.99Å; Q55-R58 PolarHBondContact O-N 3.21Å; I56-R58 VanDerWaalsContact C-N 3.32Å; I56-R58 PolarHBondContact O-N 3.39Å; R58-S61 WeakPolarHBondContact CA-OG 3.38Å; R58-S61 PolarHBondContact O-N 2.86Å; R58-S61 PolarHBondContact O-OG 3.5Å; R58-T62 WeakPolarHBondContact O-CB 3.35Å; R58-T62 PolarHBondContact O-N 3.03Å; R58-T62 PolarHBondContact O-OG1 2.86Å |
| 59 | A | 67.8 | Low | 71.4 | Confident | 44 Ų | 44 | 101.5 Ų | 101.5 | 36% | 0.364 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -57.1 | -58.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q55 I56 S61 T62 Y63 | Q55-A59 VanDerWaalsContact O-CB 3.31Å; Q55-A59 WeakPolarHBondContact O-CB 3.02Å; Q55-A59 PolarHBondContact O-N 3.42Å; I56-A59 CarbonylContact O-C 3.56Å; I56-A59 PolarHBondContact O-N 2.91Å; A59-S61 VanDerWaalsContact C-N 3.32Å; A59-S61 PolarHBondContact O-N 3.32Å; A59-T62 CarbonylContact O-C 3.58Å; A59-T62 PolarHBondContact O-N 3.46Å; A59-T62 VanDerWaalsContact O-N 3.11Å; A59-Y63 HydrophobicContact CB-CD2 4.41Å; A59-Y63 HydrophobicContact CB-CE2 4.43Å; A59-Y63 VanDerWaalsContact O-CB 3.24Å; A59-Y63 WeakPolarHBondContact O-CB 3.15Å; A59-Y63 WeakPolarHBondContact O-CD2 3.35Å; A59-Y63 PolarHBondContact O-N 3.36Å |
| 60 | V | 68.5 | Low | 70.4 | Confident | 74 Ų | 74 | 102.8 Ų | 102.8 | 45% | 0.448 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -50.5 | -47.7 | 172.3 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | I56 T62 Y63 T64 | I56-V60 HydrophobicContact CG2-CG2 3.83Å; I56-V60 WeakPolarHBondContact O-CA 3.08Å; I56-V60 WeakPolarHBondContact O-CB 3.06Å; I56-V60 WeakPolarHBondContact O-CG2 3.24Å; I56-V60 PolarHBondContact O-N 2.96Å; V60-T62 PolarHBondContact O-N 3.49Å; V60-Y63 CarbonylContact O-C 3.51Å; V60-Y63 PolarHBondContact O-N 2.94Å; V60-Y63 VanDerWaalsContact O-N 3.08Å; V60-T64 HydrophobicContact CG1-CG2 3.4Å; V60-T64 VanDerWaalsContact CG1-CG2 3.4Å; V60-T64 WeakPolarHBondContact O-CA 3.34Å; V60-T64 WeakPolarHBondContact O-CB 3.35Å; V60-T64 VanDerWaalsContact O-CG2 3.24Å; V60-T64 WeakPolarHBondContact O-CG2 3.27Å; V60-T64 PolarHBondContact O-N 3.06Å; V60-T64 PolarHBondContact O-OG1 3.28Å |
| 61 | S | 70.1 | Confident | 69.3 | Low | 69 Ų | 69 | 101.9 Ų | 101.9 | 48% | 0.483 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64 | -39.1 | 179.5 | 70 | 0 | 0 | 0 | 0 | 114 | R57 R58 A59 Y63 T64 | R57-S61 WeakPolarHBondContact O-CA 3.31Å; R57-S61 WeakPolarHBondContact O-CB 3.19Å; R57-S61 PolarHBondContact O-N 2.81Å; R57-S61 PolarHBondContact O-OG 3.28Å; R58-S61 WeakPolarHBondContact CA-OG 3.38Å; R58-S61 PolarHBondContact O-N 2.86Å; R58-S61 PolarHBondContact O-OG 3.5Å; A59-S61 VanDerWaalsContact C-N 3.32Å; A59-S61 PolarHBondContact O-N 3.32Å; S61-Y63 VanDerWaalsContact C-N 3.3Å; S61-T64 WeakPolarHBondContact CA-OG1 3.29Å; S61-T64 PolarHBondContact O-OG1 3.38Å |
| 62 | T | 62 | Low | 68.2 | Low | 103 Ų | 103 | 101.7 Ų | 101.7 | 63% | 0.632 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -70.3 | -28.6 | 174 | -55.7 | 0 | 0 | 0 | 0 | 111.2 | R58 A59 V60 | R58-T62 WeakPolarHBondContact O-CB 3.35Å; R58-T62 PolarHBondContact O-N 3.03Å; R58-T62 PolarHBondContact O-OG1 2.86Å; A59-T62 CarbonylContact O-C 3.58Å; A59-T62 PolarHBondContact O-N 3.46Å; A59-T62 VanDerWaalsContact O-N 3.11Å; V60-T62 PolarHBondContact O-N 3.49Å |
| 63 | Y | 49.7 | Very low | 67.8 | Low | 191 Ų | 191 | 103.3 Ų | 103.3 | 75% | 0.749 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -96.8 | -17.5 | -179.8 | -74.8 | -109.2 | 0 | 0 | 0 | 113.7 | A59 V60 S61 N65 | A59-Y63 HydrophobicContact CB-CD2 4.41Å; A59-Y63 HydrophobicContact CB-CE2 4.43Å; A59-Y63 VanDerWaalsContact O-CB 3.24Å; A59-Y63 WeakPolarHBondContact O-CB 3.15Å; A59-Y63 WeakPolarHBondContact O-CD2 3.35Å; A59-Y63 PolarHBondContact O-N 3.36Å; V60-Y63 CarbonylContact O-C 3.51Å; V60-Y63 PolarHBondContact O-N 2.94Å; V60-Y63 VanDerWaalsContact O-N 3.08Å; S61-Y63 VanDerWaalsContact C-N 3.3Å; Y63-N65 CarbonylContact O-C 3.55Å; Y63-N65 PolarHBondContact O-N 3.39Å |
| 64 | T | 55.9 | Low | 67.2 | Low | 82 Ų | 82 | 107.1 Ų | 107.1 | 50% | 0.503 | 53% | 0.53 | S | S | . | . | trans | -85.2 | 9.3 | 174.5 | 50.2 | 0 | 0 | 0 | 0 | 111.6 | V60 S61 V66 | V60-T64 HydrophobicContact CG1-CG2 3.4Å; V60-T64 VanDerWaalsContact CG1-CG2 3.4Å; V60-T64 WeakPolarHBondContact O-CA 3.34Å; V60-T64 WeakPolarHBondContact O-CB 3.35Å; V60-T64 VanDerWaalsContact O-CG2 3.24Å; V60-T64 WeakPolarHBondContact O-CG2 3.27Å; V60-T64 PolarHBondContact O-N 3.06Å; V60-T64 PolarHBondContact O-OG1 3.28Å; S61-T64 WeakPolarHBondContact CA-OG1 3.29Å; S61-T64 PolarHBondContact O-OG1 3.38Å; T64-V66 PolarHBondContact O-N 3.25Å | ||
| 65 | N | 56.3 | Low | 66.6 | Low | 98 Ų | 98 | 102.8 Ų | 102.8 | 52% | 0.524 | 51% | 0.513 | S | S | . | . | trans | -60.9 | 73.8 | 137.2 | -89 | -25.9 | 0 | 0 | 0 | 107.8 | Y63 D67 L68 | Y63-N65 CarbonylContact O-C 3.55Å; Y63-N65 PolarHBondContact O-N 3.39Å; N65-D67 PolarHBondContact O-N 3.04Å; N65-D67 VanDerWaalsContact O-N 3.11Å; N65-L68 HydrophobicContact CB-CB 4.5Å; N65-L68 VanDerWaalsContact O-CB 3.23Å; N65-L68 WeakPolarHBondContact O-CB 3.23Å; N65-L68 PolarHBondContact O-N 2.86Å | ||
| 66 | V | 58.5 | Low | 66.4 | Low | 100 Ų | 100 | 99.3 Ų | 99.3 | 61% | 0.606 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -54.9 | -22 | 165.5 | 177 | 0 | 0 | 0 | 0 | 109.3 | T64 L68 L69 R70 | T64-V66 PolarHBondContact O-N 3.25Å; V66-L68 PolarHBondContact O-N 3Å; V66-L69 PolarHBondContact O-N 3.45Å; V66-R70 PolarHBondContact O-N 3.37Å |
| 67 | D | 59.2 | Low | 66.3 | Low | 95 Ų | 95 | 98.5 Ų | 98.5 | 51% | 0.508 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.7 | -26.1 | 166.7 | -73.7 | -28.9 | 0 | 0 | 0 | 114.4 | N65 R70 C71 | N65-D67 PolarHBondContact O-N 3.04Å; N65-D67 VanDerWaalsContact O-N 3.11Å; D67-R70 VanDerWaalsContact O-CB 3.3Å; D67-R70 WeakPolarHBondContact O-CB 3.29Å; D67-R70 PolarHBondContact O-N 3.46Å; D67-C71 PolarHBondContact O-N 3.29Å; D67-C71 PolarHBondContact O-SG 3.39Å; D67-C71 VanDerWaalsContact O-SG 3.32Å |
| 68 | L | 56.8 | Low | 66.4 | Low | 99 Ų | 99 | 92.8 Ų | 92.8 | 52% | 0.518 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -67.9 | -44.4 | 175.7 | -165.4 | 114.1 | 0 | 0 | 0 | 110.9 | N65 V66 R70 C71 Y72 | N65-L68 HydrophobicContact CB-CB 4.5Å; N65-L68 VanDerWaalsContact O-CB 3.23Å; N65-L68 WeakPolarHBondContact O-CB 3.23Å; N65-L68 PolarHBondContact O-N 2.86Å; V66-L68 PolarHBondContact O-N 3Å; L68-R70 VanDerWaalsContact C-N 3.32Å; L68-C71 PolarHBondContact O-N 2.85Å; L68-Y72 HydrophobicContact CD2-CD2 4.39Å; L68-Y72 HydrophobicContact CD2-CE2 3.74Å; L68-Y72 HydrophobicContact CG-CE2 4Å; L68-Y72 WeakPolarHBondContact O-CD2 3.38Å; L68-Y72 PolarHBondContact O-N 3.37Å |
| 69 | L | 57.8 | Low | 66.8 | Low | 81 Ų | 81 | 88.5 Ų | 88.5 | 42% | 0.424 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.8 | -40.8 | 170.7 | -68.9 | -178.6 | 0 | 0 | 0 | 110.2 | V66 C71 Y72 F73 L101 | V66-L69 PolarHBondContact O-N 3.45Å; L69-C71 VanDerWaalsContact C-N 3.27Å; L69-C71 PolarHBondContact O-N 2.92Å; L69-Y72 CarbonylContact O-C 3.59Å; L69-Y72 WeakPolarHBondContact O-CA 3.04Å; L69-Y72 WeakPolarHBondContact O-CB 3.37Å; L69-Y72 PolarHBondContact O-N 3.37Å; L69-F73 HydrophobicContact CB-CD2 4.11Å; L69-F73 HydrophobicContact CB-CE2 4.28Å; L69-F73 HydrophobicContact CD2-CE2 4.49Å; L69-F73 VanDerWaalsContact O-CD2 3.23Å; L69-F73 WeakPolarHBondContact O-CD2 3.42Å; L69-F73 PolarHBondContact O-N 3.06Å; L69-L101 HydrophobicContact CD2-CD2 4.45Å |
| 70 | R | 68.5 | Low | 67.3 | Low | 173 Ų | 173 | 86.9 Ų | 86.9 | 65% | 0.653 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -51.4 | -46.5 | 175.2 | -167.8 | 178.8 | -176.2 | 151.4 | 3 | 111.4 | V66 D67 L68 Y72 F73 D74 | V66-R70 PolarHBondContact O-N 3.37Å; D67-R70 VanDerWaalsContact O-CB 3.3Å; D67-R70 WeakPolarHBondContact O-CB 3.29Å; D67-R70 PolarHBondContact O-N 3.46Å; L68-R70 VanDerWaalsContact C-N 3.32Å; R70-Y72 PolarHBondContact O-N 2.87Å; R70-F73 CarbonylContact O-C 3.33Å; R70-F73 PolarHBondContact O-N 3.15Å; R70-F73 VanDerWaalsContact O-N 3.1Å; R70-D74 WeakPolarHBondContact O-CB 3.25Å; R70-D74 PolarHBondContact O-N 3.36Å |
| 71 | C | 66.5 | Low | 68 | Low | 81 Ų | 81 | 87.4 Ų | 87.4 | 55% | 0.547 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.3 | -31.7 | 175.9 | -66.7 | 0 | 0 | 0 | 0 | 114.2 | D67 L68 L69 | D67-C71 PolarHBondContact O-N 3.29Å; D67-C71 PolarHBondContact O-SG 3.39Å; D67-C71 VanDerWaalsContact O-SG 3.32Å; L68-C71 PolarHBondContact O-N 2.85Å; L69-C71 VanDerWaalsContact C-N 3.27Å; L69-C71 PolarHBondContact O-N 2.92Å |
| 72 | Y | 67.1 | Low | 68.5 | Low | 53 Ų | 53 | 91.1 Ų | 91.1 | 21% | 0.208 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -85.5 | -17.3 | 177 | -65.5 | -61.3 | 0 | 0 | 0 | 114.1 | L68 L69 R70 Y99 D100 L101 V164 | L68-Y72 HydrophobicContact CD2-CD2 4.39Å; L68-Y72 HydrophobicContact CD2-CE2 3.74Å; L68-Y72 HydrophobicContact CG-CE2 4Å; L68-Y72 WeakPolarHBondContact O-CD2 3.38Å; L68-Y72 PolarHBondContact O-N 3.37Å; L69-Y72 CarbonylContact O-C 3.59Å; L69-Y72 WeakPolarHBondContact O-CA 3.04Å; L69-Y72 WeakPolarHBondContact O-CB 3.37Å; L69-Y72 PolarHBondContact O-N 3.37Å; R70-Y72 PolarHBondContact O-N 2.87Å; Y72-Y99 WeakPolarHBondContact CD1-O 3.2Å; Y72-D100 WeakPolarHBondContact O-CA 3.16Å; Y72-L101 PolarHBondContact O-N 3.47Å; Y72-V164 HydrophobicContact CD1-CG1 4.12Å; Y72-V164 HydrophobicContact CD2-CG1 3.99Å; Y72-V164 HydrophobicContact CE1-CG1 4.05Å; Y72-V164 HydrophobicContact CE2-CB 4.45Å; Y72-V164 HydrophobicContact CE2-CG1 3.94Å; Y72-V164 HydrophobicContact CE2-CG2 4.39Å; Y72-V164 HydrophobicContact CG-CG1 4.08Å |
| 73 | F | 72.2 | Confident | 69.3 | Low | 74 Ų | 74 | 87.3 Ų | 87.3 | 33% | 0.325 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -100.7 | -11.7 | 174.7 | -78.2 | -78.4 | 0 | 0 | 0 | 113.1 | L69 R70 V75 L101 Y102 L105 | L69-F73 HydrophobicContact CB-CD2 4.11Å; L69-F73 HydrophobicContact CB-CE2 4.28Å; L69-F73 HydrophobicContact CD2-CE2 4.49Å; L69-F73 VanDerWaalsContact O-CD2 3.23Å; L69-F73 WeakPolarHBondContact O-CD2 3.42Å; L69-F73 PolarHBondContact O-N 3.06Å; R70-F73 CarbonylContact O-C 3.33Å; R70-F73 PolarHBondContact O-N 3.15Å; R70-F73 VanDerWaalsContact O-N 3.1Å; F73-V75 VanDerWaalsContact C-N 3.28Å; F73-V75 PolarHBondContact O-N 3.44Å; F73-L101 HydrophobicContact CE2-CB 4.29Å; F73-L101 HydrophobicContact CE2-CD2 4.17Å; F73-L101 HydrophobicContact CZ-CB 4.14Å; F73-L101 HydrophobicContact CZ-CD2 4.16Å; F73-L101 HydrophobicContact CZ-CG 4.26Å; F73-Y102 AromaticContact CD1-CD2 3.88Å; F73-Y102 HydrophobicContact CD1-CD2 3.88Å; F73-Y102 HydrophobicContact CD1-CG 4.21Å; F73-Y102 HydrophobicContact CE1-CD2 4.25Å; F73-L105 HydrophobicContact CE1-CD1 4.4Å; F73-L105 HydrophobicContact CZ-CD1 4.22Å |
| 74 | D | 74.6 | Confident | 70.8 | Confident | 111 Ų | 111 | 79.4 Ų | 79.4 | 59% | 0.594 | 42% | 0.424 | S | S | * | . | trans | -80.1 | 75 | 178.6 | -171.7 | 41.7 | 0 | 0 | 0 | 110.4 | R70 K98 | R70-D74 WeakPolarHBondContact O-CB 3.25Å; R70-D74 PolarHBondContact O-N 3.36Å; D74-K98 PolarHBondContact O-NZ 3.42Å | ||
| 75 | V | 73.5 | Confident | 72 | Confident | 17 Ų | 17 | 80 Ų | 80 | 10% | 0.103 | 43% | 0.427 | C | S | . | . | trans | -140.8 | 137.5 | -176.2 | -175.6 | 0 | 0 | 0 | 0 | 108.7 | F73 E79 V80 K98 D100 | F73-V75 VanDerWaalsContact C-N 3.28Å; F73-V75 PolarHBondContact O-N 3.44Å; V75-E79 HydrophobicContact CG1-CB 3.92Å; V75-E79 WeakPolarHBondContact CG1-OE2 3.33Å; V75-V80 HydrophobicContact CB-CG2 4.49Å; V75-V80 HydrophobicContact CG1-CG2 3.76Å; V75-K98 HydrophobicContact CG2-CD 4.4Å; V75-D100 WeakPolarHBondContact CG1-OD2 3.5Å; V75-D100 HydrophobicContact CG2-CB 3.77Å; V75-D100 VanDerWaalsContact CG2-OD2 3.3Å; V75-D100 WeakPolarHBondContact CG2-OD2 3.26Å | ||
| 76 | T | 78.1 | Confident | 73 | Confident | 70 Ų | 70 | 76.2 Ų | 76.2 | 43% | 0.429 | 41% | 0.409 | S | S | . | . | trans | -75.4 | 137.7 | 178.2 | -49.2 | 0 | 0 | 0 | 0 | 109.2 | S78 E79 V80 | T76-S78 VanDerWaalsContact CG2-OG 3.26Å; T76-S78 WeakPolarHBondContact CG2-OG 3.47Å; T76-S78 PolarHBondContact O-N 3.46Å; T76-S78 VanDerWaalsContact O-N 3.1Å; T76-E79 PolarHBondContact N-OE2 3.01Å; T76-E79 WeakPolarHBondContact O-CA 3.31Å; T76-E79 WeakPolarHBondContact O-CB 3.47Å; T76-E79 PolarHBondContact O-N 2.93Å; T76-E79 PolarHBondContact OG1-OE2 2.85Å; T76-V80 PolarHBondContact O-N 3.12Å | ||
| 77 | P | 76.2 | Confident | 73.9 | Confident | 87 Ų | 87 | 71.9 Ų | 71.9 | 57% | 0.565 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -57.6 | -29.8 | -179.7 | 21.4 | -34.1 | 0 | 0 | 0 | 113.5 | E79 V80 V81 | P77-E79 VanDerWaalsContact C-N 3.34Å; P77-V80 WeakPolarHBondContact O-CB 3.48Å; P77-V80 PolarHBondContact O-N 3.47Å; P77-V81 WeakPolarHBondContact O-CG2 3.39Å; P77-V81 PolarHBondContact O-N 3.49Å; P77-V81 VanDerWaalsContact O-N 3.14Å |
| 78 | S | 80 | Confident | 74.7 | Confident | 69 Ų | 69 | 69.6 Ų | 69.6 | 48% | 0.483 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -64.2 | -36.7 | 173.5 | 54.8 | 0 | 0 | 0 | 0 | 112.9 | T76 V81 H82 | T76-S78 VanDerWaalsContact CG2-OG 3.26Å; T76-S78 WeakPolarHBondContact CG2-OG 3.47Å; T76-S78 PolarHBondContact O-N 3.46Å; T76-S78 VanDerWaalsContact O-N 3.1Å; S78-V81 PolarHBondContact O-N 3.44Å; S78-H82 PolarHBondContact O-CD2 2.9Å; S78-H82 PolarHBondContact O-N 3.06Å; S78-H82 VanDerWaalsContact O-N 3.09Å |
| 79 | E | 82.8 | Confident | 75.7 | Confident | 87 Ų | 87 | 67.6 Ų | 67.6 | 41% | 0.407 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -66.7 | -41.8 | 175.7 | -64.4 | 169.7 | 151.2 | 0 | 0 | 110.4 | V75 T76 P77 V81 H82 Q83 | V75-E79 HydrophobicContact CG1-CB 3.92Å; V75-E79 WeakPolarHBondContact CG1-OE2 3.33Å; T76-E79 PolarHBondContact N-OE2 3.01Å; T76-E79 WeakPolarHBondContact O-CA 3.31Å; T76-E79 WeakPolarHBondContact O-CB 3.47Å; T76-E79 PolarHBondContact O-N 2.93Å; T76-E79 PolarHBondContact OG1-OE2 2.85Å; P77-E79 VanDerWaalsContact C-N 3.34Å; E79-V81 VanDerWaalsContact C-N 3.31Å; E79-V81 PolarHBondContact O-N 3.26Å; E79-H82 PolarHBondContact O-N 3.49Å; E79-Q83 WeakPolarHBondContact O-CB 3.45Å; E79-Q83 VanDerWaalsContact O-CG 3.27Å; E79-Q83 WeakPolarHBondContact O-CG 3.41Å; E79-Q83 PolarHBondContact O-N 3.33Å |
| 80 | V | 79 | Confident | 76.2 | Confident | 11 Ų | 11 | 64.3 Ų | 64.3 | 7% | 0.067 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -57.9 | -45.1 | 175.5 | -177.4 | 0 | 0 | 0 | 0 | 110.6 | V75 T76 P77 H82 Q83 L84 Y102 | V75-V80 HydrophobicContact CB-CG2 4.49Å; V75-V80 HydrophobicContact CG1-CG2 3.76Å; T76-V80 PolarHBondContact O-N 3.12Å; P77-V80 WeakPolarHBondContact O-CB 3.48Å; P77-V80 PolarHBondContact O-N 3.47Å; V80-H82 PolarHBondContact O-N 3.36Å; V80-Q83 CarbonylContact O-C 3.47Å; V80-Q83 WeakPolarHBondContact O-CB 3.26Å; V80-Q83 PolarHBondContact O-N 2.94Å; V80-L84 HydrophobicContact CG1-CD1 4.1Å; V80-L84 HydrophobicContact CG1-CG 4.26Å; V80-L84 WeakPolarHBondContact O-CB 3.19Å; V80-L84 VanDerWaalsContact O-CG 3.23Å; V80-L84 WeakPolarHBondContact O-CG 3.19Å; V80-L84 PolarHBondContact O-N 2.88Å; V80-Y102 HydrophobicContact CG2-CD1 3.87Å; V80-Y102 HydrophobicContact CG2-CE1 4.32Å |
| 81 | V | 83.1 | Confident | 76.2 | Confident | 85 Ų | 85 | 62.1 Ų | 62.1 | 52% | 0.515 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -61.8 | -45.8 | 177.8 | 174.7 | 0 | 0 | 0 | 0 | 111.3 | P77 S78 E79 Q83 L84 V85 | P77-V81 WeakPolarHBondContact O-CG2 3.39Å; P77-V81 PolarHBondContact O-N 3.49Å; P77-V81 VanDerWaalsContact O-N 3.14Å; S78-V81 PolarHBondContact O-N 3.44Å; E79-V81 VanDerWaalsContact C-N 3.31Å; E79-V81 PolarHBondContact O-N 3.26Å; V81-Q83 VanDerWaalsContact C-N 3.27Å; V81-Q83 PolarHBondContact O-N 2.75Å; V81-L84 WeakPolarHBondContact O-CB 3.15Å; V81-L84 PolarHBondContact O-N 3.48Å; V81-L84 VanDerWaalsContact O-N 3.16Å; V81-V85 WeakPolarHBondContact O-CG2 3.34Å; V81-V85 PolarHBondContact O-N 2.97Å |
| 82 | H | 80 | Confident | 76.1 | Confident | 147 Ų | 147 | 63 Ų | 63 | 68% | 0.681 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -58.8 | -41.5 | 174.5 | -93.2 | -76.1 | 0 | 0 | 0 | 111.9 | S78 E79 V80 A86 | S78-H82 PolarHBondContact O-CD2 2.9Å; S78-H82 PolarHBondContact O-N 3.06Å; S78-H82 VanDerWaalsContact O-N 3.09Å; E79-H82 PolarHBondContact O-N 3.49Å; V80-H82 PolarHBondContact O-N 3.36Å; H82-A86 WeakPolarHBondContact O-CB 3.32Å; H82-A86 PolarHBondContact O-N 3.03Å |
| 83 | Q | 78.9 | Confident | 75.5 | Confident | 23 Ų | 23 | 63.3 Ų | 63.3 | 11% | 0.107 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -65.3 | -38.9 | 176.1 | -70.7 | -177.8 | 31.1 | 0 | 0 | 111.9 | E79 V80 V81 S87 L97 D100 Y172 | E79-Q83 WeakPolarHBondContact O-CB 3.45Å; E79-Q83 VanDerWaalsContact O-CG 3.27Å; E79-Q83 WeakPolarHBondContact O-CG 3.41Å; E79-Q83 PolarHBondContact O-N 3.33Å; V80-Q83 CarbonylContact O-C 3.47Å; V80-Q83 WeakPolarHBondContact O-CB 3.26Å; V80-Q83 PolarHBondContact O-N 2.94Å; V81-Q83 VanDerWaalsContact C-N 3.27Å; V81-Q83 PolarHBondContact O-N 2.75Å; Q83-S87 WeakPolarHBondContact O-CA 3.41Å; Q83-S87 WeakPolarHBondContact O-CB 3.15Å; Q83-S87 PolarHBondContact O-N 3.4Å; Q83-L97 HydrophobicContact CB-CD2 3.88Å; Q83-L97 HydrophobicContact CG-CD2 3.76Å; Q83-D100 PolarHBondContact NE2-OD2 3.46Å; Q83-D100 PolarHBondContact OE1-OD2 3.32Å; Q83-Y172 HydrophobicContact CB-CE1 4.3Å; Q83-Y172 VanDerWaalsContact OE1-CZ 3.27Å; Q83-Y172 PolarHBondContact OE1-OH 3.25Å |
| 84 | L | 81.8 | Confident | 74.3 | Confident | 25 Ų | 25 | 71.1 Ų | 71.1 | 13% | 0.131 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.4 | -45.1 | 177.6 | -72.8 | 173.2 | 0 | 0 | 0 | 112.5 | V80 V81 S87 L88 L107 Y172 F175 | V80-L84 HydrophobicContact CG1-CD1 4.1Å; V80-L84 HydrophobicContact CG1-CG 4.26Å; V80-L84 WeakPolarHBondContact O-CB 3.19Å; V80-L84 VanDerWaalsContact O-CG 3.23Å; V80-L84 WeakPolarHBondContact O-CG 3.19Å; V80-L84 PolarHBondContact O-N 2.88Å; V81-L84 WeakPolarHBondContact O-CB 3.15Å; V81-L84 PolarHBondContact O-N 3.48Å; V81-L84 VanDerWaalsContact O-N 3.16Å; L84-S87 WeakPolarHBondContact O-CA 3.13Å; L84-S87 WeakPolarHBondContact O-CB 3.43Å; L84-S87 PolarHBondContact O-N 3.25Å; L84-S87 PolarHBondContact O-OG 3.38Å; L84-L88 PolarHBondContact O-N 2.85Å; L84-L107 HydrophobicContact CD2-CD1 3.69Å; L84-L107 HydrophobicContact CD2-CD2 3.91Å; L84-L107 HydrophobicContact CD2-CG 4.1Å; L84-Y172 HydrophobicContact CD2-CD1 3.87Å; L84-Y172 HydrophobicContact CD2-CE1 3.95Å; L84-Y172 HydrophobicContact CG-CE1 4.41Å; L84-F175 HydrophobicContact CB-CD1 4.2Å; L84-F175 HydrophobicContact CB-CE1 3.98Å; L84-F175 HydrophobicContact CB-CE2 4.42Å; L84-F175 HydrophobicContact CB-CG 4.48Å; L84-F175 HydrophobicContact CB-CZ 4.11Å; L84-F175 HydrophobicContact CD1-CE2 4.38Å; L84-F175 HydrophobicContact CD2-CB 3.91Å; L84-F175 HydrophobicContact CD2-CD1 4.19Å; L84-F175 HydrophobicContact CD2-CD2 3.86Å; L84-F175 HydrophobicContact CD2-CE2 4.41Å; L84-F175 HydrophobicContact CD2-CG 3.73Å; L84-F175 WeakPolarHBondContact O-CD1 3.3Å; L84-F175 VanDerWaalsContact O-CE1 3.32Å; L84-F175 WeakPolarHBondContact O-CE1 3.27Å |
| 85 | V | 80.1 | Confident | 73 | Confident | 93 Ų | 93 | 71 Ų | 71 | 56% | 0.564 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -66.8 | -43.9 | 176.5 | 175.2 | 0 | 0 | 0 | 0 | 110.3 | V81 S87 L88 | V81-V85 WeakPolarHBondContact O-CG2 3.34Å; V81-V85 PolarHBondContact O-N 2.97Å; V85-S87 PolarHBondContact O-N 2.87Å; V85-L88 WeakPolarHBondContact O-CB 3.24Å; V85-L88 PolarHBondContact O-N 2.93Å |
| 86 | A | 77.8 | Confident | 72 | Confident | 20 Ų | 20 | 75 Ų | 75 | 17% | 0.165 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -61.5 | -32.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | H82 L88 N89 L95 | H82-A86 WeakPolarHBondContact O-CB 3.32Å; H82-A86 PolarHBondContact O-N 3.03Å; A86-L88 PolarHBondContact O-N 3.02Å; A86-N89 PolarHBondContact O-N 3.22Å; A86-L95 HydrophobicContact CB-CD1 3.25Å |
| 87 | S | 76.8 | Confident | 71 | Confident | 8 Ų | 8 | 73.4 Ų | 73.4 | 6% | 0.056 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -60.5 | -27 | 178.7 | 123.4 | 0 | 0 | 0 | 0 | 113.2 | Q83 L84 V85 R211 | Q83-S87 WeakPolarHBondContact O-CA 3.41Å; Q83-S87 WeakPolarHBondContact O-CB 3.15Å; Q83-S87 PolarHBondContact O-N 3.4Å; L84-S87 WeakPolarHBondContact O-CA 3.13Å; L84-S87 WeakPolarHBondContact O-CB 3.43Å; L84-S87 PolarHBondContact O-N 3.25Å; L84-S87 PolarHBondContact O-OG 3.38Å; V85-S87 PolarHBondContact O-N 2.87Å; S87-R211 VanDerWaalsContact CA-CZ 3.49Å; S87-R211 VanDerWaalsContact O-CD 3.22Å; S87-R211 WeakPolarHBondContact O-CD 3.4Å; S87-R211 PolarHBondContact O-NH1 2.88Å; S87-R211 VanDerWaalsContact O-NH1 3.1Å; S87-R211 PolarHBondContact OG-NH1 2.97Å; S87-R211 VanDerWaalsContact OG-NH1 3.09Å |
| 88 | L | 76.1 | Confident | 70.5 | Confident | 48 Ų | 48 | 74 Ų | 74 | 25% | 0.251 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -76.9 | -26.9 | 175 | -64.9 | 172.9 | 0 | 0 | 0 | 112.6 | L84 V85 A86 P90 F175 L179 L207 | L84-L88 PolarHBondContact O-N 2.85Å; V85-L88 WeakPolarHBondContact O-CB 3.24Å; V85-L88 PolarHBondContact O-N 2.93Å; A86-L88 PolarHBondContact O-N 3.02Å; L88-P90 WeakPolarHBondContact O-CD 3.44Å; L88-F175 HydrophobicContact CD1-CD1 4.4Å; L88-F175 HydrophobicContact CD1-CE1 3.68Å; L88-F175 HydrophobicContact CD2-CD1 3.74Å; L88-F175 HydrophobicContact CD2-CE1 3.85Å; L88-F175 HydrophobicContact CG-CD1 3.89Å; L88-F175 HydrophobicContact CG-CE1 3.65Å; L88-L179 HydrophobicContact CD1-CD1 3.86Å; L88-L179 HydrophobicContact CD2-CD1 3.64Å; L88-L179 HydrophobicContact CG-CD1 4.35Å; L88-L207 WeakPolarHBondContact O-CD2 3.5Å; L88-L207 WeakPolarHBondContact O-CG 3Å |
| 89 | N | 78.3 | Confident | 70.2 | Confident | 57 Ų | 57 | 74.4 Ų | 74.4 | 31% | 0.305 | 40% | 0.399 | S | S | . | . | trans | -103.1 | 97.9 | -178.7 | -171.1 | 7 | 0 | 0 | 0 | 111.6 | A86 L91 N92 | A86-N89 PolarHBondContact O-N 3.22Å; N89-L91 PolarHBondContact O-N 3.16Å; N89-L91 VanDerWaalsContact O-N 3.1Å; N89-L91 WeakPolarHBondContact OD1-CB 3.06Å; N89-L91 PolarHBondContact OD1-N 2.9Å; N89-N92 VanDerWaalsContact ND2-CG 3.29Å; N89-N92 PolarHBondContact ND2-ND2 3.23Å; N89-N92 VanDerWaalsContact ND2-ND2 3.16Å; N89-N92 PolarHBondContact ND2-OD1 2.93Å; N89-N92 PolarHBondContact O-N 3.39Å | ||
| 90 | P | 69.2 | Low | 70.3 | Confident | 11 Ų | 11 | 70.2 Ų | 70.2 | 7% | 0.071 | 38% | 0.379 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65 | -15.5 | 179.7 | 26.7 | -34.9 | 0 | 0 | 0 | 113.6 | L88 L207 L210 R211 | L88-P90 WeakPolarHBondContact O-CD 3.44Å; P90-L207 HydrophobicContact CG-CD1 3.47Å; P90-L207 VanDerWaalsContact CG-CD1 3.47Å; P90-L207 HydrophobicContact CG-CG 4.03Å; P90-L210 HydrophobicContact CB-CG 4.49Å; P90-L210 HydrophobicContact CG-CD2 4.13Å; P90-R211 HydrophobicContact CB-CB 3.98Å |
| 91 | L | 67.6 | Low | 70.6 | Confident | 128 Ų | 128 | 70.9 Ų | 70.9 | 67% | 0.67 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.9 | -24.9 | -177.3 | -68.9 | 144.8 | 0 | 0 | 0 | 112.4 | N89 G93 | N89-L91 PolarHBondContact O-N 3.16Å; N89-L91 VanDerWaalsContact O-N 3.1Å; N89-L91 WeakPolarHBondContact OD1-CB 3.06Å; N89-L91 PolarHBondContact OD1-N 2.9Å; L91-G93 PolarHBondContact O-N 2.94Å |
| 92 | N | 64 | Low | 70.7 | Confident | 98 Ų | 98 | 70.5 Ų | 70.5 | 52% | 0.524 | 37% | 0.372 | S | S | . | . | trans | -78.7 | 70.2 | -179.1 | -73.9 | -12.6 | 0 | 0 | 0 | 110.8 | N89 R94 | N89-N92 VanDerWaalsContact ND2-CG 3.29Å; N89-N92 PolarHBondContact ND2-ND2 3.23Å; N89-N92 VanDerWaalsContact ND2-ND2 3.16Å; N89-N92 PolarHBondContact ND2-OD1 2.93Å; N89-N92 PolarHBondContact O-N 3.39Å; N92-R94 PolarHBondContact O-N 3.4Å | ||
| 93 | G | 54.9 | Low | 71.1 | Confident | 61 Ų | 61 | 63.5 Ų | 63.5 | 63% | 0.629 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | 11.2 | -173.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | L91 | L91-G93 PolarHBondContact O-N 2.94Š|
| 94 | R | 46.6 | Very low | 71.7 | Confident | 237 Ų | 237 | 62.4 Ų | 62.4 | 89% | 0.894 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.7 | 2.6 | -167.5 | -136.7 | 174.4 | 76 | -174.5 | 4.5 | 115.9 | N92 A96 | N92-R94 PolarHBondContact O-N 3.4Å; R94-A96 PolarHBondContact O-N 2.86Å |
| 95 | L | 49.1 | Very low | 72.1 | Confident | 108 Ų | 108 | 63.8 Ų | 63.8 | 57% | 0.565 | 34% | 0.342 | S | S | * | . | trans | -88.8 | 96.7 | 167.8 | -70.6 | 160 | 0 | 0 | 0 | 106.8 | A86 L97 | A86-L95 HydrophobicContact CB-CD1 3.25Å; L95-L97 PolarHBondContact O-N 2.79Å | ||
| 96 | A | 51.2 | Low | 72.8 | Confident | 102 Ų | 102 | 63.4 Ų | 63.4 | 84% | 0.843 | 34% | 0.335 | S | S | * | . | trans | -56.5 | 87.7 | 158.7 | 0 | 0 | 0 | 0 | 0 | 106.3 | R94 K98 | R94-A96 PolarHBondContact O-N 2.86Å; A96-K98 PolarHBondContact O-N 2.96Å | ||
| 97 | L | 56.7 | Low | 73.5 | Confident | 36 Ų | 36 | 62.9 Ų | 62.9 | 19% | 0.188 | 33% | 0.33 | C | S | . | . | trans | -55.5 | 113.6 | 175.7 | -77.5 | 153 | 0 | 0 | 0 | 105.4 | Q83 L95 Y99 | Q83-L97 HydrophobicContact CB-CD2 3.88Å; Q83-L97 HydrophobicContact CG-CD2 3.76Å; L95-L97 PolarHBondContact O-N 2.79Å; L97-Y99 PolarHBondContact O-N 3.33Å; L97-Y99 VanDerWaalsContact O-N 3.08Å | ||
| 98 | K | 67.1 | Low | 74.4 | Confident | 101 Ų | 101 | 62.8 Ų | 62.8 | 44% | 0.439 | 33% | 0.329 | S | S | . | . | trans | -53.9 | 118.7 | 155.8 | -162.6 | -172 | 175.1 | -177.5 | 0 | 103.6 | D74 V75 A96 D100 | D74-K98 PolarHBondContact O-NZ 3.42Å; V75-K98 HydrophobicContact CG2-CD 4.4Å; A96-K98 PolarHBondContact O-N 2.96Å; K98-D100 WeakPolarHBondContact CB-OD1 3.38Å; K98-D100 WeakPolarHBondContact CD-OD1 3.38Å; K98-D100 WeakPolarHBondContact CG-OD1 3.23Å; K98-D100 PolarHBondContact O-N 3.1Å | ||
| 99 | Y | 74.1 | Confident | 75.3 | Confident | 76 Ų | 76 | 65.4 Ų | 65.4 | 30% | 0.298 | 34% | 0.338 | S | S | . | . | trans | -76.6 | 78.1 | -171.2 | -71 | -69.8 | 0 | 0 | 0 | 108.7 | Y72 L97 V165 I169 H215 | Y72-Y99 WeakPolarHBondContact CD1-O 3.2Å; L97-Y99 PolarHBondContact O-N 3.33Å; L97-Y99 VanDerWaalsContact O-N 3.08Å; Y99-V165 HydrophobicContact CD1-CB 4.34Å; Y99-V165 HydrophobicContact CD1-CG1 3.69Å; Y99-V165 HydrophobicContact CD1-CG2 4.41Å; Y99-V165 HydrophobicContact CD2-CB 4.43Å; Y99-V165 HydrophobicContact CD2-CG1 4.02Å; Y99-V165 HydrophobicContact CD2-CG2 3.72Å; Y99-V165 HydrophobicContact CE1-CG1 3.63Å; Y99-V165 HydrophobicContact CE2-CG1 3.95Å; Y99-V165 HydrophobicContact CE2-CG2 4.3Å; Y99-V165 HydrophobicContact CG-CB 4.2Å; Y99-V165 HydrophobicContact CG-CG1 3.88Å; Y99-V165 HydrophobicContact CG-CG2 3.78Å; Y99-I169 HydrophobicContact CD1-CD1 4.31Å; Y99-I169 HydrophobicContact CD1-CG1 4.03Å; Y99-I169 HydrophobicContact CE1-CD1 3.67Å; Y99-I169 HydrophobicContact CE1-CG1 3.69Å; Y99-H215 PolarHBondContact OH-CE1 2.78Å | ||
| 100 | D | 83.5 | Confident | 76.1 | Confident | 0 Ų | 0 | 65.7 Ų | 65.7 | 0% | 0 | 34% | 0.342 | C | S | . | . | trans | -86.6 | 143.3 | -169.9 | -51.3 | -23.5 | 0 | 0 | 0 | 109.4 | Y72 V75 Q83 K98 P104 S168 | Y72-D100 WeakPolarHBondContact O-CA 3.16Å; V75-D100 WeakPolarHBondContact CG1-OD2 3.5Å; V75-D100 HydrophobicContact CG2-CB 3.77Å; V75-D100 VanDerWaalsContact CG2-OD2 3.3Å; V75-D100 WeakPolarHBondContact CG2-OD2 3.26Å; Q83-D100 PolarHBondContact NE2-OD2 3.46Å; Q83-D100 PolarHBondContact OE1-OD2 3.32Å; K98-D100 WeakPolarHBondContact CB-OD1 3.38Å; K98-D100 WeakPolarHBondContact CD-OD1 3.38Å; K98-D100 WeakPolarHBondContact CG-OD1 3.23Å; K98-D100 PolarHBondContact O-N 3.1Å; D100-P104 VanDerWaalsContact O-CD 3.27Å; D100-P104 WeakPolarHBondContact O-CD 3.32Å; D100-P104 VanDerWaalsContact O-CG 3.3Å; D100-P104 WeakPolarHBondContact O-CG 3.49Å; D100-S168 VanDerWaalsContact O-CB 3.28Å; D100-S168 WeakPolarHBondContact O-CB 3.42Å; D100-S168 PolarHBondContact O-OG 2.91Å | ||
| 101 | L | 85 | Confident | 77.3 | Confident | 24 Ų | 24 | 65.1 Ų | 65.1 | 13% | 0.126 | 34% | 0.338 | C | S | . | . | S | Bend | trans | -96.9 | -18.2 | 176.9 | -159.8 | 63.3 | 0 | 0 | 0 | 112.1 | L69 Y72 F73 L105 W143 | L69-L101 HydrophobicContact CD2-CD2 4.45Å; Y72-L101 PolarHBondContact O-N 3.47Å; F73-L101 HydrophobicContact CE2-CB 4.29Å; F73-L101 HydrophobicContact CE2-CD2 4.17Å; F73-L101 HydrophobicContact CZ-CB 4.14Å; F73-L101 HydrophobicContact CZ-CD2 4.16Å; F73-L101 HydrophobicContact CZ-CG 4.26Å; L101-L105 VanDerWaalsContact O-CB 3.3Å; L101-L105 WeakPolarHBondContact O-CB 3.5Å; L101-L105 PolarHBondContact O-N 2.8Å; L101-L105 VanDerWaalsContact O-N 3.08Å; L101-W143 HydrophobicContact CD1-CH2 4.15Å; L101-W143 HydrophobicContact CD1-CZ2 3.77Å |
| 102 | Y | 86.9 | Confident | 78.6 | Confident | 77 Ų | 77 | 59.2 Ų | 59.2 | 30% | 0.302 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.3 | -52.8 | -179.5 | -178.4 | -114.8 | 0 | 0 | 0 | 113 | F73 V80 L105 M106 | F73-Y102 AromaticContact CD1-CD2 3.88Å; F73-Y102 HydrophobicContact CD1-CD2 3.88Å; F73-Y102 HydrophobicContact CD1-CG 4.21Å; F73-Y102 HydrophobicContact CE1-CD2 4.25Å; V80-Y102 HydrophobicContact CG2-CD1 3.87Å; V80-Y102 HydrophobicContact CG2-CE1 4.32Å; Y102-L105 PolarHBondContact O-N 3.3Å; Y102-M106 HydrophobicContact CD2-CG 4.35Å; Y102-M106 HydrophobicContact CE1-CG 4.24Å; Y102-M106 HydrophobicContact CE2-CG 3.97Å; Y102-M106 HydrophobicContact CE2-SD 4.19Å; Y102-M106 WeakPolarHBondContact O-CG 3.21Å; Y102-M106 PolarHBondContact O-N 3.42Å |
| 103 | G | 87.9 | Confident | 80 | Confident | 1 Ų | 1 | 57.3 Ų | 57.3 | 1% | 0.01 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -57.4 | -53.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L105 M106 L107 | G103-L105 VanDerWaalsContact C-N 3.31Å; G103-L105 PolarHBondContact O-N 3.36Å; G103-M106 WeakPolarHBondContact O-CB 3.36Å; G103-M106 PolarHBondContact O-N 2.82Å; G103-L107 WeakPolarHBondContact O-CG 3.27Å; G103-L107 PolarHBondContact O-N 3.1Å |
| 104 | P | 91.2 | Very high | 81.8 | Confident | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -48.4 | -47.2 | 172.6 | -36.2 | 41.9 | 0 | 0 | 0 | 114.3 | D100 L107 V108 S168 Y172 | D100-P104 VanDerWaalsContact O-CD 3.27Å; D100-P104 WeakPolarHBondContact O-CD 3.32Å; D100-P104 VanDerWaalsContact O-CG 3.3Å; D100-P104 WeakPolarHBondContact O-CG 3.49Å; P104-L107 WeakPolarHBondContact O-CB 3.42Å; P104-L107 PolarHBondContact O-N 3.25Å; P104-V108 WeakPolarHBondContact O-CG2 3.47Å; P104-V108 PolarHBondContact O-N 3.01Å; P104-S168 WeakPolarHBondContact CG-O 3.44Å; P104-Y172 HydrophobicContact CG-CD2 3.77Å; P104-Y172 HydrophobicContact CG-CE2 3.79Å; P104-Y172 HydrophobicContact CG-CG 4.3Å |
| 105 | L | 90.9 | Very high | 83.9 | Confident | 53 Ų | 53 | 45 Ų | 45 | 28% | 0.277 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -66 | -42.7 | -179.7 | 179.8 | 142.7 | 0 | 0 | 0 | 111.5 | F73 L101 Y102 G103 L107 V108 F109 | F73-L105 HydrophobicContact CE1-CD1 4.4Å; F73-L105 HydrophobicContact CZ-CD1 4.22Å; L101-L105 VanDerWaalsContact O-CB 3.3Å; L101-L105 WeakPolarHBondContact O-CB 3.5Å; L101-L105 PolarHBondContact O-N 2.8Å; L101-L105 VanDerWaalsContact O-N 3.08Å; Y102-L105 PolarHBondContact O-N 3.3Å; G103-L105 VanDerWaalsContact C-N 3.31Å; G103-L105 PolarHBondContact O-N 3.36Å; L105-L107 VanDerWaalsContact C-N 3.29Å; L105-L107 PolarHBondContact O-N 2.93Å; L105-V108 PolarHBondContact O-N 3.32Å; L105-F109 HydrophobicContact CD1-CE2 4.49Å; L105-F109 HydrophobicContact CD2-CD2 3.76Å; L105-F109 HydrophobicContact CD2-CE2 3.55Å; L105-F109 HydrophobicContact CG-CD2 4.11Å; L105-F109 HydrophobicContact CG-CE2 3.8Å; L105-F109 WeakPolarHBondContact O-CD2 3.46Å; L105-F109 PolarHBondContact O-N 2.84Å; L105-F109 VanDerWaalsContact O-N 3.08Å |
| 106 | M | 92.8 | Very high | 85.9 | Confident | 85 Ų | 85 | 42 Ų | 42 | 42% | 0.419 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60.4 | -38.4 | 173.4 | -71.3 | -65.1 | -68 | 0 | 0 | 112.3 | Y102 G103 F109 T110 | Y102-M106 HydrophobicContact CD2-CG 4.35Å; Y102-M106 HydrophobicContact CE1-CG 4.24Å; Y102-M106 HydrophobicContact CE2-CG 3.97Å; Y102-M106 HydrophobicContact CE2-SD 4.19Å; Y102-M106 WeakPolarHBondContact O-CG 3.21Å; Y102-M106 PolarHBondContact O-N 3.42Å; G103-M106 WeakPolarHBondContact O-CB 3.36Å; G103-M106 PolarHBondContact O-N 2.82Å; M106-F109 PolarHBondContact O-N 3.4Å; M106-T110 WeakPolarHBondContact O-CB 3.39Å; M106-T110 PolarHBondContact O-N 2.89Å; M106-T110 PolarHBondContact O-OG1 3.19Å |
| 107 | L | 93.7 | Very high | 87.6 | Confident | 10 Ų | 10 | 41.8 Ų | 41.8 | 5% | 0.052 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.8 | -41.5 | 175.9 | -69.4 | 173.4 | 0 | 0 | 0 | 112.3 | L84 G103 P104 L105 F109 T110 L111 G171 Y172 L174 F175 | L84-L107 HydrophobicContact CD2-CD1 3.69Å; L84-L107 HydrophobicContact CD2-CD2 3.91Å; L84-L107 HydrophobicContact CD2-CG 4.1Å; G103-L107 WeakPolarHBondContact O-CG 3.27Å; G103-L107 PolarHBondContact O-N 3.1Å; P104-L107 WeakPolarHBondContact O-CB 3.42Å; P104-L107 PolarHBondContact O-N 3.25Å; L105-L107 VanDerWaalsContact C-N 3.29Å; L105-L107 PolarHBondContact O-N 2.93Å; L107-F109 VanDerWaalsContact C-N 3.33Å; L107-F109 PolarHBondContact O-N 3.48Å; L107-T110 PolarHBondContact O-N 3.48Å; L107-L111 WeakPolarHBondContact O-CB 3.32Å; L107-L111 PolarHBondContact O-N 3.29Å; L107-G171 WeakPolarHBondContact CD1-O 3.49Å; L107-Y172 HydrophobicContact CD1-CD1 4.28Å; L107-L174 HydrophobicContact CB-CB 4.41Å; L107-F175 HydrophobicContact CD1-CB 3.78Å; L107-F175 HydrophobicContact CD2-CB 3.89Å; L107-F175 HydrophobicContact CD2-CD2 3.59Å; L107-F175 HydrophobicContact CD2-CG 4.17Å; L107-F175 HydrophobicContact CG-CB 4.49Å |
| 108 | V | 95.4 | Very high | 89 | Confident | 6 Ų | 6 | 40.3 Ų | 40.3 | 4% | 0.036 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.6 | -47.2 | 174.7 | 171.2 | 0 | 0 | 0 | 0 | 110.1 | P104 L105 T110 L111 V112 I140 W143 L174 | P104-V108 WeakPolarHBondContact O-CG2 3.47Å; P104-V108 PolarHBondContact O-N 3.01Å; L105-V108 PolarHBondContact O-N 3.32Å; V108-T110 PolarHBondContact O-N 3.23Å; V108-L111 PolarHBondContact O-N 2.93Å; V108-V112 WeakPolarHBondContact O-CG2 3.46Å; V108-V112 PolarHBondContact O-N 3.45Å; V108-I140 HydrophobicContact CG1-CG1 3.83Å; V108-W143 HydrophobicContact CG2-CB 4.27Å; V108-W143 HydrophobicContact CG2-CD2 4.08Å; V108-W143 HydrophobicContact CG2-CE3 4.19Å; V108-W143 HydrophobicContact CG2-CG 4.12Å; V108-L174 HydrophobicContact CG2-CD1 3.58Å |
| 109 | F | 94.8 | Very high | 89.9 | Confident | 102 Ų | 102 | 35.5 Ų | 35.5 | 45% | 0.447 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -64.8 | -38.7 | 176.7 | -77.2 | -66 | 0 | 0 | 0 | 113.1 | L105 M106 L107 L111 V112 A113 F136 | L105-F109 HydrophobicContact CD1-CE2 4.49Å; L105-F109 HydrophobicContact CD2-CD2 3.76Å; L105-F109 HydrophobicContact CD2-CE2 3.55Å; L105-F109 HydrophobicContact CG-CD2 4.11Å; L105-F109 HydrophobicContact CG-CE2 3.8Å; L105-F109 WeakPolarHBondContact O-CD2 3.46Å; L105-F109 PolarHBondContact O-N 2.84Å; L105-F109 VanDerWaalsContact O-N 3.08Å; M106-F109 PolarHBondContact O-N 3.4Å; L107-F109 VanDerWaalsContact C-N 3.33Å; L107-F109 PolarHBondContact O-N 3.48Å; F109-L111 VanDerWaalsContact C-N 3.32Å; F109-L111 PolarHBondContact O-N 3.4Å; F109-V112 WeakPolarHBondContact O-CB 3.45Å; F109-V112 PolarHBondContact O-N 2.94Å; F109-A113 PolarHBondContact O-N 2.96Å; F109-F136 AromaticContact CD1-CE1 3.84Å; F109-F136 HydrophobicContact CD1-CE1 3.84Å; F109-F136 HydrophobicContact CD1-CZ 4.31Å; F109-F136 AromaticContact CE1-CE1 3.62Å; F109-F136 HydrophobicContact CE1-CE1 3.62Å; F109-F136 HydrophobicContact CE1-CZ 4.14Å |
| 110 | T | 94.8 | Very high | 90.4 | Very high | 63 Ų | 63 | 39.5 Ų | 39.5 | 39% | 0.387 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -64 | -40.6 | 175.6 | -59.2 | 0 | 0 | 0 | 0 | 110.9 | M106 L107 V108 A113 L114 | M106-T110 WeakPolarHBondContact O-CB 3.39Å; M106-T110 PolarHBondContact O-N 2.89Å; M106-T110 PolarHBondContact O-OG1 3.19Å; L107-T110 PolarHBondContact O-N 3.48Å; V108-T110 PolarHBondContact O-N 3.23Å; T110-A113 PolarHBondContact O-N 2.94Å; T110-L114 HydrophobicContact CG2-CD1 4.19Å; T110-L114 HydrophobicContact CG2-CG 4.5Å; T110-L114 WeakPolarHBondContact O-CB 3.38Å; T110-L114 WeakPolarHBondContact O-CG 2.98Å; T110-L114 PolarHBondContact O-N 2.92Å |
| 111 | L | 94.3 | Very high | 90.3 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.9 | -41.1 | 175.9 | -169.7 | 64.2 | 0 | 0 | 0 | 111.3 | L107 V108 F109 A113 L114 L115 T139 L174 H177 L181 F240 L244 | L107-L111 WeakPolarHBondContact O-CB 3.32Å; L107-L111 PolarHBondContact O-N 3.29Å; V108-L111 PolarHBondContact O-N 2.93Å; F109-L111 VanDerWaalsContact C-N 3.32Å; F109-L111 PolarHBondContact O-N 3.4Å; L111-A113 VanDerWaalsContact C-N 3.33Å; L111-A113 PolarHBondContact O-N 3.01Å; L111-L114 PolarHBondContact O-N 2.86Å; L111-L115 HydrophobicContact CG-CD1 4.27Å; L111-L115 WeakPolarHBondContact O-CB 3.42Å; L111-L115 VanDerWaalsContact O-CG 3.25Å; L111-L115 WeakPolarHBondContact O-CG 3.31Å; L111-L115 PolarHBondContact O-N 3.28Å; L111-T139 HydrophobicContact CB-CG2 4.09Å; L111-T139 HydrophobicContact CD2-CG2 3.75Å; L111-T139 HydrophobicContact CG-CG2 3.73Å; L111-L174 HydrophobicContact CD2-CD2 4.03Å; L111-H177 HydrophobicContact CD1-CB 4.37Å; L111-L181 HydrophobicContact CD1-CD1 3.56Å; L111-F240 HydrophobicContact CD2-CE1 3.91Å; L111-F240 HydrophobicContact CD2-CZ 4.15Å; L111-L244 HydrophobicContact CD1-CD1 4.15Å; L111-L244 HydrophobicContact CD2-CD1 4.32Å; L111-L244 HydrophobicContact CG-CD1 4.5Å |
| 112 | V | 94.8 | Very high | 89.8 | Confident | 4 Ų | 4 | 43.1 Ų | 43.1 | 2% | 0.024 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -57.8 | -47.2 | 171.5 | 172 | 0 | 0 | 0 | 0 | 110.6 | V108 F109 L115 L116 A135 F136 T139 | V108-V112 WeakPolarHBondContact O-CG2 3.46Å; V108-V112 PolarHBondContact O-N 3.45Å; F109-V112 WeakPolarHBondContact O-CB 3.45Å; F109-V112 PolarHBondContact O-N 2.94Å; V112-L115 PolarHBondContact O-N 3.32Å; V112-L116 HydrophobicContact CG1-CD1 3.87Å; V112-L116 HydrophobicContact CG1-CG 4.25Å; V112-L116 WeakPolarHBondContact O-CB 3.37Å; V112-L116 VanDerWaalsContact O-CG 3.23Å; V112-L116 WeakPolarHBondContact O-CG 3.22Å; V112-L116 PolarHBondContact O-N 3.48Å; V112-A135 HydrophobicContact CG1-CB 4.08Å; V112-F136 HydrophobicContact CB-CE1 4.38Å; V112-F136 HydrophobicContact CG1-CD1 4.1Å; V112-F136 HydrophobicContact CG1-CD2 4.17Å; V112-F136 HydrophobicContact CG1-CE1 3.93Å; V112-F136 HydrophobicContact CG1-CE2 4.01Å; V112-F136 HydrophobicContact CG1-CG 4.21Å; V112-F136 HydrophobicContact CG1-CZ 3.88Å; V112-F136 HydrophobicContact CG2-CD1 3.78Å; V112-F136 HydrophobicContact CG2-CE1 3.99Å; V112-F136 HydrophobicContact CG2-CG 4.36Å; V112-T139 HydrophobicContact CG2-CG2 3.82Å; V112-T139 WeakPolarHBondContact CG2-OG1 3.23Å |
| 113 | A | 94.1 | Very high | 89 | Confident | 58 Ų | 58 | 45.9 Ų | 45.9 | 48% | 0.479 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -63.4 | -43.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F109 T110 L111 L116 H117 | F109-A113 PolarHBondContact O-N 2.96Å; T110-A113 PolarHBondContact O-N 2.94Å; L111-A113 VanDerWaalsContact C-N 3.33Å; L111-A113 PolarHBondContact O-N 3.01Å; A113-L116 PolarHBondContact O-N 3.45Å; A113-H117 WeakPolarHBondContact O-CB 3.29Å; A113-H117 PolarHBondContact O-N 2.92Å |
| 114 | L | 92.3 | Very high | 88 | Confident | 39 Ų | 39 | 48.2 Ų | 48.2 | 20% | 0.204 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.5 | -40.9 | 175.5 | -74.4 | 171.9 | 0 | 0 | 0 | 111.7 | T110 L111 H117 S118 C178 A182 | T110-L114 HydrophobicContact CG2-CD1 4.19Å; T110-L114 HydrophobicContact CG2-CG 4.5Å; T110-L114 WeakPolarHBondContact O-CB 3.38Å; T110-L114 WeakPolarHBondContact O-CG 2.98Å; T110-L114 PolarHBondContact O-N 2.92Å; L111-L114 PolarHBondContact O-N 2.86Å; L114-H117 PolarHBondContact O-N 3.24Å; L114-S118 WeakPolarHBondContact O-CB 2.93Å; L114-S118 PolarHBondContact O-N 3.39Å; L114-C178 HydrophobicContact CD1-CB 3.82Å; L114-C178 WeakPolarHBondContact CD1-O 3.45Å; L114-A182 HydrophobicContact CD1-CB 4.25Å; L114-A182 HydrophobicContact CD2-CB 3.99Å |
| 115 | L | 91.2 | Very high | 86.8 | Confident | 1 Ų | 1 | 54.2 Ų | 54.2 | 1% | 0.005 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67 | -42.7 | 176.1 | -75 | 171.9 | 0 | 0 | 0 | 112.3 | L111 V112 H117 S118 M119 A135 T139 L181 L244 F248 | L111-L115 HydrophobicContact CG-CD1 4.27Å; L111-L115 WeakPolarHBondContact O-CB 3.42Å; L111-L115 VanDerWaalsContact O-CG 3.25Å; L111-L115 WeakPolarHBondContact O-CG 3.31Å; L111-L115 PolarHBondContact O-N 3.28Å; V112-L115 PolarHBondContact O-N 3.32Å; L115-H117 VanDerWaalsContact C-N 3.27Å; L115-H117 PolarHBondContact O-N 3Å; L115-S118 PolarHBondContact O-N 3.3Å; L115-M119 HydrophobicContact CB-CE 3.93Å; L115-M119 WeakPolarHBondContact O-CB 3.21Å; L115-M119 VanDerWaalsContact O-CG 3.27Å; L115-M119 WeakPolarHBondContact O-CG 3.18Å; L115-M119 PolarHBondContact O-N 3.38Å; L115-A135 HydrophobicContact CB-CB 4.34Å; L115-T139 HydrophobicContact CD1-CG2 3.41Å; L115-T139 VanDerWaalsContact CD1-CG2 3.41Å; L115-L181 HydrophobicContact CD2-CD1 3.99Å; L115-L181 HydrophobicContact CG-CD1 4.36Å; L115-L244 HydrophobicContact CD1-CD1 4.31Å; L115-L244 HydrophobicContact CD1-CD2 3.77Å; L115-L244 HydrophobicContact CD2-CB 4.21Å; L115-L244 HydrophobicContact CD2-CD1 4.21Å; L115-L244 HydrophobicContact CD2-CD2 3.81Å; L115-L244 HydrophobicContact CD2-CG 4.29Å; L115-L244 HydrophobicContact CG-CD2 4.42Å; L115-F248 HydrophobicContact CD2-CD2 3.88Å; L115-F248 HydrophobicContact CD2-CE2 4.45Å; L115-F248 HydrophobicContact CD2-CG 4.45Å |
| 116 | L | 90.3 | Very high | 85.5 | Confident | 43 Ų | 43 | 53.4 Ų | 53.4 | 23% | 0.225 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58 | -42.8 | 172.8 | -76.8 | 172.7 | 0 | 0 | 0 | 111.2 | V112 A113 K120 L131 I132 A135 | V112-L116 HydrophobicContact CG1-CD1 3.87Å; V112-L116 HydrophobicContact CG1-CG 4.25Å; V112-L116 WeakPolarHBondContact O-CB 3.37Å; V112-L116 VanDerWaalsContact O-CG 3.23Å; V112-L116 WeakPolarHBondContact O-CG 3.22Å; V112-L116 PolarHBondContact O-N 3.48Å; A113-L116 PolarHBondContact O-N 3.45Å; L116-K120 VanDerWaalsContact O-CB 3.29Å; L116-K120 WeakPolarHBondContact O-CB 3.42Å; L116-K120 PolarHBondContact O-N 2.73Å; L116-L131 HydrophobicContact CD2-CD2 3.23Å; L116-L131 HydrophobicContact CG-CD2 4.44Å; L116-I132 HydrophobicContact CD1-CD1 3.88Å; L116-I132 HydrophobicContact CD1-CG1 4.06Å; L116-I132 HydrophobicContact CD2-CB 4.01Å; L116-I132 HydrophobicContact CD2-CD1 4.41Å; L116-I132 HydrophobicContact CD2-CG1 4.07Å; L116-A135 HydrophobicContact CD2-CB 4.04Å; L116-A135 HydrophobicContact CG-CB 4.02Å |
| 117 | H | 87.9 | Confident | 84 | Confident | 98 Ų | 98 | 58 Ų | 58 | 45% | 0.454 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.7 | -48.5 | 177.5 | -174.2 | 66.1 | 0 | 0 | 0 | 111.7 | A113 L114 L115 M119 K120 N121 | A113-H117 WeakPolarHBondContact O-CB 3.29Å; A113-H117 PolarHBondContact O-N 2.92Å; L114-H117 PolarHBondContact O-N 3.24Å; L115-H117 VanDerWaalsContact C-N 3.27Å; L115-H117 PolarHBondContact O-N 3Å; H117-M119 PolarHBondContact O-N 3.46Å; H117-K120 PolarHBondContact O-N 3.46Å; H117-N121 PolarHBondContact CD2-ND2 3.21Å; H117-N121 PolarHBondContact CE1-ND2 3.37Å; H117-N121 PolarHBondContact NE2-ND2 3.24Å; H117-N121 VanDerWaalsContact O-CG 3.29Å; H117-N121 PolarHBondContact O-N 3.46Å |
| 118 | S | 86.2 | Confident | 82.4 | Confident | 5 Ų | 5 | 65 Ų | 65 | 4% | 0.035 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.6 | -47.4 | 176.4 | 179.4 | 0 | 0 | 0 | 0 | 112.1 | L114 L115 K120 N121 S122 E185 | L114-S118 WeakPolarHBondContact O-CB 2.93Å; L114-S118 PolarHBondContact O-N 3.39Å; L115-S118 PolarHBondContact O-N 3.3Å; S118-K120 VanDerWaalsContact C-N 3.31Å; S118-K120 PolarHBondContact O-N 2.93Å; S118-N121 PolarHBondContact O-N 2.8Å; S118-S122 WeakPolarHBondContact O-CB 3.47Å; S118-S122 PolarHBondContact O-N 3.27Å; S118-S122 PolarHBondContact O-OG 3.29Å; S118-E185 WeakPolarHBondContact CB-OE1 3.45Å; S118-E185 PolarHBondContact OG-OE1 3.34Å |
| 119 | M | 85 | Confident | 81.1 | Confident | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.9 | -36.4 | 176.6 | -73.8 | -174.1 | -130 | 0 | 0 | 112.6 | L115 H117 S122 N123 Y124 L131 A135 F248 | L115-M119 HydrophobicContact CB-CE 3.93Å; L115-M119 WeakPolarHBondContact O-CB 3.21Å; L115-M119 VanDerWaalsContact O-CG 3.27Å; L115-M119 WeakPolarHBondContact O-CG 3.18Å; L115-M119 PolarHBondContact O-N 3.38Å; H117-M119 PolarHBondContact O-N 3.46Å; M119-S122 VanDerWaalsContact CA-OG 3.22Å; M119-S122 WeakPolarHBondContact CA-OG 3.3Å; M119-S122 PolarHBondContact O-OG 3.47Å; M119-S122 VanDerWaalsContact O-OG 3.09Å; M119-N123 PolarHBondContact O-N 3.05Å; M119-Y124 HydrophobicContact CB-CG 4.48Å; M119-Y124 HydrophobicContact CG-CD1 4.49Å; M119-Y124 HydrophobicContact CG-CG 4.27Å; M119-Y124 WeakPolarHBondContact O-CB 3.49Å; M119-Y124 PolarHBondContact O-N 3.22Å; M119-Y124 HydrophobicContact SD-CD1 4.27Å; M119-L131 HydrophobicContact CB-CD1 3.94Å; M119-L131 HydrophobicContact CB-CD2 3.77Å; M119-L131 HydrophobicContact CB-CG 4Å; M119-L131 HydrophobicContact CG-CD2 4.3Å; M119-L131 HydrophobicContact SD-CD2 3.57Å; M119-L131 VanDerWaalsContact SD-CD2 3.57Å; M119-L131 HydrophobicContact SD-CG 3.76Å; M119-A135 HydrophobicContact CE-CB 3.87Å; M119-F248 HydrophobicContact CE-CD1 3.23Å; M119-F248 HydrophobicContact CE-CD2 4.15Å; M119-F248 HydrophobicContact CE-CE1 3.21Å; M119-F248 HydrophobicContact CE-CE2 4.15Å; M119-F248 HydrophobicContact CE-CG 3.71Å; M119-F248 HydrophobicContact CE-CZ 3.7Å; M119-F248 HydrophobicContact CG-CB 4Å; M119-F248 HydrophobicContact CG-CD1 3.61Å; M119-F248 HydrophobicContact CG-CE1 4.42Å; M119-F248 HydrophobicContact CG-CG 4.07Å; M119-F248 HydrophobicContact SD-CD1 3.41Å; M119-F248 WeakPolarHBondContact SD-CD1 3.38Å; M119-F248 HydrophobicContact SD-CE1 3.61Å; M119-F248 HydrophobicContact SD-CG 4.28Å |
| 120 | K | 84.6 | Confident | 80.7 | Confident | 160 Ų | 160 | 72.5 Ų | 72.5 | 70% | 0.696 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -69.3 | -43.6 | 176.8 | -174.5 | 179.1 | 179 | -176.1 | 0 | 111.5 | L116 H117 S118 S122 N123 | L116-K120 VanDerWaalsContact O-CB 3.29Å; L116-K120 WeakPolarHBondContact O-CB 3.42Å; L116-K120 PolarHBondContact O-N 2.73Å; H117-K120 PolarHBondContact O-N 3.46Å; S118-K120 VanDerWaalsContact C-N 3.31Å; S118-K120 PolarHBondContact O-N 2.93Å; K120-S122 VanDerWaalsContact C-N 3.31Å; K120-N123 PolarHBondContact O-N 3.34Å |
| 121 | N | 81.7 | Confident | 80.2 | Confident | 84 Ų | 84 | 71.8 Ų | 71.8 | 45% | 0.449 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -67.5 | -33.2 | 178.5 | -67.8 | -12.3 | 0 | 0 | 0 | 112.1 | H117 S118 N123 | H117-N121 PolarHBondContact CD2-ND2 3.21Å; H117-N121 PolarHBondContact CE1-ND2 3.37Å; H117-N121 PolarHBondContact NE2-ND2 3.24Å; H117-N121 VanDerWaalsContact O-CG 3.29Å; H117-N121 PolarHBondContact O-N 3.46Å; S118-N121 PolarHBondContact O-N 2.8Å; N121-N123 VanDerWaalsContact C-N 3.3Å; N121-N123 PolarHBondContact O-N 3Å |
| 122 | S | 75.4 | Confident | 80 | Confident | 17 Ų | 17 | 75.7 Ų | 75.7 | 12% | 0.119 | 39% | 0.387 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.3 | 1.4 | 178.7 | 52.9 | 0 | 0 | 0 | 0 | 114.7 | S118 M119 K120 Y124 F248 V252 | S118-S122 WeakPolarHBondContact O-CB 3.47Å; S118-S122 PolarHBondContact O-N 3.27Å; S118-S122 PolarHBondContact O-OG 3.29Å; M119-S122 VanDerWaalsContact CA-OG 3.22Å; M119-S122 WeakPolarHBondContact CA-OG 3.3Å; M119-S122 PolarHBondContact O-OG 3.47Å; M119-S122 VanDerWaalsContact O-OG 3.09Å; K120-S122 VanDerWaalsContact C-N 3.31Å; S122-Y124 PolarHBondContact O-N 3Å; S122-F248 PolarHBondContact OG-O 3.31Å; S122-V252 WeakPolarHBondContact O-CG2 3.46Å |
| 123 | N | 70 | Confident | 79.8 | Confident | 135 Ų | 135 | 77 Ų | 77 | 72% | 0.722 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.8 | 37.3 | -172.9 | -60.2 | -76.3 | 0 | 0 | 0 | 112.8 | M119 K120 N121 V125 | M119-N123 PolarHBondContact O-N 3.05Å; K120-N123 PolarHBondContact O-N 3.34Å; N121-N123 VanDerWaalsContact C-N 3.3Å; N121-N123 PolarHBondContact O-N 3Å; N123-V125 PolarHBondContact O-N 2.88Å |
| 124 | Y | 65.8 | Low | 79.6 | Confident | 50 Ų | 50 | 75 Ų | 75 | 20% | 0.196 | 38% | 0.383 | C | S | . | . | trans | -61 | 110 | -178.6 | -175.3 | -86.9 | 0 | 0 | 0 | 111 | M119 S122 V126 G247 F248 V251 | M119-Y124 HydrophobicContact CB-CG 4.48Å; M119-Y124 HydrophobicContact CG-CD1 4.49Å; M119-Y124 HydrophobicContact CG-CG 4.27Å; M119-Y124 WeakPolarHBondContact O-CB 3.49Å; M119-Y124 PolarHBondContact O-N 3.22Å; M119-Y124 HydrophobicContact SD-CD1 4.27Å; S122-Y124 PolarHBondContact O-N 3Å; Y124-V126 HydrophobicContact CD1-CB 4.47Å; Y124-V126 HydrophobicContact CD1-CG2 3.68Å; Y124-V126 HydrophobicContact CE1-CB 3.94Å; Y124-V126 HydrophobicContact CE1-CG1 3.94Å; Y124-V126 HydrophobicContact CE1-CG2 3.45Å; Y124-V126 VanDerWaalsContact CE1-CG2 3.45Å; Y124-V126 PolarHBondContact O-N 3.28Å; Y124-G247 WeakPolarHBondContact CE2-O 3.45Å; Y124-F248 HydrophobicContact CD2-CD1 4.44Å; Y124-F248 HydrophobicContact CE2-CD1 4.09Å; Y124-V251 HydrophobicContact CD2-CB 3.57Å; Y124-V251 HydrophobicContact CD2-CG1 3.61Å; Y124-V251 HydrophobicContact CD2-CG2 3.74Å; Y124-V251 HydrophobicContact CE2-CB 3.82Å; Y124-V251 HydrophobicContact CE2-CG1 3.99Å; Y124-V251 HydrophobicContact CE2-CG2 3.41Å; Y124-V251 VanDerWaalsContact CE2-CG2 3.41Å; Y124-V251 HydrophobicContact CG-CG1 4.33Å | ||
| 125 | V | 66.4 | Low | 79.5 | Confident | 126 Ų | 126 | 73.1 Ų | 73.1 | 76% | 0.764 | 37% | 0.374 | S | S | * | . | trans | -91.8 | 99.9 | 175.5 | -175.9 | 0 | 0 | 0 | 0 | 108.8 | N123 K127 | N123-V125 PolarHBondContact O-N 2.88Å; V125-K127 PolarHBondContact O-N 2.79Å | ||
| 126 | V | 63.5 | Low | 79.7 | Confident | 35 Ų | 35 | 76.3 Ų | 76.3 | 21% | 0.212 | 39% | 0.388 | C | S | . | . | trans | -73.1 | 115 | 167.9 | -142.8 | 0 | 0 | 0 | 0 | 108 | Y124 D128 R129 L131 | Y124-V126 HydrophobicContact CD1-CB 4.47Å; Y124-V126 HydrophobicContact CD1-CG2 3.68Å; Y124-V126 HydrophobicContact CE1-CB 3.94Å; Y124-V126 HydrophobicContact CE1-CG1 3.94Å; Y124-V126 HydrophobicContact CE1-CG2 3.45Å; Y124-V126 VanDerWaalsContact CE1-CG2 3.45Å; Y124-V126 PolarHBondContact O-N 3.28Å; V126-D128 PolarHBondContact O-N 3.29Å; V126-D128 VanDerWaalsContact O-N 3.08Å; V126-R129 HydrophobicContact CB-CB 4.46Å; V126-R129 VanDerWaalsContact CB-O 3.31Å; V126-R129 WeakPolarHBondContact CB-O 3.5Å; V126-R129 HydrophobicContact CG1-CB 3.86Å; V126-R129 WeakPolarHBondContact CG2-O 3.39Å; V126-L131 HydrophobicContact CG2-CB 4.15Å | ||
| 127 | K | 62.5 | Low | 79.8 | Confident | 183 Ų | 183 | 76.9 Ų | 76.9 | 80% | 0.796 | 40% | 0.399 | S | S | * | . | S | Bend | trans | -66.2 | 106.8 | 165.5 | -155.6 | 170 | 179.6 | 176.5 | 0 | 106.9 | V125 | V125-K127 PolarHBondContact O-N 2.79Š|
| 128 | D | 59.6 | Low | 80 | Confident | 157 Ų | 157 | 73.2 Ų | 73.2 | 84% | 0.84 | 38% | 0.383 | S | S | * | . | S | Bend | trans | 78 | 15.5 | 169.1 | -44.9 | -42.8 | 0 | 0 | 0 | 119.1 | V126 | V126-D128 PolarHBondContact O-N 3.29Å; V126-D128 VanDerWaalsContact O-N 3.08Å |
| 129 | R | 68.3 | Low | 80.4 | Confident | 163 Ų | 163 | 73 Ų | 73 | 62% | 0.615 | 38% | 0.381 | S | S | * | . | S | Bend | trans | -139.3 | 145.3 | 175.6 | -169.7 | -177.7 | -68.2 | -136.2 | 5.3 | 113.7 | V126 L131 T134 | V126-R129 HydrophobicContact CB-CB 4.46Å; V126-R129 VanDerWaalsContact CB-O 3.31Å; V126-R129 WeakPolarHBondContact CB-O 3.5Å; V126-R129 HydrophobicContact CG1-CB 3.86Å; V126-R129 WeakPolarHBondContact CG2-O 3.39Å; R129-L131 PolarHBondContact O-N 2.88Å; R129-T134 WeakPolarHBondContact CD-OG1 3.31Å |
| 130 | T | 85.9 | Confident | 80.9 | Confident | 102 Ų | 102 | 76.5 Ų | 76.5 | 63% | 0.626 | 40% | 0.399 | S | S | * | . | trans | -65.3 | 122.5 | 172.8 | -38 | 0 | 0 | 0 | 0 | 110.4 | I132 G133 T134 | T130-I132 HydrophobicContact CG2-CG2 3.61Å; T130-I132 PolarHBondContact O-N 3.43Å; T130-I132 VanDerWaalsContact O-N 3.16Å; T130-G133 PolarHBondContact O-N 2.84Å; T130-T134 PolarHBondContact O-N 3.37Å | ||
| 131 | L | 84.8 | Confident | 81.4 | Confident | 47 Ų | 47 | 70.5 Ų | 70.5 | 25% | 0.246 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -50 | -41.1 | 179.8 | -168.2 | 168.6 | 0 | 0 | 0 | 112 | L116 M119 V126 R129 G133 T134 A135 | L116-L131 HydrophobicContact CD2-CD2 3.23Å; L116-L131 HydrophobicContact CG-CD2 4.44Å; M119-L131 HydrophobicContact CB-CD1 3.94Å; M119-L131 HydrophobicContact CB-CD2 3.77Å; M119-L131 HydrophobicContact CB-CG 4Å; M119-L131 HydrophobicContact CG-CD2 4.3Å; M119-L131 HydrophobicContact SD-CD2 3.57Å; M119-L131 VanDerWaalsContact SD-CD2 3.57Å; M119-L131 HydrophobicContact SD-CG 3.76Å; V126-L131 HydrophobicContact CG2-CB 4.15Å; R129-L131 PolarHBondContact O-N 2.88Å; L131-G133 PolarHBondContact O-N 3.21Å; L131-T134 PolarHBondContact O-N 2.87Å; L131-A135 PolarHBondContact O-N 2.89Å; L131-A135 VanDerWaalsContact O-N 3.1Å |
| 132 | I | 90 | Very high | 82 | Confident | 82 Ų | 82 | 67.4 Ų | 67.4 | 42% | 0.421 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.3 | -39.3 | 177.1 | -160.6 | 145.4 | 0 | 0 | 0 | 113.6 | L116 T130 T134 A135 F136 | L116-I132 HydrophobicContact CD1-CD1 3.88Å; L116-I132 HydrophobicContact CD1-CG1 4.06Å; L116-I132 HydrophobicContact CD2-CB 4.01Å; L116-I132 HydrophobicContact CD2-CD1 4.41Å; L116-I132 HydrophobicContact CD2-CG1 4.07Å; T130-I132 HydrophobicContact CG2-CG2 3.61Å; T130-I132 PolarHBondContact O-N 3.43Å; T130-I132 VanDerWaalsContact O-N 3.16Å; I132-T134 VanDerWaalsContact C-N 3.32Å; I132-T134 PolarHBondContact O-N 3.44Å; I132-A135 PolarHBondContact O-N 3.33Å; I132-F136 HydrophobicContact CD1-CE2 4.1Å; I132-F136 HydrophobicContact CG1-CD2 3.68Å; I132-F136 HydrophobicContact CG1-CE2 3.56Å; I132-F136 VanDerWaalsContact O-CD2 3.24Å; I132-F136 WeakPolarHBondContact O-CD2 3.39Å; I132-F136 PolarHBondContact O-N 2.83Å |
| 133 | G | 90 | Very high | 82.9 | Confident | 32 Ų | 32 | 69 Ų | 69 | 33% | 0.33 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.1 | -38.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | T130 L131 A137 | T130-G133 PolarHBondContact O-N 2.84Å; L131-G133 PolarHBondContact O-N 3.21Å; G133-A137 WeakPolarHBondContact O-CB 3.46Å; G133-A137 PolarHBondContact O-N 3.27Å |
| 134 | T | 89.6 | Confident | 84.1 | Confident | 16 Ų | 16 | 69.3 Ų | 69.3 | 10% | 0.098 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -65.4 | -45 | 174.9 | -51.4 | 0 | 0 | 0 | 0 | 111.8 | R129 T130 L131 I132 A137 T138 F248 | R129-T134 WeakPolarHBondContact CD-OG1 3.31Å; T130-T134 PolarHBondContact O-N 3.37Å; L131-T134 PolarHBondContact O-N 2.87Å; I132-T134 VanDerWaalsContact C-N 3.32Å; I132-T134 PolarHBondContact O-N 3.44Å; T134-A137 PolarHBondContact O-N 3.15Å; T134-T138 HydrophobicContact CG2-CG2 4.42Å; T134-T138 WeakPolarHBondContact O-CB 2.95Å; T134-T138 WeakPolarHBondContact O-CG2 3.49Å; T134-T138 PolarHBondContact O-N 3.45Å; T134-T138 PolarHBondContact O-OG1 3.31Å; T134-F248 HydrophobicContact CG2-CE1 3.8Å; T134-F248 HydrophobicContact CG2-CZ 3.88Å |
| 135 | A | 91.8 | Very high | 85.6 | Confident | 0 Ų | 0 | 71.4 Ų | 71.4 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | V112 L115 L116 M119 L131 I132 T138 T139 | V112-A135 HydrophobicContact CG1-CB 4.08Å; L115-A135 HydrophobicContact CB-CB 4.34Å; L116-A135 HydrophobicContact CD2-CB 4.04Å; L116-A135 HydrophobicContact CG-CB 4.02Å; M119-A135 HydrophobicContact CE-CB 3.87Å; L131-A135 PolarHBondContact O-N 2.89Å; L131-A135 VanDerWaalsContact O-N 3.1Å; I132-A135 PolarHBondContact O-N 3.33Å; A135-T138 PolarHBondContact O-OG1 3.11Å; A135-T138 VanDerWaalsContact O-OG1 3.1Å; A135-T139 WeakPolarHBondContact O-CG2 3.35Å; A135-T139 PolarHBondContact O-N 3.5Å; A135-T139 PolarHBondContact O-OG1 2.92Å |
| 136 | F | 93.8 | Very high | 86.9 | Confident | 68 Ų | 68 | 65.4 Ų | 65.4 | 30% | 0.298 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -64 | -47.2 | 174.9 | -86.1 | -65 | 0 | 0 | 0 | 112.8 | F109 V112 I132 T138 T139 I140 | F109-F136 AromaticContact CD1-CE1 3.84Å; F109-F136 HydrophobicContact CD1-CE1 3.84Å; F109-F136 HydrophobicContact CD1-CZ 4.31Å; F109-F136 AromaticContact CE1-CE1 3.62Å; F109-F136 HydrophobicContact CE1-CE1 3.62Å; F109-F136 HydrophobicContact CE1-CZ 4.14Å; V112-F136 HydrophobicContact CB-CE1 4.38Å; V112-F136 HydrophobicContact CG1-CD1 4.1Å; V112-F136 HydrophobicContact CG1-CD2 4.17Å; V112-F136 HydrophobicContact CG1-CE1 3.93Å; V112-F136 HydrophobicContact CG1-CE2 4.01Å; V112-F136 HydrophobicContact CG1-CG 4.21Å; V112-F136 HydrophobicContact CG1-CZ 3.88Å; V112-F136 HydrophobicContact CG2-CD1 3.78Å; V112-F136 HydrophobicContact CG2-CE1 3.99Å; V112-F136 HydrophobicContact CG2-CG 4.36Å; I132-F136 HydrophobicContact CD1-CE2 4.1Å; I132-F136 HydrophobicContact CG1-CD2 3.68Å; I132-F136 HydrophobicContact CG1-CE2 3.56Å; I132-F136 VanDerWaalsContact O-CD2 3.24Å; I132-F136 WeakPolarHBondContact O-CD2 3.39Å; I132-F136 PolarHBondContact O-N 2.83Å; F136-T138 VanDerWaalsContact C-N 3.31Å; F136-T138 PolarHBondContact O-N 2.85Å; F136-T139 PolarHBondContact O-OG1 3.39Å; F136-I140 HydrophobicContact CD1-CD1 3.86Å; F136-I140 VanDerWaalsContact O-CB 3.3Å; F136-I140 WeakPolarHBondContact O-CB 3.36Å; F136-I140 WeakPolarHBondContact O-CG1 3.45Å; F136-I140 PolarHBondContact O-N 3.3Å |
| 137 | A | 92.9 | Very high | 88.4 | Confident | 55 Ų | 55 | 64.3 Ų | 64.3 | 46% | 0.455 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63 | -37.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112 | G133 T134 G141 | G133-A137 WeakPolarHBondContact O-CB 3.46Å; G133-A137 PolarHBondContact O-N 3.27Å; T134-A137 PolarHBondContact O-N 3.15Å; A137-G141 WeakPolarHBondContact O-CA 3.5Å; A137-G141 PolarHBondContact O-N 3Å |
| 138 | T | 92.6 | Very high | 89.9 | Confident | 20 Ų | 20 | 59.6 Ų | 59.6 | 12% | 0.123 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -73.7 | -41.9 | -179.5 | 48.9 | 0 | 0 | 0 | 0 | 113 | T134 A135 F136 Y142 Y243 F248 | T134-T138 HydrophobicContact CG2-CG2 4.42Å; T134-T138 WeakPolarHBondContact O-CB 2.95Å; T134-T138 WeakPolarHBondContact O-CG2 3.49Å; T134-T138 PolarHBondContact O-N 3.45Å; T134-T138 PolarHBondContact O-OG1 3.31Å; A135-T138 PolarHBondContact O-OG1 3.11Å; A135-T138 VanDerWaalsContact O-OG1 3.1Å; F136-T138 VanDerWaalsContact C-N 3.31Å; F136-T138 PolarHBondContact O-N 2.85Å; T138-Y142 WeakPolarHBondContact O-CB 3.35Å; T138-Y142 PolarHBondContact O-N 3.46Å; T138-Y243 HydrophobicContact CG2-CE1 3.93Å; T138-F248 HydrophobicContact CG2-CE2 4.27Å; T138-F248 HydrophobicContact CG2-CZ 3.92Å |
| 139 | T | 94.3 | Very high | 91.6 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -74.4 | -51.2 | -179.9 | 56.9 | 0 | 0 | 0 | 0 | 112.6 | L111 V112 L115 A135 F136 G141 Y142 W143 | L111-T139 HydrophobicContact CB-CG2 4.09Å; L111-T139 HydrophobicContact CD2-CG2 3.75Å; L111-T139 HydrophobicContact CG-CG2 3.73Å; V112-T139 HydrophobicContact CG2-CG2 3.82Å; V112-T139 WeakPolarHBondContact CG2-OG1 3.23Å; L115-T139 HydrophobicContact CD1-CG2 3.41Å; L115-T139 VanDerWaalsContact CD1-CG2 3.41Å; A135-T139 WeakPolarHBondContact O-CG2 3.35Å; A135-T139 PolarHBondContact O-N 3.5Å; A135-T139 PolarHBondContact O-OG1 2.92Å; F136-T139 PolarHBondContact O-OG1 3.39Å; T139-G141 VanDerWaalsContact C-N 3.33Å; T139-Y142 PolarHBondContact O-N 3.47Å; T139-W143 WeakPolarHBondContact O-CB 3.32Å; T139-W143 PolarHBondContact O-N 3Å |
| 140 | I | 94.9 | Very high | 92.7 | Very high | 75 Ų | 75 | 46.3 Ų | 46.3 | 39% | 0.385 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66.1 | -42 | 177.8 | -63.6 | 174.4 | 0 | 0 | 0 | 109.3 | V108 F136 W143 F144 | V108-I140 HydrophobicContact CG1-CG1 3.83Å; F136-I140 HydrophobicContact CD1-CD1 3.86Å; F136-I140 VanDerWaalsContact O-CB 3.3Å; F136-I140 WeakPolarHBondContact O-CB 3.36Å; F136-I140 WeakPolarHBondContact O-CG1 3.45Å; F136-I140 PolarHBondContact O-N 3.3Å; I140-W143 PolarHBondContact O-N 2.7Å; I140-F144 VanDerWaalsContact O-CB 3.31Å; I140-F144 WeakPolarHBondContact O-CB 3.39Å; I140-F144 PolarHBondContact O-N 3.14Å |
| 141 | G | 95.4 | Very high | 93 | Very high | 34 Ų | 34 | 43.1 Ų | 43.1 | 35% | 0.351 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60.3 | -46.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | A137 T139 L145 | A137-G141 WeakPolarHBondContact O-CA 3.5Å; A137-G141 PolarHBondContact O-N 3Å; T139-G141 VanDerWaalsContact C-N 3.33Å; G141-L145 WeakPolarHBondContact O-CB 3.35Å; G141-L145 PolarHBondContact O-N 3Å |
| 142 | Y | 94.8 | Very high | 93.3 | Very high | 19 Ų | 19 | 44.1 Ų | 44.1 | 8% | 0.075 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.2 | -47.9 | 174.4 | 170.9 | -101.2 | 0 | 0 | 0 | 112.1 | T138 T139 F144 L145 A146 L174 L236 N237 F240 | T138-Y142 WeakPolarHBondContact O-CB 3.35Å; T138-Y142 PolarHBondContact O-N 3.46Å; T139-Y142 PolarHBondContact O-N 3.47Å; Y142-F144 VanDerWaalsContact C-N 3.3Å; Y142-F144 PolarHBondContact O-N 2.71Å; Y142-L145 PolarHBondContact O-N 2.89Å; Y142-A146 HydrophobicContact CD2-CB 4.42Å; Y142-A146 HydrophobicContact CE1-CB 4.42Å; Y142-A146 HydrophobicContact CE2-CB 4.01Å; Y142-A146 WeakPolarHBondContact O-CB 3.49Å; Y142-A146 PolarHBondContact O-N 3.49Å; Y142-L174 HydrophobicContact CD1-CD2 3.76Å; Y142-L174 HydrophobicContact CE1-CD2 3.53Å; Y142-L236 HydrophobicContact CE2-CB 4.37Å; Y142-L236 VanDerWaalsContact CE2-O 3.29Å; Y142-L236 WeakPolarHBondContact CE2-O 3.13Å; Y142-L236 PolarHBondContact OH-O 3.26Å; Y142-N237 WeakPolarHBondContact OH-CA 3.31Å; Y142-N237 PolarHBondContact OH-OD1 3.44Å; Y142-F240 AromaticContact CD1-CD1 3.45Å; Y142-F240 HydrophobicContact CD1-CD1 3.45Å; Y142-F240 VanDerWaalsContact CD1-CD1 3.45Å; Y142-F240 HydrophobicContact CD1-CD2 4.14Å; Y142-F240 AromaticContact CD1-CE1 3.36Å; Y142-F240 HydrophobicContact CD1-CE1 3.36Å; Y142-F240 HydrophobicContact CD1-CE2 4.08Å; Y142-F240 AromaticContact CD1-CG 3.83Å; Y142-F240 HydrophobicContact CD1-CG 3.83Å; Y142-F240 AromaticContact CD1-CZ 3.69Å; Y142-F240 HydrophobicContact CD1-CZ 3.69Å; Y142-F240 HydrophobicContact CD2-CB 3.63Å; Y142-F240 AromaticContact CD2-CD1 3.92Å; Y142-F240 HydrophobicContact CD2-CD1 3.92Å; Y142-F240 AromaticContact CD2-CD2 3.45Å; Y142-F240 HydrophobicContact CD2-CD2 3.45Å; Y142-F240 VanDerWaalsContact CD2-CD2 3.45Å; Y142-F240 HydrophobicContact CD2-CE1 4.41Å; Y142-F240 HydrophobicContact CD2-CE2 4.01Å; Y142-F240 AromaticContact CD2-CG 3.39Å; Y142-F240 HydrophobicContact CD2-CG 3.39Å; Y142-F240 HydrophobicContact CD2-CZ 4.44Å; Y142-F240 HydrophobicContact CE1-CB 4.37Å; Y142-F240 AromaticContact CE1-CD1 3.45Å; Y142-F240 HydrophobicContact CE1-CD1 3.45Å; Y142-F240 VanDerWaalsContact CE1-CD1 3.45Å; Y142-F240 AromaticContact CE1-CE1 3.77Å; Y142-F240 HydrophobicContact CE1-CE1 3.77Å; Y142-F240 AromaticContact CE1-CG 3.94Å; Y142-F240 HydrophobicContact CE1-CG 3.94Å; Y142-F240 HydrophobicContact CE2-CB 3.32Å; Y142-F240 AromaticContact CE2-CD1 3.93Å; Y142-F240 HydrophobicContact CE2-CD1 3.93Å; Y142-F240 HydrophobicContact CE2-CD2 4.08Å; Y142-F240 AromaticContact CE2-CG 3.53Å; Y142-F240 HydrophobicContact CE2-CG 3.53Å; Y142-F240 HydrophobicContact CG-CB 4.28Å; Y142-F240 AromaticContact CG-CD1 3.67Å; Y142-F240 HydrophobicContact CG-CD1 3.67Å; Y142-F240 AromaticContact CG-CD2 3.47Å; Y142-F240 HydrophobicContact CG-CD2 3.47Å; Y142-F240 VanDerWaalsContact CG-CD2 3.47Å; Y142-F240 AromaticContact CG-CE1 3.71Å; Y142-F240 HydrophobicContact CG-CE1 3.71Å; Y142-F240 AromaticContact CG-CE2 3.53Å; Y142-F240 HydrophobicContact CG-CE2 3.53Å; Y142-F240 AromaticContact CG-CG 3.54Å; Y142-F240 HydrophobicContact CG-CG 3.54Å; Y142-F240 AromaticContact CG-CZ 3.63Å; Y142-F240 HydrophobicContact CG-CZ 3.63Å; Y142-F240 AromaticContact CZ-CD1 3.68Å; Y142-F240 AromaticContact CZ-CG 3.78Å |
| 143 | W | 94.9 | Very high | 93.3 | Very high | 51 Ų | 51 | 41.5 Ų | 41.5 | 19% | 0.193 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -57.8 | -45.6 | -179.4 | 176.3 | 46.3 | 0 | 0 | 0 | 111.7 | L101 V108 T139 I140 S147 G167 L174 | L101-W143 HydrophobicContact CD1-CH2 4.15Å; L101-W143 HydrophobicContact CD1-CZ2 3.77Å; V108-W143 HydrophobicContact CG2-CB 4.27Å; V108-W143 HydrophobicContact CG2-CD2 4.08Å; V108-W143 HydrophobicContact CG2-CE3 4.19Å; V108-W143 HydrophobicContact CG2-CG 4.12Å; T139-W143 WeakPolarHBondContact O-CB 3.32Å; T139-W143 PolarHBondContact O-N 3Å; I140-W143 PolarHBondContact O-N 2.7Å; W143-S147 VanDerWaalsContact O-CB 3.31Å; W143-S147 WeakPolarHBondContact O-CB 3.29Å; W143-S147 PolarHBondContact O-N 3.28Å; W143-S147 VanDerWaalsContact O-N 3.14Å; W143-S147 PolarHBondContact O-OG 2.81Å; W143-G167 PolarHBondContact NE1-O 3.2Å; W143-L174 HydrophobicContact CB-CD1 4.46Å |
| 144 | F | 95 | Very high | 93.2 | Very high | 140 Ų | 140 | 40.1 Ų | 40.1 | 61% | 0.614 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -68.1 | -47.1 | 177.2 | -173.6 | -100.1 | 0 | 0 | 0 | 112.2 | I140 Y142 S147 L148 | I140-F144 VanDerWaalsContact O-CB 3.31Å; I140-F144 WeakPolarHBondContact O-CB 3.39Å; I140-F144 PolarHBondContact O-N 3.14Å; Y142-F144 VanDerWaalsContact C-N 3.3Å; Y142-F144 PolarHBondContact O-N 2.71Å; F144-S147 PolarHBondContact O-N 3.26Å; F144-L148 HydrophobicContact CE1-CD2 4.45Å; F144-L148 WeakPolarHBondContact O-CB 3.17Å; F144-L148 PolarHBondContact O-N 3.48Å |
| 145 | L | 95.6 | Very high | 93.2 | Very high | 94 Ų | 94 | 45.4 Ų | 45.4 | 49% | 0.492 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -63.5 | -46.6 | -179 | -179.9 | 62.1 | 0 | 0 | 0 | 111.9 | G141 Y142 S147 L148 C149 | G141-L145 WeakPolarHBondContact O-CB 3.35Å; G141-L145 PolarHBondContact O-N 3Å; Y142-L145 PolarHBondContact O-N 2.89Å; L145-S147 VanDerWaalsContact C-N 3.31Å; L145-S147 PolarHBondContact O-N 2.97Å; L145-L148 PolarHBondContact O-N 3.25Å; L145-C149 WeakPolarHBondContact O-CB 2.79Å; L145-C149 PolarHBondContact O-N 3.48Å; L145-C149 PolarHBondContact O-SG 3.08Å |
| 146 | A | 94.5 | Very high | 93 | Very high | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.008 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.2 | -41.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y142 C149 L150 V170 L236 | Y142-A146 HydrophobicContact CD2-CB 4.42Å; Y142-A146 HydrophobicContact CE1-CB 4.42Å; Y142-A146 HydrophobicContact CE2-CB 4.01Å; Y142-A146 WeakPolarHBondContact O-CB 3.49Å; Y142-A146 PolarHBondContact O-N 3.49Å; A146-C149 PolarHBondContact O-N 3.44Å; A146-L150 WeakPolarHBondContact O-CG 3.19Å; A146-L150 PolarHBondContact O-N 2.92Å; A146-V170 HydrophobicContact CB-CG1 3.86Å; A146-L236 HydrophobicContact CB-CD1 4.21Å; A146-L236 HydrophobicContact CB-CD2 4.43Å |
| 147 | S | 94.6 | Very high | 92.6 | Very high | 12 Ų | 12 | 50.7 Ų | 50.7 | 8% | 0.084 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.8 | -43.8 | 174.3 | -59.2 | 0 | 0 | 0 | 0 | 111.7 | W143 F144 L145 L150 L151 | W143-S147 VanDerWaalsContact O-CB 3.31Å; W143-S147 WeakPolarHBondContact O-CB 3.29Å; W143-S147 PolarHBondContact O-N 3.28Å; W143-S147 VanDerWaalsContact O-N 3.14Å; W143-S147 PolarHBondContact O-OG 2.81Å; F144-S147 PolarHBondContact O-N 3.26Å; L145-S147 VanDerWaalsContact C-N 3.31Å; L145-S147 PolarHBondContact O-N 2.97Å; S147-L150 PolarHBondContact O-N 3.15Å; S147-L151 WeakPolarHBondContact O-CB 3.31Å; S147-L151 WeakPolarHBondContact O-CD1 3.38Å; S147-L151 VanDerWaalsContact O-CG 3.23Å; S147-L151 WeakPolarHBondContact O-CG 3.2Å; S147-L151 PolarHBondContact O-N 3.05Å |
| 148 | L | 94.7 | Very high | 92.2 | Very high | 83 Ų | 83 | 53.6 Ų | 53.6 | 44% | 0.435 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -65.6 | -41.6 | 178 | -176.1 | 63.2 | 0 | 0 | 0 | 112.5 | F144 L145 L151 S152 | F144-L148 HydrophobicContact CE1-CD2 4.45Å; F144-L148 WeakPolarHBondContact O-CB 3.17Å; F144-L148 PolarHBondContact O-N 3.48Å; L145-L148 PolarHBondContact O-N 3.25Å; L148-L151 WeakPolarHBondContact O-CB 3.36Å; L148-L151 PolarHBondContact O-N 2.89Å; L148-S152 WeakPolarHBondContact O-CB 3Å; L148-S152 PolarHBondContact O-N 3.36Å; L148-S152 PolarHBondContact O-OG 3.07Å |
| 149 | C | 94.3 | Very high | 91.7 | Very high | 36 Ų | 36 | 54.3 Ų | 54.3 | 24% | 0.243 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.9 | -43.8 | 176.5 | -71 | 0 | 0 | 0 | 0 | 111.4 | L145 A146 S152 I153 L232 L236 | L145-C149 WeakPolarHBondContact O-CB 2.79Å; L145-C149 PolarHBondContact O-N 3.48Å; L145-C149 PolarHBondContact O-SG 3.08Å; A146-C149 PolarHBondContact O-N 3.44Å; C149-S152 WeakPolarHBondContact O-CB 3Å; C149-S152 PolarHBondContact O-N 3.44Å; C149-I153 PolarHBondContact O-N 3.46Å; C149-L232 HydrophobicContact CB-CD2 4.04Å; C149-L236 HydrophobicContact CB-CD1 4.01Å |
| 150 | L | 91.9 | Very high | 91 | Very high | 5 Ų | 5 | 60.1 Ų | 60.1 | 3% | 0.026 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -69 | -33.9 | 176.3 | -68.5 | 177.5 | 0 | 0 | 0 | 112.8 | A146 S147 I153 S154 I166 V170 F216 L229 L232 I233 | A146-L150 WeakPolarHBondContact O-CG 3.19Å; A146-L150 PolarHBondContact O-N 2.92Å; S147-L150 PolarHBondContact O-N 3.15Å; L150-I153 PolarHBondContact O-N 2.87Å; L150-S154 WeakPolarHBondContact O-CB 3.47Å; L150-S154 PolarHBondContact O-N 3.43Å; L150-S154 PolarHBondContact O-OG 3.4Å; L150-I166 HydrophobicContact CB-CG2 3.87Å; L150-I166 HydrophobicContact CD1-CG2 4.33Å; L150-V170 HydrophobicContact CD1-CG2 3.48Å; L150-V170 VanDerWaalsContact CD1-CG2 3.48Å; L150-F216 HydrophobicContact CB-CZ 4.32Å; L150-F216 HydrophobicContact CD1-CE2 4.1Å; L150-F216 HydrophobicContact CD1-CZ 4.29Å; L150-F216 HydrophobicContact CD2-CE2 4.36Å; L150-L229 HydrophobicContact CD2-CD1 4.48Å; L150-L232 HydrophobicContact CD2-CD2 4.28Å; L150-I233 HydrophobicContact CD2-CD1 4.35Å; L150-I233 HydrophobicContact CD2-CG1 3.7Å |
| 151 | L | 92.2 | Very high | 90.3 | Very high | 36 Ų | 36 | 57.7 Ų | 57.7 | 19% | 0.188 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.4 | -45 | 170.6 | -80.4 | 164.4 | 0 | 0 | 0 | 111.2 | S147 L148 I153 S154 I155 P163 I166 | S147-L151 WeakPolarHBondContact O-CB 3.31Å; S147-L151 WeakPolarHBondContact O-CD1 3.38Å; S147-L151 VanDerWaalsContact O-CG 3.23Å; S147-L151 WeakPolarHBondContact O-CG 3.2Å; S147-L151 PolarHBondContact O-N 3.05Å; L148-L151 WeakPolarHBondContact O-CB 3.36Å; L148-L151 PolarHBondContact O-N 2.89Å; L151-I153 PolarHBondContact O-N 3.33Å; L151-S154 WeakPolarHBondContact O-CB 3.41Å; L151-S154 PolarHBondContact O-N 3.15Å; L151-S154 VanDerWaalsContact O-N 3.11Å; L151-I155 WeakPolarHBondContact O-CG1 3.22Å; L151-I155 PolarHBondContact O-N 2.74Å; L151-P163 HydrophobicContact CD1-CB 3.86Å; L151-P163 HydrophobicContact CD2-CB 4.13Å; L151-I166 HydrophobicContact CD2-CD1 3.47Å; L151-I166 VanDerWaalsContact CD2-CD1 3.47Å; L151-I166 HydrophobicContact CG-CD1 3.81Å; L151-I166 HydrophobicContact CG-CG2 4.47Å |
| 152 | S | 91.8 | Very high | 89.9 | Confident | 67 Ų | 67 | 59.5 Ų | 59.5 | 47% | 0.469 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 178.1 | -57 | 0 | 0 | 0 | 0 | 111.5 | L148 C149 I155 W156 | L148-S152 WeakPolarHBondContact O-CB 3Å; L148-S152 PolarHBondContact O-N 3.36Å; L148-S152 PolarHBondContact O-OG 3.07Å; C149-S152 WeakPolarHBondContact O-CB 3Å; C149-S152 PolarHBondContact O-N 3.44Å; S152-I155 PolarHBondContact O-N 3.35Å; S152-W156 WeakPolarHBondContact O-CB 3.43Å; S152-W156 PolarHBondContact O-N 3.09Å |
| 153 | I | 89.3 | Confident | 89.5 | Confident | 28 Ų | 28 | 62.3 Ų | 62.3 | 14% | 0.144 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -65.1 | -39.5 | 172.8 | -69.8 | -155.9 | 0 | 0 | 0 | 111.8 | C149 L150 L151 I155 W156 L157 L229 L232 | C149-I153 PolarHBondContact O-N 3.46Å; L150-I153 PolarHBondContact O-N 2.87Å; L151-I153 PolarHBondContact O-N 3.33Å; I153-I155 VanDerWaalsContact C-N 3.32Å; I153-I155 PolarHBondContact O-N 3.29Å; I153-W156 CarbonylContact O-C 3.55Å; I153-W156 WeakPolarHBondContact O-CB 3.46Å; I153-W156 PolarHBondContact O-N 3.32Å; I153-W156 VanDerWaalsContact O-N 3.15Å; I153-L157 HydrophobicContact CG2-CD1 4.1Å; I153-L157 WeakPolarHBondContact O-CB 3.32Å; I153-L157 PolarHBondContact O-N 3.42Å; I153-L229 HydrophobicContact CG2-CD1 3.93Å; I153-L232 HydrophobicContact CD1-CB 3.87Å; I153-L232 HydrophobicContact CD1-CD2 3.19Å; I153-L232 HydrophobicContact CD1-CG 4.08Å; I153-L232 HydrophobicContact CG1-CD2 3.69Å |
| 154 | S | 88.5 | Confident | 89.1 | Confident | 3 Ų | 3 | 61.4 Ų | 61.4 | 2% | 0.021 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -62.3 | -41.7 | 179.1 | -61.5 | 0 | 0 | 0 | 0 | 111.5 | L150 L151 L157 S158 T159 | L150-S154 WeakPolarHBondContact O-CB 3.47Å; L150-S154 PolarHBondContact O-N 3.43Å; L150-S154 PolarHBondContact O-OG 3.4Å; L151-S154 WeakPolarHBondContact O-CB 3.41Å; L151-S154 PolarHBondContact O-N 3.15Å; L151-S154 VanDerWaalsContact O-N 3.11Å; S154-L157 CarbonylContact O-C 3.58Å; S154-L157 PolarHBondContact O-N 3.5Å; S154-S158 PolarHBondContact O-N 3.25Å; S154-T159 CarbonylContact C-O 3.52Å; S154-T159 PolarHBondContact O-N 3.48Å; S154-T159 VanDerWaalsContact O-O 3.11Å |
| 155 | I | 89.2 | Confident | 88.8 | Confident | 127 Ų | 127 | 55.6 Ų | 55.6 | 65% | 0.651 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -63.2 | -43.5 | 173.1 | -66.2 | 164.7 | 0 | 0 | 0 | 110.3 | L151 S152 I153 L157 S158 | L151-I155 WeakPolarHBondContact O-CG1 3.22Å; L151-I155 PolarHBondContact O-N 2.74Å; S152-I155 PolarHBondContact O-N 3.35Å; I153-I155 VanDerWaalsContact C-N 3.32Å; I153-I155 PolarHBondContact O-N 3.29Å; I155-L157 VanDerWaalsContact C-N 3.29Å; I155-L157 PolarHBondContact O-N 3.25Å; I155-S158 WeakPolarHBondContact O-CA 3.49Å; I155-S158 PolarHBondContact O-N 3.18Å |
| 156 | W | 88 | Confident | 88.5 | Confident | 155 Ų | 155 | 51.1 Ų | 51.1 | 59% | 0.587 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -62.6 | -35.1 | 176.6 | -173.8 | 70.6 | 0 | 0 | 0 | 112.8 | S152 I153 S158 Q225 | S152-W156 WeakPolarHBondContact O-CB 3.43Å; S152-W156 PolarHBondContact O-N 3.09Å; I153-W156 CarbonylContact O-C 3.55Å; I153-W156 WeakPolarHBondContact O-CB 3.46Å; I153-W156 PolarHBondContact O-N 3.32Å; I153-W156 VanDerWaalsContact O-N 3.15Å; W156-S158 PolarHBondContact O-N 3.16Å; W156-Q225 HydrophobicContact CH2-CG 3.81Å; W156-Q225 HydrophobicContact CZ3-CB 4.17Å; W156-Q225 HydrophobicContact CZ3-CG 3.61Å |
| 157 | L | 85.6 | Confident | 88.4 | Confident | 24 Ų | 24 | 51.3 Ų | 51.3 | 13% | 0.126 | 30% | 0.298 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | 5.3 | 171.2 | -99.4 | 60.5 | 0 | 0 | 0 | 113.5 | I153 S154 I155 T159 Q225 | I153-L157 HydrophobicContact CG2-CD1 4.1Å; I153-L157 WeakPolarHBondContact O-CB 3.32Å; I153-L157 PolarHBondContact O-N 3.42Å; S154-L157 CarbonylContact O-C 3.58Å; S154-L157 PolarHBondContact O-N 3.5Å; I155-L157 VanDerWaalsContact C-N 3.29Å; I155-L157 PolarHBondContact O-N 3.25Å; L157-T159 PolarHBondContact O-N 3.41Å; L157-T159 VanDerWaalsContact O-N 3.1Å; L157-T159 PolarHBondContact O-OG1 3.1Å; L157-Q225 HydrophobicContact CD1-CB 3.9Å; L157-Q225 HydrophobicContact CD1-CG 3.99Å; L157-Q225 HydrophobicContact CG-CB 4.39Å |
| 158 | S | 84.6 | Confident | 88.2 | Confident | 116 Ų | 116 | 50.8 Ų | 50.8 | 81% | 0.811 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53 | 29.5 | -175 | -57.8 | 0 | 0 | 0 | 0 | 113.2 | S154 I155 W156 | S154-S158 PolarHBondContact O-N 3.25Å; I155-S158 WeakPolarHBondContact O-CA 3.49Å; I155-S158 PolarHBondContact O-N 3.18Å; W156-S158 PolarHBondContact O-N 3.16Å |
| 159 | T | 81.4 | Confident | 88 | Confident | 35 Ų | 35 | 47.3 Ų | 47.3 | 22% | 0.215 | 28% | 0.276 | C | S | . | . | trans | -108 | 114.4 | 179.7 | -53.5 | 0 | 0 | 0 | 0 | 109.5 | S154 L157 H161 | S154-T159 CarbonylContact C-O 3.52Å; S154-T159 PolarHBondContact O-N 3.48Å; S154-T159 VanDerWaalsContact O-O 3.11Å; L157-T159 PolarHBondContact O-N 3.41Å; L157-T159 VanDerWaalsContact O-N 3.1Å; L157-T159 PolarHBondContact O-OG1 3.1Å; T159-H161 WeakPolarHBondContact CG2-CD2 3.38Å; T159-H161 WeakPolarHBondContact CG2-NE2 3.33Å; T159-H161 PolarHBondContact O-N 3.4Å | ||
| 160 | S | 80.2 | Confident | 87.9 | Confident | 121 Ų | 121 | 45.7 Ų | 45.7 | 85% | 0.846 | 27% | 0.265 | S | S | * | . | trans | -78.3 | 105.4 | 176.6 | 58.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 161 | H | 80.3 | Confident | 87.9 | Confident | 24 Ų | 24 | 45.5 Ų | 45.5 | 11% | 0.111 | 26% | 0.264 | C | S | . | . | trans | -108.7 | 139.4 | 170.4 | -75.2 | -98 | 0 | 0 | 0 | 110.4 | T159 I166 H215 R219 | T159-H161 WeakPolarHBondContact CG2-CD2 3.38Å; T159-H161 WeakPolarHBondContact CG2-NE2 3.33Å; T159-H161 PolarHBondContact O-N 3.4Å; H161-I166 HydrophobicContact CB-CD1 3.48Å; H161-I166 VanDerWaalsContact CB-CD1 3.48Å; H161-I166 HydrophobicContact CB-CG1 3.99Å; H161-H215 AromaticContact CE1-NE2 3.91Å; H161-R219 PolarHBondContact CE1-NH1 2.94Å; H161-R219 PolarHBondContact ND1-NH1 3.09Å | ||
| 162 | T | 85.8 | Confident | 87.8 | Confident | 72 Ų | 72 | 43.9 Ų | 43.9 | 44% | 0.442 | 26% | 0.256 | S | S | . | . | trans | -63.8 | 131.3 | 171.2 | -52.3 | 0 | 0 | 0 | 0 | 109.4 | V164 V165 I166 | T162-V164 HydrophobicContact CG2-CB 4.08Å; T162-V164 HydrophobicContact CG2-CG2 4.27Å; T162-V164 PolarHBondContact O-N 3.02Å; T162-V165 WeakPolarHBondContact O-CB 3.45Å; T162-V165 PolarHBondContact O-N 3.25Å; T162-I166 PolarHBondContact O-N 3.21Å | ||
| 163 | P | 86.4 | Confident | 87.8 | Confident | 79 Ų | 79 | 40.8 Ų | 40.8 | 51% | 0.513 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -59.7 | -32.8 | -179.9 | 23.8 | -34.6 | 0 | 0 | 0 | 112.9 | L151 V165 I166 G167 | L151-P163 HydrophobicContact CD1-CB 3.86Å; L151-P163 HydrophobicContact CD2-CB 4.13Å; P163-V165 VanDerWaalsContact C-N 3.33Å; P163-V165 PolarHBondContact O-N 3.38Å; P163-I166 PolarHBondContact O-N 2.78Å; P163-G167 PolarHBondContact O-N 3.32Å |
| 164 | V | 87.6 | Confident | 87.9 | Confident | 31 Ų | 31 | 39.5 Ų | 39.5 | 19% | 0.188 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.5 | -42.3 | 174.4 | -176.5 | 0 | 0 | 0 | 0 | 111.3 | Y72 T162 G167 S168 | Y72-V164 HydrophobicContact CD1-CG1 4.12Å; Y72-V164 HydrophobicContact CD2-CG1 3.99Å; Y72-V164 HydrophobicContact CE1-CG1 4.05Å; Y72-V164 HydrophobicContact CE2-CB 4.45Å; Y72-V164 HydrophobicContact CE2-CG1 3.94Å; Y72-V164 HydrophobicContact CE2-CG2 4.39Å; Y72-V164 HydrophobicContact CG-CG1 4.08Å; T162-V164 HydrophobicContact CG2-CB 4.08Å; T162-V164 HydrophobicContact CG2-CG2 4.27Å; T162-V164 PolarHBondContact O-N 3.02Å; V164-G167 PolarHBondContact O-N 2.85Å; V164-S168 WeakPolarHBondContact O-CB 3.19Å; V164-S168 PolarHBondContact O-N 3.31Å; V164-S168 PolarHBondContact O-OG 3.18Å; V164-S168 VanDerWaalsContact O-OG 3.13Å |
| 165 | V | 87.9 | Confident | 88.1 | Confident | 18 Ų | 18 | 41 Ų | 41 | 11% | 0.109 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.7 | -46.4 | 179.4 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | Y99 T162 P163 S168 I169 | Y99-V165 HydrophobicContact CD1-CB 4.34Å; Y99-V165 HydrophobicContact CD1-CG1 3.69Å; Y99-V165 HydrophobicContact CD1-CG2 4.41Å; Y99-V165 HydrophobicContact CD2-CB 4.43Å; Y99-V165 HydrophobicContact CD2-CG1 4.02Å; Y99-V165 HydrophobicContact CD2-CG2 3.72Å; Y99-V165 HydrophobicContact CE1-CG1 3.63Å; Y99-V165 HydrophobicContact CE2-CG1 3.95Å; Y99-V165 HydrophobicContact CE2-CG2 4.3Å; Y99-V165 HydrophobicContact CG-CB 4.2Å; Y99-V165 HydrophobicContact CG-CG1 3.88Å; Y99-V165 HydrophobicContact CG-CG2 3.78Å; T162-V165 WeakPolarHBondContact O-CB 3.45Å; T162-V165 PolarHBondContact O-N 3.25Å; P163-V165 VanDerWaalsContact C-N 3.33Å; P163-V165 PolarHBondContact O-N 3.38Å; V165-S168 PolarHBondContact O-N 3.16Å; V165-I169 HydrophobicContact CG1-CD1 3.73Å; V165-I169 WeakPolarHBondContact O-CB 3.4Å; V165-I169 WeakPolarHBondContact O-CD1 3.37Å; V165-I169 WeakPolarHBondContact O-CG1 3.25Å; V165-I169 PolarHBondContact O-N 3.27Å |
| 166 | I | 90.4 | Very high | 88.2 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.3 | -46.2 | 176.9 | -70 | 171.1 | 0 | 0 | 0 | 110.2 | L150 L151 H161 T162 P163 S168 I169 V170 F216 | L150-I166 HydrophobicContact CB-CG2 3.87Å; L150-I166 HydrophobicContact CD1-CG2 4.33Å; L151-I166 HydrophobicContact CD2-CD1 3.47Å; L151-I166 VanDerWaalsContact CD2-CD1 3.47Å; L151-I166 HydrophobicContact CG-CD1 3.81Å; L151-I166 HydrophobicContact CG-CG2 4.47Å; H161-I166 HydrophobicContact CB-CD1 3.48Å; H161-I166 VanDerWaalsContact CB-CD1 3.48Å; H161-I166 HydrophobicContact CB-CG1 3.99Å; T162-I166 PolarHBondContact O-N 3.21Å; P163-I166 PolarHBondContact O-N 2.78Å; I166-S168 VanDerWaalsContact C-N 3.31Å; I166-S168 PolarHBondContact O-N 3.35Å; I166-I169 PolarHBondContact O-N 2.88Å; I166-V170 HydrophobicContact CG2-CG2 4.22Å; I166-V170 WeakPolarHBondContact O-CB 3.37Å; I166-V170 VanDerWaalsContact O-CG2 3.29Å; I166-V170 WeakPolarHBondContact O-CG2 3.21Å; I166-V170 PolarHBondContact O-N 2.87Å; I166-F216 HydrophobicContact CG1-CZ 4.31Å |
| 167 | G | 91.8 | Very high | 88.4 | Confident | 5 Ų | 5 | 28 Ų | 28 | 5% | 0.052 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -57.8 | -42.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | W143 P163 V164 G171 | W143-G167 PolarHBondContact NE1-O 3.2Å; P163-G167 PolarHBondContact O-N 3.32Å; V164-G167 PolarHBondContact O-N 2.85Å; G167-G171 PolarHBondContact O-N 3.1Å |
| 168 | S | 90.9 | Very high | 88.7 | Confident | 1 Ų | 1 | 27.1 Ų | 27.1 | 1% | 0.007 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.8 | -45.7 | 176.5 | -68.4 | 0 | 0 | 0 | 0 | 112.3 | D100 P104 V164 V165 I166 G171 Y172 | D100-S168 VanDerWaalsContact O-CB 3.28Å; D100-S168 WeakPolarHBondContact O-CB 3.42Å; D100-S168 PolarHBondContact O-OG 2.91Å; P104-S168 WeakPolarHBondContact CG-O 3.44Å; V164-S168 WeakPolarHBondContact O-CB 3.19Å; V164-S168 PolarHBondContact O-N 3.31Å; V164-S168 PolarHBondContact O-OG 3.18Å; V164-S168 VanDerWaalsContact O-OG 3.13Å; V165-S168 PolarHBondContact O-N 3.16Å; I166-S168 VanDerWaalsContact C-N 3.31Å; I166-S168 PolarHBondContact O-N 3.35Å; S168-G171 PolarHBondContact O-N 3.34Å; S168-Y172 WeakPolarHBondContact O-CB 3.3Å; S168-Y172 WeakPolarHBondContact O-CD2 3.46Å; S168-Y172 PolarHBondContact O-N 3.46Å |
| 169 | I | 89.4 | Confident | 89 | Confident | 10 Ų | 10 | 24.5 Ų | 24.5 | 5% | 0.051 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61.9 | -46.9 | 179.2 | -69.8 | 163.6 | 0 | 0 | 0 | 111.1 | Y99 V165 I166 Y172 A173 L212 H215 | Y99-I169 HydrophobicContact CD1-CD1 4.31Å; Y99-I169 HydrophobicContact CD1-CG1 4.03Å; Y99-I169 HydrophobicContact CE1-CD1 3.67Å; Y99-I169 HydrophobicContact CE1-CG1 3.69Å; V165-I169 HydrophobicContact CG1-CD1 3.73Å; V165-I169 WeakPolarHBondContact O-CB 3.4Å; V165-I169 WeakPolarHBondContact O-CD1 3.37Å; V165-I169 WeakPolarHBondContact O-CG1 3.25Å; V165-I169 PolarHBondContact O-N 3.27Å; I166-I169 PolarHBondContact O-N 2.88Å; I169-Y172 PolarHBondContact O-N 3.25Å; I169-A173 PolarHBondContact O-N 2.9Å; I169-A173 VanDerWaalsContact O-N 3.15Å; I169-L212 HydrophobicContact CG2-CD2 3.29Å; I169-H215 WeakPolarHBondContact CD1-CE1 3.39Å; I169-H215 WeakPolarHBondContact CD1-NE2 3.35Å |
| 170 | V | 92.1 | Very high | 89.5 | Confident | 3 Ų | 3 | 22.9 Ų | 22.9 | 2% | 0.018 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.7 | -44.6 | 177 | 173.8 | 0 | 0 | 0 | 0 | 110.5 | A146 L150 I166 Y172 A173 L174 | A146-V170 HydrophobicContact CB-CG1 3.86Å; L150-V170 HydrophobicContact CD1-CG2 3.48Å; L150-V170 VanDerWaalsContact CD1-CG2 3.48Å; I166-V170 HydrophobicContact CG2-CG2 4.22Å; I166-V170 WeakPolarHBondContact O-CB 3.37Å; I166-V170 VanDerWaalsContact O-CG2 3.29Å; I166-V170 WeakPolarHBondContact O-CG2 3.21Å; I166-V170 PolarHBondContact O-N 2.87Å; V170-Y172 VanDerWaalsContact C-N 3.35Å; V170-Y172 PolarHBondContact O-N 3.38Å; V170-A173 VanDerWaalsContact O-CB 3.31Å; V170-A173 WeakPolarHBondContact O-CB 3.49Å; V170-A173 PolarHBondContact O-N 2.88Å; V170-A173 VanDerWaalsContact O-N 3.07Å; V170-L174 PolarHBondContact O-N 3.08Å |
| 171 | G | 92.4 | Very high | 90 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -65.7 | -37 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L107 G167 S168 A173 L174 | L107-G171 WeakPolarHBondContact CD1-O 3.49Å; G167-G171 PolarHBondContact O-N 3.1Å; S168-G171 PolarHBondContact O-N 3.34Å; G171-A173 PolarHBondContact O-N 2.9Å; G171-L174 WeakPolarHBondContact O-CB 3.45Å; G171-L174 PolarHBondContact O-N 3.3Å |
| 172 | Y | 90.9 | Very high | 90.5 | Very high | 3 Ų | 3 | 17.7 Ų | 17.7 | 1% | 0.012 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -65 | -27.3 | 171.7 | -85.5 | -64.1 | 0 | 0 | 0 | 113.2 | Q83 L84 P104 L107 S168 I169 V170 L174 F175 | Q83-Y172 HydrophobicContact CB-CE1 4.3Å; Q83-Y172 VanDerWaalsContact OE1-CZ 3.27Å; Q83-Y172 PolarHBondContact OE1-OH 3.25Å; L84-Y172 HydrophobicContact CD2-CD1 3.87Å; L84-Y172 HydrophobicContact CD2-CE1 3.95Å; L84-Y172 HydrophobicContact CG-CE1 4.41Å; P104-Y172 HydrophobicContact CG-CD2 3.77Å; P104-Y172 HydrophobicContact CG-CE2 3.79Å; P104-Y172 HydrophobicContact CG-CG 4.3Å; L107-Y172 HydrophobicContact CD1-CD1 4.28Å; S168-Y172 WeakPolarHBondContact O-CB 3.3Å; S168-Y172 WeakPolarHBondContact O-CD2 3.46Å; S168-Y172 PolarHBondContact O-N 3.46Å; I169-Y172 PolarHBondContact O-N 3.25Å; V170-Y172 VanDerWaalsContact C-N 3.35Å; V170-Y172 PolarHBondContact O-N 3.38Å; Y172-L174 PolarHBondContact O-N 3.31Å; Y172-F175 WeakPolarHBondContact O-CB 3.19Å; Y172-F175 PolarHBondContact O-N 3.22Å |
| 173 | A | 90.7 | Very high | 90.6 | Very high | 2 Ų | 2 | 15.6 Ų | 15.6 | 2% | 0.017 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -69.8 | -20.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | I169 V170 G171 F175 A176 H177 S208 L212 | I169-A173 PolarHBondContact O-N 2.9Å; I169-A173 VanDerWaalsContact O-N 3.15Å; V170-A173 VanDerWaalsContact O-CB 3.31Å; V170-A173 WeakPolarHBondContact O-CB 3.49Å; V170-A173 PolarHBondContact O-N 2.88Å; V170-A173 VanDerWaalsContact O-N 3.07Å; G171-A173 PolarHBondContact O-N 2.9Å; A173-F175 PolarHBondContact O-N 3Å; A173-A176 PolarHBondContact O-N 3.18Å; A173-H177 PolarHBondContact O-ND1 2.94Å; A173-S208 PolarHBondContact O-OG 3.4Å; A173-L212 HydrophobicContact CB-CD1 3.78Å; A173-L212 HydrophobicContact CB-CD2 4.18Å; A173-L212 HydrophobicContact CB-CG 4.12Å |
| 174 | L | 92.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 12.1 Ų | 12.1 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -65.9 | -20.1 | 172.7 | -63.1 | 176.1 | 0 | 0 | 0 | 112.8 | L107 V108 L111 Y142 W143 V170 G171 Y172 A176 H177 C178 F240 | L107-L174 HydrophobicContact CB-CB 4.41Å; V108-L174 HydrophobicContact CG2-CD1 3.58Å; L111-L174 HydrophobicContact CD2-CD2 4.03Å; Y142-L174 HydrophobicContact CD1-CD2 3.76Å; Y142-L174 HydrophobicContact CE1-CD2 3.53Å; W143-L174 HydrophobicContact CB-CD1 4.46Å; V170-L174 PolarHBondContact O-N 3.08Å; G171-L174 WeakPolarHBondContact O-CB 3.45Å; G171-L174 PolarHBondContact O-N 3.3Å; Y172-L174 PolarHBondContact O-N 3.31Å; L174-A176 VanDerWaalsContact C-N 3.29Å; L174-A176 PolarHBondContact O-N 3.26Å; L174-H177 WeakPolarHBondContact O-CA 3.48Å; L174-H177 VanDerWaalsContact O-CB 3.32Å; L174-H177 WeakPolarHBondContact O-CB 3.36Å; L174-H177 PolarHBondContact O-N 3.32Å; L174-C178 PolarHBondContact O-N 3.14Å; L174-C178 PolarHBondContact O-SG 2.79Å; L174-C178 VanDerWaalsContact O-SG 3.38Å; L174-F240 HydrophobicContact CD2-CD1 4.47Å; L174-F240 HydrophobicContact CD2-CE1 3.97Å |
| 175 | F | 92 | Very high | 90.4 | Very high | 35 Ų | 35 | 12.2 Ų | 12.2 | 15% | 0.154 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -58.7 | -42.1 | 177.2 | -178.1 | -125.9 | 0 | 0 | 0 | 112.4 | L84 L88 L107 Y172 A173 H177 C178 L179 | L84-F175 HydrophobicContact CB-CD1 4.2Å; L84-F175 HydrophobicContact CB-CE1 3.98Å; L84-F175 HydrophobicContact CB-CE2 4.42Å; L84-F175 HydrophobicContact CB-CG 4.48Å; L84-F175 HydrophobicContact CB-CZ 4.11Å; L84-F175 HydrophobicContact CD1-CE2 4.38Å; L84-F175 HydrophobicContact CD2-CB 3.91Å; L84-F175 HydrophobicContact CD2-CD1 4.19Å; L84-F175 HydrophobicContact CD2-CD2 3.86Å; L84-F175 HydrophobicContact CD2-CE2 4.41Å; L84-F175 HydrophobicContact CD2-CG 3.73Å; L84-F175 WeakPolarHBondContact O-CD1 3.3Å; L84-F175 VanDerWaalsContact O-CE1 3.32Å; L84-F175 WeakPolarHBondContact O-CE1 3.27Å; L88-F175 HydrophobicContact CD1-CD1 4.4Å; L88-F175 HydrophobicContact CD1-CE1 3.68Å; L88-F175 HydrophobicContact CD2-CD1 3.74Å; L88-F175 HydrophobicContact CD2-CE1 3.85Å; L88-F175 HydrophobicContact CG-CD1 3.89Å; L88-F175 HydrophobicContact CG-CE1 3.65Å; L107-F175 HydrophobicContact CD1-CB 3.78Å; L107-F175 HydrophobicContact CD2-CB 3.89Å; L107-F175 HydrophobicContact CD2-CD2 3.59Å; L107-F175 HydrophobicContact CD2-CG 4.17Å; L107-F175 HydrophobicContact CG-CB 4.49Å; Y172-F175 WeakPolarHBondContact O-CB 3.19Å; Y172-F175 PolarHBondContact O-N 3.22Å; A173-F175 PolarHBondContact O-N 3Å; F175-H177 VanDerWaalsContact C-N 3.27Å; F175-H177 PolarHBondContact O-N 3.25Å; F175-C178 WeakPolarHBondContact O-CB 3.49Å; F175-C178 PolarHBondContact O-N 3.4Å; F175-L179 HydrophobicContact CD1-CD1 4.26Å; F175-L179 HydrophobicContact CE1-CD1 3.82Å; F175-L179 HydrophobicContact CE1-CG 4.44Å; F175-L179 HydrophobicContact CE2-CD1 4.45Å; F175-L179 HydrophobicContact CE2-CD2 4.3Å; F175-L179 HydrophobicContact CE2-CG 4.22Å; F175-L179 HydrophobicContact CZ-CD1 3.92Å; F175-L179 HydrophobicContact CZ-CD2 4.23Å; F175-L179 HydrophobicContact CZ-CG 4.16Å; F175-L179 PolarHBondContact O-N 3.1Å |
| 176 | A | 91.4 | Very high | 90.3 | Very high | 5 Ų | 5 | 17.6 Ų | 17.6 | 4% | 0.041 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -61.6 | -37.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | A173 L174 L179 I180 | A173-A176 PolarHBondContact O-N 3.18Å; L174-A176 VanDerWaalsContact C-N 3.29Å; L174-A176 PolarHBondContact O-N 3.26Å; A176-L179 PolarHBondContact O-N 2.89Å; A176-I180 WeakPolarHBondContact O-CD1 3.44Å; A176-I180 WeakPolarHBondContact O-CG1 3.2Å; A176-I180 PolarHBondContact O-N 3.01Å |
| 177 | H | 92.1 | Very high | 89.9 | Confident | 3 Ų | 3 | 21 Ų | 21 | 1% | 0.014 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -65.4 | -43 | 176.7 | -62.2 | 74.4 | 0 | 0 | 0 | 111.3 | L111 A173 L174 F175 L179 I180 L181 N237 F240 L241 | L111-H177 HydrophobicContact CD1-CB 4.37Å; A173-H177 PolarHBondContact O-ND1 2.94Å; L174-H177 WeakPolarHBondContact O-CA 3.48Å; L174-H177 VanDerWaalsContact O-CB 3.32Å; L174-H177 WeakPolarHBondContact O-CB 3.36Å; L174-H177 PolarHBondContact O-N 3.32Å; F175-H177 VanDerWaalsContact C-N 3.27Å; F175-H177 PolarHBondContact O-N 3.25Å; H177-L179 VanDerWaalsContact C-N 3.34Å; H177-L179 PolarHBondContact O-N 2.99Å; H177-I180 PolarHBondContact O-N 3.38Å; H177-L181 WeakPolarHBondContact O-CB 3.23Å; H177-L181 WeakPolarHBondContact O-CG 3.49Å; H177-L181 PolarHBondContact O-N 3.38Å; H177-N237 PolarHBondContact NE2-O 3.1Å; H177-N237 VanDerWaalsContact NE2-O 3.12Å; H177-F240 AromaticContact CD2-CD1 3.71Å; H177-F240 AromaticContact NE2-CD1 3.89Å; H177-L241 HydrophobicContact CB-CD1 4.41Å |
| 178 | C | 92.7 | Very high | 88.8 | Confident | 6 Ų | 6 | 22.8 Ų | 22.8 | 4% | 0.041 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -58.7 | -45.5 | 174.1 | -64 | 0 | 0 | 0 | 0 | 111.5 | L114 L174 F175 A182 | L114-C178 HydrophobicContact CD1-CB 3.82Å; L114-C178 WeakPolarHBondContact CD1-O 3.45Å; L174-C178 PolarHBondContact O-N 3.14Å; L174-C178 PolarHBondContact O-SG 2.79Å; L174-C178 VanDerWaalsContact O-SG 3.38Å; F175-C178 WeakPolarHBondContact O-CB 3.49Å; F175-C178 PolarHBondContact O-N 3.4Å; C178-A182 WeakPolarHBondContact O-CB 3.46Å; C178-A182 PolarHBondContact O-N 3.49Å |
| 179 | L | 91.7 | Very high | 87.8 | Confident | 62 Ų | 62 | 33 Ų | 33 | 33% | 0.325 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -64.2 | -44.1 | 178.1 | -70.2 | 179.2 | 0 | 0 | 0 | 112.4 | L88 F175 A176 H177 A182 A183 | L88-L179 HydrophobicContact CD1-CD1 3.86Å; L88-L179 HydrophobicContact CD2-CD1 3.64Å; L88-L179 HydrophobicContact CG-CD1 4.35Å; F175-L179 HydrophobicContact CD1-CD1 4.26Å; F175-L179 HydrophobicContact CE1-CD1 3.82Å; F175-L179 HydrophobicContact CE1-CG 4.44Å; F175-L179 HydrophobicContact CE2-CD1 4.45Å; F175-L179 HydrophobicContact CE2-CD2 4.3Å; F175-L179 HydrophobicContact CE2-CG 4.22Å; F175-L179 HydrophobicContact CZ-CD1 3.92Å; F175-L179 HydrophobicContact CZ-CD2 4.23Å; F175-L179 HydrophobicContact CZ-CG 4.16Å; F175-L179 PolarHBondContact O-N 3.1Å; A176-L179 PolarHBondContact O-N 2.89Å; H177-L179 VanDerWaalsContact C-N 3.34Å; H177-L179 PolarHBondContact O-N 2.99Å; L179-A182 PolarHBondContact O-N 2.94Å; L179-A183 WeakPolarHBondContact O-CB 3.4Å; L179-A183 PolarHBondContact O-N 2.95Å |
| 180 | I | 91.3 | Very high | 86.7 | Confident | 1 Ų | 1 | 36.6 Ų | 36.6 | 1% | 0.005 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.2 | -44.7 | 179.7 | -65.2 | 161.2 | 0 | 0 | 0 | 110.3 | A176 H177 T184 F197 L200 L204 L241 | A176-I180 WeakPolarHBondContact O-CD1 3.44Å; A176-I180 WeakPolarHBondContact O-CG1 3.2Å; A176-I180 PolarHBondContact O-N 3.01Å; H177-I180 PolarHBondContact O-N 3.38Å; I180-T184 VanDerWaalsContact O-CB 3.24Å; I180-T184 WeakPolarHBondContact O-CB 3.43Å; I180-T184 PolarHBondContact O-N 3.16Å; I180-T184 PolarHBondContact O-OG1 2.93Å; I180-F197 HydrophobicContact CG2-CD2 4.32Å; I180-F197 HydrophobicContact CG2-CE2 4.04Å; I180-L200 HydrophobicContact CG2-CB 4.21Å; I180-L204 HydrophobicContact CD1-CB 3.67Å; I180-L204 HydrophobicContact CG1-CB 3.71Å; I180-L204 HydrophobicContact CG1-CD1 3.79Å; I180-L204 HydrophobicContact CG1-CG 4.39Å; I180-L241 HydrophobicContact CB-CD1 4.06Å; I180-L241 HydrophobicContact CD1-CD1 4.06Å; I180-L241 HydrophobicContact CD1-CD2 3.51Å; I180-L241 HydrophobicContact CD1-CG 4.45Å; I180-L241 HydrophobicContact CG2-CD1 3.89Å; I180-L241 HydrophobicContact CG2-CD2 4.18Å; I180-L241 HydrophobicContact CG2-CG 4.47Å |
| 181 | L | 90.2 | Very high | 85.2 | Confident | 9 Ų | 9 | 40.1 Ų | 40.1 | 5% | 0.047 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -65.3 | -47.7 | 177.2 | -74.3 | 178.7 | 0 | 0 | 0 | 111.9 | L111 L115 H177 A183 T184 E185 L244 | L111-L181 HydrophobicContact CD1-CD1 3.56Å; L115-L181 HydrophobicContact CD2-CD1 3.99Å; L115-L181 HydrophobicContact CG-CD1 4.36Å; H177-L181 WeakPolarHBondContact O-CB 3.23Å; H177-L181 WeakPolarHBondContact O-CG 3.49Å; H177-L181 PolarHBondContact O-N 3.38Å; L181-A183 PolarHBondContact O-N 2.81Å; L181-T184 PolarHBondContact O-N 3.17Å; L181-E185 WeakPolarHBondContact O-CB 3.48Å; L181-E185 WeakPolarHBondContact O-CG 3.3Å; L181-E185 PolarHBondContact O-N 2.65Å; L181-L244 HydrophobicContact CD1-CB 4.48Å; L181-L244 HydrophobicContact CD1-CD1 3.81Å; L181-L244 HydrophobicContact CD2-CB 4.48Å |
| 182 | A | 90.8 | Very high | 83.9 | Confident | 26 Ų | 26 | 47.3 Ų | 47.3 | 22% | 0.215 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60 | -45.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L114 C178 L179 L186 | L114-A182 HydrophobicContact CD1-CB 4.25Å; L114-A182 HydrophobicContact CD2-CB 3.99Å; C178-A182 WeakPolarHBondContact O-CB 3.46Å; C178-A182 PolarHBondContact O-N 3.49Å; L179-A182 PolarHBondContact O-N 2.94Å; A182-L186 WeakPolarHBondContact O-CB 3.01Å; A182-L186 WeakPolarHBondContact O-CG 3.44Å; A182-L186 PolarHBondContact O-N 3.01Å |
| 183 | A | 88.7 | Confident | 83.1 | Confident | 28 Ų | 28 | 49.4 Ų | 49.4 | 23% | 0.231 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.7 | -38.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L179 L181 L187 L200 | L179-A183 WeakPolarHBondContact O-CB 3.4Å; L179-A183 PolarHBondContact O-N 2.95Å; L181-A183 PolarHBondContact O-N 2.81Å; A183-L187 WeakPolarHBondContact O-CB 3.47Å; A183-L187 VanDerWaalsContact O-CG 3.31Å; A183-L187 WeakPolarHBondContact O-CG 3.42Å; A183-L187 PolarHBondContact O-N 3.22Å; A183-L200 HydrophobicContact CB-CD1 3.68Å |
| 184 | T | 86.1 | Confident | 82.5 | Confident | 7 Ų | 7 | 52.3 Ų | 52.3 | 4% | 0.043 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.6 | -47.4 | 177.5 | -56.2 | 0 | 0 | 0 | 0 | 110.6 | I180 L181 L186 L187 H188 F197 | I180-T184 VanDerWaalsContact O-CB 3.24Å; I180-T184 WeakPolarHBondContact O-CB 3.43Å; I180-T184 PolarHBondContact O-N 3.16Å; I180-T184 PolarHBondContact O-OG1 2.93Å; L181-T184 PolarHBondContact O-N 3.17Å; T184-L186 PolarHBondContact O-N 3.28Å; T184-L187 PolarHBondContact O-N 2.83Å; T184-H188 WeakPolarHBondContact O-CA 3.28Å; T184-H188 WeakPolarHBondContact O-CB 3.23Å; T184-H188 PolarHBondContact O-N 3.38Å; T184-F197 HydrophobicContact CG2-CB 4.26Å; T184-F197 HydrophobicContact CG2-CD2 4.05Å |
| 185 | E | 83.9 | Confident | 82 | Confident | 32 Ų | 32 | 59.7 Ų | 59.7 | 15% | 0.15 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 177 | -70.7 | -68.8 | 143.2 | 0 | 0 | 112.2 | S118 L181 L187 H249 | S118-E185 WeakPolarHBondContact CB-OE1 3.45Å; S118-E185 PolarHBondContact OG-OE1 3.34Å; L181-E185 WeakPolarHBondContact O-CB 3.48Å; L181-E185 WeakPolarHBondContact O-CG 3.3Å; L181-E185 PolarHBondContact O-N 2.65Å; E185-L187 PolarHBondContact O-N 3.44Å; E185-H249 IonicContact OE1-CD2 3.36Å; E185-H249 PolarHBondContact OE1-CD2 3.43Å |
| 186 | L | 85 | Confident | 81.6 | Confident | 131 Ų | 131 | 60.5 Ų | 60.5 | 69% | 0.686 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -66.2 | -38.5 | -179.9 | -71.2 | 172.1 | 0 | 0 | 0 | 112.7 | A182 T184 | A182-L186 WeakPolarHBondContact O-CB 3.01Å; A182-L186 WeakPolarHBondContact O-CG 3.44Å; A182-L186 PolarHBondContact O-N 3.01Å; T184-L186 PolarHBondContact O-N 3.28Å |
| 187 | L | 81 | Confident | 81.3 | Confident | 73 Ų | 73 | 60.4 Ų | 60.4 | 38% | 0.382 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -91.3 | -22.6 | -175.8 | -66.8 | 169.3 | 0 | 0 | 0 | 113.2 | A183 T184 E185 Y189 S190 V191 F196 | A183-L187 WeakPolarHBondContact O-CB 3.47Å; A183-L187 VanDerWaalsContact O-CG 3.31Å; A183-L187 WeakPolarHBondContact O-CG 3.42Å; A183-L187 PolarHBondContact O-N 3.22Å; T184-L187 PolarHBondContact O-N 2.83Å; E185-L187 PolarHBondContact O-N 3.44Å; L187-Y189 PolarHBondContact O-N 2.73Å; L187-S190 CarbonylContact O-C 3.53Å; L187-S190 WeakPolarHBondContact O-CA 3.5Å; L187-S190 WeakPolarHBondContact O-CB 3.27Å; L187-S190 PolarHBondContact O-N 2.83Å; L187-V191 PolarHBondContact O-N 3.04Å; L187-F196 HydrophobicContact CB-CD1 4.28Å; L187-F196 HydrophobicContact CB-CE1 3.8Å; L187-F196 HydrophobicContact CB-CZ 4.31Å; L187-F196 HydrophobicContact CD1-CD1 4.47Å; L187-F196 HydrophobicContact CD1-CE1 3.36Å; L187-F196 HydrophobicContact CD1-CE2 4.02Å; L187-F196 HydrophobicContact CD1-CZ 3.1Å; L187-F196 HydrophobicContact CG-CE1 4.2Å; L187-F196 HydrophobicContact CG-CZ 4.3Å |
| 188 | H | 70.6 | Confident | 81.1 | Confident | 41 Ų | 41 | 63.7 Ų | 63.7 | 19% | 0.19 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -64 | -29.1 | 175.1 | -171.9 | 68.2 | 0 | 0 | 0 | 111.8 | T184 S190 H192 H249 | T184-H188 WeakPolarHBondContact O-CA 3.28Å; T184-H188 WeakPolarHBondContact O-CB 3.23Å; T184-H188 PolarHBondContact O-N 3.38Å; H188-S190 PolarHBondContact O-N 3.13Å; H188-H192 AromaticContact CD2-ND1 3.92Å; H188-H192 AromaticContact CE1-CE1 3.5Å; H188-H192 AromaticContact CE1-CG 3.77Å; H188-H192 AromaticContact CE1-ND1 3.17Å; H188-H192 PolarHBondContact CE1-ND1 2.8Å; H188-H192 AromaticContact ND1-ND1 3.96Å; H188-H192 AromaticContact NE2-CE1 3.11Å; H188-H192 PolarHBondContact NE2-CE1 3.3Å; H188-H192 AromaticContact NE2-ND1 3.11Å; H188-H192 PolarHBondContact NE2-ND1 3.08Å; H188-H192 VanDerWaalsContact NE2-ND1 3.11Å; H188-H249 AromaticContact CD2-CE1 3.57Å; H188-H249 AromaticContact CD2-NE2 3.57Å; H188-H249 AromaticContact CE1-CE1 3.78Å; H188-H249 AromaticContact CG-CE1 3.97Å; H188-H249 AromaticContact CG-NE2 3.79Å; H188-H249 AromaticContact NE2-CE1 3.46Å; H188-H249 PolarHBondContact NE2-CE1 3.49Å; H188-H249 AromaticContact NE2-NE2 3.96Å |
| 189 | Y | 68.6 | Low | 80.9 | Confident | 215 Ų | 215 | 68.6 Ų | 68.6 | 84% | 0.843 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55 | -35.7 | 166.5 | -179.1 | -98.6 | 0 | 0 | 0 | 112.5 | L187 | L187-Y189 PolarHBondContact O-N 2.73Š|
| 190 | S | 66.5 | Low | 80.7 | Confident | 87 Ų | 87 | 66.6 Ų | 66.6 | 61% | 0.608 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.1 | -34.9 | -176.3 | -61.1 | 0 | 0 | 0 | 0 | 113.5 | L187 H188 | L187-S190 CarbonylContact O-C 3.53Å; L187-S190 WeakPolarHBondContact O-CA 3.5Å; L187-S190 WeakPolarHBondContact O-CB 3.27Å; L187-S190 PolarHBondContact O-N 2.83Å; H188-S190 PolarHBondContact O-N 3.13Å |
| 191 | V | 60.6 | Low | 80.6 | Confident | 76 Ų | 76 | 66.7 Ų | 66.7 | 46% | 0.461 | 34% | 0.335 | S | S | . | . | trans | -138.2 | 100.6 | -172.8 | -167.8 | 0 | 0 | 0 | 0 | 109.3 | L187 S193 | L187-V191 PolarHBondContact O-N 3.04Å; V191-S193 WeakPolarHBondContact CG1-OG 3.26Å; V191-S193 PolarHBondContact O-N 2.78Å | ||
| 192 | H | 65.4 | Low | 80.6 | Confident | 152 Ų | 152 | 72.2 Ų | 72.2 | 70% | 0.704 | 36% | 0.364 | S | S | * | . | trans | -70.6 | 22.8 | -177.3 | -142.9 | 61.7 | 0 | 0 | 0 | 114.2 | H188 | H188-H192 AromaticContact CD2-ND1 3.92Å; H188-H192 AromaticContact CE1-CE1 3.5Å; H188-H192 AromaticContact CE1-CG 3.77Å; H188-H192 AromaticContact CE1-ND1 3.17Å; H188-H192 PolarHBondContact CE1-ND1 2.8Å; H188-H192 AromaticContact ND1-ND1 3.96Å; H188-H192 AromaticContact NE2-CE1 3.11Å; H188-H192 PolarHBondContact NE2-CE1 3.3Å; H188-H192 AromaticContact NE2-ND1 3.11Å; H188-H192 PolarHBondContact NE2-ND1 3.08Å; H188-H192 VanDerWaalsContact NE2-ND1 3.11Å | ||
| 193 | S | 73.4 | Confident | 80.5 | Confident | 47 Ų | 47 | 73.7 Ų | 73.7 | 33% | 0.329 | 37% | 0.371 | S | S | . | . | trans | -96.8 | 120.3 | -174.1 | 77.5 | 0 | 0 | 0 | 0 | 111.7 | V191 F195 F196 | V191-S193 WeakPolarHBondContact CG1-OG 3.26Å; V191-S193 PolarHBondContact O-N 2.78Å; S193-F195 PolarHBondContact O-N 3.23Å; S193-F195 VanDerWaalsContact O-N 3.14Å; S193-F196 WeakPolarHBondContact O-CB 3.29Å; S193-F196 PolarHBondContact O-N 3.33Å; S193-F196 VanDerWaalsContact O-N 3.14Å | ||
| 194 | H | 78.1 | Confident | 80.6 | Confident | 62 Ų | 62 | 74.5 Ų | 74.5 | 29% | 0.287 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -57 | -24.8 | 169.9 | -63.1 | -56.8 | 0 | 0 | 0 | 113.1 | F196 F197 H198 K250 E253 | H194-F196 PolarHBondContact O-N 2.97Å; H194-F197 PolarHBondContact O-N 2.8Å; H194-F197 VanDerWaalsContact O-N 3.12Å; H194-H198 PolarHBondContact O-CD2 3.3Å; H194-H198 PolarHBondContact O-N 3.39Å; H194-H198 VanDerWaalsContact O-N 3.12Å; H194-K250 VanDerWaalsContact CE1-CE 3.46Å; H194-K250 WeakPolarHBondContact CE1-CE 3.22Å; H194-K250 PolarHBondContact NE2-NZ 3.12Å; H194-K250 VanDerWaalsContact NE2-NZ 3.12Å; H194-E253 IonicContact CE1-OE1 2.91Å; H194-E253 IonicContact NE2-OE1 2.66Å; H194-E253 PolarHBondContact NE2-OE1 2.91Å |
| 195 | F | 82.7 | Confident | 80.7 | Confident | 155 Ų | 155 | 74.4 Ų | 74.4 | 68% | 0.68 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -53.3 | -38.3 | 176.1 | -175.7 | -96.2 | 0 | 0 | 0 | 112.2 | S193 H198 F199 | S193-F195 PolarHBondContact O-N 3.23Å; S193-F195 VanDerWaalsContact O-N 3.14Å; F195-H198 PolarHBondContact O-N 3.1Å; F195-F199 WeakPolarHBondContact O-CB 3.37Å; F195-F199 PolarHBondContact O-N 3.22Å |
| 196 | F | 82.7 | Confident | 81 | Confident | 53 Ų | 53 | 75.7 Ų | 75.7 | 23% | 0.232 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -64.4 | -43.5 | 179.4 | -175.9 | -103.4 | 0 | 0 | 0 | 112.4 | L187 S193 H194 H198 F199 L200 | L187-F196 HydrophobicContact CB-CD1 4.28Å; L187-F196 HydrophobicContact CB-CE1 3.8Å; L187-F196 HydrophobicContact CB-CZ 4.31Å; L187-F196 HydrophobicContact CD1-CD1 4.47Å; L187-F196 HydrophobicContact CD1-CE1 3.36Å; L187-F196 HydrophobicContact CD1-CE2 4.02Å; L187-F196 HydrophobicContact CD1-CZ 3.1Å; L187-F196 HydrophobicContact CG-CE1 4.2Å; L187-F196 HydrophobicContact CG-CZ 4.3Å; S193-F196 WeakPolarHBondContact O-CB 3.29Å; S193-F196 PolarHBondContact O-N 3.33Å; S193-F196 VanDerWaalsContact O-N 3.14Å; H194-F196 PolarHBondContact O-N 2.97Å; F196-H198 PolarHBondContact O-N 2.74Å; F196-F199 PolarHBondContact O-N 3.09Å; F196-L200 HydrophobicContact CD1-CD1 4.05Å; F196-L200 HydrophobicContact CD1-CG 4.41Å; F196-L200 HydrophobicContact CE1-CD1 3.19Å; F196-L200 HydrophobicContact CE1-CG 3.79Å; F196-L200 HydrophobicContact CE2-CD1 4.4Å; F196-L200 HydrophobicContact CE2-CG 4.2Å; F196-L200 HydrophobicContact CZ-CD1 3.39Å; F196-L200 HydrophobicContact CZ-CD2 4.04Å; F196-L200 HydrophobicContact CZ-CG 3.63Å; F196-L200 PolarHBondContact O-N 3.14Å |
| 197 | F | 85.3 | Confident | 81.2 | Confident | 3 Ų | 3 | 72.2 Ų | 72.2 | 1% | 0.013 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.7 | -46.4 | 174.6 | 173.2 | -100.7 | 0 | 0 | 0 | 111.2 | I180 T184 H194 F199 L200 S201 L241 Y242 H245 | I180-F197 HydrophobicContact CG2-CD2 4.32Å; I180-F197 HydrophobicContact CG2-CE2 4.04Å; T184-F197 HydrophobicContact CG2-CB 4.26Å; T184-F197 HydrophobicContact CG2-CD2 4.05Å; H194-F197 PolarHBondContact O-N 2.8Å; H194-F197 VanDerWaalsContact O-N 3.12Å; F197-F199 VanDerWaalsContact C-N 3.29Å; F197-F199 PolarHBondContact O-N 3.48Å; F197-L200 PolarHBondContact O-N 3.38Å; F197-S201 WeakPolarHBondContact O-CB 3.24Å; F197-S201 PolarHBondContact O-N 3.22Å; F197-L241 HydrophobicContact CE2-CG 4.39Å; F197-L241 HydrophobicContact CZ-CG 4.14Å; F197-Y242 AromaticContact CE1-CD1 3.91Å; F197-Y242 HydrophobicContact CE1-CD1 3.91Å; F197-Y242 AromaticContact CE1-CE1 3.83Å; F197-Y242 HydrophobicContact CE1-CE1 3.83Å; F197-H245 HydrophobicContact CD1-CB 4.37Å; F197-H245 AromaticContact CD1-CD2 3.66Å; F197-H245 AromaticContact CD1-CE1 3.72Å; F197-H245 AromaticContact CD1-CG 3.69Å; F197-H245 AromaticContact CD1-ND1 3.74Å; F197-H245 AromaticContact CD1-NE2 3.68Å; F197-H245 HydrophobicContact CD2-CB 4.24Å; F197-H245 AromaticContact CD2-CD2 3.27Å; F197-H245 WeakPolarHBondContact CD2-CD2 3.41Å; F197-H245 AromaticContact CD2-CG 3.83Å; F197-H245 AromaticContact CD2-NE2 3.85Å; F197-H245 HydrophobicContact CE1-CB 3.67Å; F197-H245 AromaticContact CE1-CD2 3.86Å; F197-H245 AromaticContact CE1-CG 3.46Å; F197-H245 VanDerWaalsContact CE1-CG 3.46Å; F197-H245 AromaticContact CE1-ND1 3.67Å; F197-H245 HydrophobicContact CE2-CB 3.52Å; F197-H245 AromaticContact CE2-CD2 3.49Å; F197-H245 VanDerWaalsContact CE2-CD2 3.49Å; F197-H245 WeakPolarHBondContact CE2-CD2 3.42Å; F197-H245 AromaticContact CE2-CG 3.61Å; F197-H245 AromaticContact CG-CD2 3.36Å; F197-H245 WeakPolarHBondContact CG-CD2 3.31Å; F197-H245 AromaticContact CG-CE1 3.98Å; F197-H245 AromaticContact CG-CG 3.87Å; F197-H245 AromaticContact CG-NE2 3.44Å; F197-H245 WeakPolarHBondContact CG-NE2 3.24Å; F197-H245 HydrophobicContact CZ-CB 3.18Å; F197-H245 AromaticContact CZ-CD2 3.79Å; F197-H245 AromaticContact CZ-CG 3.43Å; F197-H245 VanDerWaalsContact CZ-CG 3.43Å |
| 198 | H | 88 | Confident | 81.6 | Confident | 72 Ų | 72 | 69.1 Ų | 69.1 | 33% | 0.333 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61 | -38.9 | 177.2 | -68.5 | -65.1 | 0 | 0 | 0 | 112.3 | H194 F195 F196 L202 Y242 | H194-H198 PolarHBondContact O-CD2 3.3Å; H194-H198 PolarHBondContact O-N 3.39Å; H194-H198 VanDerWaalsContact O-N 3.12Å; F195-H198 PolarHBondContact O-N 3.1Å; F196-H198 PolarHBondContact O-N 2.74Å; H198-L202 VanDerWaalsContact O-CB 3.24Å; H198-L202 WeakPolarHBondContact O-CB 3.31Å; H198-L202 PolarHBondContact O-N 2.92Å; H198-Y242 AromaticContact CE1-CE1 3.72Å; H198-Y242 AromaticContact ND1-CE1 3.65Å; H198-Y242 AromaticContact ND1-CZ 3.8Å; H198-Y242 PolarHBondContact ND1-OH 3.07Å |
| 199 | F | 89 | Confident | 82.6 | Confident | 108 Ų | 108 | 67.5 Ų | 67.5 | 47% | 0.474 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65.4 | -48.1 | 177.2 | -178.9 | -99.8 | 0 | 0 | 0 | 112.5 | F195 F196 F197 L202 T203 | F195-F199 WeakPolarHBondContact O-CB 3.37Å; F195-F199 PolarHBondContact O-N 3.22Å; F196-F199 PolarHBondContact O-N 3.09Å; F197-F199 VanDerWaalsContact C-N 3.29Å; F197-F199 PolarHBondContact O-N 3.48Å; F199-L202 PolarHBondContact O-N 3.5Å; F199-T203 HydrophobicContact CE1-CG2 4.26Å; F199-T203 HydrophobicContact CE2-CG2 4.13Å; F199-T203 HydrophobicContact CZ-CG2 4Å; F199-T203 WeakPolarHBondContact O-CB 3.25Å; F199-T203 WeakPolarHBondContact O-CG2 3.31Å; F199-T203 PolarHBondContact O-N 2.92Å; F199-T203 PolarHBondContact O-OG1 3.14Å |
| 200 | L | 87.9 | Confident | 83.6 | Confident | 21 Ų | 21 | 61.8 Ų | 61.8 | 11% | 0.11 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 175.5 | -74.8 | -173.1 | 0 | 0 | 0 | 112.3 | I180 A183 F196 F197 L202 T203 L204 | I180-L200 HydrophobicContact CG2-CB 4.21Å; A183-L200 HydrophobicContact CB-CD1 3.68Å; F196-L200 HydrophobicContact CD1-CD1 4.05Å; F196-L200 HydrophobicContact CD1-CG 4.41Å; F196-L200 HydrophobicContact CE1-CD1 3.19Å; F196-L200 HydrophobicContact CE1-CG 3.79Å; F196-L200 HydrophobicContact CE2-CD1 4.4Å; F196-L200 HydrophobicContact CE2-CG 4.2Å; F196-L200 HydrophobicContact CZ-CD1 3.39Å; F196-L200 HydrophobicContact CZ-CD2 4.04Å; F196-L200 HydrophobicContact CZ-CG 3.63Å; F196-L200 PolarHBondContact O-N 3.14Å; F197-L200 PolarHBondContact O-N 3.38Å; L200-L202 VanDerWaalsContact C-N 3.34Å; L200-L202 PolarHBondContact O-N 2.98Å; L200-T203 WeakPolarHBondContact CA-OG1 3.09Å; L200-T203 PolarHBondContact O-N 2.97Å; L200-T203 PolarHBondContact O-OG1 3.11Å; L200-L204 HydrophobicContact CD2-CD1 4.44Å; L200-L204 WeakPolarHBondContact O-CB 3.35Å; L200-L204 PolarHBondContact O-N 2.9Å |
| 201 | S | 88.5 | Confident | 84.4 | Confident | 3 Ų | 3 | 59.1 Ų | 59.1 | 2% | 0.021 | 30% | 0.303 | C | S | . | . | I | π-helix | trans | -59.5 | -44.8 | 176 | 175.8 | 0 | 0 | 0 | 0 | 111.3 | F197 G205 L241 | F197-S201 WeakPolarHBondContact O-CB 3.24Å; F197-S201 PolarHBondContact O-N 3.22Å; S201-G205 WeakPolarHBondContact O-CA 3.14Å; S201-G205 PolarHBondContact O-N 2.8Å; S201-L241 VanDerWaalsContact OG-CD2 3.31Å; S201-L241 WeakPolarHBondContact OG-CD2 3.12Å |
| 202 | L | 89.5 | Confident | 85.7 | Confident | 125 Ų | 125 | 55.7 Ų | 55.7 | 65% | 0.654 | 28% | 0.282 | S | S | * | . | I | π-helix | trans | -68 | -44.1 | 177.9 | -173.5 | 65 | 0 | 0 | 0 | 111.6 | H198 F199 L200 S206 | H198-L202 VanDerWaalsContact O-CB 3.24Å; H198-L202 WeakPolarHBondContact O-CB 3.31Å; H198-L202 PolarHBondContact O-N 2.92Å; F199-L202 PolarHBondContact O-N 3.5Å; L200-L202 VanDerWaalsContact C-N 3.34Å; L200-L202 PolarHBondContact O-N 2.98Å; L202-S206 WeakPolarHBondContact O-CB 3.3Å; L202-S206 PolarHBondContact O-N 3.28Å; L202-S206 PolarHBondContact O-OG 3.41Å |
| 203 | T | 89.8 | Confident | 86.8 | Confident | 57 Ų | 57 | 49.6 Ų | 49.6 | 35% | 0.35 | 25% | 0.254 | S | S | . | . | I | π-helix | trans | -74.1 | -62.2 | -176.3 | 51.2 | 0 | 0 | 0 | 0 | 112.4 | F199 L200 S206 L207 | F199-T203 HydrophobicContact CE1-CG2 4.26Å; F199-T203 HydrophobicContact CE2-CG2 4.13Å; F199-T203 HydrophobicContact CZ-CG2 4Å; F199-T203 WeakPolarHBondContact O-CB 3.25Å; F199-T203 WeakPolarHBondContact O-CG2 3.31Å; F199-T203 PolarHBondContact O-N 2.92Å; F199-T203 PolarHBondContact O-OG1 3.14Å; L200-T203 WeakPolarHBondContact CA-OG1 3.09Å; L200-T203 PolarHBondContact O-N 2.97Å; L200-T203 PolarHBondContact O-OG1 3.11Å; T203-S206 PolarHBondContact O-OG 3.48Å; T203-L207 WeakPolarHBondContact O-CB 3.4Å; T203-L207 PolarHBondContact O-N 2.7Å |
| 204 | L | 89.7 | Confident | 87.4 | Confident | 44 Ų | 44 | 53.7 Ų | 53.7 | 23% | 0.23 | 26% | 0.263 | C | S | . | . | I | π-helix | trans | -74.6 | -34 | -177.9 | -68.1 | 176.3 | 0 | 0 | 0 | 112.5 | I180 L200 L207 S208 | I180-L204 HydrophobicContact CD1-CB 3.67Å; I180-L204 HydrophobicContact CG1-CB 3.71Å; I180-L204 HydrophobicContact CG1-CD1 3.79Å; I180-L204 HydrophobicContact CG1-CG 4.39Å; L200-L204 HydrophobicContact CD2-CD1 4.44Å; L200-L204 WeakPolarHBondContact O-CB 3.35Å; L200-L204 PolarHBondContact O-N 2.9Å; L204-L207 PolarHBondContact O-N 2.91Å; L204-S208 PolarHBondContact O-N 3.27Å |
| 205 | G | 89 | Confident | 87.6 | Confident | 5 Ų | 5 | 52.5 Ų | 52.5 | 5% | 0.052 | 26% | 0.257 | C | S | . | . | I | π-helix | trans | -68.8 | -40.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | S201 L207 S208 T209 | S201-G205 WeakPolarHBondContact O-CA 3.14Å; S201-G205 PolarHBondContact O-N 2.8Å; G205-L207 VanDerWaalsContact C-N 3.34Å; G205-S208 PolarHBondContact O-N 2.83Å; G205-T209 WeakPolarHBondContact O-CB 3.23Å; G205-T209 PolarHBondContact O-N 3.49Å; G205-T209 PolarHBondContact O-OG1 2.77Å |
| 206 | S | 89.4 | Confident | 87.6 | Confident | 60 Ų | 60 | 45.5 Ų | 45.5 | 42% | 0.42 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -65.6 | -38.2 | 173 | 66.8 | 0 | 0 | 0 | 0 | 111.9 | L202 T203 S208 T209 L210 | L202-S206 WeakPolarHBondContact O-CB 3.3Å; L202-S206 PolarHBondContact O-N 3.28Å; L202-S206 PolarHBondContact O-OG 3.41Å; T203-S206 PolarHBondContact O-OG 3.48Å; S206-S208 PolarHBondContact O-N 2.83Å; S206-T209 PolarHBondContact O-N 3.47Å; S206-L210 VanDerWaalsContact O-CB 3.32Å; S206-L210 WeakPolarHBondContact O-CB 2.94Å; S206-L210 PolarHBondContact O-N 2.84Å |
| 207 | L | 89.9 | Confident | 87.6 | Confident | 58 Ų | 58 | 49 Ų | 49 | 30% | 0.304 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.5 | -43.3 | 178.7 | -160.1 | 65.2 | 0 | 0 | 0 | 111.9 | L88 P90 T203 L204 G205 R211 | L88-L207 WeakPolarHBondContact O-CD2 3.5Å; L88-L207 WeakPolarHBondContact O-CG 3Å; P90-L207 HydrophobicContact CG-CD1 3.47Å; P90-L207 VanDerWaalsContact CG-CD1 3.47Å; P90-L207 HydrophobicContact CG-CG 4.03Å; T203-L207 WeakPolarHBondContact O-CB 3.4Å; T203-L207 PolarHBondContact O-N 2.7Å; L204-L207 PolarHBondContact O-N 2.91Å; G205-L207 VanDerWaalsContact C-N 3.34Å; L207-R211 PolarHBondContact O-N 3.27Å |
| 208 | S | 88.9 | Confident | 87.2 | Confident | 7 Ų | 7 | 53.4 Ų | 53.4 | 5% | 0.049 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64 | -44.8 | 173.2 | -171.7 | 0 | 0 | 0 | 0 | 112.1 | A173 L204 G205 S206 L210 R211 L212 | A173-S208 PolarHBondContact O-OG 3.4Å; L204-S208 PolarHBondContact O-N 3.27Å; G205-S208 PolarHBondContact O-N 2.83Å; S206-S208 PolarHBondContact O-N 2.83Å; S208-L210 PolarHBondContact O-N 2.7Å; S208-R211 WeakPolarHBondContact O-CB 3.41Å; S208-R211 PolarHBondContact O-N 2.8Å; S208-L212 PolarHBondContact O-N 3.5Å |
| 209 | T | 91.1 | Very high | 86.6 | Confident | 8 Ų | 8 | 55.9 Ų | 55.9 | 5% | 0.049 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.4 | -44.5 | 178.2 | -57.3 | 0 | 0 | 0 | 0 | 111.3 | G205 S206 R211 L212 I213 I233 | G205-T209 WeakPolarHBondContact O-CB 3.23Å; G205-T209 PolarHBondContact O-N 3.49Å; G205-T209 PolarHBondContact O-OG1 2.77Å; S206-T209 PolarHBondContact O-N 3.47Å; T209-R211 VanDerWaalsContact C-N 3.3Å; T209-R211 PolarHBondContact O-N 3.22Å; T209-L212 PolarHBondContact O-N 3.48Å; T209-I213 HydrophobicContact CG2-CD1 3.73Å; T209-I213 HydrophobicContact CG2-CG1 4.39Å; T209-I213 VanDerWaalsContact O-CG1 3.31Å; T209-I213 WeakPolarHBondContact O-CG1 3.12Å; T209-I213 PolarHBondContact O-N 2.9Å; T209-I233 HydrophobicContact CG2-CG2 4.04Å |
| 210 | L | 89.4 | Confident | 86 | Confident | 94 Ų | 94 | 51 Ų | 51 | 49% | 0.492 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.8 | -38.2 | 179.6 | -176.7 | 62.1 | 0 | 0 | 0 | 111.8 | P90 S206 S208 I213 R214 | P90-L210 HydrophobicContact CB-CG 4.49Å; P90-L210 HydrophobicContact CG-CD2 4.13Å; S206-L210 VanDerWaalsContact O-CB 3.32Å; S206-L210 WeakPolarHBondContact O-CB 2.94Å; S206-L210 PolarHBondContact O-N 2.84Å; S208-L210 PolarHBondContact O-N 2.7Å; L210-I213 PolarHBondContact O-N 2.91Å; L210-R214 VanDerWaalsContact O-CB 3.29Å; L210-R214 WeakPolarHBondContact O-CB 3.3Å; L210-R214 PolarHBondContact O-N 3.07Å |
| 211 | R | 84.2 | Confident | 85.3 | Confident | 32 Ų | 32 | 57.6 Ų | 57.6 | 12% | 0.121 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.1 | -48 | 175.1 | -177.3 | 176.3 | 166.5 | -151.2 | -0.4 | 111.8 | S87 P90 L207 S208 T209 R214 H215 | S87-R211 VanDerWaalsContact CA-CZ 3.49Å; S87-R211 VanDerWaalsContact O-CD 3.22Å; S87-R211 WeakPolarHBondContact O-CD 3.4Å; S87-R211 PolarHBondContact O-NH1 2.88Å; S87-R211 VanDerWaalsContact O-NH1 3.1Å; S87-R211 PolarHBondContact OG-NH1 2.97Å; S87-R211 VanDerWaalsContact OG-NH1 3.09Å; P90-R211 HydrophobicContact CB-CB 3.98Å; L207-R211 PolarHBondContact O-N 3.27Å; S208-R211 WeakPolarHBondContact O-CB 3.41Å; S208-R211 PolarHBondContact O-N 2.8Å; T209-R211 VanDerWaalsContact C-N 3.3Å; T209-R211 PolarHBondContact O-N 3.22Å; R211-R214 PolarHBondContact O-N 2.89Å; R211-H215 PolarHBondContact O-N 2.98Å |
| 212 | L | 88 | Confident | 85.1 | Confident | 3 Ų | 3 | 62.2 Ų | 62.2 | 2% | 0.016 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.8 | -46.6 | 178.8 | -70.4 | 173.8 | 0 | 0 | 0 | 111.2 | I169 A173 S208 T209 R214 H215 F216 I233 N237 | I169-L212 HydrophobicContact CG2-CD2 3.29Å; A173-L212 HydrophobicContact CB-CD1 3.78Å; A173-L212 HydrophobicContact CB-CD2 4.18Å; A173-L212 HydrophobicContact CB-CG 4.12Å; S208-L212 PolarHBondContact O-N 3.5Å; T209-L212 PolarHBondContact O-N 3.48Å; L212-R214 VanDerWaalsContact C-N 3.33Å; L212-R214 PolarHBondContact O-N 3.47Å; L212-H215 WeakPolarHBondContact O-CB 3.46Å; L212-H215 PolarHBondContact O-N 2.91Å; L212-F216 WeakPolarHBondContact O-CD2 3.26Å; L212-F216 PolarHBondContact O-N 3.44Å; L212-I233 HydrophobicContact CB-CD1 4.34Å; L212-I233 HydrophobicContact CB-CG2 3.49Å; L212-I233 VanDerWaalsContact CB-CG2 3.49Å; L212-I233 HydrophobicContact CD1-CG2 3.9Å; L212-I233 HydrophobicContact CG-CG2 4.37Å; L212-N237 WeakPolarHBondContact CD1-ND2 3.24Å; L212-N237 WeakPolarHBondContact CD1-OD1 3.38Å |
| 213 | I | 89.3 | Confident | 84.8 | Confident | 25 Ų | 25 | 61.4 Ų | 61.4 | 13% | 0.128 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -56.9 | -49.3 | 176.2 | -66.9 | 161.7 | 0 | 0 | 0 | 109.9 | T209 L210 H215 F216 Y217 T230 I233 | T209-I213 HydrophobicContact CG2-CD1 3.73Å; T209-I213 HydrophobicContact CG2-CG1 4.39Å; T209-I213 VanDerWaalsContact O-CG1 3.31Å; T209-I213 WeakPolarHBondContact O-CG1 3.12Å; T209-I213 PolarHBondContact O-N 2.9Å; L210-I213 PolarHBondContact O-N 2.91Å; I213-H215 VanDerWaalsContact C-N 3.27Å; I213-H215 PolarHBondContact O-N 3.39Å; I213-F216 PolarHBondContact O-N 3.32Å; I213-F216 VanDerWaalsContact O-N 3.16Å; I213-Y217 WeakPolarHBondContact O-CB 3.07Å; I213-Y217 PolarHBondContact O-N 3.39Å; I213-T230 HydrophobicContact CD1-CG2 3.67Å; I213-T230 HydrophobicContact CG1-CG2 4.27Å; I213-I233 HydrophobicContact CG1-CB 4.31Å; I213-I233 HydrophobicContact CG1-CD1 4.16Å; I213-I233 HydrophobicContact CG1-CG2 4.09Å |
| 214 | R | 85.6 | Confident | 84.6 | Confident | 132 Ų | 132 | 62.3 Ų | 62.3 | 50% | 0.498 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -57 | -39.6 | -178.4 | -177.2 | 178.7 | 174.2 | 133 | 1.7 | 112.6 | L210 R211 L212 F216 Y217 | L210-R214 VanDerWaalsContact O-CB 3.29Å; L210-R214 WeakPolarHBondContact O-CB 3.3Å; L210-R214 PolarHBondContact O-N 3.07Å; R211-R214 PolarHBondContact O-N 2.89Å; L212-R214 VanDerWaalsContact C-N 3.33Å; L212-R214 PolarHBondContact O-N 3.47Å; R214-F216 PolarHBondContact O-N 2.79Å; R214-Y217 PolarHBondContact O-N 2.8Å |
| 215 | H | 82.8 | Confident | 84.5 | Confident | 38 Ų | 38 | 61.4 Ų | 61.4 | 18% | 0.176 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -57.4 | -50.7 | 177.5 | -178.1 | 82.8 | 0 | 0 | 0 | 111.3 | Y99 H161 I169 R211 L212 I213 S218 | Y99-H215 PolarHBondContact OH-CE1 2.78Å; H161-H215 AromaticContact CE1-NE2 3.91Å; I169-H215 WeakPolarHBondContact CD1-CE1 3.39Å; I169-H215 WeakPolarHBondContact CD1-NE2 3.35Å; R211-H215 PolarHBondContact O-N 2.98Å; L212-H215 WeakPolarHBondContact O-CB 3.46Å; L212-H215 PolarHBondContact O-N 2.91Å; I213-H215 VanDerWaalsContact C-N 3.27Å; I213-H215 PolarHBondContact O-N 3.39Å; H215-S218 PolarHBondContact O-OG 2.88Å |
| 216 | F | 81.7 | Confident | 84.4 | Confident | 7 Ų | 7 | 63.4 Ų | 63.4 | 3% | 0.031 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -81.6 | -25.3 | -178.3 | -68.8 | -80.8 | 0 | 0 | 0 | 113.6 | L150 I166 L212 I213 R214 S218 R219 S220 L229 I233 | L150-F216 HydrophobicContact CB-CZ 4.32Å; L150-F216 HydrophobicContact CD1-CE2 4.1Å; L150-F216 HydrophobicContact CD1-CZ 4.29Å; L150-F216 HydrophobicContact CD2-CE2 4.36Å; I166-F216 HydrophobicContact CG1-CZ 4.31Å; L212-F216 WeakPolarHBondContact O-CD2 3.26Å; L212-F216 PolarHBondContact O-N 3.44Å; I213-F216 PolarHBondContact O-N 3.32Å; I213-F216 VanDerWaalsContact O-N 3.16Å; R214-F216 PolarHBondContact O-N 2.79Å; F216-S218 VanDerWaalsContact C-N 3.28Å; F216-S218 PolarHBondContact O-N 2.86Å; F216-R219 PolarHBondContact O-N 3.05Å; F216-R219 VanDerWaalsContact O-N 3.09Å; F216-S220 PolarHBondContact O-N 2.89Å; F216-S220 VanDerWaalsContact O-N 3.15Å; F216-L229 HydrophobicContact CB-CD1 4.03Å; F216-L229 HydrophobicContact CB-CD2 3.35Å; F216-L229 HydrophobicContact CB-CG 4.16Å; F216-L229 HydrophobicContact CD1-CD1 4.49Å; F216-L229 HydrophobicContact CD2-CD1 4.39Å; F216-L229 HydrophobicContact CG-CD1 4.08Å; F216-L229 HydrophobicContact CG-CD2 4.3Å; F216-I233 HydrophobicContact CD2-CD1 3.93Å |
| 217 | Y | 83.1 | Confident | 84.4 | Confident | 126 Ų | 126 | 66.2 Ų | 66.2 | 49% | 0.494 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.5 | -36.6 | -179 | -169.9 | -88.2 | 0 | 0 | 0 | 112.1 | I213 R214 R219 K226 | I213-Y217 WeakPolarHBondContact O-CB 3.07Å; I213-Y217 PolarHBondContact O-N 3.39Å; R214-Y217 PolarHBondContact O-N 2.8Å; Y217-R219 PolarHBondContact O-N 2.78Å; Y217-R219 VanDerWaalsContact O-N 3.14Å; Y217-K226 HydrophobicContact CD2-CD 4.24Å; Y217-K226 HydrophobicContact CD2-CG 4.41Å; Y217-K226 HydrophobicContact CE2-CD 3.72Å; Y217-K226 HydrophobicContact CE2-CG 4.3Å |
| 218 | S | 77.3 | Confident | 84.4 | Confident | 96 Ų | 96 | 65.6 Ų | 65.6 | 67% | 0.671 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -18.3 | 177.8 | 66.1 | 0 | 0 | 0 | 0 | 114 | H215 F216 | H215-S218 PolarHBondContact O-OG 2.88Å; F216-S218 VanDerWaalsContact C-N 3.28Å; F216-S218 PolarHBondContact O-N 2.86Å |
| 219 | R | 75.1 | Confident | 84.5 | Confident | 124 Ų | 124 | 65.4 Ų | 65.4 | 47% | 0.468 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.8 | -24.3 | -173.1 | -61.5 | -176.6 | -177.8 | -170.3 | -1.6 | 113.9 | H161 F216 Y217 | H161-R219 PolarHBondContact CE1-NH1 2.94Å; H161-R219 PolarHBondContact ND1-NH1 3.09Å; F216-R219 PolarHBondContact O-N 3.05Å; F216-R219 VanDerWaalsContact O-N 3.09Å; Y217-R219 PolarHBondContact O-N 2.78Å; Y217-R219 VanDerWaalsContact O-N 3.14Å |
| 220 | S | 76.9 | Confident | 84.5 | Confident | 7 Ų | 7 | 67 Ų | 67 | 5% | 0.049 | 35% | 0.346 | C | S | . | . | trans | -76.7 | 126.9 | 177 | -177.8 | 0 | 0 | 0 | 0 | 110.8 | F216 K226 | F216-S220 PolarHBondContact O-N 2.89Å; F216-S220 VanDerWaalsContact O-N 3.15Å; S220-K226 WeakPolarHBondContact O-CE 3.33Å; S220-K226 PolarHBondContact O-NZ 3.44Å; S220-K226 WeakPolarHBondContact OG-CG 3.35Å | ||
| 221 | L | 72.5 | Confident | 84.6 | Confident | 158 Ų | 158 | 66.6 Ų | 66.6 | 83% | 0.827 | 35% | 0.347 | S | S | * | . | trans | -91.2 | -40.8 | -179.7 | -74.7 | 153.2 | 0 | 0 | 0 | 112.2 | ||||
| 222 | Q | 83.9 | Confident | 85.1 | Confident | 101 Ų | 101 | 66.9 Ų | 66.9 | 47% | 0.472 | 35% | 0.351 | S | S | . | . | trans | -87.3 | 138.2 | -171.2 | -61 | 179.8 | -1.2 | 0 | 0 | 112.8 | S224 Q225 K226 | Q222-S224 PolarHBondContact O-N 3.5Å; Q222-Q225 HydrophobicContact CB-CB 4.13Å; Q222-Q225 HydrophobicContact CB-CG 3.83Å; Q222-Q225 PolarHBondContact O-N 2.73Å; Q222-K226 WeakPolarHBondContact O-CG 3.46Å; Q222-K226 PolarHBondContact O-N 3.35Å | ||
| 223 | P | 83.5 | Confident | 85.3 | Confident | 108 Ų | 108 | 66.8 Ų | 66.8 | 70% | 0.701 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -65.9 | -37 | -177.9 | 25.6 | -33.8 | 0 | 0 | 0 | 113.5 | Q225 K226 L227 | P223-Q225 VanDerWaalsContact C-N 3.34Å; P223-Q225 PolarHBondContact O-N 3.36Å; P223-K226 PolarHBondContact O-N 3.16Å; P223-L227 PolarHBondContact O-N 2.82Å |
| 224 | S | 85.8 | Confident | 85.5 | Confident | 75 Ų | 75 | 67.9 Ų | 67.9 | 52% | 0.524 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -61.9 | -42.5 | 175.9 | 53.4 | 0 | 0 | 0 | 0 | 111.8 | Q222 L227 A228 | Q222-S224 PolarHBondContact O-N 3.5Å; S224-L227 PolarHBondContact O-N 2.77Å; S224-A228 PolarHBondContact O-N 3.46Å |
| 225 | Q | 86.9 | Confident | 85.9 | Confident | 26 Ų | 26 | 67.3 Ų | 67.3 | 12% | 0.121 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -64.9 | -42.3 | 176.6 | -66 | -175.4 | -25.3 | 0 | 0 | 111.9 | W156 L157 Q222 P223 L227 A228 L229 | W156-Q225 HydrophobicContact CH2-CG 3.81Å; W156-Q225 HydrophobicContact CZ3-CB 4.17Å; W156-Q225 HydrophobicContact CZ3-CG 3.61Å; L157-Q225 HydrophobicContact CD1-CB 3.9Å; L157-Q225 HydrophobicContact CD1-CG 3.99Å; L157-Q225 HydrophobicContact CG-CB 4.39Å; Q222-Q225 HydrophobicContact CB-CB 4.13Å; Q222-Q225 HydrophobicContact CB-CG 3.83Å; Q222-Q225 PolarHBondContact O-N 2.73Å; P223-Q225 VanDerWaalsContact C-N 3.34Å; P223-Q225 PolarHBondContact O-N 3.36Å; Q225-L227 VanDerWaalsContact C-N 3.32Å; Q225-L227 PolarHBondContact O-N 2.81Å; Q225-A228 PolarHBondContact O-N 2.65Å; Q225-L229 WeakPolarHBondContact O-CB 3.5Å; Q225-L229 PolarHBondContact O-N 3.43Å |
| 226 | K | 88 | Confident | 86.4 | Confident | 47 Ų | 47 | 66.8 Ų | 66.8 | 20% | 0.204 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.3 | -42.9 | 175.2 | -72.2 | 173.5 | 179.4 | -179.9 | 0 | 111.9 | Y217 S220 Q222 P223 T230 | Y217-K226 HydrophobicContact CD2-CD 4.24Å; Y217-K226 HydrophobicContact CD2-CG 4.41Å; Y217-K226 HydrophobicContact CE2-CD 3.72Å; Y217-K226 HydrophobicContact CE2-CG 4.3Å; S220-K226 WeakPolarHBondContact O-CE 3.33Å; S220-K226 PolarHBondContact O-NZ 3.44Å; S220-K226 WeakPolarHBondContact OG-CG 3.35Å; Q222-K226 WeakPolarHBondContact O-CG 3.46Å; Q222-K226 PolarHBondContact O-N 3.35Å; P223-K226 PolarHBondContact O-N 3.16Å; K226-T230 VanDerWaalsContact O-CB 3.26Å; K226-T230 WeakPolarHBondContact O-CB 3.24Å; K226-T230 PolarHBondContact O-N 3.11Å; K226-T230 PolarHBondContact O-OG1 3.42Å |
| 227 | L | 89.5 | Confident | 86.9 | Confident | 119 Ų | 119 | 66.8 Ų | 66.8 | 62% | 0.623 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -64.7 | -51 | 177.8 | -173.9 | 66.5 | 0 | 0 | 0 | 110.8 | P223 S224 Q225 L229 T230 T231 | P223-L227 PolarHBondContact O-N 2.82Å; S224-L227 PolarHBondContact O-N 2.77Å; Q225-L227 VanDerWaalsContact C-N 3.32Å; Q225-L227 PolarHBondContact O-N 2.81Å; L227-L229 VanDerWaalsContact C-N 3.34Å; L227-L229 PolarHBondContact O-N 3.02Å; L227-T230 PolarHBondContact O-N 2.69Å; L227-T230 VanDerWaalsContact O-N 3.15Å; L227-T231 PolarHBondContact O-N 2.77Å; L227-T231 PolarHBondContact O-OG1 2.82Å; L227-T231 VanDerWaalsContact O-OG1 3.06Å |
| 228 | A | 89.5 | Confident | 87.3 | Confident | 44 Ų | 44 | 62.6 Ų | 62.6 | 36% | 0.364 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.7 | -44.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | S224 Q225 T231 L232 | S224-A228 PolarHBondContact O-N 3.46Å; Q225-A228 PolarHBondContact O-N 2.65Å; A228-T231 PolarHBondContact O-N 3.23Å; A228-L232 WeakPolarHBondContact O-CB 3.15Å; A228-L232 PolarHBondContact O-N 3.19Å |
| 229 | L | 90.3 | Very high | 88 | Confident | 3 Ų | 3 | 59.6 Ų | 59.6 | 2% | 0.016 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.1 | -45.9 | 175.3 | 171.7 | 71.1 | 0 | 0 | 0 | 112 | L150 I153 F216 Q225 L227 L232 I233 | L150-L229 HydrophobicContact CD2-CD1 4.48Å; I153-L229 HydrophobicContact CG2-CD1 3.93Å; F216-L229 HydrophobicContact CB-CD1 4.03Å; F216-L229 HydrophobicContact CB-CD2 3.35Å; F216-L229 HydrophobicContact CB-CG 4.16Å; F216-L229 HydrophobicContact CD1-CD1 4.49Å; F216-L229 HydrophobicContact CD2-CD1 4.39Å; F216-L229 HydrophobicContact CG-CD1 4.08Å; F216-L229 HydrophobicContact CG-CD2 4.3Å; Q225-L229 WeakPolarHBondContact O-CB 3.5Å; Q225-L229 PolarHBondContact O-N 3.43Å; L227-L229 VanDerWaalsContact C-N 3.34Å; L227-L229 PolarHBondContact O-N 3.02Å; L229-L232 PolarHBondContact O-N 2.55Å; L229-I233 HydrophobicContact CD1-CD1 3.7Å; L229-I233 HydrophobicContact CD1-CG1 4.26Å; L229-I233 HydrophobicContact CG-CD1 3.87Å; L229-I233 WeakPolarHBondContact O-CB 3.4Å; L229-I233 VanDerWaalsContact O-CG1 3.27Å; L229-I233 WeakPolarHBondContact O-CG1 3.42Å; L229-I233 PolarHBondContact O-N 2.96Å |
| 230 | T | 91.7 | Very high | 88.8 | Confident | 43 Ų | 43 | 54.2 Ų | 54.2 | 26% | 0.264 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.1 | -46 | 178.8 | -63 | 0 | 0 | 0 | 0 | 111.1 | I213 K226 L227 I233 S234 | I213-T230 HydrophobicContact CD1-CG2 3.67Å; I213-T230 HydrophobicContact CG1-CG2 4.27Å; K226-T230 VanDerWaalsContact O-CB 3.26Å; K226-T230 WeakPolarHBondContact O-CB 3.24Å; K226-T230 PolarHBondContact O-N 3.11Å; K226-T230 PolarHBondContact O-OG1 3.42Å; L227-T230 PolarHBondContact O-N 2.69Å; L227-T230 VanDerWaalsContact O-N 3.15Å; T230-I233 PolarHBondContact O-N 2.81Å; T230-S234 VanDerWaalsContact O-CB 3.26Å; T230-S234 WeakPolarHBondContact O-CB 3.31Å; T230-S234 PolarHBondContact O-N 2.8Å |
| 231 | T | 91.9 | Very high | 89.5 | Confident | 84 Ų | 84 | 54 Ų | 54 | 52% | 0.515 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61.5 | -45.5 | 176.4 | -57.8 | 0 | 0 | 0 | 0 | 111.3 | L227 A228 S234 L235 | L227-T231 PolarHBondContact O-N 2.77Å; L227-T231 PolarHBondContact O-OG1 2.82Å; L227-T231 VanDerWaalsContact O-OG1 3.06Å; A228-T231 PolarHBondContact O-N 3.23Å; T231-S234 PolarHBondContact O-N 3.42Å; T231-L235 VanDerWaalsContact O-CB 3.23Å; T231-L235 WeakPolarHBondContact O-CB 3.25Å; T231-L235 PolarHBondContact O-N 2.98Å |
| 232 | L | 92.9 | Very high | 90.3 | Very high | 38 Ų | 38 | 49.9 Ų | 49.9 | 20% | 0.199 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.7 | -48.5 | 178.1 | -177.6 | 72.3 | 0 | 0 | 0 | 111.7 | C149 L150 I153 A228 L229 S234 L235 L236 | C149-L232 HydrophobicContact CB-CD2 4.04Å; L150-L232 HydrophobicContact CD2-CD2 4.28Å; I153-L232 HydrophobicContact CD1-CB 3.87Å; I153-L232 HydrophobicContact CD1-CD2 3.19Å; I153-L232 HydrophobicContact CD1-CG 4.08Å; I153-L232 HydrophobicContact CG1-CD2 3.69Å; A228-L232 WeakPolarHBondContact O-CB 3.15Å; A228-L232 PolarHBondContact O-N 3.19Å; L229-L232 PolarHBondContact O-N 2.55Å; L232-S234 VanDerWaalsContact C-N 3.3Å; L232-S234 PolarHBondContact O-N 3.11Å; L232-L235 PolarHBondContact O-N 3.27Å; L232-L236 HydrophobicContact CD1-CD1 4.11Å; L232-L236 HydrophobicContact CD1-CG 4.22Å; L232-L236 HydrophobicContact CD2-CD1 4.11Å; L232-L236 HydrophobicContact CG-CD1 3.8Å; L232-L236 HydrophobicContact CG-CG 4.28Å; L232-L236 WeakPolarHBondContact O-CB 3.34Å; L232-L236 WeakPolarHBondContact O-CG 3.23Å; L232-L236 PolarHBondContact O-N 2.78Å |
| 233 | I | 93.1 | Very high | 90.6 | Very high | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.005 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.8 | -43.8 | -179.7 | -69.9 | 169 | 0 | 0 | 0 | 110.4 | L150 T209 L212 I213 F216 L229 T230 L236 N237 | L150-I233 HydrophobicContact CD2-CD1 4.35Å; L150-I233 HydrophobicContact CD2-CG1 3.7Å; T209-I233 HydrophobicContact CG2-CG2 4.04Å; L212-I233 HydrophobicContact CB-CD1 4.34Å; L212-I233 HydrophobicContact CB-CG2 3.49Å; L212-I233 VanDerWaalsContact CB-CG2 3.49Å; L212-I233 HydrophobicContact CD1-CG2 3.9Å; L212-I233 HydrophobicContact CG-CG2 4.37Å; I213-I233 HydrophobicContact CG1-CB 4.31Å; I213-I233 HydrophobicContact CG1-CD1 4.16Å; I213-I233 HydrophobicContact CG1-CG2 4.09Å; F216-I233 HydrophobicContact CD2-CD1 3.93Å; L229-I233 HydrophobicContact CD1-CD1 3.7Å; L229-I233 HydrophobicContact CD1-CG1 4.26Å; L229-I233 HydrophobicContact CG-CD1 3.87Å; L229-I233 WeakPolarHBondContact O-CB 3.4Å; L229-I233 VanDerWaalsContact O-CG1 3.27Å; L229-I233 WeakPolarHBondContact O-CG1 3.42Å; L229-I233 PolarHBondContact O-N 2.96Å; T230-I233 PolarHBondContact O-N 2.81Å; I233-L236 PolarHBondContact O-N 3.39Å; I233-N237 PolarHBondContact O-N 3.32Å; I233-N237 PolarHBondContact O-ND2 3.08Å |
| 234 | S | 93.1 | Very high | 90.8 | Very high | 49 Ų | 49 | 46 Ų | 46 | 34% | 0.343 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.9 | -46.9 | 177.2 | -177.3 | 0 | 0 | 0 | 0 | 111.3 | T230 T231 L232 L236 N237 V238 | T230-S234 VanDerWaalsContact O-CB 3.26Å; T230-S234 WeakPolarHBondContact O-CB 3.31Å; T230-S234 PolarHBondContact O-N 2.8Å; T231-S234 PolarHBondContact O-N 3.42Å; L232-S234 VanDerWaalsContact C-N 3.3Å; L232-S234 PolarHBondContact O-N 3.11Å; S234-L236 PolarHBondContact O-N 2.92Å; S234-N237 PolarHBondContact O-N 2.77Å; S234-V238 VanDerWaalsContact O-CB 3.25Å; S234-V238 WeakPolarHBondContact O-CB 3.37Å; S234-V238 PolarHBondContact O-N 3.24Å |
| 235 | L | 94.2 | Very high | 90.8 | Very high | 120 Ų | 120 | 42.6 Ų | 42.6 | 63% | 0.628 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -60.4 | -45 | 177.9 | -172.7 | 75 | 0 | 0 | 0 | 111.7 | T231 L232 G239 | T231-L235 VanDerWaalsContact O-CB 3.23Å; T231-L235 WeakPolarHBondContact O-CB 3.25Å; T231-L235 PolarHBondContact O-N 2.98Å; L232-L235 PolarHBondContact O-N 3.27Å; L235-G239 WeakPolarHBondContact O-CA 3.05Å; L235-G239 PolarHBondContact O-N 3.3Å |
| 236 | L | 93.6 | Very high | 90.6 | Very high | 26 Ų | 26 | 45.8 Ų | 45.8 | 14% | 0.136 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.6 | -51.8 | 179.4 | -74.4 | 171 | 0 | 0 | 0 | 111.5 | Y142 A146 C149 L232 I233 S234 F240 | Y142-L236 HydrophobicContact CE2-CB 4.37Å; Y142-L236 VanDerWaalsContact CE2-O 3.29Å; Y142-L236 WeakPolarHBondContact CE2-O 3.13Å; Y142-L236 PolarHBondContact OH-O 3.26Å; A146-L236 HydrophobicContact CB-CD1 4.21Å; A146-L236 HydrophobicContact CB-CD2 4.43Å; C149-L236 HydrophobicContact CB-CD1 4.01Å; L232-L236 HydrophobicContact CD1-CD1 4.11Å; L232-L236 HydrophobicContact CD1-CG 4.22Å; L232-L236 HydrophobicContact CD2-CD1 4.11Å; L232-L236 HydrophobicContact CG-CD1 3.8Å; L232-L236 HydrophobicContact CG-CG 4.28Å; L232-L236 WeakPolarHBondContact O-CB 3.34Å; L232-L236 WeakPolarHBondContact O-CG 3.23Å; L232-L236 PolarHBondContact O-N 2.78Å; I233-L236 PolarHBondContact O-N 3.39Å; S234-L236 PolarHBondContact O-N 2.92Å; L236-F240 WeakPolarHBondContact O-CB 3.36Å; L236-F240 PolarHBondContact O-N 3.48Å |
| 237 | N | 91.9 | Very high | 90.1 | Very high | 8 Ų | 8 | 44.8 Ų | 44.8 | 4% | 0.043 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -72.4 | -56 | -175.6 | -74 | -83.9 | 0 | 0 | 0 | 112.4 | Y142 H177 L212 I233 S234 F240 L241 | Y142-N237 WeakPolarHBondContact OH-CA 3.31Å; Y142-N237 PolarHBondContact OH-OD1 3.44Å; H177-N237 PolarHBondContact NE2-O 3.1Å; H177-N237 VanDerWaalsContact NE2-O 3.12Å; L212-N237 WeakPolarHBondContact CD1-ND2 3.24Å; L212-N237 WeakPolarHBondContact CD1-OD1 3.38Å; I233-N237 PolarHBondContact O-N 3.32Å; I233-N237 PolarHBondContact O-ND2 3.08Å; S234-N237 PolarHBondContact O-N 2.77Å; N237-F240 PolarHBondContact O-N 2.72Å; N237-L241 PolarHBondContact O-N 3.32Å |
| 238 | V | 91.6 | Very high | 89.5 | Confident | 37 Ų | 37 | 39.2 Ų | 39.2 | 22% | 0.224 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -67.6 | -43.5 | -176.6 | 179.2 | 0 | 0 | 0 | 0 | 109.5 | S234 F240 L241 Y242 | S234-V238 VanDerWaalsContact O-CB 3.25Å; S234-V238 WeakPolarHBondContact O-CB 3.37Å; S234-V238 PolarHBondContact O-N 3.24Å; V238-F240 VanDerWaalsContact C-N 3.33Å; V238-F240 PolarHBondContact O-N 2.66Å; V238-L241 PolarHBondContact O-N 2.75Å; V238-Y242 HydrophobicContact CG1-CD2 3.59Å; V238-Y242 HydrophobicContact CG1-CE2 3.55Å; V238-Y242 VanDerWaalsContact O-CD2 3.25Å; V238-Y242 WeakPolarHBondContact O-CD2 3.11Å; V238-Y242 PolarHBondContact O-N 3.08Å |
| 239 | G | 91.6 | Very high | 88.4 | Confident | 33 Ų | 33 | 38.2 Ų | 38.2 | 34% | 0.34 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -60.8 | -39.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L235 Y242 Y243 | L235-G239 WeakPolarHBondContact O-CA 3.05Å; L235-G239 PolarHBondContact O-N 3.3Å; G239-Y242 PolarHBondContact O-N 3.26Å; G239-Y243 VanDerWaalsContact O-CB 3.3Å; G239-Y243 WeakPolarHBondContact O-CB 3.41Å; G239-Y243 PolarHBondContact O-N 3.08Å |
| 240 | F | 92.7 | Very high | 86.8 | Confident | 12 Ų | 12 | 40.8 Ų | 40.8 | 5% | 0.053 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -66.8 | -42.5 | 175.3 | 179.8 | -119.9 | 0 | 0 | 0 | 112.7 | L111 Y142 L174 H177 L236 N237 V238 Y242 Y243 L244 | L111-F240 HydrophobicContact CD2-CE1 3.91Å; L111-F240 HydrophobicContact CD2-CZ 4.15Å; Y142-F240 AromaticContact CD1-CD1 3.45Å; Y142-F240 HydrophobicContact CD1-CD1 3.45Å; Y142-F240 VanDerWaalsContact CD1-CD1 3.45Å; Y142-F240 HydrophobicContact CD1-CD2 4.14Å; Y142-F240 AromaticContact CD1-CE1 3.36Å; Y142-F240 HydrophobicContact CD1-CE1 3.36Å; Y142-F240 HydrophobicContact CD1-CE2 4.08Å; Y142-F240 AromaticContact CD1-CG 3.83Å; Y142-F240 HydrophobicContact CD1-CG 3.83Å; Y142-F240 AromaticContact CD1-CZ 3.69Å; Y142-F240 HydrophobicContact CD1-CZ 3.69Å; Y142-F240 HydrophobicContact CD2-CB 3.63Å; Y142-F240 AromaticContact CD2-CD1 3.92Å; Y142-F240 HydrophobicContact CD2-CD1 3.92Å; Y142-F240 AromaticContact CD2-CD2 3.45Å; Y142-F240 HydrophobicContact CD2-CD2 3.45Å; Y142-F240 VanDerWaalsContact CD2-CD2 3.45Å; Y142-F240 HydrophobicContact CD2-CE1 4.41Å; Y142-F240 HydrophobicContact CD2-CE2 4.01Å; Y142-F240 AromaticContact CD2-CG 3.39Å; Y142-F240 HydrophobicContact CD2-CG 3.39Å; Y142-F240 HydrophobicContact CD2-CZ 4.44Å; Y142-F240 HydrophobicContact CE1-CB 4.37Å; Y142-F240 AromaticContact CE1-CD1 3.45Å; Y142-F240 HydrophobicContact CE1-CD1 3.45Å; Y142-F240 VanDerWaalsContact CE1-CD1 3.45Å; Y142-F240 AromaticContact CE1-CE1 3.77Å; Y142-F240 HydrophobicContact CE1-CE1 3.77Å; Y142-F240 AromaticContact CE1-CG 3.94Å; Y142-F240 HydrophobicContact CE1-CG 3.94Å; Y142-F240 HydrophobicContact CE2-CB 3.32Å; Y142-F240 AromaticContact CE2-CD1 3.93Å; Y142-F240 HydrophobicContact CE2-CD1 3.93Å; Y142-F240 HydrophobicContact CE2-CD2 4.08Å; Y142-F240 AromaticContact CE2-CG 3.53Å; Y142-F240 HydrophobicContact CE2-CG 3.53Å; Y142-F240 HydrophobicContact CG-CB 4.28Å; Y142-F240 AromaticContact CG-CD1 3.67Å; Y142-F240 HydrophobicContact CG-CD1 3.67Å; Y142-F240 AromaticContact CG-CD2 3.47Å; Y142-F240 HydrophobicContact CG-CD2 3.47Å; Y142-F240 VanDerWaalsContact CG-CD2 3.47Å; Y142-F240 AromaticContact CG-CE1 3.71Å; Y142-F240 HydrophobicContact CG-CE1 3.71Å; Y142-F240 AromaticContact CG-CE2 3.53Å; Y142-F240 HydrophobicContact CG-CE2 3.53Å; Y142-F240 AromaticContact CG-CG 3.54Å; Y142-F240 HydrophobicContact CG-CG 3.54Å; Y142-F240 AromaticContact CG-CZ 3.63Å; Y142-F240 HydrophobicContact CG-CZ 3.63Å; Y142-F240 AromaticContact CZ-CD1 3.68Å; Y142-F240 AromaticContact CZ-CG 3.78Å; L174-F240 HydrophobicContact CD2-CD1 4.47Å; L174-F240 HydrophobicContact CD2-CE1 3.97Å; H177-F240 AromaticContact CD2-CD1 3.71Å; H177-F240 AromaticContact NE2-CD1 3.89Å; L236-F240 WeakPolarHBondContact O-CB 3.36Å; L236-F240 PolarHBondContact O-N 3.48Å; N237-F240 PolarHBondContact O-N 2.72Å; V238-F240 VanDerWaalsContact C-N 3.33Å; V238-F240 PolarHBondContact O-N 2.66Å; F240-Y242 VanDerWaalsContact C-N 3.31Å; F240-Y242 PolarHBondContact O-N 3.16Å; F240-Y243 HydrophobicContact CD2-CD1 4.32Å; F240-Y243 HydrophobicContact CE2-CD1 4.47Å; F240-Y243 WeakPolarHBondContact O-CB 3.29Å; F240-Y243 PolarHBondContact O-N 3.28Å; F240-Y243 VanDerWaalsContact O-N 3.16Å; F240-L244 HydrophobicContact CD1-CD1 4.18Å; F240-L244 HydrophobicContact CD1-CG 4.5Å; F240-L244 HydrophobicContact CD2-CD2 4.45Å; F240-L244 HydrophobicContact CD2-CG 4.26Å; F240-L244 HydrophobicContact CE1-CD1 3.59Å; F240-L244 HydrophobicContact CE1-CG 4.16Å; F240-L244 HydrophobicContact CE2-CD1 4.17Å; F240-L244 HydrophobicContact CE2-CD2 3.72Å; F240-L244 HydrophobicContact CE2-CG 3.89Å; F240-L244 HydrophobicContact CZ-CD1 3.59Å; F240-L244 HydrophobicContact CZ-CD2 3.83Å; F240-L244 HydrophobicContact CZ-CG 3.84Å; F240-L244 WeakPolarHBondContact O-CG 3.41Å; F240-L244 PolarHBondContact O-N 3.17Å |
| 241 | L | 90.6 | Very high | 84.7 | Confident | 2 Ų | 2 | 41.9 Ų | 41.9 | 1% | 0.01 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.6 | -44.1 | 175.8 | -174 | 67.7 | 0 | 0 | 0 | 111.8 | H177 I180 F197 S201 N237 V238 L244 H245 | H177-L241 HydrophobicContact CB-CD1 4.41Å; I180-L241 HydrophobicContact CB-CD1 4.06Å; I180-L241 HydrophobicContact CD1-CD1 4.06Å; I180-L241 HydrophobicContact CD1-CD2 3.51Å; I180-L241 HydrophobicContact CD1-CG 4.45Å; I180-L241 HydrophobicContact CG2-CD1 3.89Å; I180-L241 HydrophobicContact CG2-CD2 4.18Å; I180-L241 HydrophobicContact CG2-CG 4.47Å; F197-L241 HydrophobicContact CE2-CG 4.39Å; F197-L241 HydrophobicContact CZ-CG 4.14Å; S201-L241 VanDerWaalsContact OG-CD2 3.31Å; S201-L241 WeakPolarHBondContact OG-CD2 3.12Å; N237-L241 PolarHBondContact O-N 3.32Å; V238-L241 PolarHBondContact O-N 2.75Å; L241-L244 PolarHBondContact O-N 3.29Å; L241-H245 PolarHBondContact O-N 3.22Å; L241-H245 VanDerWaalsContact O-N 3.08Å |
| 242 | Y | 89.7 | Confident | 82.4 | Confident | 71 Ų | 71 | 42 Ų | 42 | 28% | 0.278 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.9 | -40 | 174 | -86.2 | -70.9 | 0 | 0 | 0 | 112.4 | F197 H198 V238 G239 F240 L244 H245 F246 | F197-Y242 AromaticContact CE1-CD1 3.91Å; F197-Y242 HydrophobicContact CE1-CD1 3.91Å; F197-Y242 AromaticContact CE1-CE1 3.83Å; F197-Y242 HydrophobicContact CE1-CE1 3.83Å; H198-Y242 AromaticContact CE1-CE1 3.72Å; H198-Y242 AromaticContact ND1-CE1 3.65Å; H198-Y242 AromaticContact ND1-CZ 3.8Å; H198-Y242 PolarHBondContact ND1-OH 3.07Å; V238-Y242 HydrophobicContact CG1-CD2 3.59Å; V238-Y242 HydrophobicContact CG1-CE2 3.55Å; V238-Y242 VanDerWaalsContact O-CD2 3.25Å; V238-Y242 WeakPolarHBondContact O-CD2 3.11Å; V238-Y242 PolarHBondContact O-N 3.08Å; G239-Y242 PolarHBondContact O-N 3.26Å; F240-Y242 VanDerWaalsContact C-N 3.31Å; F240-Y242 PolarHBondContact O-N 3.16Å; Y242-L244 VanDerWaalsContact C-N 3.35Å; Y242-L244 PolarHBondContact O-N 2.83Å; Y242-H245 PolarHBondContact O-N 3.43Å; Y242-F246 AromaticContact CD1-CD2 3.9Å; Y242-F246 HydrophobicContact CD1-CD2 3.9Å; Y242-F246 AromaticContact CD1-CE2 3.54Å; Y242-F246 HydrophobicContact CD1-CE2 3.54Å; Y242-F246 HydrophobicContact CE1-CE2 4.07Å; Y242-F246 WeakPolarHBondContact O-CB 3.22Å; Y242-F246 WeakPolarHBondContact O-CD2 3.23Å; Y242-F246 PolarHBondContact O-N 3.22Å |
| 243 | Y | 90.4 | Very high | 79.9 | Confident | 125 Ų | 125 | 46.4 Ų | 46.4 | 49% | 0.49 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -60.7 | -42.7 | 174.5 | 173.2 | -94.6 | 0 | 0 | 0 | 111.7 | T138 G239 F240 G247 F248 | T138-Y243 HydrophobicContact CG2-CE1 3.93Å; G239-Y243 VanDerWaalsContact O-CB 3.3Å; G239-Y243 WeakPolarHBondContact O-CB 3.41Å; G239-Y243 PolarHBondContact O-N 3.08Å; F240-Y243 HydrophobicContact CD2-CD1 4.32Å; F240-Y243 HydrophobicContact CE2-CD1 4.47Å; F240-Y243 WeakPolarHBondContact O-CB 3.29Å; F240-Y243 PolarHBondContact O-N 3.28Å; F240-Y243 VanDerWaalsContact O-N 3.16Å; Y243-G247 VanDerWaalsContact O-CA 3.22Å; Y243-G247 WeakPolarHBondContact O-CA 3.3Å; Y243-G247 PolarHBondContact O-N 3.15Å; Y243-F248 HydrophobicContact CE1-CE2 4.16Å |
| 244 | L | 88.9 | Confident | 77.2 | Confident | 2 Ų | 2 | 52.6 Ų | 52.6 | 1% | 0.01 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.5 | -45.1 | 177.8 | -67.9 | -174.4 | 0 | 0 | 0 | 111.7 | L111 L115 L181 F240 L241 Y242 F248 | L111-L244 HydrophobicContact CD1-CD1 4.15Å; L111-L244 HydrophobicContact CD2-CD1 4.32Å; L111-L244 HydrophobicContact CG-CD1 4.5Å; L115-L244 HydrophobicContact CD1-CD1 4.31Å; L115-L244 HydrophobicContact CD1-CD2 3.77Å; L115-L244 HydrophobicContact CD2-CB 4.21Å; L115-L244 HydrophobicContact CD2-CD1 4.21Å; L115-L244 HydrophobicContact CD2-CD2 3.81Å; L115-L244 HydrophobicContact CD2-CG 4.29Å; L115-L244 HydrophobicContact CG-CD2 4.42Å; L181-L244 HydrophobicContact CD1-CB 4.48Å; L181-L244 HydrophobicContact CD1-CD1 3.81Å; L181-L244 HydrophobicContact CD2-CB 4.48Å; F240-L244 HydrophobicContact CD1-CD1 4.18Å; F240-L244 HydrophobicContact CD1-CG 4.5Å; F240-L244 HydrophobicContact CD2-CD2 4.45Å; F240-L244 HydrophobicContact CD2-CG 4.26Å; F240-L244 HydrophobicContact CE1-CD1 3.59Å; F240-L244 HydrophobicContact CE1-CG 4.16Å; F240-L244 HydrophobicContact CE2-CD1 4.17Å; F240-L244 HydrophobicContact CE2-CD2 3.72Å; F240-L244 HydrophobicContact CE2-CG 3.89Å; F240-L244 HydrophobicContact CZ-CD1 3.59Å; F240-L244 HydrophobicContact CZ-CD2 3.83Å; F240-L244 HydrophobicContact CZ-CG 3.84Å; F240-L244 WeakPolarHBondContact O-CG 3.41Å; F240-L244 PolarHBondContact O-N 3.17Å; L241-L244 PolarHBondContact O-N 3.29Å; Y242-L244 VanDerWaalsContact C-N 3.35Å; Y242-L244 PolarHBondContact O-N 2.83Å; L244-F248 HydrophobicContact CD2-CD2 4.02Å; L244-F248 HydrophobicContact CD2-CE2 3.83Å; L244-F248 WeakPolarHBondContact O-CB 3.15Å; L244-F248 PolarHBondContact O-N 3.47Å; L244-F248 VanDerWaalsContact O-N 3.11Å |
| 245 | H | 84.4 | Confident | 76.4 | Confident | 5 Ų | 5 | 52.8 Ų | 52.8 | 2% | 0.023 | 31% | 0.308 | C | S | . | . | I | π-helix | trans | -65.6 | -53.7 | 178.1 | 178 | -90.5 | 0 | 0 | 0 | 111.9 | F197 L241 Y242 H249 K250 | F197-H245 HydrophobicContact CD1-CB 4.37Å; F197-H245 AromaticContact CD1-CD2 3.66Å; F197-H245 AromaticContact CD1-CE1 3.72Å; F197-H245 AromaticContact CD1-CG 3.69Å; F197-H245 AromaticContact CD1-ND1 3.74Å; F197-H245 AromaticContact CD1-NE2 3.68Å; F197-H245 HydrophobicContact CD2-CB 4.24Å; F197-H245 AromaticContact CD2-CD2 3.27Å; F197-H245 WeakPolarHBondContact CD2-CD2 3.41Å; F197-H245 AromaticContact CD2-CG 3.83Å; F197-H245 AromaticContact CD2-NE2 3.85Å; F197-H245 HydrophobicContact CE1-CB 3.67Å; F197-H245 AromaticContact CE1-CD2 3.86Å; F197-H245 AromaticContact CE1-CG 3.46Å; F197-H245 VanDerWaalsContact CE1-CG 3.46Å; F197-H245 AromaticContact CE1-ND1 3.67Å; F197-H245 HydrophobicContact CE2-CB 3.52Å; F197-H245 AromaticContact CE2-CD2 3.49Å; F197-H245 VanDerWaalsContact CE2-CD2 3.49Å; F197-H245 WeakPolarHBondContact CE2-CD2 3.42Å; F197-H245 AromaticContact CE2-CG 3.61Å; F197-H245 AromaticContact CG-CD2 3.36Å; F197-H245 WeakPolarHBondContact CG-CD2 3.31Å; F197-H245 AromaticContact CG-CE1 3.98Å; F197-H245 AromaticContact CG-CG 3.87Å; F197-H245 AromaticContact CG-NE2 3.44Å; F197-H245 WeakPolarHBondContact CG-NE2 3.24Å; F197-H245 HydrophobicContact CZ-CB 3.18Å; F197-H245 AromaticContact CZ-CD2 3.79Å; F197-H245 AromaticContact CZ-CG 3.43Å; F197-H245 VanDerWaalsContact CZ-CG 3.43Å; L241-H245 PolarHBondContact O-N 3.22Å; L241-H245 VanDerWaalsContact O-N 3.08Å; Y242-H245 PolarHBondContact O-N 3.43Å; H245-H249 VanDerWaalsContact O-CA 3.29Å; H245-H249 WeakPolarHBondContact O-CA 3.38Å; H245-H249 WeakPolarHBondContact O-CB 3.24Å; H245-H249 PolarHBondContact O-N 3.15Å; H245-K250 PolarHBondContact O-N 3.05Å |
| 246 | F | 83.1 | Confident | 75.5 | Confident | 93 Ų | 93 | 49.3 Ų | 49.3 | 41% | 0.408 | 29% | 0.291 | S | S | . | . | I | π-helix | trans | -71.2 | -35 | -179.6 | -76.4 | -71.9 | 0 | 0 | 0 | 113.1 | Y242 K250 | Y242-F246 AromaticContact CD1-CD2 3.9Å; Y242-F246 HydrophobicContact CD1-CD2 3.9Å; Y242-F246 AromaticContact CD1-CE2 3.54Å; Y242-F246 HydrophobicContact CD1-CE2 3.54Å; Y242-F246 HydrophobicContact CE1-CE2 4.07Å; Y242-F246 WeakPolarHBondContact O-CB 3.22Å; Y242-F246 WeakPolarHBondContact O-CD2 3.23Å; Y242-F246 PolarHBondContact O-N 3.22Å; F246-K250 HydrophobicContact CD1-CB 4.15Å; F246-K250 HydrophobicContact CD1-CD 4.08Å; F246-K250 HydrophobicContact CD1-CG 3.6Å; F246-K250 HydrophobicContact CE1-CD 4.16Å; F246-K250 HydrophobicContact CE1-CG 4.04Å; F246-K250 WeakPolarHBondContact O-CB 3.36Å |
| 247 | G | 78.5 | Confident | 74.4 | Confident | 25 Ų | 25 | 50.6 Ų | 50.6 | 26% | 0.258 | 30% | 0.3 | S | S | . | . | I | π-helix | trans | -70.3 | -35.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y124 Y243 | Y124-G247 WeakPolarHBondContact CE2-O 3.45Å; Y243-G247 VanDerWaalsContact O-CA 3.22Å; Y243-G247 WeakPolarHBondContact O-CA 3.3Å; Y243-G247 PolarHBondContact O-N 3.15Å |
| 248 | F | 76.2 | Confident | 73.4 | Confident | 3 Ų | 3 | 53.1 Ų | 53.1 | 1% | 0.013 | 32% | 0.315 | C | S | . | . | I | π-helix | trans | -118.2 | -24 | -172.5 | -59.9 | -66.9 | 0 | 0 | 0 | 114.6 | L115 M119 S122 Y124 T134 T138 Y243 L244 | L115-F248 HydrophobicContact CD2-CD2 3.88Å; L115-F248 HydrophobicContact CD2-CE2 4.45Å; L115-F248 HydrophobicContact CD2-CG 4.45Å; M119-F248 HydrophobicContact CE-CD1 3.23Å; M119-F248 HydrophobicContact CE-CD2 4.15Å; M119-F248 HydrophobicContact CE-CE1 3.21Å; M119-F248 HydrophobicContact CE-CE2 4.15Å; M119-F248 HydrophobicContact CE-CG 3.71Å; M119-F248 HydrophobicContact CE-CZ 3.7Å; M119-F248 HydrophobicContact CG-CB 4Å; M119-F248 HydrophobicContact CG-CD1 3.61Å; M119-F248 HydrophobicContact CG-CE1 4.42Å; M119-F248 HydrophobicContact CG-CG 4.07Å; M119-F248 HydrophobicContact SD-CD1 3.41Å; M119-F248 WeakPolarHBondContact SD-CD1 3.38Å; M119-F248 HydrophobicContact SD-CE1 3.61Å; M119-F248 HydrophobicContact SD-CG 4.28Å; S122-F248 PolarHBondContact OG-O 3.31Å; Y124-F248 HydrophobicContact CD2-CD1 4.44Å; Y124-F248 HydrophobicContact CE2-CD1 4.09Å; T134-F248 HydrophobicContact CG2-CE1 3.8Å; T134-F248 HydrophobicContact CG2-CZ 3.88Å; T138-F248 HydrophobicContact CG2-CE2 4.27Å; T138-F248 HydrophobicContact CG2-CZ 3.92Å; Y243-F248 HydrophobicContact CE1-CE2 4.16Å; L244-F248 HydrophobicContact CD2-CD2 4.02Å; L244-F248 HydrophobicContact CD2-CE2 3.83Å; L244-F248 WeakPolarHBondContact O-CB 3.15Å; L244-F248 PolarHBondContact O-N 3.47Å; L244-F248 VanDerWaalsContact O-N 3.11Å |
| 249 | H | 66.6 | Low | 72.3 | Confident | 23 Ų | 23 | 54.1 Ų | 54.1 | 11% | 0.106 | 32% | 0.321 | C | S | . | . | I | π-helix | trans | -95.6 | -25.4 | 177.6 | -163.6 | -65.6 | 0 | 0 | 0 | 112.9 | E185 H188 H245 | E185-H249 IonicContact OE1-CD2 3.36Å; E185-H249 PolarHBondContact OE1-CD2 3.43Å; H188-H249 AromaticContact CD2-CE1 3.57Å; H188-H249 AromaticContact CD2-NE2 3.57Å; H188-H249 AromaticContact CE1-CE1 3.78Å; H188-H249 AromaticContact CG-CE1 3.97Å; H188-H249 AromaticContact CG-NE2 3.79Å; H188-H249 AromaticContact NE2-CE1 3.46Å; H188-H249 PolarHBondContact NE2-CE1 3.49Å; H188-H249 AromaticContact NE2-NE2 3.96Å; H245-H249 VanDerWaalsContact O-CA 3.29Å; H245-H249 WeakPolarHBondContact O-CA 3.38Å; H245-H249 WeakPolarHBondContact O-CB 3.24Å; H245-H249 PolarHBondContact O-N 3.15Å |
| 250 | K | 55.5 | Low | 71 | Confident | 57 Ų | 57 | 55.5 Ų | 55.5 | 25% | 0.248 | 32% | 0.319 | C | S | . | . | G | 310 helix | trans | -89.8 | -2.8 | -179.6 | -88.1 | -105.7 | 179.7 | -159.9 | 0 | 115.9 | H194 H245 F246 V252 E253 | H194-K250 VanDerWaalsContact CE1-CE 3.46Å; H194-K250 WeakPolarHBondContact CE1-CE 3.22Å; H194-K250 PolarHBondContact NE2-NZ 3.12Å; H194-K250 VanDerWaalsContact NE2-NZ 3.12Å; H245-K250 PolarHBondContact O-N 3.05Å; F246-K250 HydrophobicContact CD1-CB 4.15Å; F246-K250 HydrophobicContact CD1-CD 4.08Å; F246-K250 HydrophobicContact CD1-CG 3.6Å; F246-K250 HydrophobicContact CE1-CD 4.16Å; F246-K250 HydrophobicContact CE1-CG 4.04Å; F246-K250 WeakPolarHBondContact O-CB 3.36Å; K250-V252 PolarHBondContact O-N 3.01Å; K250-E253 IonicContact NZ-OE1 3.02Å; K250-E253 PolarHBondContact NZ-OE1 3.31Å; K250-E253 IonicContact NZ-OE2 2.65Å; K250-E253 PolarHBondContact NZ-OE2 3.22Å; K250-E253 PolarHBondContact O-N 2.95Å |
| 251 | V | 49.2 | Very low | 69.5 | Low | 65 Ų | 65 | 58.6 Ų | 58.6 | 39% | 0.394 | 34% | 0.338 | S | S | . | . | G | 310 helix | trans | -67 | -1.9 | 168.9 | 167.3 | 0 | 0 | 0 | 0 | 112.8 | Y124 | Y124-V251 HydrophobicContact CD2-CB 3.57Å; Y124-V251 HydrophobicContact CD2-CG1 3.61Å; Y124-V251 HydrophobicContact CD2-CG2 3.74Å; Y124-V251 HydrophobicContact CE2-CB 3.82Å; Y124-V251 HydrophobicContact CE2-CG1 3.99Å; Y124-V251 HydrophobicContact CE2-CG2 3.41Å; Y124-V251 VanDerWaalsContact CE2-CG2 3.41Å; Y124-V251 HydrophobicContact CG-CG1 4.33Å |
| 252 | V | 43.6 | Very low | 67.8 | Low | 88 Ų | 88 | 62.9 Ų | 62.9 | 53% | 0.533 | 36% | 0.364 | S | S | . | . | G | 310 helix | trans | -82.1 | -13.3 | 172.8 | -169 | 0 | 0 | 0 | 0 | 113.7 | S122 K250 | S122-V252 WeakPolarHBondContact O-CG2 3.46Å; K250-V252 PolarHBondContact O-N 3.01Å |
| 253 | E | 39 | Very low | 66 | Low | 129 Ų | 129 | 62.3 Ų | 62.3 | 60% | 0.603 | 37% | 0.371 | S | S | * | . | G | 310 helix | trans | -105 | 19.4 | -178.6 | -73.4 | 176 | -151.9 | 0 | 0 | 114.7 | H194 K250 | H194-E253 IonicContact CE1-OE1 2.91Å; H194-E253 IonicContact NE2-OE1 2.66Å; H194-E253 PolarHBondContact NE2-OE1 2.91Å; K250-E253 IonicContact NZ-OE1 3.02Å; K250-E253 PolarHBondContact NZ-OE1 3.31Å; K250-E253 IonicContact NZ-OE2 2.65Å; K250-E253 PolarHBondContact NZ-OE2 3.22Å; K250-E253 PolarHBondContact O-N 2.95Å |
| 254 | G | 36.7 | Very low | 63.8 | Low | 132 Ų | 132 | 56.5 Ų | 56.5 | 100% | 1.361 | 36% | 0.36 | S | S | * | . | trans | -107.7 | 0 | 166.9 | 0 | 0 | 0 | 0 | 0 | 111.2 |
Retrieved 254 of 254 residues in 518.7 ms
(Link to these results)