| 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 | 40.7 | Very low | 40.8 | Very low | 248 Ų | 248 | 135.9 Ų | 135.9 | 100% | 1.222 | 78% | 0.78 | S | S | * | * | 0 | 103.3 | 0 | -78.7 | 167 | 168.1 | 0 | 0 | 106.9 | |||||
| 2 | T | 39.2 | Very low | 40.9 | Very low | 145 Ų | 145 | 138.1 Ų | 138.1 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 122.1 | -179.1 | 16.3 | 0 | 0 | 0 | 0 | 109.2 | ||
| 3 | A | 42.4 | Very low | 41.2 | Very low | 92 Ų | 92 | 143.3 Ų | 143.3 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 141.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 4 | P | 41.2 | Very low | 41.6 | Very low | 114 Ų | 114 | 141.9 Ų | 141.9 | 74% | 0.74 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 151.5 | -178.2 | 28.6 | -33.1 | 0 | 0 | 0 | 111.8 | D6 | P4-D6 PolarHBondContact O-N 2.83Š|
| 5 | P | 44.1 | Very low | 42.2 | Very low | 102 Ų | 102 | 146 Ų | 146 | 66% | 0.662 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 126.7 | -177.4 | 27.5 | -31.7 | 0 | 0 | 0 | 111.9 | Y7 | P5-Y7 HydrophobicContact CB-CE2 4.35Å; P5-Y7 HydrophobicContact CG-CD2 4.38Å; P5-Y7 HydrophobicContact CG-CE2 3.98Å; P5-Y7 PolarHBondContact O-N 2.78Å; P5-Y7 VanDerWaalsContact O-N 3.17Å |
| 6 | D | 40.3 | Very low | 42.5 | Very low | 150 Ų | 150 | 147.3 Ų | 147.3 | 80% | 0.802 | 77% | 0.767 | S | S | * | * | trans | -66.9 | 102.6 | 172.8 | -90 | -35.8 | 0 | 0 | 0 | 111.1 | P4 A8 | P4-D6 PolarHBondContact O-N 2.83Å; D6-A8 PolarHBondContact O-N 3.24Å | ||
| 7 | Y | 42.6 | Very low | 42.6 | Very low | 216 Ų | 216 | 141.4 Ų | 141.4 | 85% | 0.847 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | 10.3 | 172.9 | -89.3 | -89.2 | 0 | 0 | 0 | 114 | P5 | P5-Y7 HydrophobicContact CB-CE2 4.35Å; P5-Y7 HydrophobicContact CG-CD2 4.38Å; P5-Y7 HydrophobicContact CG-CE2 3.98Å; P5-Y7 PolarHBondContact O-N 2.78Å; P5-Y7 VanDerWaalsContact O-N 3.17Å |
| 8 | A | 39 | Very low | 43.1 | Very low | 76 Ų | 76 | 141.1 Ų | 141.1 | 63% | 0.628 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | -4 | -174.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | D6 | D6-A8 PolarHBondContact O-N 3.24Š|
| 9 | S | 40.9 | Very low | 43.7 | Very low | 91 Ų | 91 | 136.6 Ų | 136.6 | 64% | 0.636 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -95.3 | 4.3 | -171.7 | 66.2 | 0 | 0 | 0 | 0 | 116.1 | ||
| 10 | G | 38 | Very low | 44.1 | Very low | 57 Ų | 57 | 135.1 Ų | 135.1 | 59% | 0.588 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -97 | -18.1 | -172.7 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 11 | Y | 40.7 | Very low | 44.8 | Very low | 204 Ų | 204 | 133.4 Ų | 133.4 | 80% | 0.8 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -106.4 | -13.8 | -166.4 | -137.2 | -97.3 | 0 | 0 | 0 | 115.3 | ||
| 12 | E | 41.9 | Very low | 45.5 | Very low | 162 Ų | 162 | 125.8 Ų | 125.8 | 76% | 0.757 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -93.1 | -12.5 | -174.8 | -83.1 | 174.3 | 110.4 | 0 | 0 | 114.7 | ||
| 13 | R | 44.4 | Very low | 46.2 | Very low | 206 Ų | 206 | 123.5 Ų | 123.5 | 78% | 0.777 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -79.9 | -28.6 | -177.2 | -111.6 | -172.8 | -78.2 | 172.1 | -3.1 | 114.4 | ||
| 14 | D | 47.6 | Very low | 46.8 | Very low | 124 Ų | 124 | 128.4 Ų | 128.4 | 66% | 0.663 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -82.2 | -27.9 | -173.9 | -62.1 | -24.7 | 0 | 0 | 0 | 112.8 | F16 E18 | D14-F16 PolarHBondContact O-N 3.29Å; D14-E18 PolarHBondContact O-N 3.1Å |
| 15 | R | 49.6 | Very low | 47.6 | Very low | 203 Ų | 203 | 128.9 Ų | 128.9 | 77% | 0.766 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -74.7 | -25.9 | -173.1 | -147.7 | -164.5 | -90.6 | -162.3 | -3 | 113.9 | S19 | R15-S19 PolarHBondContact O-OG 2.82Å |
| 16 | F | 47.1 | Very low | 48 | Very low | 167 Ų | 167 | 130 Ų | 130 | 73% | 0.732 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -85.3 | -32.2 | 177.2 | -89.3 | -82.9 | 0 | 0 | 0 | 113 | D14 S19 | D14-F16 PolarHBondContact O-N 3.29Å; F16-S19 PolarHBondContact O-OG 3.5Å |
| 17 | G | 45.2 | Very low | 48.2 | Very low | 47 Ų | 47 | 128.3 Ų | 128.3 | 49% | 0.485 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -68.7 | -38.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | S19 D20 E21 | G17-S19 PolarHBondContact O-N 2.77Å; G17-D20 PolarHBondContact O-N 3.49Å; G17-E21 PolarHBondContact O-N 3.47Å |
| 18 | E | 51.4 | Low | 48.6 | Very low | 136 Ų | 136 | 121.9 Ų | 121.9 | 64% | 0.636 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -72.8 | -29.7 | -175.8 | -160.6 | 155.9 | 107.5 | 0 | 0 | 112.7 | D14 N22 | D14-E18 PolarHBondContact O-N 3.1Å; E18-N22 PolarHBondContact O-N 3.32Å; E18-N22 VanDerWaalsContact O-N 3.14Å; E18-N22 PolarHBondContact O-ND2 3.39Å |
| 19 | S | 54.5 | Low | 48.9 | Very low | 55 Ų | 55 | 127.4 Ų | 127.4 | 39% | 0.385 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -66.1 | -41.2 | 173.6 | 23.6 | 0 | 0 | 0 | 0 | 112.8 | R15 F16 G17 N22 I23 | R15-S19 PolarHBondContact O-OG 2.82Å; F16-S19 PolarHBondContact O-OG 3.5Å; G17-S19 PolarHBondContact O-N 2.77Å; S19-N22 PolarHBondContact O-N 3.05Å; S19-I23 WeakPolarHBondContact O-CG1 3.37Å; S19-I23 PolarHBondContact O-N 3.23Å; S19-I23 VanDerWaalsContact O-N 3.14Å |
| 20 | D | 51.4 | Low | 48.8 | Very low | 106 Ų | 106 | 131.6 Ų | 131.6 | 57% | 0.567 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -71.4 | -35.2 | 178.6 | -92.3 | -22.3 | 0 | 0 | 0 | 112.2 | G17 I23 R24 | G17-D20 PolarHBondContact O-N 3.49Å; D20-I23 PolarHBondContact O-N 3.32Å; D20-R24 WeakPolarHBondContact O-CG 3.09Å; D20-R24 PolarHBondContact O-N 2.88Å |
| 21 | E | 58.4 | Low | 48.4 | Very low | 100 Ų | 100 | 132.4 Ų | 132.4 | 47% | 0.467 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -68 | -37.2 | 176.4 | -158.2 | -172.8 | 154.8 | 0 | 0 | 111.8 | G17 R24 K25 | G17-E21 PolarHBondContact O-N 3.47Å; E21-R24 PolarHBondContact O-N 3.42Å; E21-K25 WeakPolarHBondContact O-CB 3.48Å; E21-K25 WeakPolarHBondContact O-CG 3.31Å; E21-K25 PolarHBondContact O-N 3.06Å; E21-K25 WeakPolarHBondContact OE1-CE 3.38Å; E21-K25 IonicContact OE1-NZ 3.89Å; E21-K25 PolarHBondContact OE1-NZ 2.74Å |
| 22 | N | 55.3 | Low | 48 | Very low | 89 Ų | 89 | 126.2 Ų | 126.2 | 48% | 0.476 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -65.9 | -39.6 | 174.5 | -81 | -65.4 | 0 | 0 | 0 | 112.1 | E18 S19 K25 L26 | E18-N22 PolarHBondContact O-N 3.32Å; E18-N22 VanDerWaalsContact O-N 3.14Å; E18-N22 PolarHBondContact O-ND2 3.39Å; S19-N22 PolarHBondContact O-N 3.05Å; N22-K25 PolarHBondContact O-N 2.81Å; N22-L26 WeakPolarHBondContact O-CD1 3.23Å; N22-L26 VanDerWaalsContact O-CG 3.26Å; N22-L26 WeakPolarHBondContact O-CG 3.15Å; N22-L26 PolarHBondContact O-N 2.86Å; N22-L26 VanDerWaalsContact O-N 3.08Å |
| 23 | I | 53.9 | Low | 47.3 | Very low | 97 Ų | 97 | 127 Ų | 127 | 50% | 0.497 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -66.5 | -42.5 | 175.4 | -66.8 | -178.1 | 0 | 0 | 0 | 110.8 | S19 D20 K25 L26 D27 | S19-I23 WeakPolarHBondContact O-CG1 3.37Å; S19-I23 PolarHBondContact O-N 3.23Å; S19-I23 VanDerWaalsContact O-N 3.14Å; D20-I23 PolarHBondContact O-N 3.32Å; I23-K25 PolarHBondContact O-N 2.62Å; I23-L26 PolarHBondContact O-N 3.44Å; I23-L26 VanDerWaalsContact O-N 3.17Å; I23-D27 PolarHBondContact O-N 2.88Å |
| 24 | R | 54.9 | Low | 46.5 | Very low | 195 Ų | 195 | 123.1 Ų | 123.1 | 74% | 0.736 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -63.9 | -36.7 | 175.9 | -74.4 | -176.6 | 179 | -168.2 | 1.4 | 113.3 | D20 E21 L26 A28 | D20-R24 WeakPolarHBondContact O-CG 3.09Å; D20-R24 PolarHBondContact O-N 2.88Å; E21-R24 PolarHBondContact O-N 3.42Å; R24-L26 VanDerWaalsContact C-N 3.32Å; R24-A28 VanDerWaalsContact O-CB 3.32Å; R24-A28 WeakPolarHBondContact O-CB 3.4Å; R24-A28 PolarHBondContact O-N 2.73Å |
| 25 | K | 58 | Low | 45.6 | Very low | 124 Ų | 124 | 122.8 Ų | 122.8 | 54% | 0.539 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -68.9 | -30.8 | 175.1 | -76.9 | 176.7 | -176.5 | 162.7 | 0 | 112.4 | E21 N22 I23 | E21-K25 WeakPolarHBondContact O-CB 3.48Å; E21-K25 WeakPolarHBondContact O-CG 3.31Å; E21-K25 PolarHBondContact O-N 3.06Å; E21-K25 WeakPolarHBondContact OE1-CE 3.38Å; E21-K25 IonicContact OE1-NZ 3.89Å; E21-K25 PolarHBondContact OE1-NZ 2.74Å; N22-K25 PolarHBondContact O-N 2.81Å; I23-K25 PolarHBondContact O-N 2.62Å |
| 26 | L | 52.5 | Low | 44.6 | Very low | 124 Ų | 124 | 118.3 Ų | 118.3 | 65% | 0.649 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -71.8 | -43.1 | 175 | -71.6 | 165.3 | 0 | 0 | 0 | 111.4 | N22 I23 R24 K29 | N22-L26 WeakPolarHBondContact O-CD1 3.23Å; N22-L26 VanDerWaalsContact O-CG 3.26Å; N22-L26 WeakPolarHBondContact O-CG 3.15Å; N22-L26 PolarHBondContact O-N 2.86Å; N22-L26 VanDerWaalsContact O-N 3.08Å; I23-L26 PolarHBondContact O-N 3.44Å; I23-L26 VanDerWaalsContact O-N 3.17Å; R24-L26 VanDerWaalsContact C-N 3.32Å; L26-K29 PolarHBondContact O-N 3.25Å |
| 27 | D | 44.4 | Very low | 43.8 | Very low | 115 Ų | 115 | 115.7 Ų | 115.7 | 62% | 0.615 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -69.9 | -36.5 | 177.6 | -80.1 | -21.9 | 0 | 0 | 0 | 113 | I23 K29 Q30 | I23-D27 PolarHBondContact O-N 2.88Å; D27-K29 PolarHBondContact O-N 3.48Å; D27-K29 VanDerWaalsContact O-N 3.14Å; D27-Q30 PolarHBondContact O-N 3.25Å |
| 28 | A | 51.3 | Low | 43 | Very low | 82 Ų | 82 | 119.4 Ų | 119.4 | 68% | 0.678 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | -19.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | R24 | R24-A28 VanDerWaalsContact O-CB 3.32Å; R24-A28 WeakPolarHBondContact O-CB 3.4Å; R24-A28 PolarHBondContact O-N 2.73Å |
| 29 | K | 45.3 | Very low | 42.2 | Very low | 192 Ų | 192 | 118.9 Ų | 118.9 | 84% | 0.835 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | -8.7 | -179.6 | -130.7 | 178.7 | -176.4 | -178.2 | 0 | 114.1 | L26 D27 | L26-K29 PolarHBondContact O-N 3.25Å; D27-K29 PolarHBondContact O-N 3.48Å; D27-K29 VanDerWaalsContact O-N 3.14Å |
| 30 | Q | 40.2 | Very low | 41.1 | Very low | 178 Ų | 178 | 126.8 Ų | 126.8 | 83% | 0.832 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.3 | -6.7 | 179.1 | -80.1 | -170.6 | -0.6 | 0 | 0 | 114.9 | D27 G32 | D27-Q30 PolarHBondContact O-N 3.25Å; Q30-G32 PolarHBondContact O-N 2.96Å |
| 31 | G | 29.2 | Very low | 40.2 | Very low | 75 Ų | 75 | 124.8 Ų | 124.8 | 77% | 0.773 | 71% | 0.711 | S | S | * | * | trans | -92.5 | 70.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 32 | G | 31.6 | Very low | 39.3 | Very low | 74 Ų | 74 | 124.1 Ų | 124.1 | 76% | 0.763 | 72% | 0.717 | S | S | * | * | trans | -149 | 69.6 | -178 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q30 | Q30-G32 PolarHBondContact O-N 2.96Š| ||
| 33 | H | 28.1 | Very low | 38.7 | Very low | 178 Ų | 178 | 131.5 Ų | 131.5 | 82% | 0.824 | 74% | 0.738 | S | S | * | * | trans | -74.6 | 123.8 | 166.9 | -147.1 | 78 | 0 | 0 | 0 | 108.9 | ||||
| 34 | N | 27.5 | Very low | 38.3 | Very low | 125 Ų | 125 | 129.6 Ų | 129.6 | 67% | 0.668 | 74% | 0.743 | S | S | * | * | trans | 157.4 | 119.8 | 133.5 | -83.7 | -17.8 | 0 | 0 | 0 | 115.2 | ||||
| 35 | T | 27.3 | Very low | 37.8 | Very low | 116 Ų | 116 | 128.9 Ų | 128.9 | 71% | 0.712 | 74% | 0.741 | S | S | * | * | trans | 57.6 | 122.8 | 130.3 | 67.2 | 0 | 0 | 0 | 0 | 122 | ||||
| 36 | S | 29.3 | Very low | 37.4 | Very low | 109 Ų | 109 | 129.1 Ų | 129.1 | 76% | 0.762 | 75% | 0.748 | S | S | * | * | 95.4 | 134.1 | 128.2 | 72.5 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 37 | S | 30.5 | Very low | 37.6 | Very low | 112 Ų | 112 | 129 Ų | 129 | 78% | 0.783 | 75% | 0.748 | S | S | * | * | trans | 80.9 | 98.4 | 164.6 | 71.3 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 38 | S | 28.2 | Very low | 38.1 | Very low | 126 Ų | 126 | 130.2 Ų | 130.2 | 88% | 0.881 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 121.5 | 160.1 | -50.4 | 0 | 0 | 0 | 0 | 109.6 | ||
| 39 | P | 34.4 | Very low | 38.6 | Very low | 124 Ų | 124 | 133.5 Ų | 133.5 | 81% | 0.805 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 125.4 | 157.3 | 3 | 16.5 | 0 | 0 | 0 | 109.7 | ||
| 40 | F | 31.1 | Very low | 39.8 | Very low | 221 Ų | 221 | 125.9 Ų | 125.9 | 97% | 0.969 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 128.7 | 167.4 | -166.5 | -99.4 | 0 | 0 | 0 | 111.7 | ||
| 41 | G | 32.8 | Very low | 41.3 | Very low | 64 Ų | 64 | 119.9 Ų | 119.9 | 66% | 0.66 | 71% | 0.706 | S | S | * | * | trans | 130.8 | 57.3 | 159.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 42 | S | 38.8 | Very low | 43.4 | Very low | 86 Ų | 86 | 120.5 Ų | 120.5 | 60% | 0.601 | 70% | 0.695 | S | S | * | * | trans | -164.4 | 62.8 | 155.5 | -93.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 43 | R | 42.9 | Very low | 45.5 | Very low | 244 Ų | 244 | 118.9 Ų | 118.9 | 92% | 0.921 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -4.3 | -174.2 | -159.9 | 167.1 | 168.2 | 134.8 | -3.5 | 113.9 | ||
| 44 | G | 46.1 | Very low | 47.8 | Very low | 58 Ų | 58 | 116.9 Ų | 116.9 | 60% | 0.598 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -40.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 45 | Y | 43.5 | Very low | 50 | Low | 179 Ų | 179 | 113.7 Ų | 113.7 | 70% | 0.702 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -77.6 | -30.5 | -176 | -104.8 | -104.9 | 0 | 0 | 0 | 113.5 | F49 | Y45-F49 HydrophobicContact CD1-CD2 4.45Å; Y45-F49 HydrophobicContact CD1-CE2 4.14Å; Y45-F49 WeakPolarHBondContact O-CD2 3.47Å; Y45-F49 PolarHBondContact O-N 3.44Å |
| 46 | L | 49.5 | Very low | 52.5 | Low | 129 Ų | 129 | 114.2 Ų | 114.2 | 68% | 0.675 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -74.3 | -26.2 | -177.4 | -66.7 | 178.1 | 0 | 0 | 0 | 113.2 | G50 | L46-G50 WeakPolarHBondContact O-CA 2.99Å; L46-G50 PolarHBondContact O-N 2.76Å |
| 47 | D | 57.8 | Low | 54.7 | Low | 122 Ų | 122 | 111.4 Ų | 111.4 | 65% | 0.652 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -75.4 | -36.8 | -178.9 | -153.4 | 44.4 | 0 | 0 | 0 | 111.1 | G50 A51 | D47-G50 PolarHBondContact O-N 3.18Å; D47-A51 WeakPolarHBondContact O-CB 3.41Å; D47-A51 PolarHBondContact O-N 2.9Å |
| 48 | E | 55 | Low | 56.8 | Low | 140 Ų | 140 | 113 Ų | 113 | 65% | 0.654 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68.7 | -46.3 | 175.1 | -164.5 | 179.7 | 154.4 | 0 | 0 | 111.6 | G50 A51 V52 | E48-G50 VanDerWaalsContact C-N 3.33Å; E48-G50 PolarHBondContact O-N 2.97Å; E48-A51 PolarHBondContact O-N 2.77Å; E48-V52 WeakPolarHBondContact O-CB 3.24Å; E48-V52 WeakPolarHBondContact O-CG2 3.13Å; E48-V52 PolarHBondContact O-N 3.36Å |
| 49 | F | 62.1 | Low | 58.7 | Low | 152 Ų | 152 | 110.1 Ų | 110.1 | 67% | 0.667 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -65.3 | -35.8 | 174.1 | -86.7 | -80.9 | 0 | 0 | 0 | 112.5 | Y45 G53 | Y45-F49 HydrophobicContact CD1-CD2 4.45Å; Y45-F49 HydrophobicContact CD1-CE2 4.14Å; Y45-F49 WeakPolarHBondContact O-CD2 3.47Å; Y45-F49 PolarHBondContact O-N 3.44Å; F49-G53 PolarHBondContact O-N 2.82Å |
| 50 | G | 69.7 | Low | 60.7 | Low | 31 Ų | 31 | 108.8 Ų | 108.8 | 32% | 0.32 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -68.2 | -43.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L46 D47 E48 G53 M54 | L46-G50 WeakPolarHBondContact O-CA 2.99Å; L46-G50 PolarHBondContact O-N 2.76Å; D47-G50 PolarHBondContact O-N 3.18Å; E48-G50 VanDerWaalsContact C-N 3.33Å; E48-G50 PolarHBondContact O-N 2.97Å; G50-G53 PolarHBondContact O-N 3.48Å; G50-M54 WeakPolarHBondContact O-CB 3.43Å; G50-M54 PolarHBondContact O-N 3.15Å |
| 51 | A | 71.8 | Confident | 62.7 | Low | 53 Ų | 53 | 103.7 Ų | 103.7 | 44% | 0.438 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67 | -41.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | D47 E48 G53 M54 A55 | D47-A51 WeakPolarHBondContact O-CB 3.41Å; D47-A51 PolarHBondContact O-N 2.9Å; E48-A51 PolarHBondContact O-N 2.77Å; A51-G53 VanDerWaalsContact C-N 3.35Å; A51-M54 PolarHBondContact O-N 3.23Å; A51-A55 WeakPolarHBondContact O-CB 3.37Å; A51-A55 PolarHBondContact O-N 3.18Å |
| 52 | V | 73.9 | Confident | 64.1 | Low | 88 Ų | 88 | 106.1 Ų | 106.1 | 53% | 0.533 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.6 | -41.2 | 173.2 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | E48 A55 K56 | E48-V52 WeakPolarHBondContact O-CB 3.24Å; E48-V52 WeakPolarHBondContact O-CG2 3.13Å; E48-V52 PolarHBondContact O-N 3.36Å; V52-A55 PolarHBondContact O-N 2.71Å; V52-K56 VanDerWaalsContact O-CB 3.28Å; V52-K56 WeakPolarHBondContact O-CB 3.36Å; V52-K56 PolarHBondContact O-N 2.84Å |
| 53 | G | 76 | Confident | 65.4 | Low | 39 Ų | 39 | 104 Ų | 104 | 40% | 0.402 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.2 | -44.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | F49 G50 A51 K56 A57 | F49-G53 PolarHBondContact O-N 2.82Å; G50-G53 PolarHBondContact O-N 3.48Å; A51-G53 VanDerWaalsContact C-N 3.35Å; G53-K56 PolarHBondContact O-N 3.31Å; G53-A57 WeakPolarHBondContact O-CB 3.14Å; G53-A57 PolarHBondContact O-N 3.5Å |
| 54 | M | 75.8 | Confident | 66.4 | Low | 136 Ų | 136 | 98.9 Ų | 98.9 | 67% | 0.67 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -67 | -41 | 174.4 | -81.3 | -168.7 | -82.2 | 0 | 0 | 112.1 | G50 A51 K56 A57 Y58 | G50-M54 WeakPolarHBondContact O-CB 3.43Å; G50-M54 PolarHBondContact O-N 3.15Å; A51-M54 PolarHBondContact O-N 3.23Å; M54-K56 VanDerWaalsContact C-N 3.3Å; M54-K56 PolarHBondContact O-N 3.37Å; M54-A57 PolarHBondContact O-N 2.9Å; M54-Y58 VanDerWaalsContact O-CB 3.23Å; M54-Y58 WeakPolarHBondContact O-CB 3.5Å; M54-Y58 PolarHBondContact O-N 3.48Å |
| 55 | A | 74.3 | Confident | 67 | Low | 59 Ų | 59 | 101.6 Ų | 101.6 | 49% | 0.488 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.3 | -39.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | A51 V52 S59 | A51-A55 WeakPolarHBondContact O-CB 3.37Å; A51-A55 PolarHBondContact O-N 3.18Å; V52-A55 PolarHBondContact O-N 2.71Å; A55-S59 WeakPolarHBondContact O-CB 3.42Å; A55-S59 PolarHBondContact O-N 3.45Å; A55-S59 PolarHBondContact O-OG 3.47Å |
| 56 | K | 78.3 | Confident | 67.7 | Low | 126 Ų | 126 | 94.4 Ų | 94.4 | 55% | 0.548 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.1 | -48.4 | 175.3 | -164.2 | -179 | -178.8 | -166.5 | 0 | 111.4 | V52 G53 M54 Y58 S59 E60 | V52-K56 VanDerWaalsContact O-CB 3.28Å; V52-K56 WeakPolarHBondContact O-CB 3.36Å; V52-K56 PolarHBondContact O-N 2.84Å; G53-K56 PolarHBondContact O-N 3.31Å; M54-K56 VanDerWaalsContact C-N 3.3Å; M54-K56 PolarHBondContact O-N 3.37Å; K56-Y58 VanDerWaalsContact C-N 3.33Å; K56-Y58 PolarHBondContact O-N 3.42Å; K56-S59 WeakPolarHBondContact CA-OG 3.23Å; K56-S59 CarbonylContact O-C 3.59Å; K56-S59 PolarHBondContact O-N 2.83Å; K56-S59 VanDerWaalsContact O-N 3.17Å; K56-S59 PolarHBondContact O-OG 2.84Å; K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 2.88Å; K56-E60 WeakPolarHBondContact O-CB 3.49Å; K56-E60 WeakPolarHBondContact O-CG 3.41Å; K56-E60 PolarHBondContact O-N 3.41Å |
| 57 | A | 76.7 | Confident | 67.9 | Low | 50 Ų | 50 | 93.5 Ų | 93.5 | 41% | 0.413 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -39.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | G53 M54 E60 Q61 | G53-A57 WeakPolarHBondContact O-CB 3.14Å; G53-A57 PolarHBondContact O-N 3.5Å; M54-A57 PolarHBondContact O-N 2.9Å; A57-E60 PolarHBondContact O-N 3.46Å; A57-Q61 WeakPolarHBondContact O-CB 3.27Å; A57-Q61 PolarHBondContact O-N 2.96Å |
| 58 | Y | 73.6 | Confident | 67.8 | Low | 147 Ų | 147 | 90.5 Ų | 90.5 | 58% | 0.576 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67.6 | -39.8 | 174.5 | -169.5 | -95 | 0 | 0 | 0 | 111.5 | M54 K56 Q61 M62 | M54-Y58 VanDerWaalsContact O-CB 3.23Å; M54-Y58 WeakPolarHBondContact O-CB 3.5Å; M54-Y58 PolarHBondContact O-N 3.48Å; K56-Y58 VanDerWaalsContact C-N 3.33Å; K56-Y58 PolarHBondContact O-N 3.42Å; Y58-Q61 PolarHBondContact O-N 3.29Å; Y58-M62 HydrophobicContact CD1-CG 4.38Å; Y58-M62 HydrophobicContact CE1-CE 3.97Å; Y58-M62 HydrophobicContact CE1-CG 3.95Å; Y58-M62 HydrophobicContact CE1-SD 4.17Å; Y58-M62 WeakPolarHBondContact O-CB 3.3Å; Y58-M62 PolarHBondContact O-N 2.78Å |
| 59 | S | 69.9 | Low | 67.7 | Low | 64 Ų | 64 | 90.9 Ų | 90.9 | 45% | 0.448 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.8 | -37.8 | 174.7 | 76.8 | 0 | 0 | 0 | 0 | 112.2 | A55 K56 A63 | A55-S59 WeakPolarHBondContact O-CB 3.42Å; A55-S59 PolarHBondContact O-N 3.45Å; A55-S59 PolarHBondContact O-OG 3.47Å; K56-S59 WeakPolarHBondContact CA-OG 3.23Å; K56-S59 CarbonylContact O-C 3.59Å; K56-S59 PolarHBondContact O-N 2.83Å; K56-S59 VanDerWaalsContact O-N 3.17Å; K56-S59 PolarHBondContact O-OG 2.84Å; S59-A63 WeakPolarHBondContact O-CB 3.37Å; S59-A63 PolarHBondContact O-N 3.45Å |
| 60 | E | 75.2 | Confident | 67.2 | Low | 96 Ų | 96 | 89.1 Ų | 89.1 | 45% | 0.449 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -70.7 | -40.2 | 176.1 | -75.2 | 174.8 | -174.8 | 0 | 0 | 110.8 | K56 A57 A63 Q64 | K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 2.88Å; K56-E60 WeakPolarHBondContact O-CB 3.49Å; K56-E60 WeakPolarHBondContact O-CG 3.41Å; K56-E60 PolarHBondContact O-N 3.41Å; A57-E60 PolarHBondContact O-N 3.46Å; E60-A63 PolarHBondContact O-N 3.32Å; E60-Q64 WeakPolarHBondContact O-CB 3.34Å; E60-Q64 VanDerWaalsContact O-CG 3.28Å; E60-Q64 WeakPolarHBondContact O-CG 3.38Å; E60-Q64 PolarHBondContact O-N 3.46Å |
| 61 | Q | 72.5 | Confident | 66.4 | Low | 115 Ų | 115 | 91.5 Ų | 91.5 | 54% | 0.537 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.3 | -40.2 | 173.1 | -84.7 | -171.8 | -18.2 | 0 | 0 | 112.8 | A57 Y58 Q64 H65 | A57-Q61 WeakPolarHBondContact O-CB 3.27Å; A57-Q61 PolarHBondContact O-N 2.96Å; Y58-Q61 PolarHBondContact O-N 3.29Å; Q61-Q64 PolarHBondContact O-N 2.92Å; Q61-H65 VanDerWaalsContact O-CB 3.3Å; Q61-H65 WeakPolarHBondContact O-CB 3.32Å; Q61-H65 PolarHBondContact O-N 3.28Å; Q61-H65 PolarHBondContact O-ND1 3.23Å |
| 62 | M | 63.3 | Low | 65.6 | Low | 114 Ų | 114 | 99.4 Ų | 99.4 | 56% | 0.562 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -69 | -34.5 | 173.4 | -96.8 | -141.5 | 174 | 0 | 0 | 112 | Y58 G66 | Y58-M62 HydrophobicContact CD1-CG 4.38Å; Y58-M62 HydrophobicContact CE1-CE 3.97Å; Y58-M62 HydrophobicContact CE1-CG 3.95Å; Y58-M62 HydrophobicContact CE1-SD 4.17Å; Y58-M62 WeakPolarHBondContact O-CB 3.3Å; Y58-M62 PolarHBondContact O-N 2.78Å; M62-G66 WeakPolarHBondContact O-CA 3.36Å; M62-G66 PolarHBondContact O-N 3.28Å |
| 63 | A | 66.8 | Low | 64.5 | Low | 42 Ų | 42 | 105 Ų | 105 | 35% | 0.347 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.6 | -51.7 | 170.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | S59 E60 H65 I67 | S59-A63 WeakPolarHBondContact O-CB 3.37Å; S59-A63 PolarHBondContact O-N 3.45Å; E60-A63 PolarHBondContact O-N 3.32Å; A63-H65 PolarHBondContact O-N 3.42Å; A63-I67 HydrophobicContact CB-CD1 3.85Å; A63-I67 WeakPolarHBondContact O-CA 3.41Å; A63-I67 WeakPolarHBondContact O-CB 3.13Å; A63-I67 WeakPolarHBondContact O-CD1 3.43Å; A63-I67 WeakPolarHBondContact O-CG1 3.47Å; A63-I67 PolarHBondContact O-N 3.09Å |
| 64 | Q | 63.9 | Low | 63.3 | Low | 136 Ų | 136 | 106.1 Ų | 106.1 | 64% | 0.636 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.8 | -44.9 | -179.7 | -71.3 | 175.6 | 4.1 | 0 | 0 | 112.9 | E60 Q61 A68 | E60-Q64 WeakPolarHBondContact O-CB 3.34Å; E60-Q64 VanDerWaalsContact O-CG 3.28Å; E60-Q64 WeakPolarHBondContact O-CG 3.38Å; E60-Q64 PolarHBondContact O-N 3.46Å; Q61-Q64 PolarHBondContact O-N 2.92Å; Q64-A68 WeakPolarHBondContact O-CB 3.32Å; Q64-A68 PolarHBondContact O-N 3.47Å |
| 65 | H | 58.4 | Low | 62.4 | Low | 116 Ų | 116 | 101.4 Ų | 101.4 | 54% | 0.537 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -79.5 | -35 | -179.9 | -72.8 | 79.5 | 0 | 0 | 0 | 113.3 | Q61 A63 K69 | Q61-H65 VanDerWaalsContact O-CB 3.3Å; Q61-H65 WeakPolarHBondContact O-CB 3.32Å; Q61-H65 PolarHBondContact O-N 3.28Å; Q61-H65 PolarHBondContact O-ND1 3.23Å; A63-H65 PolarHBondContact O-N 3.42Å; H65-K69 VanDerWaalsContact O-CB 3.26Å; H65-K69 WeakPolarHBondContact O-CB 3.38Å; H65-K69 WeakPolarHBondContact O-CG 3.27Å; H65-K69 PolarHBondContact O-N 3.28Å |
| 66 | G | 56.4 | Low | 61.8 | Low | 27 Ų | 27 | 101.1 Ų | 101.1 | 28% | 0.278 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -75.2 | -44.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | M62 K69 L70 | M62-G66 WeakPolarHBondContact O-CA 3.36Å; M62-G66 PolarHBondContact O-N 3.28Å; G66-K69 PolarHBondContact O-N 3.29Å; G66-L70 WeakPolarHBondContact O-CB 3.27Å; G66-L70 WeakPolarHBondContact O-CD1 3.44Å; G66-L70 VanDerWaalsContact O-CG 3.26Å; G66-L70 WeakPolarHBondContact O-CG 3.46Å; G66-L70 PolarHBondContact O-N 3.01Å |
| 67 | I | 54.2 | Low | 61.3 | Low | 110 Ų | 110 | 99.2 Ų | 99.2 | 56% | 0.564 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.2 | -43.9 | 171.4 | -55.9 | 163.4 | 0 | 0 | 0 | 108.9 | A63 K69 L70 D71 | A63-I67 HydrophobicContact CB-CD1 3.85Å; A63-I67 WeakPolarHBondContact O-CA 3.41Å; A63-I67 WeakPolarHBondContact O-CB 3.13Å; A63-I67 WeakPolarHBondContact O-CD1 3.43Å; A63-I67 WeakPolarHBondContact O-CG1 3.47Å; A63-I67 PolarHBondContact O-N 3.09Å; I67-K69 PolarHBondContact O-N 2.98Å; I67-L70 PolarHBondContact O-N 2.92Å; I67-D71 WeakPolarHBondContact O-CB 3.4Å; I67-D71 PolarHBondContact O-N 3.45Å |
| 68 | A | 56.8 | Low | 61 | Low | 59 Ų | 59 | 101 Ų | 101 | 49% | 0.488 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.2 | -35.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q64 R72 | Q64-A68 WeakPolarHBondContact O-CB 3.32Å; Q64-A68 PolarHBondContact O-N 3.47Å; A68-R72 PolarHBondContact O-N 3.03Å |
| 69 | K | 52.5 | Low | 61.2 | Low | 149 Ų | 149 | 96.2 Ų | 96.2 | 65% | 0.648 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -74.8 | -39.2 | 175.4 | -78.5 | 179.6 | -178.8 | -176.7 | 0 | 112.4 | H65 G66 I67 D71 R72 Y73 | H65-K69 VanDerWaalsContact O-CB 3.26Å; H65-K69 WeakPolarHBondContact O-CB 3.38Å; H65-K69 WeakPolarHBondContact O-CG 3.27Å; H65-K69 PolarHBondContact O-N 3.28Å; G66-K69 PolarHBondContact O-N 3.29Å; I67-K69 PolarHBondContact O-N 2.98Å; K69-D71 VanDerWaalsContact C-N 3.31Å; K69-R72 PolarHBondContact O-N 3.23Å; K69-Y73 PolarHBondContact O-N 2.97Å; K69-Y73 VanDerWaalsContact O-N 3.08Å |
| 70 | L | 51.8 | Low | 61.9 | Low | 114 Ų | 114 | 100.5 Ų | 100.5 | 60% | 0.597 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.9 | -40.5 | 171.9 | -79.2 | 163.4 | 0 | 0 | 0 | 110.4 | G66 I67 R72 Y73 V74 | G66-L70 WeakPolarHBondContact O-CB 3.27Å; G66-L70 WeakPolarHBondContact O-CD1 3.44Å; G66-L70 VanDerWaalsContact O-CG 3.26Å; G66-L70 WeakPolarHBondContact O-CG 3.46Å; G66-L70 PolarHBondContact O-N 3.01Å; I67-L70 PolarHBondContact O-N 2.92Å; L70-R72 PolarHBondContact O-N 2.51Å; L70-Y73 PolarHBondContact O-N 2.69Å; L70-V74 CarbonylContact O-C 3.58Å; L70-V74 VanDerWaalsContact O-C 3.3Å; L70-V74 VanDerWaalsContact O-CA 3.31Å; L70-V74 WeakPolarHBondContact O-CA 3.06Å; L70-V74 WeakPolarHBondContact O-CB 3.39Å; L70-V74 PolarHBondContact O-N 3.25Å |
| 71 | D | 52.8 | Low | 62.2 | Low | 82 Ų | 82 | 99.4 Ų | 99.4 | 44% | 0.439 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.1 | -24.4 | 177.9 | -150.6 | 26.7 | 0 | 0 | 0 | 112.1 | I67 K69 V74 S75 | I67-D71 WeakPolarHBondContact O-CB 3.4Å; I67-D71 PolarHBondContact O-N 3.45Å; K69-D71 VanDerWaalsContact C-N 3.31Å; D71-V74 WeakPolarHBondContact CA-O 3.41Å; D71-V74 CarbonylContact O-C 3.3Å; D71-S75 WeakPolarHBondContact O-CA 3.36Å; D71-S75 PolarHBondContact O-N 3.09Å |
| 72 | R | 55.5 | Low | 62.8 | Low | 219 Ų | 219 | 94.7 Ų | 94.7 | 83% | 0.826 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -77.6 | -41.9 | 172.1 | -168.9 | 174.3 | -179.8 | 171.3 | -0.1 | 113.2 | A68 K69 L70 | A68-R72 PolarHBondContact O-N 3.03Å; K69-R72 PolarHBondContact O-N 3.23Å; L70-R72 PolarHBondContact O-N 2.51Å |
| 73 | Y | 49.8 | Very low | 64 | Low | 205 Ų | 205 | 93.3 Ų | 93.3 | 80% | 0.804 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -84.4 | -36 | -178.5 | -93.5 | -85.2 | 0 | 0 | 0 | 113.2 | K69 L70 | K69-Y73 PolarHBondContact O-N 2.97Å; K69-Y73 VanDerWaalsContact O-N 3.08Å; L70-Y73 PolarHBondContact O-N 2.69Å |
| 74 | V | 51.4 | Low | 64.9 | Low | 62 Ų | 62 | 97.3 Ų | 97.3 | 38% | 0.376 | 48% | 0.484 | S | S | . | . | S | Bend | trans | -119.7 | 83.5 | 172 | -173.9 | 0 | 0 | 0 | 0 | 104.8 | L70 D71 A76 | L70-V74 CarbonylContact O-C 3.58Å; L70-V74 VanDerWaalsContact O-C 3.3Å; L70-V74 VanDerWaalsContact O-CA 3.31Å; L70-V74 WeakPolarHBondContact O-CA 3.06Å; L70-V74 WeakPolarHBondContact O-CB 3.39Å; L70-V74 PolarHBondContact O-N 3.25Å; D71-V74 WeakPolarHBondContact CA-O 3.41Å; D71-V74 CarbonylContact O-C 3.3Å; V74-A76 PolarHBondContact O-N 2.82Å |
| 75 | S | 57.1 | Low | 65.9 | Low | 37 Ų | 37 | 92.3 Ų | 92.3 | 26% | 0.259 | 46% | 0.462 | S | S | . | . | trans | -61.9 | 84.6 | 167.6 | -165.6 | 0 | 0 | 0 | 0 | 107.1 | D71 V77 K78 L79 | D71-S75 WeakPolarHBondContact O-CA 3.36Å; D71-S75 PolarHBondContact O-N 3.09Å; S75-V77 PolarHBondContact O-N 3.42Å; S75-V77 VanDerWaalsContact O-N 3.16Å; S75-K78 WeakPolarHBondContact O-CA 3.48Å; S75-K78 WeakPolarHBondContact O-CB 3.5Å; S75-K78 PolarHBondContact O-N 2.85Å; S75-L79 PolarHBondContact O-N 3Å | ||
| 76 | A | 61 | Low | 67.2 | Low | 53 Ų | 53 | 91.7 Ų | 91.7 | 44% | 0.438 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.2 | -30.2 | -171.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | V74 L79 K80 | V74-A76 PolarHBondContact O-N 2.82Å; A76-L79 PolarHBondContact O-N 3.3Å; A76-K80 VanDerWaalsContact O-CB 3.32Å; A76-K80 WeakPolarHBondContact O-CB 3.41Å; A76-K80 PolarHBondContact O-N 2.9Å |
| 77 | V | 67.8 | Low | 68.7 | Low | 87 Ų | 87 | 97.1 Ų | 97.1 | 53% | 0.527 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.1 | -46.1 | 170.5 | -175.1 | 0 | 0 | 0 | 0 | 111.9 | S75 Q81 | S75-V77 PolarHBondContact O-N 3.42Å; S75-V77 VanDerWaalsContact O-N 3.16Å; V77-Q81 WeakPolarHBondContact O-CG 3.45Å; V77-Q81 PolarHBondContact O-N 3.33Å |
| 78 | K | 70.7 | Confident | 70 | Confident | 88 Ų | 88 | 93.8 Ų | 93.8 | 38% | 0.383 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.4 | -41.6 | 175.9 | -70.5 | -177.9 | -179.6 | 175.9 | 0 | 111.3 | S75 K80 Q81 Y82 | S75-K78 WeakPolarHBondContact O-CA 3.48Å; S75-K78 WeakPolarHBondContact O-CB 3.5Å; S75-K78 PolarHBondContact O-N 2.85Å; K78-K80 VanDerWaalsContact C-N 3.32Å; K78-K80 PolarHBondContact O-N 3.46Å; K78-Q81 WeakPolarHBondContact O-CB 3.33Å; K78-Q81 PolarHBondContact O-N 2.9Å; K78-Q81 VanDerWaalsContact O-N 3.11Å; K78-Y82 HydrophobicContact CB-CE2 4.4Å; K78-Y82 WeakPolarHBondContact O-CD2 3.21Å; K78-Y82 PolarHBondContact O-N 3.49Å |
| 79 | L | 78.5 | Confident | 71.4 | Confident | 45 Ų | 45 | 92.4 Ų | 92.4 | 24% | 0.236 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -58.7 | -46.7 | 176.7 | -169 | 66.7 | 0 | 0 | 0 | 110.8 | S75 A76 Q81 Y82 F83 L137 W200 | S75-L79 PolarHBondContact O-N 3Å; A76-L79 PolarHBondContact O-N 3.3Å; L79-Q81 PolarHBondContact O-N 3.42Å; L79-Y82 PolarHBondContact O-N 3.42Å; L79-F83 HydrophobicContact CD1-CD2 4.37Å; L79-F83 HydrophobicContact CD1-CE2 3.89Å; L79-F83 HydrophobicContact CG-CD2 4.28Å; L79-F83 HydrophobicContact CG-CE2 4.14Å; L79-F83 WeakPolarHBondContact O-CD2 2.97Å; L79-F83 PolarHBondContact O-N 2.92Å; L79-L137 HydrophobicContact CD1-CD2 4.18Å; L79-W200 HydrophobicContact CD1-CD2 3.86Å; L79-W200 HydrophobicContact CD1-CE3 3.9Å; L79-W200 HydrophobicContact CD1-CG 4.48Å; L79-W200 HydrophobicContact CD1-CH2 4.11Å; L79-W200 HydrophobicContact CD1-CZ2 4.08Å; L79-W200 HydrophobicContact CD1-CZ3 4.03Å |
| 80 | K | 83.2 | Confident | 73.1 | Confident | 154 Ų | 154 | 86.5 Ų | 86.5 | 67% | 0.67 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -53.8 | -42.7 | 174.7 | -175.5 | 180 | 177.1 | -175.5 | 0 | 111.5 | A76 K78 Y82 F83 D84 | A76-K80 VanDerWaalsContact O-CB 3.32Å; A76-K80 WeakPolarHBondContact O-CB 3.41Å; A76-K80 PolarHBondContact O-N 2.9Å; K78-K80 VanDerWaalsContact C-N 3.32Å; K78-K80 PolarHBondContact O-N 3.46Å; K80-Y82 VanDerWaalsContact C-N 3.34Å; K80-Y82 PolarHBondContact O-N 3.1Å; K80-F83 CarbonylContact O-C 3.42Å; K80-F83 PolarHBondContact O-N 3.45Å; K80-F83 VanDerWaalsContact O-N 3.09Å; K80-D84 PolarHBondContact O-N 2.92Å |
| 81 | Q | 81.7 | Confident | 74.9 | Confident | 74 Ų | 74 | 83.1 Ų | 83.1 | 35% | 0.346 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.5 | -32.1 | 178.1 | -70 | 167.9 | -8.9 | 0 | 0 | 113.9 | V77 K78 L79 F83 D84 R129 | V77-Q81 WeakPolarHBondContact O-CG 3.45Å; V77-Q81 PolarHBondContact O-N 3.33Å; K78-Q81 WeakPolarHBondContact O-CB 3.33Å; K78-Q81 PolarHBondContact O-N 2.9Å; K78-Q81 VanDerWaalsContact O-N 3.11Å; L79-Q81 PolarHBondContact O-N 3.42Å; Q81-F83 PolarHBondContact O-N 3.31Å; Q81-D84 PolarHBondContact O-N 2.99Å; Q81-R129 VanDerWaalsContact OE1-CZ 3.24Å |
| 82 | Y | 86 | Confident | 76.3 | Confident | 16 Ų | 16 | 80.7 Ų | 80.7 | 6% | 0.063 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -70.3 | -17.5 | 175.1 | -69.8 | -77.5 | 0 | 0 | 0 | 113.3 | K78 L79 K80 I135 L137 Y138 W200 D201 | K78-Y82 HydrophobicContact CB-CE2 4.4Å; K78-Y82 WeakPolarHBondContact O-CD2 3.21Å; K78-Y82 PolarHBondContact O-N 3.49Å; L79-Y82 PolarHBondContact O-N 3.42Å; K80-Y82 VanDerWaalsContact C-N 3.34Å; K80-Y82 PolarHBondContact O-N 3.1Å; Y82-I135 HydrophobicContact CD1-CG2 4.32Å; Y82-I135 WeakPolarHBondContact CD1-O 3.48Å; Y82-I135 HydrophobicContact CE1-CB 4.32Å; Y82-I135 HydrophobicContact CE1-CG2 3.97Å; Y82-L137 HydrophobicContact CD1-CB 4.39Å; Y82-L137 HydrophobicContact CG-CB 4.19Å; Y82-L137 PolarHBondContact O-N 2.84Å; Y82-Y138 PolarHBondContact O-N 3Å; Y82-W200 HydrophobicContact CD2-CB 4.06Å; Y82-W200 HydrophobicContact CE1-CB 4.38Å; Y82-W200 HydrophobicContact CE2-CB 3.5Å; Y82-W200 HydrophobicContact CE2-CG 4.14Å; Y82-D201 WeakPolarHBondContact CE1-OD1 3.41Å; Y82-D201 PolarHBondContact OH-OD1 2.97Å; Y82-D201 PolarHBondContact OH-OD2 3.39Å |
| 83 | F | 88.3 | Confident | 77.9 | Confident | 85 Ų | 85 | 70.4 Ų | 70.4 | 37% | 0.373 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -108.8 | -4.7 | 178.8 | -72.6 | -76.8 | 0 | 0 | 0 | 113.5 | L79 K80 Q81 V85 L137 Y138 V141 | L79-F83 HydrophobicContact CD1-CD2 4.37Å; L79-F83 HydrophobicContact CD1-CE2 3.89Å; L79-F83 HydrophobicContact CG-CD2 4.28Å; L79-F83 HydrophobicContact CG-CE2 4.14Å; L79-F83 WeakPolarHBondContact O-CD2 2.97Å; L79-F83 PolarHBondContact O-N 2.92Å; K80-F83 CarbonylContact O-C 3.42Å; K80-F83 PolarHBondContact O-N 3.45Å; K80-F83 VanDerWaalsContact O-N 3.09Å; Q81-F83 PolarHBondContact O-N 3.31Å; F83-V85 VanDerWaalsContact C-N 3.27Å; F83-V85 PolarHBondContact O-N 3.21Å; F83-L137 HydrophobicContact CE2-CB 4.42Å; F83-L137 HydrophobicContact CE2-CD2 3.82Å; F83-L137 HydrophobicContact CE2-CG 4.39Å; F83-L137 HydrophobicContact CZ-CB 4.3Å; F83-L137 HydrophobicContact CZ-CD2 3.84Å; F83-L137 HydrophobicContact CZ-CG 4.05Å; F83-Y138 HydrophobicContact CD1-CD2 4.22Å; F83-V141 HydrophobicContact CE1-CG2 4.36Å; F83-V141 HydrophobicContact CZ-CG2 4.27Å |
| 84 | D | 85.7 | Confident | 79.9 | Confident | 126 Ų | 126 | 63.4 Ų | 63.4 | 67% | 0.674 | 34% | 0.343 | S | S | * | . | trans | -80.2 | 78.4 | 177.6 | -163.5 | 22.3 | 0 | 0 | 0 | 109.3 | K80 Q81 | K80-D84 PolarHBondContact O-N 2.92Å; Q81-D84 PolarHBondContact O-N 2.99Å | ||
| 85 | V | 85.5 | Confident | 81.7 | Confident | 30 Ų | 30 | 63.3 Ų | 63.3 | 18% | 0.182 | 34% | 0.34 | C | S | . | . | trans | -133.6 | 127.1 | -168.9 | 175.5 | 0 | 0 | 0 | 0 | 110.3 | F83 Y89 V90 D136 Y138 | F83-V85 VanDerWaalsContact C-N 3.27Å; F83-V85 PolarHBondContact O-N 3.21Å; V85-Y89 HydrophobicContact CB-CD1 4.45Å; V85-Y89 HydrophobicContact CG1-CD1 3.34Å; V85-Y89 HydrophobicContact CG1-CE1 4.03Å; V85-Y89 HydrophobicContact CG1-CG 4Å; V85-Y89 HydrophobicContact CG2-CD1 4.42Å; V85-Y89 HydrophobicContact CG2-CE1 4.41Å; V85-V90 HydrophobicContact CG1-CG2 3.48Å; V85-V90 VanDerWaalsContact CG1-CG2 3.48Å; V85-D136 HydrophobicContact CG2-CB 4.04Å; V85-Y138 HydrophobicContact CB-CG 4.43Å; V85-Y138 HydrophobicContact CG1-CD1 4.34Å | ||
| 86 | D | 85 | Confident | 83.2 | Confident | 103 Ų | 103 | 61.7 Ų | 61.7 | 55% | 0.551 | 33% | 0.328 | S | S | * | . | trans | -84.8 | 152.9 | 173.2 | -71.1 | -43.2 | 0 | 0 | 0 | 112.9 | L88 Y89 V90 | D86-L88 PolarHBondContact O-N 3.13Å; D86-L88 VanDerWaalsContact O-N 3.1Å; D86-Y89 WeakPolarHBondContact O-CA 3.43Å; D86-Y89 VanDerWaalsContact O-CB 3.31Å; D86-Y89 WeakPolarHBondContact O-CB 3.25Å; D86-Y89 PolarHBondContact O-N 3.36Å; D86-V90 PolarHBondContact O-N 2.86Å | ||
| 87 | N | 87 | Confident | 84.7 | Confident | 141 Ų | 141 | 59.1 Ų | 59.1 | 75% | 0.754 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -52.9 | -35.9 | 173.4 | -70.1 | -31.8 | 0 | 0 | 0 | 112.9 | V90 G91 | N87-V90 PolarHBondContact O-N 3.45Å; N87-G91 PolarHBondContact O-N 2.83Å; N87-G91 VanDerWaalsContact O-N 3.1Å |
| 88 | L | 83 | Confident | 85.8 | Confident | 40 Ų | 40 | 56.1 Ų | 56.1 | 21% | 0.209 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -67.7 | -40 | 177.5 | 177.8 | 58.7 | 0 | 0 | 0 | 112.2 | D86 V90 K92 W114 | D86-L88 PolarHBondContact O-N 3.13Å; D86-L88 VanDerWaalsContact O-N 3.1Å; L88-V90 VanDerWaalsContact C-N 3.33Å; L88-K92 HydrophobicContact CD1-CD 4.46Å; L88-K92 HydrophobicContact CG-CD 4.4Å; L88-K92 WeakPolarHBondContact O-CB 3.41Å; L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 3.02Å; L88-W114 HydrophobicContact CD1-CD2 3.42Å; L88-W114 VanDerWaalsContact CD1-CD2 3.42Å; L88-W114 HydrophobicContact CD1-CE3 3.39Å; L88-W114 HydrophobicContact CD1-CG 3.92Å; L88-W114 HydrophobicContact CD1-CH2 4Å; L88-W114 HydrophobicContact CD1-CZ2 4.04Å; L88-W114 HydrophobicContact CD1-CZ3 3.68Å; L88-W114 HydrophobicContact CD2-CB 4.07Å; L88-W114 HydrophobicContact CD2-CD2 4.14Å; L88-W114 HydrophobicContact CD2-CE3 3.76Å; L88-W114 HydrophobicContact CD2-CG 4.26Å; L88-W114 HydrophobicContact CD2-CZ3 4.5Å; L88-W114 HydrophobicContact CG-CD2 4.41Å; L88-W114 HydrophobicContact CG-CE3 4.22Å |
| 89 | Y | 84.5 | Confident | 86.8 | Confident | 31 Ų | 31 | 56.1 Ų | 56.1 | 12% | 0.122 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.8 | -46 | 173.1 | 174.5 | -78.8 | 0 | 0 | 0 | 110.1 | V85 D86 G91 K92 K93 A134 D136 I139 | V85-Y89 HydrophobicContact CB-CD1 4.45Å; V85-Y89 HydrophobicContact CG1-CD1 3.34Å; V85-Y89 HydrophobicContact CG1-CE1 4.03Å; V85-Y89 HydrophobicContact CG1-CG 4Å; V85-Y89 HydrophobicContact CG2-CD1 4.42Å; V85-Y89 HydrophobicContact CG2-CE1 4.41Å; D86-Y89 WeakPolarHBondContact O-CA 3.43Å; D86-Y89 VanDerWaalsContact O-CB 3.31Å; D86-Y89 WeakPolarHBondContact O-CB 3.25Å; D86-Y89 PolarHBondContact O-N 3.36Å; Y89-G91 PolarHBondContact O-N 2.84Å; Y89-K92 WeakPolarHBondContact O-CB 3.37Å; Y89-K92 PolarHBondContact O-N 3.32Å; Y89-K93 HydrophobicContact CD1-CB 4.38Å; Y89-K93 HydrophobicContact CE1-CB 4.13Å; Y89-K93 HydrophobicContact CE1-CD 4.32Å; Y89-K93 HydrophobicContact CE1-CG 4.27Å; Y89-K93 WeakPolarHBondContact O-CB 3.4Å; Y89-K93 PolarHBondContact O-N 2.74Å; Y89-K93 PolarHBondContact OH-NZ 3.34Å; Y89-A134 PolarHBondContact OH-O 3.41Å; Y89-D136 HydrophobicContact CE1-CB 4.14Å; Y89-D136 PolarHBondContact OH-OD2 3.32Å; Y89-I139 HydrophobicContact CD1-CD1 4.48Å; Y89-I139 HydrophobicContact CE1-CD1 4.13Å |
| 90 | V | 89.8 | Confident | 87.1 | Confident | 25 Ų | 25 | 54 Ų | 54 | 15% | 0.152 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -57.6 | -50.1 | -179.7 | 178.9 | 0 | 0 | 0 | 0 | 111.2 | V85 D86 N87 L88 K92 K93 L94 Y138 I139 | V85-V90 HydrophobicContact CG1-CG2 3.48Å; V85-V90 VanDerWaalsContact CG1-CG2 3.48Å; D86-V90 PolarHBondContact O-N 2.86Å; N87-V90 PolarHBondContact O-N 3.45Å; L88-V90 VanDerWaalsContact C-N 3.33Å; V90-K92 VanDerWaalsContact C-N 3.34Å; V90-K92 PolarHBondContact O-N 3.33Å; V90-K93 PolarHBondContact O-N 3.22Å; V90-L94 HydrophobicContact CG1-CD1 3.74Å; V90-L94 HydrophobicContact CG1-CG 4.08Å; V90-L94 WeakPolarHBondContact O-CB 3.34Å; V90-L94 VanDerWaalsContact O-CG 3.3Å; V90-L94 WeakPolarHBondContact O-CG 3.3Å; V90-L94 PolarHBondContact O-N 3.07Å; V90-Y138 HydrophobicContact CG2-CD1 4.03Å; V90-Y138 HydrophobicContact CG2-CE1 3.86Å; V90-I139 HydrophobicContact CG1-CD1 4.4Å; V90-I139 HydrophobicContact CG1-CG1 4.24Å; V90-I139 HydrophobicContact CG2-CG1 4.34Å |
| 91 | G | 88.3 | Confident | 87.1 | Confident | 42 Ų | 42 | 52 Ų | 52 | 43% | 0.433 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.1 | -43.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | N87 Y89 L95 | N87-G91 PolarHBondContact O-N 2.83Å; N87-G91 VanDerWaalsContact O-N 3.1Å; Y89-G91 PolarHBondContact O-N 2.84Å; G91-L95 PolarHBondContact O-N 3.3Å; G91-L95 VanDerWaalsContact O-N 3.12Å |
| 92 | K | 83.3 | Confident | 86.8 | Confident | 32 Ų | 32 | 52.9 Ų | 52.9 | 14% | 0.139 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.2 | -46.3 | 174.6 | -78.8 | 175.3 | -174.9 | 172.1 | 0 | 111.6 | L88 Y89 V90 L96 F107 I110 | L88-K92 HydrophobicContact CD1-CD 4.46Å; L88-K92 HydrophobicContact CG-CD 4.4Å; L88-K92 WeakPolarHBondContact O-CB 3.41Å; L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 3.02Å; Y89-K92 WeakPolarHBondContact O-CB 3.37Å; Y89-K92 PolarHBondContact O-N 3.32Å; V90-K92 VanDerWaalsContact C-N 3.34Å; V90-K92 PolarHBondContact O-N 3.33Å; K92-L96 WeakPolarHBondContact O-CB 3.24Å; K92-L96 PolarHBondContact O-N 3.3Å; K92-L96 VanDerWaalsContact O-N 3.12Å; K92-F107 HydrophobicContact CB-CE2 3.7Å; K92-F107 HydrophobicContact CB-CZ 4.02Å; K92-F107 HydrophobicContact CD-CZ 4.3Å; K92-F107 HydrophobicContact CG-CE2 4.09Å; K92-F107 HydrophobicContact CG-CZ 4.26Å; K92-I110 HydrophobicContact CG-CG2 4.45Å |
| 93 | K | 88.5 | Confident | 85.7 | Confident | 2 Ų | 2 | 53.2 Ų | 53.2 | 1% | 0.009 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -67.3 | -44.1 | -178.4 | -166.8 | 76.4 | 164 | -136.8 | 0 | 111.8 | Y89 V90 L95 L96 V97 V132 A134 D136 I139 Y208 | Y89-K93 HydrophobicContact CD1-CB 4.38Å; Y89-K93 HydrophobicContact CE1-CB 4.13Å; Y89-K93 HydrophobicContact CE1-CD 4.32Å; Y89-K93 HydrophobicContact CE1-CG 4.27Å; Y89-K93 WeakPolarHBondContact O-CB 3.4Å; Y89-K93 PolarHBondContact O-N 2.74Å; Y89-K93 PolarHBondContact OH-NZ 3.34Å; V90-K93 PolarHBondContact O-N 3.22Å; K93-L95 VanDerWaalsContact C-N 3.34Å; K93-L95 PolarHBondContact O-N 3.08Å; K93-L96 WeakPolarHBondContact O-CB 3.42Å; K93-L96 PolarHBondContact O-N 3.21Å; K93-L96 VanDerWaalsContact O-N 3.13Å; K93-V97 HydrophobicContact CG-CG2 4.39Å; K93-V97 WeakPolarHBondContact O-CB 3.46Å; K93-V97 WeakPolarHBondContact O-CG2 3.44Å; K93-V97 PolarHBondContact O-N 2.92Å; K93-V132 WeakPolarHBondContact CD-O 3.26Å; K93-V132 PolarHBondContact NZ-O 2.89Å; K93-A134 PolarHBondContact NZ-O 3.44Å; K93-D136 WeakPolarHBondContact CE-OD2 3.38Å; K93-D136 IonicContact NZ-OD2 3.35Å; K93-D136 PolarHBondContact NZ-OD2 2.91Å; K93-I139 HydrophobicContact CB-CD1 3.55Å; K93-I139 HydrophobicContact CG-CD1 3.46Å; K93-I139 VanDerWaalsContact CG-CD1 3.46Å; K93-Y208 WeakPolarHBondContact CE-OH 3.42Å |
| 94 | L | 91.8 | Very high | 84.5 | Confident | 59 Ų | 59 | 56.8 Ų | 56.8 | 31% | 0.309 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.5 | -43.8 | 177.2 | -71.8 | 176.3 | 0 | 0 | 0 | 111.6 | V90 L96 V97 L98 I139 V211 | V90-L94 HydrophobicContact CG1-CD1 3.74Å; V90-L94 HydrophobicContact CG1-CG 4.08Å; V90-L94 WeakPolarHBondContact O-CB 3.34Å; V90-L94 VanDerWaalsContact O-CG 3.3Å; V90-L94 WeakPolarHBondContact O-CG 3.3Å; V90-L94 PolarHBondContact O-N 3.07Å; L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 3.41Å; L94-V97 PolarHBondContact O-N 3.06Å; L94-L98 WeakPolarHBondContact O-CB 3.08Å; L94-L98 WeakPolarHBondContact O-CG 3.38Å; L94-L98 PolarHBondContact O-N 3.36Å; L94-I139 HydrophobicContact CD2-CG2 4.02Å; L94-V211 HydrophobicContact CD2-CG1 3.66Å; L94-V211 HydrophobicContact CD2-CG2 4.11Å |
| 95 | L | 90.2 | Very high | 83.5 | Confident | 60 Ų | 60 | 57.9 Ų | 57.9 | 31% | 0.314 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -59.7 | -41.2 | 175.2 | -173.5 | 74.8 | 0 | 0 | 0 | 111.4 | G91 K93 L98 F99 T106 I110 | G91-L95 PolarHBondContact O-N 3.3Å; G91-L95 VanDerWaalsContact O-N 3.12Å; K93-L95 VanDerWaalsContact C-N 3.34Å; K93-L95 PolarHBondContact O-N 3.08Å; L95-L98 PolarHBondContact O-N 2.86Å; L95-F99 HydrophobicContact CD1-CD2 3.74Å; L95-F99 HydrophobicContact CD1-CE2 4.23Å; L95-F99 HydrophobicContact CG-CD2 4.48Å; L95-F99 WeakPolarHBondContact O-CA 3.31Å; L95-F99 WeakPolarHBondContact O-CB 3.41Å; L95-F99 PolarHBondContact O-N 2.85Å; L95-T106 HydrophobicContact CD2-CG2 4.46Å; L95-I110 HydrophobicContact CD2-CD1 3.58Å |
| 96 | L | 88.6 | Confident | 82.5 | Confident | 2 Ų | 2 | 59.1 Ų | 59.1 | 1% | 0.01 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -66.9 | -42.4 | 178.9 | -172.2 | 164.8 | 0 | 0 | 0 | 111.9 | K92 K93 L94 L98 F99 P100 H103 F107 V132 F242 | K92-L96 WeakPolarHBondContact O-CB 3.24Å; K92-L96 PolarHBondContact O-N 3.3Å; K92-L96 VanDerWaalsContact O-N 3.12Å; K93-L96 WeakPolarHBondContact O-CB 3.42Å; K93-L96 PolarHBondContact O-N 3.21Å; K93-L96 VanDerWaalsContact O-N 3.13Å; L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 3.41Å; L96-L98 VanDerWaalsContact C-N 3.33Å; L96-L98 PolarHBondContact O-N 2.9Å; L96-F99 CarbonylContact O-C 3.58Å; L96-P100 WeakPolarHBondContact O-CA 3.37Å; L96-P100 WeakPolarHBondContact O-CB 3.25Å; L96-H103 WeakPolarHBondContact CD1-CD2 3.39Å; L96-H103 VanDerWaalsContact CD1-NE2 3.3Å; L96-H103 WeakPolarHBondContact CD1-NE2 3.25Å; L96-H103 VanDerWaalsContact CG-CD2 3.48Å; L96-H103 WeakPolarHBondContact CG-CD2 3.28Å; L96-F107 HydrophobicContact CB-CD2 4.49Å; L96-F107 HydrophobicContact CD1-CE2 4.49Å; L96-V132 HydrophobicContact CD1-CG1 3.32Å; L96-F242 HydrophobicContact CD2-CD2 3.05Å; L96-F242 HydrophobicContact CD2-CE2 3.15Å; L96-F242 HydrophobicContact CD2-CG 4.23Å; L96-F242 HydrophobicContact CD2-CZ 4.39Å |
| 97 | V | 91 | Very high | 81.7 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.6 | -39.9 | 177.1 | 171.2 | 0 | 0 | 0 | 0 | 111.2 | K93 L94 Y208 V211 I239 F242 | K93-V97 HydrophobicContact CG-CG2 4.39Å; K93-V97 WeakPolarHBondContact O-CB 3.46Å; K93-V97 WeakPolarHBondContact O-CG2 3.44Å; K93-V97 PolarHBondContact O-N 2.92Å; L94-V97 PolarHBondContact O-N 3.06Å; V97-Y208 HydrophobicContact CG2-CD1 4.11Å; V97-V211 HydrophobicContact CG1-CB 3.95Å; V97-V211 HydrophobicContact CG1-CG1 3.83Å; V97-V211 HydrophobicContact CG1-CG2 4.46Å; V97-I239 HydrophobicContact CG1-CD1 3.38Å; V97-F242 HydrophobicContact CG2-CD1 3.98Å; V97-F242 HydrophobicContact CG2-CD2 4.41Å; V97-F242 HydrophobicContact CG2-CE1 3.67Å; V97-F242 HydrophobicContact CG2-CE2 4.1Å; V97-F242 HydrophobicContact CG2-CG 4.33Å; V97-F242 HydrophobicContact CG2-CZ 3.71Å |
| 98 | L | 91.5 | Very high | 80.7 | Confident | 23 Ų | 23 | 50.5 Ų | 50.5 | 12% | 0.12 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -84.9 | -31.2 | -177.8 | -65.5 | 178.6 | 0 | 0 | 0 | 114.1 | L94 L95 L96 V211 M215 Y234 | L94-L98 WeakPolarHBondContact O-CB 3.08Å; L94-L98 WeakPolarHBondContact O-CG 3.38Å; L94-L98 PolarHBondContact O-N 3.36Å; L95-L98 PolarHBondContact O-N 2.86Å; L96-L98 VanDerWaalsContact C-N 3.33Å; L96-L98 PolarHBondContact O-N 2.9Å; L98-V211 HydrophobicContact CD2-CG1 4.06Å; L98-V211 HydrophobicContact CG-CG1 4.34Å; L98-M215 HydrophobicContact CD1-CE 4.28Å; L98-M215 HydrophobicContact CD1-CG 3.69Å; L98-M215 HydrophobicContact CD1-SD 3.92Å; L98-M215 HydrophobicContact CD2-CB 4.26Å; L98-M215 HydrophobicContact CD2-CG 3.46Å; L98-M215 VanDerWaalsContact CD2-CG 3.46Å; L98-M215 HydrophobicContact CG-CG 4.22Å; L98-Y234 WeakPolarHBondContact O-CE1 3.21Å; L98-Y234 PolarHBondContact O-OH 3.29Å |
| 99 | F | 90.7 | Very high | 80 | Confident | 88 Ų | 88 | 51.7 Ų | 51.7 | 39% | 0.386 | 28% | 0.279 | S | S | . | . | trans | -130.2 | 64.5 | -178 | -57 | -80.7 | 0 | 0 | 0 | 110.8 | L95 L96 F101 L102 Y234 | L95-F99 HydrophobicContact CD1-CD2 3.74Å; L95-F99 HydrophobicContact CD1-CE2 4.23Å; L95-F99 HydrophobicContact CG-CD2 4.48Å; L95-F99 WeakPolarHBondContact O-CA 3.31Å; L95-F99 WeakPolarHBondContact O-CB 3.41Å; L95-F99 PolarHBondContact O-N 2.85Å; L96-F99 CarbonylContact O-C 3.58Å; F99-F101 PolarHBondContact O-N 3.29Å; F99-L102 HydrophobicContact CB-CB 4.33Å; F99-L102 PolarHBondContact O-N 2.92Å; F99-Y234 VanDerWaalsContact CD1-OH 3.3Å; F99-Y234 WeakPolarHBondContact CD1-OH 3.5Å | ||
| 100 | P | 86.2 | Confident | 79.3 | Confident | 1 Ų | 1 | 52.3 Ų | 52.3 | 1% | 0.006 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -72.4 | -18.1 | -172.7 | 35.5 | -41.9 | 0 | 0 | 0 | 112.5 | L96 H103 A238 F241 F242 | L96-P100 WeakPolarHBondContact O-CA 3.37Å; L96-P100 WeakPolarHBondContact O-CB 3.25Å; P100-H103 VanDerWaalsContact O-CB 3.27Å; P100-H103 WeakPolarHBondContact O-CB 3.34Å; P100-A238 HydrophobicContact CG-CB 4Å; P100-A238 WeakPolarHBondContact CG-O 3.49Å; P100-F241 HydrophobicContact CB-CD1 3.68Å; P100-F241 HydrophobicContact CB-CE1 4.18Å; P100-F241 HydrophobicContact CG-CD1 3.78Å; P100-F242 HydrophobicContact CB-CB 4.18Å |
| 101 | F | 82.6 | Confident | 78.2 | Confident | 111 Ų | 111 | 52.8 Ų | 52.8 | 49% | 0.487 | 29% | 0.289 | S | S | . | . | S | Bend | trans | -76.6 | -34.6 | 176.6 | -49.5 | -64.5 | 0 | 0 | 0 | 112.7 | F99 H103 Y234 F241 | F99-F101 PolarHBondContact O-N 3.29Å; F101-H103 PolarHBondContact O-N 3.23Å; F101-Y234 HydrophobicContact CE2-CE2 4.48Å; F101-F241 AromaticContact CD1-CD1 3.99Å; F101-F241 HydrophobicContact CD1-CD1 3.99Å; F101-F241 AromaticContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CG 4.34Å; F101-F241 HydrophobicContact CD1-CZ 4.3Å; F101-F241 HydrophobicContact CE1-CB 4.1Å; F101-F241 AromaticContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD2 4Å; F101-F241 HydrophobicContact CE1-CE1 4.14Å; F101-F241 HydrophobicContact CE1-CE2 4.36Å; F101-F241 AromaticContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CZ 4.43Å; F101-F241 HydrophobicContact CZ-CB 4.29Å; F101-F241 HydrophobicContact CZ-CG 4.34Å |
| 102 | L | 75.5 | Confident | 77.3 | Confident | 94 Ų | 94 | 58 Ų | 58 | 49% | 0.492 | 30% | 0.302 | S | S | . | . | G | 310 helix | trans | -77.9 | -0.1 | 179.5 | -84.6 | 65.2 | 0 | 0 | 0 | 112.6 | F99 Q104 L105 T106 | F99-L102 HydrophobicContact CB-CB 4.33Å; F99-L102 PolarHBondContact O-N 2.92Å; L102-Q104 VanDerWaalsContact C-N 3.34Å; L102-Q104 PolarHBondContact O-N 2.82Å; L102-L105 PolarHBondContact O-N 3.35Å; L102-T106 PolarHBondContact O-N 3.07Å |
| 103 | H | 63.4 | Low | 76.4 | Confident | 23 Ų | 23 | 66.1 Ų | 66.1 | 11% | 0.106 | 33% | 0.332 | C | S | . | . | G | 310 helix | trans | -56.5 | -39.2 | -171.8 | -177.9 | -43.8 | 0 | 0 | 0 | 113.4 | L96 P100 F101 L105 F107 R245 | L96-H103 WeakPolarHBondContact CD1-CD2 3.39Å; L96-H103 VanDerWaalsContact CD1-NE2 3.3Å; L96-H103 WeakPolarHBondContact CD1-NE2 3.25Å; L96-H103 VanDerWaalsContact CG-CD2 3.48Å; L96-H103 WeakPolarHBondContact CG-CD2 3.28Å; P100-H103 VanDerWaalsContact O-CB 3.27Å; P100-H103 WeakPolarHBondContact O-CB 3.34Å; F101-H103 PolarHBondContact O-N 3.23Å; H103-L105 PolarHBondContact O-N 3.17Å; H103-F107 AromaticContact CE1-CD1 3.72Å; H103-F107 WeakPolarHBondContact O-CB 3.38Å; H103-F107 PolarHBondContact O-N 3.42Å; H103-R245 VanDerWaalsContact CB-NH1 3.3Å; H103-R245 PolarHBondContact CD2-NH1 3.08Å; H103-R245 VanDerWaalsContact CD2-NH1 3.28Å; H103-R245 PolarHBondContact CD2-NH2 2.63Å; H103-R245 PolarHBondContact CE1-NH2 3.11Å; H103-R245 VanDerWaalsContact CG-CZ 3.42Å; H103-R245 PolarHBondContact ND1-NH2 3.45Å; H103-R245 VanDerWaalsContact ND1-NH2 3.15Å; H103-R245 PolarHBondContact NE2-NH2 3.19Å; H103-R245 VanDerWaalsContact NE2-NH2 3.14Å |
| 104 | Q | 62.8 | Low | 75 | Confident | 159 Ų | 159 | 71.1 Ų | 71.1 | 74% | 0.743 | 35% | 0.35 | S | S | * | . | G | 310 helix | trans | -69.9 | -35.5 | -173.5 | -73.5 | -179.1 | -12.6 | 0 | 0 | 112.8 | L102 A108 | L102-Q104 VanDerWaalsContact C-N 3.34Å; L102-Q104 PolarHBondContact O-N 2.82Å; Q104-A108 WeakPolarHBondContact O-CB 3.44Å |
| 105 | L | 64 | Low | 73.7 | Confident | 149 Ų | 149 | 71.9 Ų | 71.9 | 78% | 0.78 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.5 | -52.2 | -173.5 | -68.3 | 170.3 | 0 | 0 | 0 | 112.3 | L102 H103 S109 | L102-L105 PolarHBondContact O-N 3.35Å; H103-L105 PolarHBondContact O-N 3.17Å; L105-S109 PolarHBondContact O-N 2.73Å; L105-S109 PolarHBondContact O-OG 3.4Å |
| 106 | T | 65.9 | Low | 72.5 | Confident | 57 Ų | 57 | 72.5 Ų | 72.5 | 35% | 0.35 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -76.7 | -40.7 | -175 | -50.4 | 0 | 0 | 0 | 0 | 111.2 | L95 L102 S109 I110 | L95-T106 HydrophobicContact CD2-CG2 4.46Å; L102-T106 PolarHBondContact O-N 3.07Å; T106-S109 PolarHBondContact O-OG 2.91Å; T106-I110 HydrophobicContact CG2-CD1 3.79Å; T106-I110 WeakPolarHBondContact O-CB 3.38Å; T106-I110 WeakPolarHBondContact O-CD1 3.49Å; T106-I110 WeakPolarHBondContact O-CG1 3.3Å; T106-I110 PolarHBondContact O-N 2.87Å |
| 107 | F | 67.2 | Low | 71.2 | Confident | 16 Ų | 16 | 81 Ų | 81 | 7% | 0.07 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -69 | -41.9 | -178.5 | -167.1 | -93.3 | 0 | 0 | 0 | 112.2 | K92 L96 H103 I110 S111 V132 | K92-F107 HydrophobicContact CB-CE2 3.7Å; K92-F107 HydrophobicContact CB-CZ 4.02Å; K92-F107 HydrophobicContact CD-CZ 4.3Å; K92-F107 HydrophobicContact CG-CE2 4.09Å; K92-F107 HydrophobicContact CG-CZ 4.26Å; L96-F107 HydrophobicContact CB-CD2 4.49Å; L96-F107 HydrophobicContact CD1-CE2 4.49Å; H103-F107 AromaticContact CE1-CD1 3.72Å; H103-F107 WeakPolarHBondContact O-CB 3.38Å; H103-F107 PolarHBondContact O-N 3.42Å; F107-I110 PolarHBondContact O-N 3.2Å; F107-S111 WeakPolarHBondContact O-CB 3.3Å; F107-S111 PolarHBondContact O-N 3.26Å; F107-S111 PolarHBondContact O-OG 3.21Å; F107-V132 HydrophobicContact CE1-CB 3.87Å; F107-V132 HydrophobicContact CE1-CG1 3.86Å; F107-V132 HydrophobicContact CE1-CG2 3.62Å; F107-V132 HydrophobicContact CE2-CG1 3.83Å; F107-V132 HydrophobicContact CE2-CG2 4.31Å; F107-V132 HydrophobicContact CZ-CB 3.65Å; F107-V132 HydrophobicContact CZ-CG1 3.36Å; F107-V132 HydrophobicContact CZ-CG2 3.2Å |
| 108 | A | 66.9 | Low | 69.7 | Low | 47 Ų | 47 | 85.5 Ų | 85.5 | 39% | 0.388 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.9 | -45.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q104 S111 Q112 | Q104-A108 WeakPolarHBondContact O-CB 3.44Å; A108-S111 VanDerWaalsContact CA-OG 3.32Å; A108-S111 WeakPolarHBondContact CA-OG 3.11Å; A108-S111 PolarHBondContact O-N 2.91Å; A108-S111 PolarHBondContact O-OG 3.27Å; A108-Q112 PolarHBondContact O-N 3.02Å |
| 109 | S | 66.9 | Low | 68.2 | Low | 64 Ų | 64 | 88.8 Ų | 88.8 | 45% | 0.448 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.4 | -40.2 | 177.4 | 55.6 | 0 | 0 | 0 | 0 | 112.6 | L105 T106 R113 | L105-S109 PolarHBondContact O-N 2.73Å; L105-S109 PolarHBondContact O-OG 3.4Å; T106-S109 PolarHBondContact O-OG 2.91Å; S109-R113 WeakPolarHBondContact O-CG 3.39Å; S109-R113 PolarHBondContact O-N 3.42Å |
| 110 | I | 69.6 | Low | 66.6 | Low | 44 Ų | 44 | 88.9 Ų | 88.9 | 23% | 0.226 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -60.1 | -54.8 | 171.1 | -72 | 172.6 | 0 | 0 | 0 | 109.1 | K92 L95 T106 F107 Q112 R113 W114 | K92-I110 HydrophobicContact CG-CG2 4.45Å; L95-I110 HydrophobicContact CD2-CD1 3.58Å; T106-I110 HydrophobicContact CG2-CD1 3.79Å; T106-I110 WeakPolarHBondContact O-CB 3.38Å; T106-I110 WeakPolarHBondContact O-CD1 3.49Å; T106-I110 WeakPolarHBondContact O-CG1 3.3Å; T106-I110 PolarHBondContact O-N 2.87Å; F107-I110 PolarHBondContact O-N 3.2Å; I110-Q112 VanDerWaalsContact C-N 3.3Å; I110-Q112 PolarHBondContact O-N 2.91Å; I110-R113 PolarHBondContact O-N 3.3Å; I110-R113 VanDerWaalsContact O-N 3.09Å; I110-W114 VanDerWaalsContact CG2-CD1 3.43Å; I110-W114 VanDerWaalsContact CG2-NE1 3.29Å; I110-W114 PolarHBondContact O-N 3.31Å |
| 111 | S | 68 | Low | 64.8 | Low | 35 Ų | 35 | 95.9 Ų | 95.9 | 25% | 0.245 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -54.4 | -42.6 | -175.9 | 56 | 0 | 0 | 0 | 0 | 113.3 | F107 A108 R113 W114 S115 | F107-S111 WeakPolarHBondContact O-CB 3.3Å; F107-S111 PolarHBondContact O-N 3.26Å; F107-S111 PolarHBondContact O-OG 3.21Å; A108-S111 VanDerWaalsContact CA-OG 3.32Å; A108-S111 WeakPolarHBondContact CA-OG 3.11Å; A108-S111 PolarHBondContact O-N 2.91Å; A108-S111 PolarHBondContact O-OG 3.27Å; S111-R113 PolarHBondContact O-N 3.2Å; S111-W114 PolarHBondContact O-N 2.72Å; S111-S115 PolarHBondContact O-N 3.35Å; S111-S115 PolarHBondContact O-OG 2.83Å |
| 112 | Q | 68.5 | Low | 63.3 | Low | 152 Ų | 152 | 95.7 Ų | 95.7 | 71% | 0.71 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.9 | -43.1 | 179.9 | -170.1 | 179.9 | -56 | 0 | 0 | 112.2 | A108 I110 W114 A116 | A108-Q112 PolarHBondContact O-N 3.02Å; I110-Q112 VanDerWaalsContact C-N 3.3Å; I110-Q112 PolarHBondContact O-N 2.91Å; Q112-W114 VanDerWaalsContact C-N 3.26Å; Q112-W114 PolarHBondContact O-N 3.2Å; Q112-A116 PolarHBondContact O-N 2.98Å |
| 113 | R | 64.3 | Low | 62.1 | Low | 203 Ų | 203 | 100.9 Ų | 100.9 | 77% | 0.766 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.6 | -32.9 | 178.1 | -69.2 | 174.8 | 68.9 | 168.9 | 2.1 | 112.5 | S109 I110 S111 | S109-R113 WeakPolarHBondContact O-CG 3.39Å; S109-R113 PolarHBondContact O-N 3.42Å; I110-R113 PolarHBondContact O-N 3.3Å; I110-R113 VanDerWaalsContact O-N 3.09Å; S111-R113 PolarHBondContact O-N 3.2Å |
| 114 | W | 59.9 | Low | 61.3 | Low | 106 Ų | 106 | 108 Ų | 108 | 40% | 0.402 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -86.6 | -36.3 | -179.4 | -62.9 | 105.3 | 0 | 0 | 0 | 113.3 | L88 I110 S111 Q112 A116 R117 Q118 | L88-W114 HydrophobicContact CD1-CD2 3.42Å; L88-W114 VanDerWaalsContact CD1-CD2 3.42Å; L88-W114 HydrophobicContact CD1-CE3 3.39Å; L88-W114 HydrophobicContact CD1-CG 3.92Å; L88-W114 HydrophobicContact CD1-CH2 4Å; L88-W114 HydrophobicContact CD1-CZ2 4.04Å; L88-W114 HydrophobicContact CD1-CZ3 3.68Å; L88-W114 HydrophobicContact CD2-CB 4.07Å; L88-W114 HydrophobicContact CD2-CD2 4.14Å; L88-W114 HydrophobicContact CD2-CE3 3.76Å; L88-W114 HydrophobicContact CD2-CG 4.26Å; L88-W114 HydrophobicContact CD2-CZ3 4.5Å; L88-W114 HydrophobicContact CG-CD2 4.41Å; L88-W114 HydrophobicContact CG-CE3 4.22Å; I110-W114 VanDerWaalsContact CG2-CD1 3.43Å; I110-W114 VanDerWaalsContact CG2-NE1 3.29Å; I110-W114 PolarHBondContact O-N 3.31Å; S111-W114 PolarHBondContact O-N 2.72Å; Q112-W114 VanDerWaalsContact C-N 3.26Å; Q112-W114 PolarHBondContact O-N 3.2Å; W114-A116 PolarHBondContact O-N 3.37Å; W114-R117 CarbonylContact O-C 3.54Å; W114-R117 WeakPolarHBondContact O-CA 3.37Å; W114-R117 WeakPolarHBondContact O-CB 3.31Å; W114-R117 PolarHBondContact O-N 3.35Å; W114-Q118 PolarHBondContact O-N 3.43Å |
| 115 | S | 65 | Low | 60.5 | Low | 75 Ų | 75 | 108 Ų | 108 | 52% | 0.524 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -58.5 | -38.3 | 173.9 | -66.6 | 0 | 0 | 0 | 0 | 111.4 | S111 R117 Q118 A119 | S111-S115 PolarHBondContact O-N 3.35Å; S111-S115 PolarHBondContact O-OG 2.83Å; S115-R117 PolarHBondContact O-N 3.27Å; S115-Q118 PolarHBondContact O-N 3.18Å; S115-A119 WeakPolarHBondContact O-CB 3.48Å; S115-A119 PolarHBondContact O-N 3.18Å |
| 116 | A | 64.4 | Low | 59.8 | Low | 73 Ų | 73 | 104.6 Ų | 104.6 | 60% | 0.603 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -61.5 | -27.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q112 W114 | Q112-A116 PolarHBondContact O-N 2.98Å; W114-A116 PolarHBondContact O-N 3.37Å |
| 117 | R | 60.4 | Low | 58.8 | Low | 182 Ų | 182 | 104.4 Ų | 104.4 | 69% | 0.687 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -91.5 | -26.1 | -178.8 | -163.1 | 170.2 | 173.4 | 108.7 | -3.9 | 113.1 | W114 S115 S120 | W114-R117 CarbonylContact O-C 3.54Å; W114-R117 WeakPolarHBondContact O-CA 3.37Å; W114-R117 WeakPolarHBondContact O-CB 3.31Å; W114-R117 PolarHBondContact O-N 3.35Å; S115-R117 PolarHBondContact O-N 3.27Å; R117-S120 PolarHBondContact O-OG 2.89Å |
| 118 | Q | 59.3 | Low | 57.8 | Low | 94 Ų | 94 | 109.3 Ų | 109.3 | 44% | 0.439 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -79.1 | -39.6 | 174.9 | -151.4 | 85.3 | 31.5 | 0 | 0 | 111.2 | W114 S115 S120 H121 D122 | W114-Q118 PolarHBondContact O-N 3.43Å; S115-Q118 PolarHBondContact O-N 3.18Å; Q118-S120 PolarHBondContact O-N 3.16Å; Q118-S120 VanDerWaalsContact O-N 3.07Å; Q118-H121 PolarHBondContact O-N 2.89Å; Q118-D122 PolarHBondContact O-N 3.48Å |
| 119 | A | 60.3 | Low | 57 | Low | 91 Ų | 91 | 113.2 Ų | 113.2 | 75% | 0.752 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | -21 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | S115 | S115-A119 WeakPolarHBondContact O-CB 3.48Å; S115-A119 PolarHBondContact O-N 3.18Å |
| 120 | S | 57.2 | Low | 56.3 | Low | 91 Ų | 91 | 114.7 Ų | 114.7 | 64% | 0.636 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -7.6 | 176.1 | 54.5 | 0 | 0 | 0 | 0 | 115.3 | R117 Q118 | R117-S120 PolarHBondContact O-OG 2.89Å; Q118-S120 PolarHBondContact O-N 3.16Å; Q118-S120 VanDerWaalsContact O-N 3.07Å |
| 121 | H | 48.8 | Very low | 55.9 | Low | 148 Ų | 148 | 115.6 Ų | 115.6 | 69% | 0.685 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.6 | -13.6 | -169.8 | -158 | -84 | 0 | 0 | 0 | 117.8 | Q118 | Q118-H121 PolarHBondContact O-N 2.89Š|
| 122 | D | 51.1 | Low | 55.5 | Low | 106 Ų | 106 | 114.9 Ų | 114.9 | 57% | 0.567 | 60% | 0.603 | S | S | * | * | trans | -158.7 | 127.3 | 173.6 | -101.3 | -46.7 | 0 | 0 | 0 | 113.6 | Q118 K124 | Q118-D122 PolarHBondContact O-N 3.48Å; D122-K124 PolarHBondContact O-N 2.96Å | ||
| 123 | E | 50 | Low | 55.5 | Low | 204 Ų | 204 | 109.3 Ų | 109.3 | 95% | 0.953 | 58% | 0.578 | S | S | * | * | trans | -71.4 | 35.2 | 168.8 | -65.5 | -174.7 | 142.8 | 0 | 0 | 112.6 | D125 | E123-D125 PolarHBondContact O-N 2.77Š| ||
| 124 | K | 46.1 | Very low | 56 | Low | 173 Ų | 173 | 101 Ų | 101 | 75% | 0.752 | 55% | 0.552 | S | S | * | * | trans | -82.8 | 102.2 | 160.9 | -75.4 | -174 | -178.4 | 173.2 | 0 | 105.9 | D122 A126 | D122-K124 PolarHBondContact O-N 2.96Å; K124-A126 PolarHBondContact O-N 2.9Å | ||
| 125 | D | 46.1 | Very low | 57 | Low | 159 Ų | 159 | 97 Ų | 97 | 85% | 0.85 | 54% | 0.539 | S | S | * | . | trans | -31.2 | 106.1 | 164.3 | -83.4 | -34.5 | 0 | 0 | 0 | 108.4 | E123 S127 | E123-D125 PolarHBondContact O-N 2.77Å; D125-S127 VanDerWaalsContact C-N 3.26Å; D125-S127 PolarHBondContact O-N 3.21Å | ||
| 126 | A | 50 | Low | 58.2 | Low | 77 Ų | 77 | 93.6 Ų | 93.6 | 64% | 0.636 | 51% | 0.514 | S | S | * | . | trans | -57.9 | 101.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 105.1 | K124 D130 | K124-A126 PolarHBondContact O-N 2.9Å; A126-D130 WeakPolarHBondContact CA-OD2 3.29Å | ||
| 127 | S | 44.8 | Very low | 59.5 | Low | 53 Ų | 53 | 90.4 Ų | 90.4 | 37% | 0.371 | 49% | 0.487 | S | S | . | . | trans | -57.1 | 139.5 | 180 | -174.8 | 0 | 0 | 0 | 0 | 105.4 | D125 R129 D130 | D125-S127 VanDerWaalsContact C-N 3.26Å; D125-S127 PolarHBondContact O-N 3.21Å; S127-R129 PolarHBondContact O-N 2.9Å; S127-D130 PolarHBondContact N-OD2 2.88Å; S127-D130 WeakPolarHBondContact O-CB 3.46Å; S127-D130 PolarHBondContact O-N 3.18Å | ||
| 128 | P | 46.2 | Very low | 61.1 | Low | 118 Ų | 118 | 85 Ų | 85 | 77% | 0.766 | 47% | 0.468 | S | S | * | . | G | 310 helix | trans | -54.6 | -11.1 | 173.5 | -28 | 35.6 | 0 | 0 | 0 | 113.8 | S131 | P128-S131 WeakPolarHBondContact O-CB 3.09Å; P128-S131 PolarHBondContact O-N 3.48Å; P128-S131 PolarHBondContact O-OG 3.27Å |
| 129 | R | 50.7 | Low | 62.7 | Low | 130 Ų | 130 | 80.8 Ų | 80.8 | 49% | 0.491 | 45% | 0.448 | S | S | . | . | G | 310 helix | trans | -74.9 | -14.7 | 170.2 | -58.7 | 179.3 | 67.6 | 169.8 | -3 | 114.7 | Q81 S127 S131 A134 | Q81-R129 VanDerWaalsContact OE1-CZ 3.24Å; S127-R129 PolarHBondContact O-N 2.9Å; R129-S131 PolarHBondContact O-N 2.8Å; R129-A134 WeakPolarHBondContact O-CB 3.43Å |
| 130 | D | 52.4 | Low | 64.3 | Low | 95 Ų | 95 | 76.7 Ų | 76.7 | 51% | 0.508 | 41% | 0.414 | S | S | . | . | G | 310 helix | trans | -71.2 | -4.4 | 167.6 | -72 | -26.5 | 0 | 0 | 0 | 112.4 | A126 S127 V132 | A126-D130 WeakPolarHBondContact CA-OD2 3.29Å; S127-D130 PolarHBondContact N-OD2 2.88Å; S127-D130 WeakPolarHBondContact O-CB 3.46Å; S127-D130 PolarHBondContact O-N 3.18Å; D130-V132 PolarHBondContact O-N 3.18Å; D130-V132 VanDerWaalsContact O-N 3.16Å |
| 131 | S | 59.6 | Low | 66.1 | Low | 63 Ų | 63 | 75.2 Ų | 75.2 | 44% | 0.441 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -58.3 | 124.6 | 165.8 | 65.7 | 0 | 0 | 0 | 0 | 107.9 | P128 R129 N133 A134 | P128-S131 WeakPolarHBondContact O-CB 3.09Å; P128-S131 PolarHBondContact O-N 3.48Å; P128-S131 PolarHBondContact O-OG 3.27Å; R129-S131 PolarHBondContact O-N 2.8Å; S131-N133 PolarHBondContact O-N 3.23Å; S131-A134 WeakPolarHBondContact O-CB 3.25Å; S131-A134 PolarHBondContact O-N 3.1Å |
| 132 | V | 60.7 | Low | 68.4 | Low | 19 Ų | 19 | 72 Ų | 72 | 12% | 0.115 | 39% | 0.387 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.5 | -12.6 | -171.2 | 166.2 | 0 | 0 | 0 | 0 | 114.4 | K93 L96 F107 D130 | K93-V132 WeakPolarHBondContact CD-O 3.26Å; K93-V132 PolarHBondContact NZ-O 2.89Å; L96-V132 HydrophobicContact CD1-CG1 3.32Å; F107-V132 HydrophobicContact CE1-CB 3.87Å; F107-V132 HydrophobicContact CE1-CG1 3.86Å; F107-V132 HydrophobicContact CE1-CG2 3.62Å; F107-V132 HydrophobicContact CE2-CG1 3.83Å; F107-V132 HydrophobicContact CE2-CG2 4.31Å; F107-V132 HydrophobicContact CZ-CB 3.65Å; F107-V132 HydrophobicContact CZ-CG1 3.36Å; F107-V132 HydrophobicContact CZ-CG2 3.2Å; D130-V132 PolarHBondContact O-N 3.18Å; D130-V132 VanDerWaalsContact O-N 3.16Å |
| 133 | N | 67.3 | Low | 70.5 | Confident | 36 Ų | 36 | 67.3 Ų | 67.3 | 19% | 0.193 | 36% | 0.362 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83 | -10.7 | 174.8 | -62.7 | -33.7 | 0 | 0 | 0 | 114.7 | S131 V249 | S131-N133 PolarHBondContact O-N 3.23Å; N133-V249 HydrophobicContact CB-CB 4.23Å; N133-V249 HydrophobicContact CB-CG1 3.73Å |
| 134 | A | 74.8 | Confident | 72.7 | Confident | 27 Ų | 27 | 58.8 Ų | 58.8 | 22% | 0.223 | 32% | 0.324 | C | S | . | . | S | Bend | trans | -59 | 143 | 176 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y89 K93 R129 S131 | Y89-A134 PolarHBondContact OH-O 3.41Å; K93-A134 PolarHBondContact NZ-O 3.44Å; R129-A134 WeakPolarHBondContact O-CB 3.43Å; S131-A134 WeakPolarHBondContact O-CB 3.25Å; S131-A134 PolarHBondContact O-N 3.1Å |
| 135 | I | 82.8 | Confident | 75.1 | Confident | 23 Ų | 23 | 53.9 Ų | 53.9 | 12% | 0.118 | 31% | 0.309 | C | S | . | . | trans | -79.5 | 130.2 | -177.4 | -59.3 | 168 | 0 | 0 | 0 | 108.4 | Y82 D201 A204 Y205 H250 | Y82-I135 HydrophobicContact CD1-CG2 4.32Å; Y82-I135 WeakPolarHBondContact CD1-O 3.48Å; Y82-I135 HydrophobicContact CE1-CB 4.32Å; Y82-I135 HydrophobicContact CE1-CG2 3.97Å; I135-D201 HydrophobicContact CD1-CB 4.14Å; I135-A204 HydrophobicContact CG2-CB 3.41Å; I135-A204 VanDerWaalsContact CG2-CB 3.41Å; I135-Y205 HydrophobicContact CD1-CD2 4.34Å; I135-Y205 HydrophobicContact CD1-CE2 3.4Å; I135-Y205 WeakPolarHBondContact CD1-OH 3.24Å; I135-Y205 HydrophobicContact CG1-CE2 4.12Å; I135-H250 WeakPolarHBondContact CD1-ND1 3.42Å | ||
| 136 | D | 90 | Very high | 77.5 | Confident | 3 Ų | 3 | 49 Ų | 49 | 2% | 0.016 | 29% | 0.285 | C | S | . | . | trans | -122 | 147.5 | 176.7 | 70.5 | 89.4 | 0 | 0 | 0 | 110 | V85 Y89 K93 I139 P140 A204 Y208 | V85-D136 HydrophobicContact CG2-CB 4.04Å; Y89-D136 HydrophobicContact CE1-CB 4.14Å; Y89-D136 PolarHBondContact OH-OD2 3.32Å; K93-D136 WeakPolarHBondContact CE-OD2 3.38Å; K93-D136 IonicContact NZ-OD2 3.35Å; K93-D136 PolarHBondContact NZ-OD2 2.91Å; D136-I139 WeakPolarHBondContact OD1-CB 3.4Å; D136-I139 WeakPolarHBondContact OD1-CD1 3.29Å; D136-I139 WeakPolarHBondContact OD1-CG1 3.34Å; D136-I139 PolarHBondContact OD1-N 3.45Å; D136-P140 WeakPolarHBondContact O-CD 3.33Å; D136-P140 WeakPolarHBondContact O-CG 3.48Å; D136-P140 WeakPolarHBondContact OD1-CD 3.35Å; D136-A204 VanDerWaalsContact O-CB 3.29Å; D136-A204 WeakPolarHBondContact O-CB 3.35Å; D136-Y208 PolarHBondContact N-OH 3.34Å; D136-Y208 PolarHBondContact O-OH 2.9Å; D136-Y208 PolarHBondContact OD2-OH 3.35Å | ||
| 137 | L | 91 | Very high | 79.6 | Confident | 6 Ų | 6 | 45.5 Ų | 45.5 | 3% | 0.031 | 26% | 0.255 | C | S | . | . | S | Bend | trans | -103.6 | -19.5 | 175.2 | -169.2 | 64.7 | 0 | 0 | 0 | 111.3 | L79 Y82 F83 I139 P140 V141 W200 L203 A204 | L79-L137 HydrophobicContact CD1-CD2 4.18Å; Y82-L137 HydrophobicContact CD1-CB 4.39Å; Y82-L137 HydrophobicContact CG-CB 4.19Å; Y82-L137 PolarHBondContact O-N 2.84Å; F83-L137 HydrophobicContact CE2-CB 4.42Å; F83-L137 HydrophobicContact CE2-CD2 3.82Å; F83-L137 HydrophobicContact CE2-CG 4.39Å; F83-L137 HydrophobicContact CZ-CB 4.3Å; F83-L137 HydrophobicContact CZ-CD2 3.84Å; F83-L137 HydrophobicContact CZ-CG 4.05Å; L137-I139 PolarHBondContact O-N 3.32Å; L137-P140 HydrophobicContact CD1-CB 4.47Å; L137-P140 WeakPolarHBondContact O-CD 3.21Å; L137-V141 HydrophobicContact CD1-CG2 4.42Å; L137-V141 HydrophobicContact CG-CG2 3.99Å; L137-V141 WeakPolarHBondContact O-CB 3.47Å; L137-V141 VanDerWaalsContact O-CG2 3.27Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.47Å; L137-W200 HydrophobicContact CD2-CE3 3.75Å; L137-W200 HydrophobicContact CD2-CZ3 4.19Å; L137-L203 HydrophobicContact CD1-CB 4.4Å; L137-L203 HydrophobicContact CD1-CD2 4.05Å; L137-L203 HydrophobicContact CD1-CG 3.97Å; L137-A204 HydrophobicContact CD1-CB 4.08Å |
| 138 | Y | 93.4 | Very high | 82 | Confident | 70 Ų | 70 | 44.4 Ų | 44.4 | 28% | 0.275 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -55.3 | -51.1 | 176.8 | 179.2 | -91.5 | 0 | 0 | 0 | 112.3 | Y82 F83 V85 V90 V141 M142 | Y82-Y138 PolarHBondContact O-N 3Å; F83-Y138 HydrophobicContact CD1-CD2 4.22Å; V85-Y138 HydrophobicContact CB-CG 4.43Å; V85-Y138 HydrophobicContact CG1-CD1 4.34Å; V90-Y138 HydrophobicContact CG2-CD1 4.03Å; V90-Y138 HydrophobicContact CG2-CE1 3.86Å; Y138-V141 PolarHBondContact O-N 3.44Å; Y138-M142 HydrophobicContact CD1-CG 4.23Å; Y138-M142 HydrophobicContact CD2-CE 4.21Å; Y138-M142 HydrophobicContact CD2-CG 4.39Å; Y138-M142 HydrophobicContact CE1-CG 3.83Å; Y138-M142 HydrophobicContact CE2-CE 3.46Å; Y138-M142 VanDerWaalsContact CE2-CE 3.46Å; Y138-M142 HydrophobicContact CE2-CG 4.03Å; Y138-M142 HydrophobicContact CG-CG 4.48Å; Y138-M142 WeakPolarHBondContact O-CB 3.46Å; Y138-M142 WeakPolarHBondContact O-CG 3.21Å; Y138-M142 PolarHBondContact O-N 3.48Å |
| 139 | I | 93.9 | Very high | 84.3 | Confident | 5 Ų | 5 | 44.1 Ų | 44.1 | 3% | 0.026 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.6 | -48.4 | -177.1 | -62.9 | 166 | 0 | 0 | 0 | 111.3 | Y89 V90 K93 L94 D136 L137 V141 M142 A143 Y208 V211 | Y89-I139 HydrophobicContact CD1-CD1 4.48Å; Y89-I139 HydrophobicContact CE1-CD1 4.13Å; V90-I139 HydrophobicContact CG1-CD1 4.4Å; V90-I139 HydrophobicContact CG1-CG1 4.24Å; V90-I139 HydrophobicContact CG2-CG1 4.34Å; K93-I139 HydrophobicContact CB-CD1 3.55Å; K93-I139 HydrophobicContact CG-CD1 3.46Å; K93-I139 VanDerWaalsContact CG-CD1 3.46Å; L94-I139 HydrophobicContact CD2-CG2 4.02Å; D136-I139 WeakPolarHBondContact OD1-CB 3.4Å; D136-I139 WeakPolarHBondContact OD1-CD1 3.29Å; D136-I139 WeakPolarHBondContact OD1-CG1 3.34Å; D136-I139 PolarHBondContact OD1-N 3.45Å; L137-I139 PolarHBondContact O-N 3.32Å; I139-V141 VanDerWaalsContact C-N 3.33Å; I139-V141 PolarHBondContact O-N 2.87Å; I139-M142 PolarHBondContact O-N 2.82Å; I139-A143 WeakPolarHBondContact O-CB 3.39Å; I139-A143 PolarHBondContact O-N 3.28Å; I139-Y208 HydrophobicContact CB-CE1 4.31Å; I139-Y208 HydrophobicContact CG2-CD1 4.37Å; I139-Y208 HydrophobicContact CG2-CE1 4.28Å; I139-V211 HydrophobicContact CG2-CG2 3.92Å |
| 140 | P | 94.1 | Very high | 86.4 | Confident | 5 Ų | 5 | 38.5 Ų | 38.5 | 3% | 0.032 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -50.2 | -47.5 | 171.9 | -34.1 | 39 | 0 | 0 | 0 | 114.4 | D136 L137 A143 V144 A204 Y208 | D136-P140 WeakPolarHBondContact O-CD 3.33Å; D136-P140 WeakPolarHBondContact O-CG 3.48Å; D136-P140 WeakPolarHBondContact OD1-CD 3.35Å; L137-P140 HydrophobicContact CD1-CB 4.47Å; L137-P140 WeakPolarHBondContact O-CD 3.21Å; P140-A143 PolarHBondContact O-N 3Å; P140-V144 WeakPolarHBondContact O-CG2 3.23Å; P140-V144 PolarHBondContact O-N 3.37Å; P140-A204 HydrophobicContact CG-CB 4.29Å; P140-A204 WeakPolarHBondContact CG-O 3.26Å; P140-Y208 HydrophobicContact CG-CD1 4.35Å; P140-Y208 HydrophobicContact CG-CD2 4.33Å; P140-Y208 HydrophobicContact CG-CE1 4.22Å; P140-Y208 HydrophobicContact CG-CE2 4.21Å; P140-Y208 HydrophobicContact CG-CG 4.41Å |
| 141 | V | 94.6 | Very high | 88.3 | Confident | 60 Ų | 60 | 34.1 Ų | 34.1 | 36% | 0.364 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -65.3 | -48.5 | -179.2 | 169.9 | 0 | 0 | 0 | 0 | 110.8 | F83 L137 Y138 I139 A143 V144 V145 | F83-V141 HydrophobicContact CE1-CG2 4.36Å; F83-V141 HydrophobicContact CZ-CG2 4.27Å; L137-V141 HydrophobicContact CD1-CG2 4.42Å; L137-V141 HydrophobicContact CG-CG2 3.99Å; L137-V141 WeakPolarHBondContact O-CB 3.47Å; L137-V141 VanDerWaalsContact O-CG2 3.27Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.47Å; Y138-V141 PolarHBondContact O-N 3.44Å; I139-V141 VanDerWaalsContact C-N 3.33Å; I139-V141 PolarHBondContact O-N 2.87Å; V141-A143 VanDerWaalsContact C-N 3.29Å; V141-A143 PolarHBondContact O-N 3.22Å; V141-V144 PolarHBondContact O-N 3.34Å; V141-V145 PolarHBondContact O-N 3.23Å; V141-V145 VanDerWaalsContact O-N 3.16Å |
| 142 | M | 96 | Very high | 89.9 | Confident | 81 Ų | 81 | 31.5 Ų | 31.5 | 40% | 0.399 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -62.9 | -38.3 | 177.3 | -69.1 | -58.6 | 176.8 | 0 | 0 | 111.5 | Y138 I139 V144 V145 T146 | Y138-M142 HydrophobicContact CD1-CG 4.23Å; Y138-M142 HydrophobicContact CD2-CE 4.21Å; Y138-M142 HydrophobicContact CD2-CG 4.39Å; Y138-M142 HydrophobicContact CE1-CG 3.83Å; Y138-M142 HydrophobicContact CE2-CE 3.46Å; Y138-M142 VanDerWaalsContact CE2-CE 3.46Å; Y138-M142 HydrophobicContact CE2-CG 4.03Å; Y138-M142 HydrophobicContact CG-CG 4.48Å; Y138-M142 WeakPolarHBondContact O-CB 3.46Å; Y138-M142 WeakPolarHBondContact O-CG 3.21Å; Y138-M142 PolarHBondContact O-N 3.48Å; I139-M142 PolarHBondContact O-N 2.82Å; M142-V144 PolarHBondContact O-N 3.43Å; M142-V145 PolarHBondContact O-N 3.06Å; M142-T146 WeakPolarHBondContact O-CB 3.27Å; M142-T146 PolarHBondContact O-N 3.46Å; M142-T146 PolarHBondContact O-OG1 2.98Å |
| 143 | A | 96.2 | Very high | 91.4 | Very high | 6 Ų | 6 | 35.1 Ų | 35.1 | 5% | 0.05 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.5 | -37.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | I139 P140 V141 Y147 V211 I214 | I139-A143 WeakPolarHBondContact O-CB 3.39Å; I139-A143 PolarHBondContact O-N 3.28Å; P140-A143 PolarHBondContact O-N 3Å; V141-A143 VanDerWaalsContact C-N 3.29Å; V141-A143 PolarHBondContact O-N 3.22Å; A143-Y147 WeakPolarHBondContact O-CB 3.4Å; A143-Y147 PolarHBondContact O-N 3.37Å; A143-V211 HydrophobicContact CB-CG2 3.76Å; A143-I214 HydrophobicContact CB-CD1 4.14Å; A143-I214 WeakPolarHBondContact O-CD1 3.3Å |
| 144 | V | 95.5 | Very high | 92.5 | Very high | 25 Ų | 25 | 34 Ų | 34 | 15% | 0.152 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.2 | -48.7 | 173 | 168.6 | 0 | 0 | 0 | 0 | 110.8 | P140 V141 M142 Y147 I148 I173 L177 Y210 | P140-V144 WeakPolarHBondContact O-CG2 3.23Å; P140-V144 PolarHBondContact O-N 3.37Å; V141-V144 PolarHBondContact O-N 3.34Å; M142-V144 PolarHBondContact O-N 3.43Å; V144-Y147 PolarHBondContact O-N 2.91Å; V144-I148 HydrophobicContact CG1-CD1 4Å; V144-I148 WeakPolarHBondContact O-CG1 3.32Å; V144-I148 PolarHBondContact O-N 2.92Å; V144-I173 HydrophobicContact CG1-CG2 3.93Å; V144-L177 HydrophobicContact CG1-CD1 4.45Å; V144-L177 HydrophobicContact CG2-CD1 3.95Å; V144-Y210 HydrophobicContact CG2-CD1 4.32Å; V144-Y210 HydrophobicContact CG2-CD2 3.47Å; V144-Y210 VanDerWaalsContact CG2-CD2 3.47Å; V144-Y210 HydrophobicContact CG2-CE1 4.48Å; V144-Y210 HydrophobicContact CG2-CE2 3.68Å; V144-Y210 HydrophobicContact CG2-CG 3.88Å |
| 145 | V | 96.4 | Very high | 93.3 | Very high | 70 Ų | 70 | 33.4 Ų | 33.4 | 42% | 0.424 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -61.9 | -49.4 | 179.4 | 175.9 | 0 | 0 | 0 | 0 | 110.9 | V141 M142 Y147 I148 L149 | V141-V145 PolarHBondContact O-N 3.23Å; V141-V145 VanDerWaalsContact O-N 3.16Å; M142-V145 PolarHBondContact O-N 3.06Å; V145-Y147 VanDerWaalsContact C-N 3.32Å; V145-Y147 PolarHBondContact O-N 2.8Å; V145-I148 WeakPolarHBondContact O-CB 3.38Å; V145-I148 PolarHBondContact O-N 3.41Å; V145-L149 HydrophobicContact CG1-CD1 4.1Å; V145-L149 WeakPolarHBondContact O-CG 3.29Å; V145-L149 PolarHBondContact O-N 2.86Å |
| 146 | T | 96.5 | Very high | 93.7 | Very high | 58 Ų | 58 | 33.8 Ų | 33.8 | 36% | 0.356 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -62.1 | -39.9 | 178 | -57.6 | 0 | 0 | 0 | 0 | 111.3 | M142 I148 L149 T150 I214 | M142-T146 WeakPolarHBondContact O-CB 3.27Å; M142-T146 PolarHBondContact O-N 3.46Å; M142-T146 PolarHBondContact O-OG1 2.98Å; T146-I148 VanDerWaalsContact C-N 3.34Å; T146-I148 PolarHBondContact O-N 2.89Å; T146-L149 PolarHBondContact O-N 3.36Å; T146-T150 WeakPolarHBondContact O-CB 3.38Å; T146-T150 PolarHBondContact O-N 3.47Å; T146-T150 PolarHBondContact O-OG1 3.32Å; T146-I214 HydrophobicContact CG2-CD1 3.79Å; T146-I214 HydrophobicContact CG2-CG1 4.25Å; T146-I214 HydrophobicContact CG2-CG2 4.21Å |
| 147 | Y | 94.7 | Very high | 93.7 | Very high | 2 Ų | 2 | 38.2 Ų | 38.2 | 1% | 0.008 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.7 | -41.8 | 176.7 | 178 | -107.5 | 0 | 0 | 0 | 112.2 | A143 V144 V145 S151 I173 Y210 M213 I214 L217 L282 | A143-Y147 WeakPolarHBondContact O-CB 3.4Å; A143-Y147 PolarHBondContact O-N 3.37Å; V144-Y147 PolarHBondContact O-N 2.91Å; V145-Y147 VanDerWaalsContact C-N 3.32Å; V145-Y147 PolarHBondContact O-N 2.8Å; Y147-S151 VanDerWaalsContact O-CB 3.25Å; Y147-S151 WeakPolarHBondContact O-CB 3.44Å; Y147-S151 PolarHBondContact O-N 2.94Å; Y147-S151 PolarHBondContact O-OG 3.42Å; Y147-I173 HydrophobicContact CD1-CD1 3.52Å; Y147-I173 HydrophobicContact CD1-CG1 4.3Å; Y147-I173 HydrophobicContact CE1-CD1 3.63Å; Y147-I173 HydrophobicContact CE1-CG1 4.13Å; Y147-Y210 AromaticContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CE1 4.23Å; Y147-Y210 HydrophobicContact CE1-CD1 4.44Å; Y147-Y210 HydrophobicContact CG-CD1 4.04Å; Y147-M213 HydrophobicContact CD2-CB 3.85Å; Y147-M213 HydrophobicContact CE2-CB 3.65Å; Y147-I214 HydrophobicContact CD2-CG1 4.25Å; Y147-L217 HydrophobicContact CD2-CD1 3.75Å; Y147-L217 HydrophobicContact CE2-CD1 3.47Å; Y147-L217 VanDerWaalsContact CE2-CD1 3.47Å; Y147-L217 HydrophobicContact CE2-CG 4.23Å; Y147-L282 HydrophobicContact CE1-CD2 4.17Å; Y147-L282 VanDerWaalsContact OH-CD2 3.31Å; Y147-L282 WeakPolarHBondContact OH-CD2 3.46Å |
| 148 | I | 94.5 | Very high | 93.6 | Very high | 30 Ų | 30 | 40 Ų | 40 | 15% | 0.154 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.8 | -49.2 | 173.5 | -69 | 162.3 | 0 | 0 | 0 | 110.2 | V144 V145 T146 S151 G152 L166 L169 C170 I173 | V144-I148 HydrophobicContact CG1-CD1 4Å; V144-I148 WeakPolarHBondContact O-CG1 3.32Å; V144-I148 PolarHBondContact O-N 2.92Å; V145-I148 WeakPolarHBondContact O-CB 3.38Å; V145-I148 PolarHBondContact O-N 3.41Å; T146-I148 VanDerWaalsContact C-N 3.34Å; T146-I148 PolarHBondContact O-N 2.89Å; I148-S151 PolarHBondContact O-N 3.33Å; I148-G152 PolarHBondContact O-N 2.96Å; I148-L166 HydrophobicContact CG2-CD1 3.78Å; I148-L166 HydrophobicContact CG2-CG 4.32Å; I148-L166 WeakPolarHBondContact O-CD1 3.03Å; I148-L169 HydrophobicContact CB-CD2 4.21Å; I148-L169 HydrophobicContact CG1-CD2 3.86Å; I148-L169 HydrophobicContact CG2-CD2 4.35Å; I148-C170 HydrophobicContact CD1-CB 4.45Å; I148-C170 WeakPolarHBondContact CG2-SG 3.45Å; I148-I173 HydrophobicContact CD1-CD1 4.34Å; I148-I173 HydrophobicContact CG1-CD1 3.64Å |
| 149 | L | 95.4 | Very high | 93.5 | Very high | 112 Ų | 112 | 44.1 Ų | 44.1 | 59% | 0.586 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -64.5 | -45.3 | -179.1 | -67.4 | 176 | 0 | 0 | 0 | 112.5 | V145 T146 S151 G152 L153 | V145-L149 HydrophobicContact CG1-CD1 4.1Å; V145-L149 WeakPolarHBondContact O-CG 3.29Å; V145-L149 PolarHBondContact O-N 2.86Å; T146-L149 PolarHBondContact O-N 3.36Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.43Å; L149-G152 CarbonylContact O-C 3.49Å; L149-G152 PolarHBondContact O-N 3.39Å; L149-L153 PolarHBondContact O-N 3.48Å |
| 150 | T | 94.1 | Very high | 93.1 | Very high | 13 Ų | 13 | 47.6 Ų | 47.6 | 8% | 0.08 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65.8 | -36.3 | 177.2 | -54.3 | 0 | 0 | 0 | 0 | 111.2 | T146 L153 V154 L217 L218 | T146-T150 WeakPolarHBondContact O-CB 3.38Å; T146-T150 PolarHBondContact O-N 3.47Å; T146-T150 PolarHBondContact O-OG1 3.32Å; T150-L153 WeakPolarHBondContact O-CB 3.36Å; T150-L153 PolarHBondContact O-N 2.7Å; T150-V154 WeakPolarHBondContact O-CG2 3.32Å; T150-V154 PolarHBondContact O-N 2.86Å; T150-L217 HydrophobicContact CG2-CB 3.81Å; T150-L217 HydrophobicContact CG2-CD1 4.15Å; T150-L218 HydrophobicContact CG2-CD2 4.04Å |
| 151 | S | 92.3 | Very high | 92.9 | Very high | 3 Ų | 3 | 53 Ų | 53 | 2% | 0.021 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.6 | -41.7 | 172.4 | -59.5 | 0 | 0 | 0 | 0 | 111.4 | Y147 I148 L149 L153 V154 L155 L217 | Y147-S151 VanDerWaalsContact O-CB 3.25Å; Y147-S151 WeakPolarHBondContact O-CB 3.44Å; Y147-S151 PolarHBondContact O-N 2.94Å; Y147-S151 PolarHBondContact O-OG 3.42Å; I148-S151 PolarHBondContact O-N 3.33Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.43Å; S151-L153 VanDerWaalsContact C-N 3.33Å; S151-L153 PolarHBondContact O-N 3.38Å; S151-V154 PolarHBondContact O-N 2.87Å; S151-L155 WeakPolarHBondContact O-CG 3.25Å; S151-L155 PolarHBondContact O-N 3.5Å; S151-L217 WeakPolarHBondContact OG-CD1 3.33Å |
| 152 | G | 92.9 | Very high | 92.7 | Very high | 8 Ų | 8 | 51.5 Ų | 51.5 | 8% | 0.082 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.7 | -41.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | I148 L149 L155 G156 | I148-G152 PolarHBondContact O-N 2.96Å; L149-G152 CarbonylContact O-C 3.49Å; L149-G152 PolarHBondContact O-N 3.39Å; G152-L155 PolarHBondContact O-N 2.64Å; G152-G156 PolarHBondContact O-N 2.87Å |
| 153 | L | 93.1 | Very high | 92.6 | Very high | 94 Ų | 94 | 51.6 Ų | 51.6 | 49% | 0.492 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61 | -45.8 | 174.8 | 179.2 | 65 | 0 | 0 | 0 | 111.5 | L149 T150 S151 L155 G156 V157 L221 | L149-L153 PolarHBondContact O-N 3.48Å; T150-L153 WeakPolarHBondContact O-CB 3.36Å; T150-L153 PolarHBondContact O-N 2.7Å; S151-L153 VanDerWaalsContact C-N 3.33Å; S151-L153 PolarHBondContact O-N 3.38Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L153-L155 PolarHBondContact O-N 2.64Å; L153-G156 WeakPolarHBondContact O-CA 3.22Å; L153-G156 PolarHBondContact O-N 2.99Å; L153-G156 VanDerWaalsContact O-N 3.1Å; L153-V157 WeakPolarHBondContact O-CG2 3.47Å; L153-V157 PolarHBondContact O-N 3.24Å; L153-L221 HydrophobicContact CD2-CD1 3.88Å; L153-L221 HydrophobicContact CG-CD1 4.31Å |
| 154 | V | 91.5 | Very high | 92.4 | Very high | 13 Ų | 13 | 57.3 Ų | 57.3 | 8% | 0.079 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.5 | -43.9 | 176 | 169.9 | 0 | 0 | 0 | 0 | 111.4 | T150 S151 G156 V157 Q158 L217 Y220 L221 | T150-V154 WeakPolarHBondContact O-CG2 3.32Å; T150-V154 PolarHBondContact O-N 2.86Å; S151-V154 PolarHBondContact O-N 2.87Å; V154-G156 VanDerWaalsContact C-N 3.29Å; V154-G156 PolarHBondContact O-N 3.2Å; V154-V157 PolarHBondContact O-N 3.43Å; V154-Q158 WeakPolarHBondContact O-CG 3.42Å; V154-Q158 PolarHBondContact O-N 3.04Å; V154-Q158 VanDerWaalsContact O-N 3.15Å; V154-L217 HydrophobicContact CG2-CB 4.45Å; V154-L217 HydrophobicContact CG2-CD2 4.41Å; V154-Y220 HydrophobicContact CG1-CD1 3.94Å; V154-Y220 HydrophobicContact CG1-CE1 3.67Å; V154-Y220 HydrophobicContact CG2-CD1 4.27Å; V154-L221 HydrophobicContact CB-CD2 4.43Å; V154-L221 HydrophobicContact CG2-CD1 4.17Å; V154-L221 HydrophobicContact CG2-CD2 3.7Å; V154-L221 HydrophobicContact CG2-CG 3.87Å |
| 155 | L | 90 | Very high | 92 | Very high | 15 Ų | 15 | 59.8 Ų | 59.8 | 8% | 0.079 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.8 | -36.2 | 174.8 | -68.5 | 172.5 | 0 | 0 | 0 | 112.2 | S151 G152 L153 Q158 N159 R160 F161 K165 | S151-L155 WeakPolarHBondContact O-CG 3.25Å; S151-L155 PolarHBondContact O-N 3.5Å; G152-L155 PolarHBondContact O-N 2.64Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L153-L155 PolarHBondContact O-N 2.64Å; L155-Q158 PolarHBondContact O-N 3.01Å; L155-N159 PolarHBondContact O-N 3.38Å; L155-R160 CarbonylContact O-C 3.57Å; L155-R160 WeakPolarHBondContact O-CA 3.38Å; L155-R160 PolarHBondContact O-N 3.36Å; L155-F161 PolarHBondContact O-N 2.84Å; L155-F161 VanDerWaalsContact O-N 3.09Å; L155-K165 HydrophobicContact CD1-CB 3.93Å; L155-K165 HydrophobicContact CD2-CD 4.27Å |
| 156 | G | 92.2 | Very high | 91.7 | Very high | 31 Ų | 31 | 58.2 Ų | 58.2 | 32% | 0.32 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -64.5 | -49.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | G152 L153 V154 Q158 N159 | G152-G156 PolarHBondContact O-N 2.87Å; L153-G156 WeakPolarHBondContact O-CA 3.22Å; L153-G156 PolarHBondContact O-N 2.99Å; L153-G156 VanDerWaalsContact O-N 3.1Å; V154-G156 VanDerWaalsContact C-N 3.29Å; V154-G156 PolarHBondContact O-N 3.2Å; G156-Q158 PolarHBondContact O-N 3.43Å; G156-N159 PolarHBondContact O-N 3.17Å |
| 157 | V | 90.4 | Very high | 91.6 | Very high | 96 Ų | 96 | 57 Ų | 57 | 58% | 0.582 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -59.3 | -32.5 | 177.1 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | L153 V154 N159 L221 | L153-V157 WeakPolarHBondContact O-CG2 3.47Å; L153-V157 PolarHBondContact O-N 3.24Å; V154-V157 PolarHBondContact O-N 3.43Å; V157-N159 PolarHBondContact O-N 3.11Å; V157-L221 HydrophobicContact CB-CD2 4.3Å; V157-L221 HydrophobicContact CG1-CD2 4.43Å; V157-L221 HydrophobicContact CG2-CD2 4.09Å |
| 158 | Q | 88.4 | Confident | 91.5 | Very high | 43 Ų | 43 | 62.4 Ų | 62.4 | 20% | 0.201 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | 5.4 | 175.3 | -67.4 | 177.5 | 5.9 | 0 | 0 | 114.3 | V154 L155 G156 R160 Y220 | V154-Q158 WeakPolarHBondContact O-CG 3.42Å; V154-Q158 PolarHBondContact O-N 3.04Å; V154-Q158 VanDerWaalsContact O-N 3.15Å; L155-Q158 PolarHBondContact O-N 3.01Å; G156-Q158 PolarHBondContact O-N 3.43Å; Q158-R160 HydrophobicContact CB-CB 4.32Å; Q158-R160 HydrophobicContact CB-CG 4.44Å; Q158-R160 WeakPolarHBondContact O-CG 3.36Å; Q158-R160 PolarHBondContact O-N 3.33Å; Q158-Y220 PolarHBondContact NE2-OH 2.94Å |
| 159 | N | 90.3 | Very high | 91.3 | Very high | 157 Ų | 157 | 61.8 Ų | 61.8 | 84% | 0.84 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | 29.5 | -173.3 | -61.5 | -58.5 | 0 | 0 | 0 | 113.7 | L155 G156 V157 | L155-N159 PolarHBondContact O-N 3.38Å; G156-N159 PolarHBondContact O-N 3.17Å; V157-N159 PolarHBondContact O-N 3.11Å |
| 160 | R | 85.5 | Confident | 91.2 | Very high | 78 Ų | 78 | 58.4 Ų | 58.4 | 29% | 0.294 | 32% | 0.321 | S | S | . | . | trans | -122.5 | 14.7 | -174.3 | -76 | 174.8 | -165.6 | -169.8 | 5.4 | 112.2 | L155 Q158 S162 K165 V290 | L155-R160 CarbonylContact O-C 3.57Å; L155-R160 WeakPolarHBondContact O-CA 3.38Å; L155-R160 PolarHBondContact O-N 3.36Å; Q158-R160 HydrophobicContact CB-CB 4.32Å; Q158-R160 HydrophobicContact CB-CG 4.44Å; Q158-R160 WeakPolarHBondContact O-CG 3.36Å; Q158-R160 PolarHBondContact O-N 3.33Å; R160-S162 PolarHBondContact O-N 3.42Å; R160-K165 PolarHBondContact O-NZ 2.8Å; R160-V290 PolarHBondContact NH1-O 2.96Å | ||
| 161 | F | 90 | Very high | 91.2 | Very high | 117 Ų | 117 | 61.4 Ų | 61.4 | 51% | 0.513 | 34% | 0.343 | S | S | . | . | trans | -61.5 | 121.2 | 177.3 | -178.1 | -98.5 | 0 | 0 | 0 | 109.5 | L155 L166 | L155-F161 PolarHBondContact O-N 2.84Å; L155-F161 VanDerWaalsContact O-N 3.09Å; F161-L166 HydrophobicContact CE2-CD2 4.25Å | ||
| 162 | S | 91 | Very high | 91.1 | Very high | 29 Ų | 29 | 64 Ų | 64 | 20% | 0.203 | 36% | 0.359 | C | S | . | . | trans | -143 | 136.4 | 166.8 | 109.9 | 0 | 0 | 0 | 0 | 107.5 | R160 E164 K165 L166 | R160-S162 PolarHBondContact O-N 3.42Å; S162-E164 WeakPolarHBondContact CB-OE2 3.37Å; S162-E164 PolarHBondContact O-N 3.25Å; S162-E164 VanDerWaalsContact O-N 3.17Å; S162-E164 PolarHBondContact OG-OE2 3.26Å; S162-K165 PolarHBondContact O-N 2.98Å; S162-K165 VanDerWaalsContact O-N 3.07Å; S162-L166 PolarHBondContact O-N 3.49Å | ||
| 163 | P | 93.1 | Very high | 91.1 | Very high | 83 Ų | 83 | 63.8 Ų | 63.8 | 54% | 0.539 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -59.7 | -26.8 | -178 | 24.5 | -33.5 | 0 | 0 | 0 | 111.8 | L166 G167 | P163-L166 PolarHBondContact O-N 3.16Å; P163-G167 PolarHBondContact O-N 3.45Å |
| 164 | E | 92.3 | Very high | 91 | Very high | 126 Ų | 126 | 64.3 Ų | 64.3 | 59% | 0.589 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -62.6 | -44 | 175.4 | -56.6 | 75.7 | -164 | 0 | 0 | 111.4 | S162 G167 L168 | S162-E164 WeakPolarHBondContact CB-OE2 3.37Å; S162-E164 PolarHBondContact O-N 3.25Å; S162-E164 VanDerWaalsContact O-N 3.17Å; S162-E164 PolarHBondContact OG-OE2 3.26Å; E164-G167 PolarHBondContact O-N 3.01Å; E164-L168 WeakPolarHBondContact O-CB 3.23Å; E164-L168 VanDerWaalsContact O-CG 3.24Å; E164-L168 WeakPolarHBondContact O-CG 3.49Å; E164-L168 PolarHBondContact O-N 3.26Å |
| 165 | K | 87.6 | Confident | 91 | Very high | 78 Ų | 78 | 66.3 Ų | 66.3 | 34% | 0.339 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -66.4 | -40 | 177.2 | -66.3 | 179.2 | -171.3 | 166.9 | 0 | 111.8 | L155 R160 S162 L169 | L155-K165 HydrophobicContact CD1-CB 3.93Å; L155-K165 HydrophobicContact CD2-CD 4.27Å; R160-K165 PolarHBondContact O-NZ 2.8Å; S162-K165 PolarHBondContact O-N 2.98Å; S162-K165 VanDerWaalsContact O-N 3.07Å; K165-L169 WeakPolarHBondContact O-CB 3.24Å; K165-L169 PolarHBondContact O-N 3.37Å |
| 166 | L | 91 | Very high | 91 | Very high | 37 Ų | 37 | 69.9 Ų | 69.9 | 19% | 0.194 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -65.5 | -44.5 | 177.3 | -170.8 | 65.4 | 0 | 0 | 0 | 110.8 | I148 F161 S162 P163 L169 C170 | I148-L166 HydrophobicContact CG2-CD1 3.78Å; I148-L166 HydrophobicContact CG2-CG 4.32Å; I148-L166 WeakPolarHBondContact O-CD1 3.03Å; F161-L166 HydrophobicContact CE2-CD2 4.25Å; S162-L166 PolarHBondContact O-N 3.49Å; P163-L166 PolarHBondContact O-N 3.16Å; L166-L169 WeakPolarHBondContact O-CB 3.42Å; L166-L169 PolarHBondContact O-N 3.09Å; L166-C170 PolarHBondContact O-N 3.49Å; L166-C170 PolarHBondContact O-SG 2.99Å |
| 167 | G | 93.2 | Very high | 91 | Very high | 32 Ų | 32 | 69.4 Ų | 69.4 | 33% | 0.33 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.3 | -40.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | P163 E164 L169 C170 S171 | P163-G167 PolarHBondContact O-N 3.45Å; E164-G167 PolarHBondContact O-N 3.01Å; G167-L169 VanDerWaalsContact C-N 3.34Å; G167-C170 PolarHBondContact O-N 3.44Å; G167-S171 WeakPolarHBondContact O-CB 3.08Å; G167-S171 PolarHBondContact O-N 3.44Å; G167-S171 PolarHBondContact O-OG 3.29Å |
| 168 | L | 92.2 | Very high | 91.1 | Very high | 116 Ų | 116 | 69.7 Ų | 69.7 | 61% | 0.607 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -62.3 | -41.3 | 172.8 | -74.6 | 171.6 | 0 | 0 | 0 | 111.8 | E164 S171 T172 | E164-L168 WeakPolarHBondContact O-CB 3.23Å; E164-L168 VanDerWaalsContact O-CG 3.24Å; E164-L168 WeakPolarHBondContact O-CG 3.49Å; E164-L168 PolarHBondContact O-N 3.26Å; L168-S171 PolarHBondContact O-N 2.98Å; L168-T172 VanDerWaalsContact O-CB 3.28Å; L168-T172 WeakPolarHBondContact O-CB 3.45Å; L168-T172 PolarHBondContact O-N 2.87Å; L168-T172 PolarHBondContact O-OG1 2.86Å |
| 169 | L | 91 | Very high | 91.2 | Very high | 16 Ų | 16 | 69.5 Ų | 69.5 | 8% | 0.084 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -63.8 | -47.6 | 175.7 | 178.4 | 136 | 0 | 0 | 0 | 111.3 | I148 K165 L166 G167 S171 T172 I173 L286 | I148-L169 HydrophobicContact CB-CD2 4.21Å; I148-L169 HydrophobicContact CG1-CD2 3.86Å; I148-L169 HydrophobicContact CG2-CD2 4.35Å; K165-L169 WeakPolarHBondContact O-CB 3.24Å; K165-L169 PolarHBondContact O-N 3.37Å; L166-L169 WeakPolarHBondContact O-CB 3.42Å; L166-L169 PolarHBondContact O-N 3.09Å; G167-L169 VanDerWaalsContact C-N 3.34Å; L169-S171 VanDerWaalsContact C-N 3.32Å; L169-S171 PolarHBondContact O-N 3.09Å; L169-T172 PolarHBondContact O-N 3.41Å; L169-I173 HydrophobicContact CD2-CD1 3.43Å; L169-I173 VanDerWaalsContact CD2-CD1 3.43Å; L169-I173 HydrophobicContact CG-CD1 3.84Å; L169-I173 WeakPolarHBondContact O-CD1 3.17Å; L169-I173 VanDerWaalsContact O-CG1 3.25Å; L169-I173 WeakPolarHBondContact O-CG1 3.36Å; L169-I173 PolarHBondContact O-N 2.78Å; L169-L286 HydrophobicContact CD1-CD1 3.79Å; L169-L286 HydrophobicContact CD1-CD2 4.39Å |
| 170 | C | 92.4 | Very high | 91.2 | Very high | 42 Ų | 42 | 62.7 Ų | 62.7 | 28% | 0.284 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -55 | -48.5 | 174.3 | -66 | 0 | 0 | 0 | 0 | 111.8 | I148 L166 G167 T172 I173 L174 | I148-C170 HydrophobicContact CD1-CB 4.45Å; I148-C170 WeakPolarHBondContact CG2-SG 3.45Å; L166-C170 PolarHBondContact O-N 3.49Å; L166-C170 PolarHBondContact O-SG 2.99Å; G167-C170 PolarHBondContact O-N 3.44Å; C170-T172 PolarHBondContact O-N 3.05Å; C170-I173 PolarHBondContact O-N 3.26Å; C170-L174 WeakPolarHBondContact O-CB 3.48Å; C170-L174 PolarHBondContact O-N 3.29Å |
| 171 | S | 94 | Very high | 91.4 | Very high | 75 Ų | 75 | 59.2 Ų | 59.2 | 52% | 0.524 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.9 | -40.3 | -179 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | G167 L168 L169 L174 A175 | G167-S171 WeakPolarHBondContact O-CB 3.08Å; G167-S171 PolarHBondContact O-N 3.44Å; G167-S171 PolarHBondContact O-OG 3.29Å; L168-S171 PolarHBondContact O-N 2.98Å; L169-S171 VanDerWaalsContact C-N 3.32Å; L169-S171 PolarHBondContact O-N 3.09Å; S171-L174 PolarHBondContact O-N 3.31Å; S171-A175 VanDerWaalsContact O-CB 3.29Å; S171-A175 WeakPolarHBondContact O-CB 3.08Å; S171-A175 PolarHBondContact O-N 3.46Å |
| 172 | T | 91.1 | Very high | 91.4 | Very high | 58 Ų | 58 | 58.4 Ų | 58.4 | 36% | 0.356 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 177.4 | -60.5 | 0 | 0 | 0 | 0 | 111.2 | L168 L169 C170 A175 W176 | L168-T172 VanDerWaalsContact O-CB 3.28Å; L168-T172 WeakPolarHBondContact O-CB 3.45Å; L168-T172 PolarHBondContact O-N 2.87Å; L168-T172 PolarHBondContact O-OG1 2.86Å; L169-T172 PolarHBondContact O-N 3.41Å; C170-T172 PolarHBondContact O-N 3.05Å; T172-A175 PolarHBondContact O-N 3.39Å; T172-W176 PolarHBondContact O-N 2.85Å |
| 173 | I | 92 | Very high | 91.3 | Very high | 4 Ų | 4 | 61 Ų | 61 | 2% | 0.021 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.6 | -47 | 176.3 | -70 | 160.1 | 0 | 0 | 0 | 110.5 | V144 Y147 I148 L169 C170 A175 W176 L177 Y210 | V144-I173 HydrophobicContact CG1-CG2 3.93Å; Y147-I173 HydrophobicContact CD1-CD1 3.52Å; Y147-I173 HydrophobicContact CD1-CG1 4.3Å; Y147-I173 HydrophobicContact CE1-CD1 3.63Å; Y147-I173 HydrophobicContact CE1-CG1 4.13Å; I148-I173 HydrophobicContact CD1-CD1 4.34Å; I148-I173 HydrophobicContact CG1-CD1 3.64Å; L169-I173 HydrophobicContact CD2-CD1 3.43Å; L169-I173 VanDerWaalsContact CD2-CD1 3.43Å; L169-I173 HydrophobicContact CG-CD1 3.84Å; L169-I173 WeakPolarHBondContact O-CD1 3.17Å; L169-I173 VanDerWaalsContact O-CG1 3.25Å; L169-I173 WeakPolarHBondContact O-CG1 3.36Å; L169-I173 PolarHBondContact O-N 2.78Å; C170-I173 PolarHBondContact O-N 3.26Å; I173-A175 PolarHBondContact O-N 2.85Å; I173-W176 PolarHBondContact O-N 3.13Å; I173-L177 HydrophobicContact CG2-CD1 3.89Å; I173-L177 HydrophobicContact CG2-CG 4.42Å; I173-L177 WeakPolarHBondContact O-CB 3.48Å; I173-L177 WeakPolarHBondContact O-CG 3.45Å; I173-L177 PolarHBondContact O-N 2.84Å; I173-Y210 HydrophobicContact CG1-CE1 4.28Å; I173-Y210 HydrophobicContact CG2-CE1 3.76Å |
| 174 | L | 92.4 | Very high | 90.9 | Very high | 104 Ų | 104 | 57.6 Ų | 57.6 | 55% | 0.545 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62.5 | -44.1 | 179.2 | -174.7 | 65.4 | 0 | 0 | 0 | 111.4 | C170 S171 W176 L177 I178 | C170-L174 WeakPolarHBondContact O-CB 3.48Å; C170-L174 PolarHBondContact O-N 3.29Å; S171-L174 PolarHBondContact O-N 3.31Å; L174-W176 PolarHBondContact O-N 3.12Å; L174-L177 PolarHBondContact O-N 3.11Å; L174-I178 HydrophobicContact CD1-CD1 4.28Å; L174-I178 HydrophobicContact CG-CD1 3.99Å; L174-I178 VanDerWaalsContact O-CG1 3.31Å; L174-I178 WeakPolarHBondContact O-CG1 3.21Å; L174-I178 PolarHBondContact O-N 3.45Å |
| 175 | A | 92 | Very high | 90.6 | Very high | 56 Ų | 56 | 54.8 Ų | 54.8 | 46% | 0.463 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.3 | -44.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S171 T172 I173 I178 A179 | S171-A175 VanDerWaalsContact O-CB 3.29Å; S171-A175 WeakPolarHBondContact O-CB 3.08Å; S171-A175 PolarHBondContact O-N 3.46Å; T172-A175 PolarHBondContact O-N 3.39Å; I173-A175 PolarHBondContact O-N 2.85Å; A175-I178 PolarHBondContact O-N 3.22Å; A175-A179 VanDerWaalsContact O-CB 3.23Å; A175-A179 WeakPolarHBondContact O-CB 3.49Å; A175-A179 PolarHBondContact O-N 3.39Å |
| 176 | W | 89.9 | Confident | 90.6 | Very high | 89 Ų | 89 | 55.8 Ų | 55.8 | 34% | 0.337 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65.8 | -41.5 | 176 | -82.4 | 114.9 | 0 | 0 | 0 | 112.9 | T172 I173 L174 I178 A179 E180 W281 L282 | T172-W176 PolarHBondContact O-N 2.85Å; I173-W176 PolarHBondContact O-N 3.13Å; L174-W176 PolarHBondContact O-N 3.12Å; W176-I178 PolarHBondContact O-N 3.12Å; W176-A179 PolarHBondContact O-N 3.28Å; W176-E180 WeakPolarHBondContact O-CB 3.3Å; W176-E180 WeakPolarHBondContact O-CG 3.3Å; W176-E180 PolarHBondContact O-N 3.06Å; W176-W281 AromaticContact CZ2-CD1 3.89Å; W176-W281 AromaticContact CZ2-NE1 3.95Å; W176-L282 HydrophobicContact CG-CD1 4.34Å |
| 177 | L | 91 | Very high | 90.2 | Very high | 21 Ų | 21 | 55.6 Ų | 55.6 | 11% | 0.11 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59.2 | -46.4 | 174.8 | -79.5 | 170.5 | 0 | 0 | 0 | 111.4 | V144 I173 L174 N181 Y210 | V144-L177 HydrophobicContact CG1-CD1 4.45Å; V144-L177 HydrophobicContact CG2-CD1 3.95Å; I173-L177 HydrophobicContact CG2-CD1 3.89Å; I173-L177 HydrophobicContact CG2-CG 4.42Å; I173-L177 WeakPolarHBondContact O-CB 3.48Å; I173-L177 WeakPolarHBondContact O-CG 3.45Å; I173-L177 PolarHBondContact O-N 2.84Å; L174-L177 PolarHBondContact O-N 3.11Å; L177-N181 WeakPolarHBondContact O-CB 3.48Å; L177-N181 PolarHBondContact O-N 3.16Å; L177-N181 VanDerWaalsContact O-N 3.11Å; L177-N181 PolarHBondContact O-ND2 2.95Å; L177-Y210 HydrophobicContact CD1-CE2 4.46Å; L177-Y210 HydrophobicContact CD2-CE2 3.74Å; L177-Y210 HydrophobicContact CG-CE2 4.25Å |
| 178 | I | 91.9 | Very high | 89.6 | Confident | 102 Ų | 102 | 56.9 Ų | 56.9 | 52% | 0.523 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64.7 | -47.3 | 177.6 | -67.7 | 168.5 | 0 | 0 | 0 | 110.3 | L174 A175 W176 E180 N181 L182 | L174-I178 HydrophobicContact CD1-CD1 4.28Å; L174-I178 HydrophobicContact CG-CD1 3.99Å; L174-I178 VanDerWaalsContact O-CG1 3.31Å; L174-I178 WeakPolarHBondContact O-CG1 3.21Å; L174-I178 PolarHBondContact O-N 3.45Å; A175-I178 PolarHBondContact O-N 3.22Å; W176-I178 PolarHBondContact O-N 3.12Å; I178-E180 PolarHBondContact O-N 3.14Å; I178-N181 PolarHBondContact O-N 3.04Å; I178-L182 VanDerWaalsContact O-CB 3.31Å; I178-L182 WeakPolarHBondContact O-CB 2.99Å; I178-L182 PolarHBondContact O-N 3.15Å |
| 179 | A | 91.1 | Very high | 89.1 | Confident | 39 Ų | 39 | 60.8 Ų | 60.8 | 32% | 0.322 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | -179 | 0 | 0 | 0 | 0 | 0 | 112.2 | A175 W176 L182 V183 | A175-A179 VanDerWaalsContact O-CB 3.23Å; A175-A179 WeakPolarHBondContact O-CB 3.49Å; A175-A179 PolarHBondContact O-N 3.39Å; W176-A179 PolarHBondContact O-N 3.28Å; A179-L182 PolarHBondContact O-N 3.46Å; A179-V183 VanDerWaalsContact O-CG2 3.3Å; A179-V183 WeakPolarHBondContact O-CG2 3.32Å; A179-V183 PolarHBondContact O-N 3.41Å |
| 180 | E | 90.1 | Very high | 88.7 | Confident | 15 Ų | 15 | 63.5 Ų | 63.5 | 7% | 0.07 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -61 | -48.9 | 175.9 | -77.4 | 178.5 | 143 | 0 | 0 | 111.6 | W176 I178 L182 V183 I184 K209 I278 | W176-E180 WeakPolarHBondContact O-CB 3.3Å; W176-E180 WeakPolarHBondContact O-CG 3.3Å; W176-E180 PolarHBondContact O-N 3.06Å; I178-E180 PolarHBondContact O-N 3.14Å; E180-L182 VanDerWaalsContact C-N 3.26Å; E180-L182 PolarHBondContact O-N 2.85Å; E180-V183 PolarHBondContact O-N 2.86Å; E180-I184 WeakPolarHBondContact O-CD1 3.3Å; E180-I184 WeakPolarHBondContact O-CG1 3.46Å; E180-I184 PolarHBondContact O-N 3.33Å; E180-K209 IonicContact OE1-NZ 2.64Å; E180-K209 PolarHBondContact OE1-NZ 3.32Å; E180-K209 IonicContact OE2-NZ 2.64Å; E180-K209 PolarHBondContact OE2-NZ 3.49Å; E180-I278 HydrophobicContact CG-CD1 4.25Å; E180-I278 WeakPolarHBondContact OE1-CD1 3.42Å |
| 181 | N | 89.8 | Confident | 88.1 | Confident | 4 Ų | 4 | 65 Ų | 65 | 2% | 0.021 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -64.3 | -34.2 | 179.5 | -80.1 | -84.5 | 0 | 0 | 0 | 111.8 | L177 I178 T185 F199 L203 S206 | L177-N181 WeakPolarHBondContact O-CB 3.48Å; L177-N181 PolarHBondContact O-N 3.16Å; L177-N181 VanDerWaalsContact O-N 3.11Å; L177-N181 PolarHBondContact O-ND2 2.95Å; I178-N181 PolarHBondContact O-N 3.04Å; N181-T185 VanDerWaalsContact O-CB 3.3Å; N181-T185 WeakPolarHBondContact O-CB 3.41Å; N181-T185 PolarHBondContact O-N 3.47Å; N181-T185 PolarHBondContact O-OG1 2.81Å; N181-F199 HydrophobicContact CB-CE2 4.03Å; N181-L203 VanDerWaalsContact ND2-CD1 3.29Å; N181-L203 WeakPolarHBondContact ND2-CD1 3.46Å; N181-L203 VanDerWaalsContact OD1-CA 3.24Å; N181-L203 WeakPolarHBondContact OD1-CA 3.45Å; N181-L203 PolarHBondContact OD1-N 3.06Å; N181-S206 PolarHBondContact ND2-OG 3.42Å |
| 182 | L | 90.2 | Very high | 87.2 | Confident | 100 Ų | 100 | 67 Ų | 67 | 52% | 0.524 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -66.8 | -48.3 | 174.5 | -177.2 | 62.8 | 0 | 0 | 0 | 111.5 | I178 A179 E180 I184 T185 I186 | I178-L182 VanDerWaalsContact O-CB 3.31Å; I178-L182 WeakPolarHBondContact O-CB 2.99Å; I178-L182 PolarHBondContact O-N 3.15Å; A179-L182 PolarHBondContact O-N 3.46Å; E180-L182 VanDerWaalsContact C-N 3.26Å; E180-L182 PolarHBondContact O-N 2.85Å; L182-I184 VanDerWaalsContact C-N 3.27Å; L182-I184 PolarHBondContact O-N 3.18Å; L182-T185 PolarHBondContact O-N 3.35Å; L182-I186 HydrophobicContact CD1-CD1 4.1Å; L182-I186 HydrophobicContact CD1-CG1 4.34Å; L182-I186 HydrophobicContact CG-CD1 3.88Å; L182-I186 HydrophobicContact CG-CG1 4.5Å; L182-I186 WeakPolarHBondContact O-CB 3.17Å; L182-I186 VanDerWaalsContact O-CG1 3.28Å; L182-I186 WeakPolarHBondContact O-CG1 3.35Å; L182-I186 PolarHBondContact O-N 3.28Å |
| 183 | V | 88.7 | Confident | 86 | Confident | 83 Ų | 83 | 64.7 Ų | 64.7 | 50% | 0.503 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -58.2 | -42.2 | 176.6 | 170.5 | 0 | 0 | 0 | 0 | 110.7 | A179 E180 I186 T187 | A179-V183 VanDerWaalsContact O-CG2 3.3Å; A179-V183 WeakPolarHBondContact O-CG2 3.32Å; A179-V183 PolarHBondContact O-N 3.41Å; E180-V183 PolarHBondContact O-N 2.86Å; V183-I186 PolarHBondContact O-N 3.48Å; V183-T187 WeakPolarHBondContact O-CB 3.43Å; V183-T187 PolarHBondContact O-N 3.32Å; V183-T187 PolarHBondContact O-OG1 3.39Å |
| 184 | I | 85.7 | Confident | 84.5 | Confident | 13 Ų | 13 | 68 Ų | 68 | 7% | 0.067 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -69.3 | -39.9 | 179.1 | -61 | 162.1 | 0 | 0 | 0 | 111 | E180 L182 T187 R188 T202 L267 I271 | E180-I184 WeakPolarHBondContact O-CD1 3.3Å; E180-I184 WeakPolarHBondContact O-CG1 3.46Å; E180-I184 PolarHBondContact O-N 3.33Å; L182-I184 VanDerWaalsContact C-N 3.27Å; L182-I184 PolarHBondContact O-N 3.18Å; I184-T187 PolarHBondContact O-N 3.39Å; I184-R188 VanDerWaalsContact O-CB 3.26Å; I184-R188 WeakPolarHBondContact O-CB 3.44Å; I184-R188 PolarHBondContact O-N 3.4Å; I184-T202 HydrophobicContact CB-CG2 3.63Å; I184-T202 HydrophobicContact CD1-CG2 3.39Å; I184-T202 HydrophobicContact CG1-CG2 4.07Å; I184-T202 HydrophobicContact CG2-CG2 3.31Å; I184-L267 HydrophobicContact CG2-CD2 4.14Å; I184-I271 HydrophobicContact CB-CD1 4.32Å; I184-I271 HydrophobicContact CD1-CD1 3.64Å; I184-I271 HydrophobicContact CD1-CG1 4.01Å; I184-I271 HydrophobicContact CD1-CG2 4.3Å; I184-I271 HydrophobicContact CG1-CD1 3.58Å; I184-I271 HydrophobicContact CG1-CG1 3.9Å; I184-I271 HydrophobicContact CG2-CD1 3.77Å |
| 185 | T | 85 | Confident | 83 | Confident | 66 Ų | 66 | 70.6 Ų | 70.6 | 41% | 0.405 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.2 | -45.8 | 175.5 | -60.6 | 0 | 0 | 0 | 0 | 111.1 | N181 L182 R188 Y189 | N181-T185 VanDerWaalsContact O-CB 3.3Å; N181-T185 WeakPolarHBondContact O-CB 3.41Å; N181-T185 PolarHBondContact O-N 3.47Å; N181-T185 PolarHBondContact O-OG1 2.81Å; L182-T185 PolarHBondContact O-N 3.35Å; T185-R188 PolarHBondContact O-N 2.83Å; T185-Y189 WeakPolarHBondContact O-CB 3.31Å; T185-Y189 PolarHBondContact O-N 2.81Å |
| 186 | I | 87.5 | Confident | 81.5 | Confident | 99 Ų | 99 | 70.2 Ų | 70.2 | 51% | 0.508 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.2 | -46.3 | 175.8 | -67.5 | 167.4 | 0 | 0 | 0 | 110.2 | L182 V183 R188 Y189 A190 | L182-I186 HydrophobicContact CD1-CD1 4.1Å; L182-I186 HydrophobicContact CD1-CG1 4.34Å; L182-I186 HydrophobicContact CG-CD1 3.88Å; L182-I186 HydrophobicContact CG-CG1 4.5Å; L182-I186 WeakPolarHBondContact O-CB 3.17Å; L182-I186 VanDerWaalsContact O-CG1 3.28Å; L182-I186 WeakPolarHBondContact O-CG1 3.35Å; L182-I186 PolarHBondContact O-N 3.28Å; V183-I186 PolarHBondContact O-N 3.48Å; I186-R188 PolarHBondContact O-N 3.45Å; I186-Y189 PolarHBondContact O-N 2.94Å; I186-A190 WeakPolarHBondContact O-CB 3.31Å; I186-A190 PolarHBondContact O-N 3.49Å |
| 187 | T | 83.9 | Confident | 80.3 | Confident | 34 Ų | 34 | 66.2 Ų | 66.2 | 21% | 0.209 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.9 | -42.1 | 179.8 | -54.3 | 0 | 0 | 0 | 0 | 111.5 | V183 I184 Y189 A190 M191 L267 | V183-T187 WeakPolarHBondContact O-CB 3.43Å; V183-T187 PolarHBondContact O-N 3.32Å; V183-T187 PolarHBondContact O-OG1 3.39Å; I184-T187 PolarHBondContact O-N 3.39Å; T187-Y189 VanDerWaalsContact C-N 3.34Å; T187-Y189 PolarHBondContact O-N 2.93Å; T187-A190 PolarHBondContact O-N 3.3Å; T187-M191 HydrophobicContact CG2-CE 3.98Å; T187-M191 HydrophobicContact CG2-CG 4.44Å; T187-M191 HydrophobicContact CG2-SD 4.25Å; T187-M191 WeakPolarHBondContact O-CB 3.28Å; T187-M191 WeakPolarHBondContact O-CG 3.5Å; T187-M191 PolarHBondContact O-N 3.24Å; T187-L267 HydrophobicContact CG2-CD1 3.74Å; T187-L267 HydrophobicContact CG2-CG 4.11Å |
| 188 | R | 80 | Confident | 79.6 | Confident | 59 Ų | 59 | 67.6 Ų | 67.6 | 22% | 0.223 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -60.1 | -45.2 | 175.4 | 176.8 | -171.2 | -179.8 | -86.6 | 18.9 | 111.2 | I184 T185 I186 V192 I193 E195 L197 L267 | I184-R188 VanDerWaalsContact O-CB 3.26Å; I184-R188 WeakPolarHBondContact O-CB 3.44Å; I184-R188 PolarHBondContact O-N 3.4Å; T185-R188 PolarHBondContact O-N 2.83Å; I186-R188 PolarHBondContact O-N 3.45Å; R188-V192 PolarHBondContact O-N 2.9Å; R188-I193 PolarHBondContact O-N 3.42Å; R188-E195 VanDerWaalsContact NH2-CB 3.34Å; R188-E195 PolarHBondContact NH2-O 3.11Å; R188-E195 VanDerWaalsContact NH2-O 3.13Å; R188-L197 PolarHBondContact NE-O 3.49Å; R188-L197 PolarHBondContact NH2-O 2.98Å; R188-L197 VanDerWaalsContact NH2-O 3.13Å; R188-L267 HydrophobicContact CB-CD1 4.28Å |
| 189 | Y | 82.4 | Confident | 79.1 | Confident | 197 Ų | 197 | 67.8 Ų | 67.8 | 77% | 0.773 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -65.5 | -47 | 178.1 | -174.1 | -100 | 0 | 0 | 0 | 111.3 | T185 I186 T187 M191 V192 | T185-Y189 WeakPolarHBondContact O-CB 3.31Å; T185-Y189 PolarHBondContact O-N 2.81Å; I186-Y189 PolarHBondContact O-N 2.94Å; T187-Y189 VanDerWaalsContact C-N 3.34Å; T187-Y189 PolarHBondContact O-N 2.93Å; Y189-M191 VanDerWaalsContact C-N 3.34Å; Y189-M191 PolarHBondContact O-N 3.45Å; Y189-V192 PolarHBondContact O-N 2.94Å; Y189-V192 VanDerWaalsContact O-N 3.16Å |
| 190 | A | 82.8 | Confident | 78.9 | Confident | 74 Ų | 74 | 69.3 Ų | 69.3 | 61% | 0.612 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -62.1 | -37.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | I186 T187 V192 | I186-A190 WeakPolarHBondContact O-CB 3.31Å; I186-A190 PolarHBondContact O-N 3.49Å; T187-A190 PolarHBondContact O-N 3.3Å; A190-V192 VanDerWaalsContact C-N 3.25Å; A190-V192 PolarHBondContact O-N 2.87Å |
| 191 | M | 78.9 | Confident | 78.6 | Confident | 73 Ų | 73 | 69 Ų | 69 | 36% | 0.36 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.5 | -0.9 | 179.1 | -70.2 | -168.2 | 177.1 | 0 | 0 | 114.2 | T187 Y189 I193 R263 L267 | T187-M191 HydrophobicContact CG2-CE 3.98Å; T187-M191 HydrophobicContact CG2-CG 4.44Å; T187-M191 HydrophobicContact CG2-SD 4.25Å; T187-M191 WeakPolarHBondContact O-CB 3.28Å; T187-M191 WeakPolarHBondContact O-CG 3.5Å; T187-M191 PolarHBondContact O-N 3.24Å; Y189-M191 VanDerWaalsContact C-N 3.34Å; Y189-M191 PolarHBondContact O-N 3.45Å; M191-I193 HydrophobicContact CB-CD1 3.65Å; M191-I193 HydrophobicContact CB-CG1 3.71Å; M191-I193 HydrophobicContact CG-CD1 4.42Å; M191-I193 PolarHBondContact O-N 3.2Å; M191-I193 HydrophobicContact SD-CD1 4Å; M191-R263 PolarHBondContact O-NH1 3.27Å; M191-R263 VanDerWaalsContact O-NH1 3.15Å; M191-L267 HydrophobicContact SD-CB 4.22Å; M191-L267 HydrophobicContact SD-CD1 4.36Å |
| 192 | V | 74.3 | Confident | 78.4 | Confident | 116 Ų | 116 | 69.2 Ų | 69.2 | 70% | 0.703 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.2 | 43 | -175.9 | -166.1 | 0 | 0 | 0 | 0 | 110.5 | R188 Y189 A190 S194 | R188-V192 PolarHBondContact O-N 2.9Å; Y189-V192 PolarHBondContact O-N 2.94Å; Y189-V192 VanDerWaalsContact O-N 3.16Å; A190-V192 VanDerWaalsContact C-N 3.25Å; A190-V192 PolarHBondContact O-N 2.87Å; V192-S194 PolarHBondContact O-N 3.35Å |
| 193 | I | 67.4 | Low | 78.3 | Confident | 10 Ų | 10 | 66.2 Ų | 66.2 | 5% | 0.051 | 35% | 0.349 | C | S | . | . | trans | -76.4 | 126.2 | 178.1 | -68.4 | 165.3 | 0 | 0 | 0 | 107.1 | R188 M191 E195 R263 K264 L267 | R188-I193 PolarHBondContact O-N 3.42Å; M191-I193 HydrophobicContact CB-CD1 3.65Å; M191-I193 HydrophobicContact CB-CG1 3.71Å; M191-I193 HydrophobicContact CG-CD1 4.42Å; M191-I193 PolarHBondContact O-N 3.2Å; M191-I193 HydrophobicContact SD-CD1 4Å; I193-E195 PolarHBondContact O-N 2.7Å; I193-R263 HydrophobicContact CD1-CB 4.04Å; I193-R263 HydrophobicContact CG1-CB 3.82Å; I193-K264 HydrophobicContact CG2-CB 4.41Å; I193-L267 HydrophobicContact CD1-CB 4.17Å; I193-L267 HydrophobicContact CD1-CD1 3.64Å | ||
| 194 | S | 59.7 | Low | 78.4 | Confident | 75 Ų | 75 | 62.3 Ų | 62.3 | 52% | 0.524 | 33% | 0.325 | S | S | . | . | trans | -46.6 | 140.6 | 174.3 | -46.9 | 0 | 0 | 0 | 0 | 109.9 | V192 S196 | V192-S194 PolarHBondContact O-N 3.35Å; S194-S196 PolarHBondContact O-N 3.37Å; S194-S196 PolarHBondContact O-OG 3.31Å | ||
| 195 | E | 60.2 | Low | 78.4 | Confident | 157 Ų | 157 | 62.2 Ų | 62.2 | 73% | 0.734 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | 13.1 | -165.4 | -64.5 | -176.3 | 162.6 | 0 | 0 | 117.2 | R188 I193 L197 | R188-E195 VanDerWaalsContact NH2-CB 3.34Å; R188-E195 PolarHBondContact NH2-O 3.11Å; R188-E195 VanDerWaalsContact NH2-O 3.13Å; I193-E195 PolarHBondContact O-N 2.7Å; E195-L197 PolarHBondContact O-N 2.78Å; E195-L197 VanDerWaalsContact O-N 3.08Å |
| 196 | S | 60.7 | Low | 78.5 | Confident | 49 Ų | 49 | 59.1 Ų | 59.1 | 34% | 0.343 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.6 | -30.2 | -176.8 | 64.8 | 0 | 0 | 0 | 0 | 115.9 | S194 | S194-S196 PolarHBondContact O-N 3.37Å; S194-S196 PolarHBondContact O-OG 3.31Å |
| 197 | L | 65.8 | Low | 78.7 | Confident | 4 Ų | 4 | 54.5 Ų | 54.5 | 2% | 0.021 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -91.8 | 119.5 | 175 | -72.2 | 175.7 | 0 | 0 | 0 | 110 | R188 E195 D201 K264 L268 | R188-L197 PolarHBondContact NE-O 3.49Å; R188-L197 PolarHBondContact NH2-O 2.98Å; R188-L197 VanDerWaalsContact NH2-O 3.13Å; E195-L197 PolarHBondContact O-N 2.78Å; E195-L197 VanDerWaalsContact O-N 3.08Å; L197-D201 HydrophobicContact CD2-CB 4.26Å; L197-K264 HydrophobicContact CD1-CG 4.35Å; L197-K264 VanDerWaalsContact CD2-CE 3.47Å; L197-K264 HydrophobicContact CG-CD 4.34Å; L197-L268 HydrophobicContact CD1-CD1 4.07Å; L197-L268 HydrophobicContact CD1-CD2 4.39Å; L197-L268 HydrophobicContact CD1-CG 4.46Å |
| 198 | N | 75.3 | Confident | 79.1 | Confident | 50 Ų | 50 | 53 Ų | 53 | 27% | 0.267 | 27% | 0.273 | S | S | . | . | trans | -75.3 | 155.8 | 170.6 | -56.4 | -56.1 | 0 | 0 | 0 | 109.5 | W200 D201 T202 | N198-W200 PolarHBondContact O-N 3.31Å; N198-D201 WeakPolarHBondContact CB-OD2 3.34Å; N198-D201 PolarHBondContact N-OD2 3.5Å; N198-D201 PolarHBondContact ND2-OD2 3.49Å; N198-D201 PolarHBondContact O-N 3.49Å; N198-D201 VanDerWaalsContact O-N 3.12Å; N198-T202 PolarHBondContact O-N 2.99Å; N198-T202 PolarHBondContact O-OG1 3.43Å | ||
| 199 | F | 82.5 | Confident | 79.7 | Confident | 107 Ų | 107 | 50.3 Ų | 50.3 | 47% | 0.469 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -50.8 | -42.3 | 169.6 | 173.2 | -101.4 | 0 | 0 | 0 | 111.4 | N181 D201 T202 L203 | N181-F199 HydrophobicContact CB-CE2 4.03Å; F199-D201 PolarHBondContact O-N 2.73Å; F199-T202 PolarHBondContact O-N 3.05Å; F199-L203 HydrophobicContact CE1-CD2 4.19Å; F199-L203 PolarHBondContact O-N 3.48Å |
| 200 | W | 86 | Confident | 80.2 | Confident | 70 Ų | 70 | 40.9 Ų | 40.9 | 27% | 0.265 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62.3 | -35.9 | 179 | -55.1 | 115.4 | 0 | 0 | 0 | 114.2 | L79 Y82 L137 N198 L203 A204 | L79-W200 HydrophobicContact CD1-CD2 3.86Å; L79-W200 HydrophobicContact CD1-CE3 3.9Å; L79-W200 HydrophobicContact CD1-CG 4.48Å; L79-W200 HydrophobicContact CD1-CH2 4.11Å; L79-W200 HydrophobicContact CD1-CZ2 4.08Å; L79-W200 HydrophobicContact CD1-CZ3 4.03Å; Y82-W200 HydrophobicContact CD2-CB 4.06Å; Y82-W200 HydrophobicContact CE1-CB 4.38Å; Y82-W200 HydrophobicContact CE2-CB 3.5Å; Y82-W200 HydrophobicContact CE2-CG 4.14Å; L137-W200 HydrophobicContact CD2-CE3 3.75Å; L137-W200 HydrophobicContact CD2-CZ3 4.19Å; N198-W200 PolarHBondContact O-N 3.31Å; W200-L203 HydrophobicContact CE3-CD2 4.08Å; W200-L203 HydrophobicContact CZ3-CD2 4.15Å; W200-L203 PolarHBondContact O-N 3.23Å; W200-A204 WeakPolarHBondContact O-CB 3.38Å; W200-A204 PolarHBondContact O-N 3.41Å |
| 201 | D | 84.4 | Confident | 80.8 | Confident | 8 Ų | 8 | 37.8 Ų | 37.8 | 4% | 0.043 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65 | -44.2 | 177 | -63.7 | -46.5 | 0 | 0 | 0 | 110.8 | Y82 I135 L197 N198 F199 A204 Y205 | Y82-D201 WeakPolarHBondContact CE1-OD1 3.41Å; Y82-D201 PolarHBondContact OH-OD1 2.97Å; Y82-D201 PolarHBondContact OH-OD2 3.39Å; I135-D201 HydrophobicContact CD1-CB 4.14Å; L197-D201 HydrophobicContact CD2-CB 4.26Å; N198-D201 WeakPolarHBondContact CB-OD2 3.34Å; N198-D201 PolarHBondContact N-OD2 3.5Å; N198-D201 PolarHBondContact ND2-OD2 3.49Å; N198-D201 PolarHBondContact O-N 3.49Å; N198-D201 VanDerWaalsContact O-N 3.12Å; F199-D201 PolarHBondContact O-N 2.73Å; D201-A204 PolarHBondContact O-N 3.45Å; D201-Y205 WeakPolarHBondContact O-CD2 3.2Å; D201-Y205 PolarHBondContact O-N 3.36Å |
| 202 | T | 84.7 | Confident | 81.5 | Confident | 9 Ų | 9 | 34.4 Ų | 34.4 | 6% | 0.055 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.2 | -44.1 | -179.8 | -57 | 0 | 0 | 0 | 0 | 110.9 | I184 N198 F199 A204 Y205 S206 | I184-T202 HydrophobicContact CB-CG2 3.63Å; I184-T202 HydrophobicContact CD1-CG2 3.39Å; I184-T202 HydrophobicContact CG1-CG2 4.07Å; I184-T202 HydrophobicContact CG2-CG2 3.31Å; N198-T202 PolarHBondContact O-N 2.99Å; N198-T202 PolarHBondContact O-OG1 3.43Å; F199-T202 PolarHBondContact O-N 3.05Å; T202-A204 VanDerWaalsContact C-N 3.35Å; T202-A204 PolarHBondContact O-N 3.36Å; T202-Y205 PolarHBondContact O-N 3.37Å; T202-S206 PolarHBondContact O-N 3.37Å; T202-S206 PolarHBondContact O-OG 3.41Å |
| 203 | L | 89.3 | Confident | 82.3 | Confident | 38 Ų | 38 | 29.1 Ų | 29.1 | 20% | 0.199 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60.6 | -45.7 | 176.7 | -178 | 61.6 | 0 | 0 | 0 | 111.1 | L137 N181 F199 W200 Y205 S206 G207 | L137-L203 HydrophobicContact CD1-CB 4.4Å; L137-L203 HydrophobicContact CD1-CD2 4.05Å; L137-L203 HydrophobicContact CD1-CG 3.97Å; N181-L203 VanDerWaalsContact ND2-CD1 3.29Å; N181-L203 WeakPolarHBondContact ND2-CD1 3.46Å; N181-L203 VanDerWaalsContact OD1-CA 3.24Å; N181-L203 WeakPolarHBondContact OD1-CA 3.45Å; N181-L203 PolarHBondContact OD1-N 3.06Å; F199-L203 HydrophobicContact CE1-CD2 4.19Å; F199-L203 PolarHBondContact O-N 3.48Å; W200-L203 HydrophobicContact CE3-CD2 4.08Å; W200-L203 HydrophobicContact CZ3-CD2 4.15Å; W200-L203 PolarHBondContact O-N 3.23Å; L203-Y205 PolarHBondContact O-N 3.5Å; L203-S206 PolarHBondContact O-N 3.44Å; L203-S206 PolarHBondContact O-OG 3.49Å; L203-G207 PolarHBondContact O-N 2.96Å |
| 204 | A | 89.8 | Confident | 83.6 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -58.5 | -49.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | I135 D136 L137 P140 W200 D201 T202 S206 G207 Y208 | I135-A204 HydrophobicContact CG2-CB 3.41Å; I135-A204 VanDerWaalsContact CG2-CB 3.41Å; D136-A204 VanDerWaalsContact O-CB 3.29Å; D136-A204 WeakPolarHBondContact O-CB 3.35Å; L137-A204 HydrophobicContact CD1-CB 4.08Å; P140-A204 HydrophobicContact CG-CB 4.29Å; P140-A204 WeakPolarHBondContact CG-O 3.26Å; W200-A204 WeakPolarHBondContact O-CB 3.38Å; W200-A204 PolarHBondContact O-N 3.41Å; D201-A204 PolarHBondContact O-N 3.45Å; T202-A204 VanDerWaalsContact C-N 3.35Å; T202-A204 PolarHBondContact O-N 3.36Å; A204-S206 VanDerWaalsContact C-N 3.32Å; A204-S206 PolarHBondContact O-N 3Å; A204-G207 PolarHBondContact O-N 3Å; A204-G207 VanDerWaalsContact O-N 3.11Å; A204-Y208 WeakPolarHBondContact O-CD2 3.3Å; A204-Y208 WeakPolarHBondContact O-CE2 3.46Å; A204-Y208 PolarHBondContact O-N 3.01Å |
| 205 | Y | 87.1 | Confident | 85.3 | Confident | 12 Ų | 12 | 29.1 Ų | 29.1 | 5% | 0.047 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -59.1 | -40.9 | 177.8 | -80 | -57.8 | 0 | 0 | 0 | 113.1 | I135 D201 T202 L203 G207 L243 S246 H250 L268 | I135-Y205 HydrophobicContact CD1-CD2 4.34Å; I135-Y205 HydrophobicContact CD1-CE2 3.4Å; I135-Y205 WeakPolarHBondContact CD1-OH 3.24Å; I135-Y205 HydrophobicContact CG1-CE2 4.12Å; D201-Y205 WeakPolarHBondContact O-CD2 3.2Å; D201-Y205 PolarHBondContact O-N 3.36Å; T202-Y205 PolarHBondContact O-N 3.37Å; L203-Y205 PolarHBondContact O-N 3.5Å; Y205-G207 VanDerWaalsContact C-N 3.26Å; Y205-G207 PolarHBondContact O-N 3.47Å; Y205-L243 HydrophobicContact CD1-CD2 3.61Å; Y205-L243 HydrophobicContact CE1-CD2 4.41Å; Y205-L243 HydrophobicContact CG-CD2 4.48Å; Y205-S246 PolarHBondContact OH-O 3.46Å; Y205-H250 WeakPolarHBondContact OH-CB 3.44Å; Y205-L268 HydrophobicContact CD2-CD2 4.38Å |
| 206 | S | 86.6 | Confident | 86.8 | Confident | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.007 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -66.5 | -25.7 | 178 | 70.6 | 0 | 0 | 0 | 0 | 113.4 | N181 T202 L203 A204 K209 | N181-S206 PolarHBondContact ND2-OG 3.42Å; T202-S206 PolarHBondContact O-N 3.37Å; T202-S206 PolarHBondContact O-OG 3.41Å; L203-S206 PolarHBondContact O-N 3.44Å; L203-S206 PolarHBondContact O-OG 3.49Å; A204-S206 VanDerWaalsContact C-N 3.32Å; A204-S206 PolarHBondContact O-N 3Å; S206-K209 WeakPolarHBondContact O-CD 3.46Å; S206-K209 VanDerWaalsContact O-CE 3.25Å; S206-K209 WeakPolarHBondContact O-CE 3.43Å; S206-K209 VanDerWaalsContact O-CG 3.3Å; S206-K209 WeakPolarHBondContact O-CG 3.29Å |
| 207 | G | 91.1 | Very high | 88.3 | Confident | 2 Ų | 2 | 19.8 Ų | 19.8 | 2% | 0.021 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -92.5 | -15.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | L203 A204 Y205 K209 Y210 | L203-G207 PolarHBondContact O-N 2.96Å; A204-G207 PolarHBondContact O-N 3Å; A204-G207 VanDerWaalsContact O-N 3.11Å; Y205-G207 VanDerWaalsContact C-N 3.26Å; Y205-G207 PolarHBondContact O-N 3.47Å; G207-K209 PolarHBondContact O-N 2.95Å; G207-K209 VanDerWaalsContact O-N 3.09Å; G207-Y210 VanDerWaalsContact O-CD2 3.22Å; G207-Y210 WeakPolarHBondContact O-CD2 3.39Å; G207-Y210 PolarHBondContact O-N 2.85Å; G207-Y210 VanDerWaalsContact O-N 3.16Å |
| 208 | Y | 92.1 | Very high | 89.6 | Confident | 3 Ų | 3 | 23.1 Ų | 23.1 | 1% | 0.012 | 11% | 0.112 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -23.3 | 176.7 | -74 | -74 | 0 | 0 | 0 | 113.2 | K93 V97 D136 I139 P140 A204 Y210 V211 I239 F242 L243 | K93-Y208 WeakPolarHBondContact CE-OH 3.42Å; V97-Y208 HydrophobicContact CG2-CD1 4.11Å; D136-Y208 PolarHBondContact N-OH 3.34Å; D136-Y208 PolarHBondContact O-OH 2.9Å; D136-Y208 PolarHBondContact OD2-OH 3.35Å; I139-Y208 HydrophobicContact CB-CE1 4.31Å; I139-Y208 HydrophobicContact CG2-CD1 4.37Å; I139-Y208 HydrophobicContact CG2-CE1 4.28Å; P140-Y208 HydrophobicContact CG-CD1 4.35Å; P140-Y208 HydrophobicContact CG-CD2 4.33Å; P140-Y208 HydrophobicContact CG-CE1 4.22Å; P140-Y208 HydrophobicContact CG-CE2 4.21Å; P140-Y208 HydrophobicContact CG-CG 4.41Å; A204-Y208 WeakPolarHBondContact O-CD2 3.3Å; A204-Y208 WeakPolarHBondContact O-CE2 3.46Å; A204-Y208 PolarHBondContact O-N 3.01Å; Y208-Y210 PolarHBondContact O-N 3.36Å; Y208-V211 WeakPolarHBondContact O-CB 3.43Å; Y208-V211 PolarHBondContact O-N 3.2Å; Y208-V211 VanDerWaalsContact O-N 3.1Å; Y208-I239 VanDerWaalsContact O-CD1 3.26Å; Y208-I239 WeakPolarHBondContact O-CD1 3.37Å; Y208-F242 AromaticContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CZ 4.42Å; Y208-F242 AromaticContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CE1-CE1 4.38Å; Y208-F242 HydrophobicContact CE1-CZ 4.41Å; Y208-F242 HydrophobicContact CE2-CE1 4.36Å; Y208-F242 AromaticContact CG-CE1 3.74Å; Y208-F242 HydrophobicContact CG-CE1 3.74Å; Y208-L243 HydrophobicContact CD2-CD2 4.24Å |
| 209 | K | 91.9 | Very high | 90.5 | Very high | 1 Ų | 1 | 22.7 Ų | 22.7 | 0% | 0.004 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -55.4 | -33.1 | 176.3 | 73.4 | -178.8 | 170.1 | -175.8 | 0 | 113 | E180 S206 G207 V211 G212 M213 I239 M279 | E180-K209 IonicContact OE1-NZ 2.64Å; E180-K209 PolarHBondContact OE1-NZ 3.32Å; E180-K209 IonicContact OE2-NZ 2.64Å; E180-K209 PolarHBondContact OE2-NZ 3.49Å; S206-K209 WeakPolarHBondContact O-CD 3.46Å; S206-K209 VanDerWaalsContact O-CE 3.25Å; S206-K209 WeakPolarHBondContact O-CE 3.43Å; S206-K209 VanDerWaalsContact O-CG 3.3Å; S206-K209 WeakPolarHBondContact O-CG 3.29Å; G207-K209 PolarHBondContact O-N 2.95Å; G207-K209 VanDerWaalsContact O-N 3.09Å; K209-V211 PolarHBondContact O-N 3.23Å; K209-G212 PolarHBondContact O-N 3.49Å; K209-M213 HydrophobicContact CG-CE 4.11Å; K209-M213 PolarHBondContact O-N 3.32Å; K209-I239 HydrophobicContact CB-CG2 4.42Å; K209-M279 HydrophobicContact CB-CE 3.41Å; K209-M279 VanDerWaalsContact CB-CE 3.41Å; K209-M279 HydrophobicContact CB-CG 4.39Å; K209-M279 WeakPolarHBondContact O-CE 3.38Å |
| 210 | Y | 94 | Very high | 90.9 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -63.9 | -27.9 | -178.3 | -65.1 | -80.2 | 0 | 0 | 0 | 111.9 | V144 Y147 I173 L177 G207 Y208 M213 I214 | V144-Y210 HydrophobicContact CG2-CD1 4.32Å; V144-Y210 HydrophobicContact CG2-CD2 3.47Å; V144-Y210 VanDerWaalsContact CG2-CD2 3.47Å; V144-Y210 HydrophobicContact CG2-CE1 4.48Å; V144-Y210 HydrophobicContact CG2-CE2 3.68Å; V144-Y210 HydrophobicContact CG2-CG 3.88Å; Y147-Y210 AromaticContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CE1 4.23Å; Y147-Y210 HydrophobicContact CE1-CD1 4.44Å; Y147-Y210 HydrophobicContact CG-CD1 4.04Å; I173-Y210 HydrophobicContact CG1-CE1 4.28Å; I173-Y210 HydrophobicContact CG2-CE1 3.76Å; L177-Y210 HydrophobicContact CD1-CE2 4.46Å; L177-Y210 HydrophobicContact CD2-CE2 3.74Å; L177-Y210 HydrophobicContact CG-CE2 4.25Å; G207-Y210 VanDerWaalsContact O-CD2 3.22Å; G207-Y210 WeakPolarHBondContact O-CD2 3.39Å; G207-Y210 PolarHBondContact O-N 2.85Å; G207-Y210 VanDerWaalsContact O-N 3.16Å; Y208-Y210 PolarHBondContact O-N 3.36Å; Y210-M213 HydrophobicContact CD1-CE 3.05Å; Y210-M213 HydrophobicContact CE1-CE 3.32Å; Y210-M213 HydrophobicContact CG-CE 3.71Å; Y210-M213 PolarHBondContact O-N 2.54Å; Y210-I214 WeakPolarHBondContact O-CD1 3.49Å; Y210-I214 VanDerWaalsContact O-CG1 3.25Å; Y210-I214 WeakPolarHBondContact O-CG1 3.1Å; Y210-I214 PolarHBondContact O-N 3.35Å |
| 211 | V | 94.9 | Very high | 91.1 | Very high | 9 Ų | 9 | 19.4 Ų | 19.4 | 6% | 0.055 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -60.9 | -47.8 | 175 | -178.8 | 0 | 0 | 0 | 0 | 111.3 | L94 V97 L98 I139 A143 Y208 K209 M213 I214 M215 | L94-V211 HydrophobicContact CD2-CG1 3.66Å; L94-V211 HydrophobicContact CD2-CG2 4.11Å; V97-V211 HydrophobicContact CG1-CB 3.95Å; V97-V211 HydrophobicContact CG1-CG1 3.83Å; V97-V211 HydrophobicContact CG1-CG2 4.46Å; L98-V211 HydrophobicContact CD2-CG1 4.06Å; L98-V211 HydrophobicContact CG-CG1 4.34Å; I139-V211 HydrophobicContact CG2-CG2 3.92Å; A143-V211 HydrophobicContact CB-CG2 3.76Å; Y208-V211 WeakPolarHBondContact O-CB 3.43Å; Y208-V211 PolarHBondContact O-N 3.2Å; Y208-V211 VanDerWaalsContact O-N 3.1Å; K209-V211 PolarHBondContact O-N 3.23Å; V211-M213 VanDerWaalsContact C-N 3.33Å; V211-M213 PolarHBondContact O-N 2.67Å; V211-I214 PolarHBondContact O-N 3.24Å; V211-M215 PolarHBondContact O-N 2.68Å |
| 212 | G | 93.2 | Very high | 91.5 | Very high | 1 Ų | 1 | 25.3 Ų | 25.3 | 1% | 0.01 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -65.9 | -36 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | K209 M215 S216 | K209-G212 PolarHBondContact O-N 3.49Å; G212-M215 PolarHBondContact O-N 2.93Å; G212-S216 PolarHBondContact O-N 3.44Å; G212-S216 PolarHBondContact O-OG 2.86Å |
| 213 | M | 92.4 | Very high | 91.8 | Very high | 5 Ų | 5 | 27 Ų | 27 | 3% | 0.025 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -68.1 | -38.8 | 177.1 | -64.9 | -168.4 | -63.2 | 0 | 0 | 112.4 | Y147 K209 Y210 V211 S216 L217 M279 L282 | Y147-M213 HydrophobicContact CD2-CB 3.85Å; Y147-M213 HydrophobicContact CE2-CB 3.65Å; K209-M213 HydrophobicContact CG-CE 4.11Å; K209-M213 PolarHBondContact O-N 3.32Å; Y210-M213 HydrophobicContact CD1-CE 3.05Å; Y210-M213 HydrophobicContact CE1-CE 3.32Å; Y210-M213 HydrophobicContact CG-CE 3.71Å; Y210-M213 PolarHBondContact O-N 2.54Å; V211-M213 VanDerWaalsContact C-N 3.33Å; V211-M213 PolarHBondContact O-N 2.67Å; M213-S216 PolarHBondContact O-N 2.89Å; M213-L217 WeakPolarHBondContact O-CG 3.29Å; M213-L217 PolarHBondContact O-N 2.92Å; M213-M279 HydrophobicContact CG-CE 4.3Å; M213-M279 HydrophobicContact CG-CG 4.34Å; M213-M279 HydrophobicContact SD-CG 4.34Å; M213-L282 HydrophobicContact CE-CD2 4.44Å; M213-L282 HydrophobicContact SD-CD2 4Å |
| 214 | I | 94.2 | Very high | 91.7 | Very high | 18 Ų | 18 | 26.7 Ų | 26.7 | 9% | 0.092 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.1 | -49.6 | 172.8 | -68 | 157.2 | 0 | 0 | 0 | 110.4 | A143 T146 Y147 Y210 V211 S216 L217 L218 | A143-I214 HydrophobicContact CB-CD1 4.14Å; A143-I214 WeakPolarHBondContact O-CD1 3.3Å; T146-I214 HydrophobicContact CG2-CD1 3.79Å; T146-I214 HydrophobicContact CG2-CG1 4.25Å; T146-I214 HydrophobicContact CG2-CG2 4.21Å; Y147-I214 HydrophobicContact CD2-CG1 4.25Å; Y210-I214 WeakPolarHBondContact O-CD1 3.49Å; Y210-I214 VanDerWaalsContact O-CG1 3.25Å; Y210-I214 WeakPolarHBondContact O-CG1 3.1Å; Y210-I214 PolarHBondContact O-N 3.35Å; V211-I214 PolarHBondContact O-N 3.24Å; I214-S216 PolarHBondContact O-N 3.06Å; I214-L217 WeakPolarHBondContact O-CB 3.36Å; I214-L217 PolarHBondContact O-N 3.39Å; I214-L218 HydrophobicContact CG2-CD1 4.05Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.77Å |
| 215 | M | 94.3 | Very high | 91.4 | Very high | 68 Ų | 68 | 28.9 Ų | 28.9 | 34% | 0.335 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -58.7 | -39.9 | 179.6 | -71.7 | -54.9 | -62.7 | 0 | 0 | 112.2 | L98 V211 G212 L218 V219 | L98-M215 HydrophobicContact CD1-CE 4.28Å; L98-M215 HydrophobicContact CD1-CG 3.69Å; L98-M215 HydrophobicContact CD1-SD 3.92Å; L98-M215 HydrophobicContact CD2-CB 4.26Å; L98-M215 HydrophobicContact CD2-CG 3.46Å; L98-M215 VanDerWaalsContact CD2-CG 3.46Å; L98-M215 HydrophobicContact CG-CG 4.22Å; V211-M215 PolarHBondContact O-N 2.68Å; G212-M215 PolarHBondContact O-N 2.93Å; M215-L218 PolarHBondContact O-N 3.13Å; M215-L218 HydrophobicContact SD-CD1 4.2Å; M215-V219 WeakPolarHBondContact O-CG2 3.13Å; M215-V219 PolarHBondContact O-N 3.21Å |
| 216 | S | 92.7 | Very high | 91.3 | Very high | 3 Ų | 3 | 32.5 Ų | 32.5 | 2% | 0.021 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.4 | -45.4 | 175.2 | -54.2 | 0 | 0 | 0 | 0 | 111.1 | G212 M213 I214 L218 V219 Y220 Y228 L232 | G212-S216 PolarHBondContact O-N 3.44Å; G212-S216 PolarHBondContact O-OG 2.86Å; M213-S216 PolarHBondContact O-N 2.89Å; I214-S216 PolarHBondContact O-N 3.06Å; S216-L218 PolarHBondContact O-N 3.13Å; S216-V219 PolarHBondContact O-N 2.73Å; S216-Y220 PolarHBondContact O-N 3.18Å; S216-Y228 VanDerWaalsContact O-CD2 3.3Å; S216-Y228 WeakPolarHBondContact O-CD2 3.37Å; S216-L232 WeakPolarHBondContact OG-CA 3.41Å |
| 217 | L | 91.8 | Very high | 91.5 | Very high | 6 Ų | 6 | 36.6 Ų | 36.6 | 3% | 0.031 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.1 | -37 | 176.3 | -69.2 | -179.5 | 0 | 0 | 0 | 113.3 | Y147 T150 S151 V154 M213 I214 Y220 L221 Y228 | Y147-L217 HydrophobicContact CD2-CD1 3.75Å; Y147-L217 HydrophobicContact CE2-CD1 3.47Å; Y147-L217 VanDerWaalsContact CE2-CD1 3.47Å; Y147-L217 HydrophobicContact CE2-CG 4.23Å; T150-L217 HydrophobicContact CG2-CB 3.81Å; T150-L217 HydrophobicContact CG2-CD1 4.15Å; S151-L217 WeakPolarHBondContact OG-CD1 3.33Å; V154-L217 HydrophobicContact CG2-CB 4.45Å; V154-L217 HydrophobicContact CG2-CD2 4.41Å; M213-L217 WeakPolarHBondContact O-CG 3.29Å; M213-L217 PolarHBondContact O-N 2.92Å; I214-L217 WeakPolarHBondContact O-CB 3.36Å; I214-L217 PolarHBondContact O-N 3.39Å; L217-Y220 WeakPolarHBondContact O-CB 3.45Å; L217-Y220 PolarHBondContact O-N 3.1Å; L217-L221 WeakPolarHBondContact O-CG 3.48Å; L217-L221 PolarHBondContact O-N 3.16Å; L217-L221 VanDerWaalsContact O-N 3.09Å; L217-Y228 HydrophobicContact CD2-CE2 4.16Å |
| 218 | L | 94.1 | Very high | 91.4 | Very high | 74 Ų | 74 | 36.9 Ų | 36.9 | 39% | 0.387 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -65.5 | -41.1 | 175.2 | -67.2 | 177.6 | 0 | 0 | 0 | 111.4 | T150 I214 M215 S216 Y220 L221 V222 | T150-L218 HydrophobicContact CG2-CD2 4.04Å; I214-L218 HydrophobicContact CG2-CD1 4.05Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.77Å; M215-L218 PolarHBondContact O-N 3.13Å; M215-L218 HydrophobicContact SD-CD1 4.2Å; S216-L218 PolarHBondContact O-N 3.13Å; L218-Y220 VanDerWaalsContact C-N 3.3Å; L218-Y220 PolarHBondContact O-N 3.02Å; L218-L221 HydrophobicContact CD2-CD1 4.47Å; L218-L221 PolarHBondContact O-N 2.75Å; L218-V222 PolarHBondContact O-N 3.27Å |
| 219 | V | 93.1 | Very high | 91.2 | Very high | 41 Ų | 41 | 40.7 Ų | 40.7 | 25% | 0.248 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.7 | -38 | 173.6 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | M215 S216 L221 V222 A223 L227 C231 | M215-V219 WeakPolarHBondContact O-CG2 3.13Å; M215-V219 PolarHBondContact O-N 3.21Å; S216-V219 PolarHBondContact O-N 2.73Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 3.18Å; V219-V222 PolarHBondContact O-N 3.43Å; V219-A223 HydrophobicContact CG1-CB 4.29Å; V219-A223 WeakPolarHBondContact O-CA 3.5Å; V219-A223 WeakPolarHBondContact O-CB 3.42Å; V219-A223 PolarHBondContact O-N 2.9Å; V219-L227 HydrophobicContact CG1-CB 3.8Å; V219-C231 HydrophobicContact CB-CB 4.17Å; V219-C231 HydrophobicContact CG1-CB 4.06Å; V219-C231 HydrophobicContact CG2-CB 4.23Å |
| 220 | Y | 91.4 | Very high | 91.2 | Very high | 51 Ų | 51 | 48.8 Ų | 48.8 | 20% | 0.2 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -58 | -43.4 | 173.8 | 173.1 | -97.6 | 0 | 0 | 0 | 112.2 | V154 Q158 S216 L217 L218 V222 G224 Y228 M287 | V154-Y220 HydrophobicContact CG1-CD1 3.94Å; V154-Y220 HydrophobicContact CG1-CE1 3.67Å; V154-Y220 HydrophobicContact CG2-CD1 4.27Å; Q158-Y220 PolarHBondContact NE2-OH 2.94Å; S216-Y220 PolarHBondContact O-N 3.18Å; L217-Y220 WeakPolarHBondContact O-CB 3.45Å; L217-Y220 PolarHBondContact O-N 3.1Å; L218-Y220 VanDerWaalsContact C-N 3.3Å; L218-Y220 PolarHBondContact O-N 3.02Å; Y220-V222 VanDerWaalsContact C-N 3.34Å; Y220-V222 PolarHBondContact O-N 3.36Å; Y220-G224 WeakPolarHBondContact O-CA 3.34Å; Y220-G224 PolarHBondContact O-N 3.46Å; Y220-Y228 HydrophobicContact CD2-CG 4.38Å; Y220-M287 HydrophobicContact CE2-CE 4.27Å |
| 221 | L | 90.6 | Very high | 91.1 | Very high | 58 Ų | 58 | 49.9 Ų | 49.9 | 30% | 0.304 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64.3 | -36.4 | 179.1 | -71.2 | 175.4 | 0 | 0 | 0 | 113.1 | L153 V154 V157 L217 L218 V219 | L153-L221 HydrophobicContact CD2-CD1 3.88Å; L153-L221 HydrophobicContact CG-CD1 4.31Å; V154-L221 HydrophobicContact CB-CD2 4.43Å; V154-L221 HydrophobicContact CG2-CD1 4.17Å; V154-L221 HydrophobicContact CG2-CD2 3.7Å; V154-L221 HydrophobicContact CG2-CG 3.87Å; V157-L221 HydrophobicContact CB-CD2 4.3Å; V157-L221 HydrophobicContact CG1-CD2 4.43Å; V157-L221 HydrophobicContact CG2-CD2 4.09Å; L217-L221 WeakPolarHBondContact O-CG 3.48Å; L217-L221 PolarHBondContact O-N 3.16Å; L217-L221 VanDerWaalsContact O-N 3.09Å; L218-L221 HydrophobicContact CD2-CD1 4.47Å; L218-L221 PolarHBondContact O-N 2.75Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 3.18Å |
| 222 | V | 93 | Very high | 90.8 | Very high | 131 Ų | 131 | 49.7 Ų | 49.7 | 79% | 0.794 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -89 | -38 | -175.4 | 177.6 | 0 | 0 | 0 | 0 | 112.2 | L218 V219 Y220 | L218-V222 PolarHBondContact O-N 3.27Å; V219-V222 PolarHBondContact O-N 3.43Å; Y220-V222 VanDerWaalsContact C-N 3.34Å; Y220-V222 PolarHBondContact O-N 3.36Å |
| 223 | A | 89.8 | Confident | 90.7 | Very high | 46 Ų | 46 | 55.7 Ų | 55.7 | 38% | 0.38 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -129.5 | 3.6 | -160.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | V219 L227 | V219-A223 HydrophobicContact CG1-CB 4.29Å; V219-A223 WeakPolarHBondContact O-CA 3.5Å; V219-A223 WeakPolarHBondContact O-CB 3.42Å; V219-A223 PolarHBondContact O-N 2.9Å; A223-L227 HydrophobicContact CB-CB 4Å; A223-L227 HydrophobicContact CB-CD1 3.34Å; A223-L227 HydrophobicContact CB-CG 4.29Å |
| 224 | G | 87.8 | Confident | 90.7 | Very high | 30 Ų | 30 | 59.4 Ų | 59.4 | 31% | 0.309 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | 80.9 | -172.8 | 171.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | Y220 S226 Y228 | Y220-G224 WeakPolarHBondContact O-CA 3.34Å; Y220-G224 PolarHBondContact O-N 3.46Å; G224-S226 PolarHBondContact O-N 3.22Å; G224-Y228 PolarHBondContact O-N 3.24Å |
| 225 | S | 83 | Confident | 90.7 | Very high | 47 Ų | 47 | 58.8 Ų | 58.8 | 33% | 0.329 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -69.5 | -29 | -169.6 | -166.8 | 0 | 0 | 0 | 0 | 114.5 | Y228 F229 | S225-Y228 WeakPolarHBondContact O-CB 3.45Å; S225-F229 WeakPolarHBondContact O-CD2 3.34Å |
| 226 | S | 86.2 | Confident | 90.5 | Very high | 87 Ų | 87 | 55.9 Ų | 55.9 | 61% | 0.608 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -69.7 | -48.4 | -177.8 | -54.3 | 0 | 0 | 0 | 0 | 111.2 | G224 Y228 F229 Y230 | G224-S226 PolarHBondContact O-N 3.22Å; S226-Y228 VanDerWaalsContact C-N 3.26Å; S226-Y228 PolarHBondContact O-N 3.34Å; S226-F229 PolarHBondContact O-N 3.09Å; S226-Y230 WeakPolarHBondContact O-CD2 3.33Å |
| 227 | L | 89.5 | Confident | 90.5 | Very high | 88 Ų | 88 | 59.6 Ų | 59.6 | 46% | 0.461 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -70.7 | -23.4 | 179.5 | -74.1 | 170.5 | 0 | 0 | 0 | 112.9 | V219 A223 Y230 C231 | V219-L227 HydrophobicContact CG1-CB 3.8Å; A223-L227 HydrophobicContact CB-CB 4Å; A223-L227 HydrophobicContact CB-CD1 3.34Å; A223-L227 HydrophobicContact CB-CG 4.29Å; L227-Y230 HydrophobicContact CD2-CD2 4.3Å; L227-Y230 PolarHBondContact O-N 3.2Å; L227-C231 VanDerWaalsContact O-CB 3.23Å; L227-C231 WeakPolarHBondContact O-CB 3.42Å; L227-C231 PolarHBondContact O-N 3.3Å |
| 228 | Y | 88.5 | Confident | 90.5 | Very high | 7 Ų | 7 | 59.4 Ų | 59.4 | 3% | 0.027 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -55.2 | -50.9 | 169.5 | 173.6 | -108.3 | 0 | 0 | 0 | 112.6 | S216 L217 Y220 G224 S225 S226 Y230 C231 L232 T283 | S216-Y228 VanDerWaalsContact O-CD2 3.3Å; S216-Y228 WeakPolarHBondContact O-CD2 3.37Å; L217-Y228 HydrophobicContact CD2-CE2 4.16Å; Y220-Y228 HydrophobicContact CD2-CG 4.38Å; G224-Y228 PolarHBondContact O-N 3.24Å; S225-Y228 WeakPolarHBondContact O-CB 3.45Å; S226-Y228 VanDerWaalsContact C-N 3.26Å; S226-Y228 PolarHBondContact O-N 3.34Å; Y228-Y230 PolarHBondContact O-N 3.28Å; Y228-C231 PolarHBondContact O-N 3.16Å; Y228-L232 HydrophobicContact CE1-CD1 4.26Å; Y228-L232 WeakPolarHBondContact O-CB 3.47Å; Y228-L232 PolarHBondContact O-N 3.15Å; Y228-T283 HydrophobicContact CE1-CG2 3.61Å; Y228-T283 WeakPolarHBondContact OH-CG2 3.37Å |
| 229 | F | 89 | Confident | 90.3 | Very high | 84 Ų | 84 | 55.9 Ų | 55.9 | 37% | 0.368 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -66.6 | -39.1 | -178 | -67.9 | -68.4 | 0 | 0 | 0 | 112.3 | S225 S226 L232 F233 W280 | S225-F229 WeakPolarHBondContact O-CD2 3.34Å; S226-F229 PolarHBondContact O-N 3.09Å; F229-L232 PolarHBondContact O-N 3.17Å; F229-F233 WeakPolarHBondContact O-CB 3.13Å; F229-F233 PolarHBondContact O-N 3.49Å; F229-W280 HydrophobicContact CD1-CZ3 4.44Å |
| 230 | Y | 91.5 | Very high | 90.2 | Very high | 171 Ų | 171 | 54.6 Ų | 54.6 | 67% | 0.671 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -63.9 | -44.2 | 174.2 | -68.3 | -64.7 | 0 | 0 | 0 | 112.1 | S226 L227 Y228 F233 Y234 | S226-Y230 WeakPolarHBondContact O-CD2 3.33Å; L227-Y230 HydrophobicContact CD2-CD2 4.3Å; L227-Y230 PolarHBondContact O-N 3.2Å; Y228-Y230 PolarHBondContact O-N 3.28Å; Y230-F233 PolarHBondContact O-N 3.26Å; Y230-Y234 PolarHBondContact O-N 3.25Å |
| 231 | C | 91.1 | Very high | 90.1 | Very high | 22 Ų | 22 | 56.5 Ų | 56.5 | 15% | 0.149 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.7 | -43.3 | 177.7 | -174.1 | 0 | 0 | 0 | 0 | 111.3 | V219 L227 Y228 F233 Y234 C235 | V219-C231 HydrophobicContact CB-CB 4.17Å; V219-C231 HydrophobicContact CG1-CB 4.06Å; V219-C231 HydrophobicContact CG2-CB 4.23Å; L227-C231 VanDerWaalsContact O-CB 3.23Å; L227-C231 WeakPolarHBondContact O-CB 3.42Å; L227-C231 PolarHBondContact O-N 3.3Å; Y228-C231 PolarHBondContact O-N 3.16Å; C231-F233 PolarHBondContact O-N 3.38Å; C231-Y234 PolarHBondContact O-N 3.43Å; C231-C235 VanDerWaalsContact O-CB 3.32Å; C231-C235 WeakPolarHBondContact O-CB 3.34Å; C231-C235 PolarHBondContact O-N 2.98Å; C231-C235 PolarHBondContact O-SG 3.35Å; C231-C235 VanDerWaalsContact O-SG 3.41Å |
| 232 | L | 89.9 | Confident | 90 | Very high | 5 Ų | 5 | 53.7 Ų | 53.7 | 3% | 0.026 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60 | -47.1 | 176.2 | -176.8 | 157.7 | 0 | 0 | 0 | 111.6 | S216 Y228 F229 Y234 C235 S236 W280 T283 | S216-L232 WeakPolarHBondContact OG-CA 3.41Å; Y228-L232 HydrophobicContact CE1-CD1 4.26Å; Y228-L232 WeakPolarHBondContact O-CB 3.47Å; Y228-L232 PolarHBondContact O-N 3.15Å; F229-L232 PolarHBondContact O-N 3.17Å; L232-Y234 VanDerWaalsContact C-N 3.34Å; L232-Y234 PolarHBondContact O-N 3.47Å; L232-C235 PolarHBondContact O-N 3.47Å; L232-S236 WeakPolarHBondContact O-CB 3.35Å; L232-S236 PolarHBondContact O-N 3.21Å; L232-S236 PolarHBondContact O-OG 3.13Å; L232-W280 HydrophobicContact CD2-CE3 3.94Å; L232-W280 HydrophobicContact CD2-CZ3 4.48Å; L232-T283 HydrophobicContact CD1-CG2 3.28Å; L232-T283 VanDerWaalsContact CD1-OG1 3.27Å; L232-T283 WeakPolarHBondContact CD1-OG1 3.38Å |
| 233 | F | 90.9 | Very high | 89.7 | Confident | 127 Ų | 127 | 47.8 Ų | 47.8 | 56% | 0.557 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -58 | -49.1 | 177.6 | -178.3 | -103.8 | 0 | 0 | 0 | 110.8 | F229 Y230 C231 C235 S236 L237 | F229-F233 WeakPolarHBondContact O-CB 3.13Å; F229-F233 PolarHBondContact O-N 3.49Å; Y230-F233 PolarHBondContact O-N 3.26Å; C231-F233 PolarHBondContact O-N 3.38Å; F233-C235 PolarHBondContact O-N 3.25Å; F233-S236 PolarHBondContact O-N 3.4Å; F233-S236 PolarHBondContact O-OG 3.12Å; F233-L237 HydrophobicContact CD1-CD1 4.12Å; F233-L237 HydrophobicContact CE1-CD1 3.53Å; F233-L237 HydrophobicContact CE1-CG 4.47Å; F233-L237 HydrophobicContact CE2-CD1 4.44Å; F233-L237 HydrophobicContact CZ-CD1 3.72Å; F233-L237 HydrophobicContact CZ-CG 4.41Å; F233-L237 PolarHBondContact O-N 3Å |
| 234 | Y | 93.3 | Very high | 89.5 | Confident | 83 Ų | 83 | 47.1 Ų | 47.1 | 33% | 0.325 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -57.8 | -50.5 | 175 | 172.5 | -92.7 | 0 | 0 | 0 | 112.5 | L98 F99 F101 Y230 C231 L232 S236 L237 A238 | L98-Y234 WeakPolarHBondContact O-CE1 3.21Å; L98-Y234 PolarHBondContact O-OH 3.29Å; F99-Y234 VanDerWaalsContact CD1-OH 3.3Å; F99-Y234 WeakPolarHBondContact CD1-OH 3.5Å; F101-Y234 HydrophobicContact CE2-CE2 4.48Å; Y230-Y234 PolarHBondContact O-N 3.25Å; C231-Y234 PolarHBondContact O-N 3.43Å; L232-Y234 VanDerWaalsContact C-N 3.34Å; L232-Y234 PolarHBondContact O-N 3.47Å; Y234-S236 VanDerWaalsContact C-N 3.28Å; Y234-S236 PolarHBondContact O-N 2.53Å; Y234-L237 PolarHBondContact O-N 2.95Å; Y234-A238 HydrophobicContact CE1-CB 4.3Å; Y234-A238 WeakPolarHBondContact O-CB 3.46Å; Y234-A238 PolarHBondContact O-N 3.42Å |
| 235 | C | 92.7 | Very high | 89.3 | Confident | 5 Ų | 5 | 48.6 Ų | 48.6 | 3% | 0.034 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.8 | -35.4 | -179.5 | -77.9 | 0 | 0 | 0 | 0 | 112.2 | C231 L232 F233 A238 I239 | C231-C235 VanDerWaalsContact O-CB 3.32Å; C231-C235 WeakPolarHBondContact O-CB 3.34Å; C231-C235 PolarHBondContact O-N 2.98Å; C231-C235 PolarHBondContact O-SG 3.35Å; C231-C235 VanDerWaalsContact O-SG 3.41Å; L232-C235 PolarHBondContact O-N 3.47Å; F233-C235 PolarHBondContact O-N 3.25Å; C235-A238 PolarHBondContact O-N 2.97Å; C235-I239 WeakPolarHBondContact O-CB 3.27Å; C235-I239 VanDerWaalsContact O-CG1 3.25Å; C235-I239 WeakPolarHBondContact O-CG1 3.36Å; C235-I239 PolarHBondContact O-N 3.43Å |
| 236 | S | 91.5 | Very high | 89.2 | Confident | 8 Ų | 8 | 46.5 Ų | 46.5 | 6% | 0.056 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -66.1 | -41.9 | 177 | 76.5 | 0 | 0 | 0 | 0 | 112.3 | L232 F233 Y234 S240 | L232-S236 WeakPolarHBondContact O-CB 3.35Å; L232-S236 PolarHBondContact O-N 3.21Å; L232-S236 PolarHBondContact O-OG 3.13Å; F233-S236 PolarHBondContact O-N 3.4Å; F233-S236 PolarHBondContact O-OG 3.12Å; Y234-S236 VanDerWaalsContact C-N 3.28Å; Y234-S236 PolarHBondContact O-N 2.53Å; S236-S240 WeakPolarHBondContact O-CB 3.35Å; S236-S240 PolarHBondContact O-N 3.28Å; S236-S240 VanDerWaalsContact O-N 3.08Å; S236-S240 PolarHBondContact O-OG 2.82Å |
| 237 | L | 91 | Very high | 88.7 | Confident | 81 Ų | 81 | 42.5 Ų | 42.5 | 42% | 0.424 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -68.5 | -42.7 | 174.5 | -67.4 | 178.7 | 0 | 0 | 0 | 111.4 | F233 Y234 S240 F241 | F233-L237 HydrophobicContact CD1-CD1 4.12Å; F233-L237 HydrophobicContact CE1-CD1 3.53Å; F233-L237 HydrophobicContact CE1-CG 4.47Å; F233-L237 HydrophobicContact CE2-CD1 4.44Å; F233-L237 HydrophobicContact CZ-CD1 3.72Å; F233-L237 HydrophobicContact CZ-CG 4.41Å; F233-L237 PolarHBondContact O-N 3Å; Y234-L237 PolarHBondContact O-N 2.95Å; L237-S240 PolarHBondContact O-N 2.95Å; L237-F241 WeakPolarHBondContact O-CB 3.46Å; L237-F241 PolarHBondContact O-N 3.21Å |
| 238 | A | 92.1 | Very high | 88.1 | Confident | 1 Ų | 1 | 45.3 Ų | 45.3 | 1% | 0.008 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60 | -49.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | P100 Y234 C235 S240 F241 F242 | P100-A238 HydrophobicContact CG-CB 4Å; P100-A238 WeakPolarHBondContact CG-O 3.49Å; Y234-A238 HydrophobicContact CE1-CB 4.3Å; Y234-A238 WeakPolarHBondContact O-CB 3.46Å; Y234-A238 PolarHBondContact O-N 3.42Å; C235-A238 PolarHBondContact O-N 2.97Å; A238-S240 PolarHBondContact O-N 3.27Å; A238-F241 PolarHBondContact O-N 3.1Å; A238-F242 VanDerWaalsContact O-CB 3.29Å; A238-F242 WeakPolarHBondContact O-CB 3.38Å; A238-F242 PolarHBondContact O-N 2.9Å |
| 239 | I | 91 | Very high | 87.6 | Confident | 1 Ų | 1 | 47.7 Ų | 47.7 | 1% | 0.005 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.5 | -44.3 | 177.7 | -71.9 | -73.8 | 0 | 0 | 0 | 111.3 | V97 Y208 K209 C235 F241 F242 L243 M279 | V97-I239 HydrophobicContact CG1-CD1 3.38Å; Y208-I239 VanDerWaalsContact O-CD1 3.26Å; Y208-I239 WeakPolarHBondContact O-CD1 3.37Å; K209-I239 HydrophobicContact CB-CG2 4.42Å; C235-I239 WeakPolarHBondContact O-CB 3.27Å; C235-I239 VanDerWaalsContact O-CG1 3.25Å; C235-I239 WeakPolarHBondContact O-CG1 3.36Å; C235-I239 PolarHBondContact O-N 3.43Å; I239-F241 PolarHBondContact O-N 2.93Å; I239-F242 PolarHBondContact O-N 3.4Å; I239-L243 HydrophobicContact CG2-CD1 3.68Å; I239-L243 HydrophobicContact CG2-CG 4.2Å; I239-L243 WeakPolarHBondContact O-CB 3.34Å; I239-L243 VanDerWaalsContact O-CG 3.24Å; I239-L243 WeakPolarHBondContact O-CG 3.5Å; I239-L243 PolarHBondContact O-N 3.13Å; I239-M279 HydrophobicContact CB-CE 3.98Å; I239-M279 HydrophobicContact CG1-CE 3.69Å; I239-M279 HydrophobicContact CG2-CE 4.05Å |
| 240 | S | 90 | Very high | 86.9 | Confident | 13 Ų | 13 | 45.8 Ų | 45.8 | 9% | 0.091 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61 | -45.9 | 178.5 | -57.2 | 0 | 0 | 0 | 0 | 111.6 | S236 L237 A238 L243 A244 S272 P276 | S236-S240 WeakPolarHBondContact O-CB 3.35Å; S236-S240 PolarHBondContact O-N 3.28Å; S236-S240 VanDerWaalsContact O-N 3.08Å; S236-S240 PolarHBondContact O-OG 2.82Å; L237-S240 PolarHBondContact O-N 2.95Å; A238-S240 PolarHBondContact O-N 3.27Å; S240-L243 PolarHBondContact O-N 2.88Å; S240-A244 WeakPolarHBondContact O-CB 3.39Å; S240-A244 PolarHBondContact O-N 3.49Å; S240-S272 PolarHBondContact O-OG 3.17Å; S240-S272 PolarHBondContact OG-O 3.24Å; S240-P276 WeakPolarHBondContact OG-CD 3.04Å; S240-P276 WeakPolarHBondContact OG-CG 3.3Å |
| 241 | F | 88.7 | Confident | 85.9 | Confident | 91 Ų | 91 | 38.1 Ų | 38.1 | 40% | 0.399 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -67.2 | -40 | 178.6 | -178.8 | -93.9 | 0 | 0 | 0 | 112 | P100 F101 L237 A238 I239 R245 | P100-F241 HydrophobicContact CB-CD1 3.68Å; P100-F241 HydrophobicContact CB-CE1 4.18Å; P100-F241 HydrophobicContact CG-CD1 3.78Å; F101-F241 AromaticContact CD1-CD1 3.99Å; F101-F241 HydrophobicContact CD1-CD1 3.99Å; F101-F241 AromaticContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CG 4.34Å; F101-F241 HydrophobicContact CD1-CZ 4.3Å; F101-F241 HydrophobicContact CE1-CB 4.1Å; F101-F241 AromaticContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD2 4Å; F101-F241 HydrophobicContact CE1-CE1 4.14Å; F101-F241 HydrophobicContact CE1-CE2 4.36Å; F101-F241 AromaticContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CZ 4.43Å; F101-F241 HydrophobicContact CZ-CB 4.29Å; F101-F241 HydrophobicContact CZ-CG 4.34Å; L237-F241 WeakPolarHBondContact O-CB 3.46Å; L237-F241 PolarHBondContact O-N 3.21Å; A238-F241 PolarHBondContact O-N 3.1Å; I239-F241 PolarHBondContact O-N 2.93Å; F241-R245 WeakPolarHBondContact O-CB 3.43Å; F241-R245 PolarHBondContact O-N 3.41Å |
| 242 | F | 89.2 | Confident | 84.8 | Confident | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -57.9 | -52.1 | 173.7 | 164.4 | -113.2 | 0 | 0 | 0 | 111.7 | L96 V97 P100 Y208 A238 I239 A244 R245 S246 | L96-F242 HydrophobicContact CD2-CD2 3.05Å; L96-F242 HydrophobicContact CD2-CE2 3.15Å; L96-F242 HydrophobicContact CD2-CG 4.23Å; L96-F242 HydrophobicContact CD2-CZ 4.39Å; V97-F242 HydrophobicContact CG2-CD1 3.98Å; V97-F242 HydrophobicContact CG2-CD2 4.41Å; V97-F242 HydrophobicContact CG2-CE1 3.67Å; V97-F242 HydrophobicContact CG2-CE2 4.1Å; V97-F242 HydrophobicContact CG2-CG 4.33Å; V97-F242 HydrophobicContact CG2-CZ 3.71Å; P100-F242 HydrophobicContact CB-CB 4.18Å; Y208-F242 AromaticContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CZ 4.42Å; Y208-F242 AromaticContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CE1-CE1 4.38Å; Y208-F242 HydrophobicContact CE1-CZ 4.41Å; Y208-F242 HydrophobicContact CE2-CE1 4.36Å; Y208-F242 AromaticContact CG-CE1 3.74Å; Y208-F242 HydrophobicContact CG-CE1 3.74Å; A238-F242 VanDerWaalsContact O-CB 3.29Å; A238-F242 WeakPolarHBondContact O-CB 3.38Å; A238-F242 PolarHBondContact O-N 2.9Å; I239-F242 PolarHBondContact O-N 3.4Å; F242-A244 PolarHBondContact O-N 2.76Å; F242-R245 WeakPolarHBondContact O-CB 3.27Å; F242-R245 PolarHBondContact O-N 3.29Å; F242-R245 VanDerWaalsContact O-N 3.11Å; F242-S246 WeakPolarHBondContact CE2-OG 2.94Å; F242-S246 WeakPolarHBondContact CZ-OG 3.31Å; F242-S246 PolarHBondContact O-N 2.92Å; F242-S246 PolarHBondContact O-OG 3.05Å |
| 243 | L | 87.8 | Confident | 83.7 | Confident | 7 Ų | 7 | 47.2 Ų | 47.2 | 4% | 0.037 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.1 | -44.4 | -179.4 | -69.4 | 172.5 | 0 | 0 | 0 | 111.5 | Y205 Y208 I239 S240 R245 S246 L247 Q275 | Y205-L243 HydrophobicContact CD1-CD2 3.61Å; Y205-L243 HydrophobicContact CE1-CD2 4.41Å; Y205-L243 HydrophobicContact CG-CD2 4.48Å; Y208-L243 HydrophobicContact CD2-CD2 4.24Å; I239-L243 HydrophobicContact CG2-CD1 3.68Å; I239-L243 HydrophobicContact CG2-CG 4.2Å; I239-L243 WeakPolarHBondContact O-CB 3.34Å; I239-L243 VanDerWaalsContact O-CG 3.24Å; I239-L243 WeakPolarHBondContact O-CG 3.5Å; I239-L243 PolarHBondContact O-N 3.13Å; S240-L243 PolarHBondContact O-N 2.88Å; L243-R245 PolarHBondContact O-N 3.05Å; L243-S246 PolarHBondContact O-N 3.35Å; L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 PolarHBondContact O-N 3.4Å; L243-Q275 HydrophobicContact CD1-CG 3.55Å |
| 244 | A | 85.1 | Confident | 82.3 | Confident | 31 Ų | 31 | 42.4 Ų | 42.4 | 26% | 0.256 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.6 | -33.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | S240 F242 L247 K248 | S240-A244 WeakPolarHBondContact O-CB 3.39Å; S240-A244 PolarHBondContact O-N 3.49Å; F242-A244 PolarHBondContact O-N 2.76Å; A244-L247 WeakPolarHBondContact O-CB 3.47Å; A244-K248 WeakPolarHBondContact O-CG 3.5Å; A244-K248 PolarHBondContact O-N 2.94Å |
| 245 | R | 83.1 | Confident | 80.6 | Confident | 61 Ų | 61 | 50.6 Ų | 50.6 | 23% | 0.23 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -74.9 | -51 | 175.5 | -179.2 | -177.2 | 175.3 | 149.1 | 3.2 | 112.1 | H103 F241 F242 L243 L247 K248 V249 | H103-R245 VanDerWaalsContact CB-NH1 3.3Å; H103-R245 PolarHBondContact CD2-NH1 3.08Å; H103-R245 VanDerWaalsContact CD2-NH1 3.28Å; H103-R245 PolarHBondContact CD2-NH2 2.63Å; H103-R245 PolarHBondContact CE1-NH2 3.11Å; H103-R245 VanDerWaalsContact CG-CZ 3.42Å; H103-R245 PolarHBondContact ND1-NH2 3.45Å; H103-R245 VanDerWaalsContact ND1-NH2 3.15Å; H103-R245 PolarHBondContact NE2-NH2 3.19Å; H103-R245 VanDerWaalsContact NE2-NH2 3.14Å; F241-R245 WeakPolarHBondContact O-CB 3.43Å; F241-R245 PolarHBondContact O-N 3.41Å; F242-R245 WeakPolarHBondContact O-CB 3.27Å; F242-R245 PolarHBondContact O-N 3.29Å; F242-R245 VanDerWaalsContact O-N 3.11Å; L243-R245 PolarHBondContact O-N 3.05Å; R245-L247 PolarHBondContact O-N 3.28Å; R245-K248 PolarHBondContact O-N 2.96Å; R245-V249 PolarHBondContact O-N 3.13Å |
| 246 | S | 81.6 | Confident | 78.9 | Confident | 3 Ų | 3 | 52.1 Ų | 52.1 | 2% | 0.021 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.5 | -35.7 | 177.3 | -67.1 | 0 | 0 | 0 | 0 | 111.3 | Y205 F242 L243 V249 H250 | Y205-S246 PolarHBondContact OH-O 3.46Å; F242-S246 WeakPolarHBondContact CE2-OG 2.94Å; F242-S246 WeakPolarHBondContact CZ-OG 3.31Å; F242-S246 PolarHBondContact O-N 2.92Å; F242-S246 PolarHBondContact O-OG 3.05Å; L243-S246 PolarHBondContact O-N 3.35Å; S246-V249 PolarHBondContact O-N 3.34Å; S246-H250 WeakPolarHBondContact O-CB 3.37Å; S246-H250 PolarHBondContact O-N 3.09Å |
| 247 | L | 75.6 | Confident | 77.4 | Confident | 3 Ų | 3 | 61.7 Ų | 61.7 | 2% | 0.016 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -56.7 | -54.5 | 170.5 | 165.9 | 58.2 | 0 | 0 | 0 | 112.8 | L243 A244 R245 V249 H250 V251 L265 L268 V269 | L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 PolarHBondContact O-N 3.4Å; A244-L247 WeakPolarHBondContact O-CB 3.47Å; R245-L247 PolarHBondContact O-N 3.28Å; L247-V249 PolarHBondContact O-N 2.76Å; L247-H250 PolarHBondContact O-N 3.47Å; L247-V251 HydrophobicContact CD1-CG2 3.47Å; L247-V251 VanDerWaalsContact CD1-CG2 3.47Å; L247-V251 HydrophobicContact CG-CG2 4.46Å; L247-V251 WeakPolarHBondContact O-CB 3.03Å; L247-V251 WeakPolarHBondContact O-CG2 3.38Å; L247-V251 PolarHBondContact O-N 2.76Å; L247-L265 HydrophobicContact CD1-CD1 4.44Å; L247-L265 HydrophobicContact CD2-CD1 3.83Å; L247-L265 HydrophobicContact CG-CD1 3.92Å; L247-L268 HydrophobicContact CD1-CB 3.23Å; L247-L268 HydrophobicContact CD1-CD1 3.04Å; L247-L268 HydrophobicContact CD1-CG 3.67Å; L247-L268 HydrophobicContact CD2-CB 3.36Å; L247-L268 HydrophobicContact CG-CB 3.86Å; L247-L268 HydrophobicContact CG-CD1 4.41Å; L247-V269 HydrophobicContact CD2-CG2 3.74Å |
| 248 | K | 76.3 | Confident | 76.3 | Confident | 148 Ų | 148 | 63.1 Ų | 63.1 | 64% | 0.643 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -56 | -39.8 | -178.7 | -77.2 | 178 | 179 | 179.4 | 0 | 111.4 | A244 R245 A252 | A244-K248 WeakPolarHBondContact O-CG 3.5Å; A244-K248 PolarHBondContact O-N 2.94Å; R245-K248 PolarHBondContact O-N 2.96Å; K248-A252 VanDerWaalsContact O-CB 3.27Å; K248-A252 WeakPolarHBondContact O-CB 3.35Å; K248-A252 PolarHBondContact O-N 3.44Å |
| 249 | V | 77.3 | Confident | 75 | Confident | 56 Ų | 56 | 70.1 Ų | 70.1 | 34% | 0.339 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -70.2 | -47.9 | 178.3 | 179.6 | 0 | 0 | 0 | 0 | 111.4 | N133 R245 S246 L247 V251 A252 D253 | N133-V249 HydrophobicContact CB-CB 4.23Å; N133-V249 HydrophobicContact CB-CG1 3.73Å; R245-V249 PolarHBondContact O-N 3.13Å; S246-V249 PolarHBondContact O-N 3.34Å; L247-V249 PolarHBondContact O-N 2.76Å; V249-V251 VanDerWaalsContact C-N 3.29Å; V249-V251 PolarHBondContact O-N 2.79Å; V249-A252 WeakPolarHBondContact O-CB 3.38Å; V249-A252 PolarHBondContact O-N 3.07Å; V249-A252 VanDerWaalsContact O-N 3.13Å; V249-D253 PolarHBondContact O-N 3.29Å; V249-D253 VanDerWaalsContact O-N 3.13Å |
| 250 | H | 75 | Confident | 74.1 | Confident | 44 Ų | 44 | 70.8 Ų | 70.8 | 20% | 0.204 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.9 | -31.4 | -179.5 | -178.5 | 77.5 | 0 | 0 | 0 | 113 | I135 Y205 S246 L247 K264 | I135-H250 WeakPolarHBondContact CD1-ND1 3.42Å; Y205-H250 WeakPolarHBondContact OH-CB 3.44Å; S246-H250 WeakPolarHBondContact O-CB 3.37Å; S246-H250 PolarHBondContact O-N 3.09Å; L247-H250 PolarHBondContact O-N 3.47Å; H250-K264 PolarHBondContact CD2-NZ 2.79Å; H250-K264 VanDerWaalsContact CD2-NZ 3.27Å; H250-K264 PolarHBondContact NE2-NZ 3.18Å; H250-K264 VanDerWaalsContact NE2-NZ 3.13Å |
| 251 | V | 70.3 | Confident | 73.3 | Confident | 11 Ų | 11 | 74.7 Ų | 74.7 | 7% | 0.067 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -75.8 | -31.8 | 173.8 | 173 | 0 | 0 | 0 | 0 | 111.7 | L247 V249 G254 R261 K264 L268 | L247-V251 HydrophobicContact CD1-CG2 3.47Å; L247-V251 VanDerWaalsContact CD1-CG2 3.47Å; L247-V251 HydrophobicContact CG-CG2 4.46Å; L247-V251 WeakPolarHBondContact O-CB 3.03Å; L247-V251 WeakPolarHBondContact O-CG2 3.38Å; L247-V251 PolarHBondContact O-N 2.76Å; V249-V251 VanDerWaalsContact C-N 3.29Å; V249-V251 PolarHBondContact O-N 2.79Å; V251-G254 PolarHBondContact O-N 2.73Å; V251-R261 HydrophobicContact CG1-CG 3.3Å; V251-K264 HydrophobicContact CG2-CD 3.87Å; V251-K264 HydrophobicContact CG2-CG 3.93Å; V251-L268 HydrophobicContact CG2-CD1 4.43Å |
| 252 | A | 68.4 | Low | 72.7 | Confident | 77 Ų | 77 | 76.2 Ų | 76.2 | 64% | 0.636 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -69.5 | -32.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | K248 V249 G254 | K248-A252 VanDerWaalsContact O-CB 3.27Å; K248-A252 WeakPolarHBondContact O-CB 3.35Å; K248-A252 PolarHBondContact O-N 3.44Å; V249-A252 WeakPolarHBondContact O-CB 3.38Å; V249-A252 PolarHBondContact O-N 3.07Å; V249-A252 VanDerWaalsContact O-N 3.13Å; A252-G254 VanDerWaalsContact C-N 3.33Å |
| 253 | D | 66.7 | Low | 72.1 | Confident | 140 Ų | 140 | 81.8 Ų | 81.8 | 75% | 0.749 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -72.8 | -26.4 | 177.7 | -168.4 | 45.3 | 0 | 0 | 0 | 112.9 | V249 R255 | V249-D253 PolarHBondContact O-N 3.29Å; V249-D253 VanDerWaalsContact O-N 3.13Å; D253-R255 PolarHBondContact O-N 3.49Å |
| 254 | G | 62 | Low | 71.5 | Confident | 27 Ų | 27 | 81.9 Ų | 81.9 | 28% | 0.278 | 39% | 0.391 | S | S | . | . | trans | -72.8 | 116.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V251 A252 S256 | V251-G254 PolarHBondContact O-N 2.73Å; A252-G254 VanDerWaalsContact C-N 3.33Å; G254-S256 PolarHBondContact O-N 3Å | ||
| 255 | R | 57.9 | Low | 71.2 | Confident | 254 Ų | 254 | 83.4 Ų | 83.4 | 96% | 0.958 | 40% | 0.395 | S | S | * | . | trans | -65.9 | 34.3 | 164.1 | -58.9 | -171.7 | -170.3 | -175.7 | 3.2 | 113.2 | D253 | D253-R255 PolarHBondContact O-N 3.49Š| ||
| 256 | S | 56.9 | Low | 71.2 | Confident | 37 Ų | 37 | 88.5 Ų | 88.5 | 26% | 0.259 | 42% | 0.415 | S | S | . | . | trans | -72.2 | 138.4 | 179.1 | -65.5 | 0 | 0 | 0 | 0 | 109.9 | G254 E258 | G254-S256 PolarHBondContact O-N 3Å; S256-E258 PolarHBondContact O-N 2.71Å | ||
| 257 | Y | 59.3 | Low | 71 | Confident | 210 Ų | 210 | 88.5 Ų | 88.5 | 82% | 0.824 | 42% | 0.415 | S | S | * | . | trans | -45.5 | 135.6 | 168.6 | -72.5 | -90.4 | 0 | 0 | 0 | 110.6 | E259 G260 R261 | Y257-E259 PolarHBondContact O-N 2.96Å; Y257-G260 PolarHBondContact O-N 3.18Å; Y257-R261 PolarHBondContact O-N 3.16Å | ||
| 258 | E | 67.4 | Low | 71.1 | Confident | 110 Ų | 110 | 88.8 Ų | 88.8 | 51% | 0.514 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -41.9 | -38.3 | -175.9 | -85.3 | -79.9 | 157.9 | 0 | 0 | 113.9 | S256 R261 K262 | S256-E258 PolarHBondContact O-N 2.71Å; E258-R261 WeakPolarHBondContact O-CB 3.47Å; E258-R261 PolarHBondContact O-N 2.64Å; E258-R261 IonicContact OE1-CZ 3.68Å; E258-R261 IonicContact OE1-NH2 2.77Å; E258-R261 PolarHBondContact OE1-NH2 2.84Å; E258-R261 IonicContact OE2-CZ 3.41Å; E258-R261 IonicContact OE2-NE 2.69Å; E258-R261 IonicContact OE2-NH2 2.68Å; E258-R261 PolarHBondContact OE2-NH2 3.32Å; E258-K262 PolarHBondContact O-N 2.84Å |
| 259 | E | 66.2 | Low | 71.3 | Confident | 148 Ų | 148 | 84.3 Ų | 84.3 | 69% | 0.692 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -68.2 | -46.9 | -179.3 | -66.6 | -176.1 | 174 | 0 | 0 | 113.7 | Y257 R261 K262 R263 | Y257-E259 PolarHBondContact O-N 2.96Å; E259-R261 VanDerWaalsContact C-N 3.25Å; E259-R261 PolarHBondContact O-N 3.39Å; E259-K262 PolarHBondContact O-N 2.86Å; E259-R263 PolarHBondContact O-N 3.08Å |
| 260 | G | 70.7 | Confident | 71.5 | Confident | 15 Ų | 15 | 87.6 Ų | 87.6 | 16% | 0.155 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -65.8 | -32.4 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y257 R263 K264 | Y257-G260 PolarHBondContact O-N 3.18Å; G260-R263 PolarHBondContact O-N 3.28Å; G260-K264 VanDerWaalsContact O-CB 3.3Å; G260-K264 WeakPolarHBondContact O-CB 3.18Å; G260-K264 PolarHBondContact O-N 3.32Å |
| 261 | R | 73.4 | Confident | 71.7 | Confident | 96 Ų | 96 | 86.1 Ų | 86.1 | 36% | 0.362 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.3 | -46.4 | 177.7 | -166.1 | 179.1 | 62.9 | 156.9 | -3.5 | 112.4 | V251 Y257 E258 E259 K264 L265 | V251-R261 HydrophobicContact CG1-CG 3.3Å; Y257-R261 PolarHBondContact O-N 3.16Å; E258-R261 WeakPolarHBondContact O-CB 3.47Å; E258-R261 PolarHBondContact O-N 2.64Å; E258-R261 IonicContact OE1-CZ 3.68Å; E258-R261 IonicContact OE1-NH2 2.77Å; E258-R261 PolarHBondContact OE1-NH2 2.84Å; E258-R261 IonicContact OE2-CZ 3.41Å; E258-R261 IonicContact OE2-NE 2.69Å; E258-R261 IonicContact OE2-NH2 2.68Å; E258-R261 PolarHBondContact OE2-NH2 3.32Å; E259-R261 VanDerWaalsContact C-N 3.25Å; E259-R261 PolarHBondContact O-N 3.39Å; R261-K264 PolarHBondContact O-N 3.35Å; R261-L265 WeakPolarHBondContact O-CB 3.34Å; R261-L265 PolarHBondContact O-N 2.91Å |
| 262 | K | 77.2 | Confident | 72.2 | Confident | 122 Ų | 122 | 85.8 Ų | 85.8 | 53% | 0.53 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.2 | -46.3 | 179.1 | -68.2 | 176.8 | -174.1 | 177.6 | 0 | 111.5 | E258 E259 K264 L265 Y266 | E258-K262 PolarHBondContact O-N 2.84Å; E259-K262 PolarHBondContact O-N 2.86Å; K262-K264 PolarHBondContact O-N 3.27Å; K262-L265 WeakPolarHBondContact O-CB 3.46Å; K262-L265 PolarHBondContact O-N 2.95Å; K262-Y266 HydrophobicContact CB-CE2 4.41Å; K262-Y266 WeakPolarHBondContact O-CD2 3.26Å; K262-Y266 PolarHBondContact O-N 2.78Å |
| 263 | R | 77.1 | Confident | 72.9 | Confident | 117 Ų | 117 | 87.7 Ų | 87.7 | 44% | 0.442 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.4 | -43.4 | 178.1 | -62.9 | -177.9 | -168.7 | -179.1 | 6.2 | 112.1 | M191 I193 E259 G260 L265 Y266 L267 | M191-R263 PolarHBondContact O-NH1 3.27Å; M191-R263 VanDerWaalsContact O-NH1 3.15Å; I193-R263 HydrophobicContact CD1-CB 4.04Å; I193-R263 HydrophobicContact CG1-CB 3.82Å; E259-R263 PolarHBondContact O-N 3.08Å; G260-R263 PolarHBondContact O-N 3.28Å; R263-L265 VanDerWaalsContact C-N 3.32Å; R263-L265 PolarHBondContact O-N 3.39Å; R263-Y266 PolarHBondContact O-N 2.76Å; R263-L267 PolarHBondContact O-N 2.78Å |
| 264 | K | 74.1 | Confident | 73.6 | Confident | 10 Ų | 10 | 82.6 Ų | 82.6 | 4% | 0.043 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -57.9 | -44.6 | 174 | -179.2 | 174.6 | 175.8 | 175 | 0 | 111.4 | I193 L197 H250 V251 G260 R261 K262 L267 L268 | I193-K264 HydrophobicContact CG2-CB 4.41Å; L197-K264 HydrophobicContact CD1-CG 4.35Å; L197-K264 VanDerWaalsContact CD2-CE 3.47Å; L197-K264 HydrophobicContact CG-CD 4.34Å; H250-K264 PolarHBondContact CD2-NZ 2.79Å; H250-K264 VanDerWaalsContact CD2-NZ 3.27Å; H250-K264 PolarHBondContact NE2-NZ 3.18Å; H250-K264 VanDerWaalsContact NE2-NZ 3.13Å; V251-K264 HydrophobicContact CG2-CD 3.87Å; V251-K264 HydrophobicContact CG2-CG 3.93Å; G260-K264 VanDerWaalsContact O-CB 3.3Å; G260-K264 WeakPolarHBondContact O-CB 3.18Å; G260-K264 PolarHBondContact O-N 3.32Å; R261-K264 PolarHBondContact O-N 3.35Å; K262-K264 PolarHBondContact O-N 3.27Å; K264-L267 PolarHBondContact O-N 2.93Å; K264-L268 HydrophobicContact CD-CD1 4.43Å; K264-L268 HydrophobicContact CG-CD1 3.61Å; K264-L268 WeakPolarHBondContact O-CB 3.31Å; K264-L268 WeakPolarHBondContact O-CD1 3.45Å; K264-L268 WeakPolarHBondContact O-CG 3.46Å; K264-L268 PolarHBondContact O-N 3.41Å; K264-L268 VanDerWaalsContact O-N 3.09Å |
| 265 | L | 78.9 | Confident | 74.7 | Confident | 63 Ų | 63 | 81.5 Ų | 81.5 | 33% | 0.33 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.1 | -47.5 | 176.3 | -176 | 70.2 | 0 | 0 | 0 | 111.6 | L247 R261 K262 R263 L267 L268 V269 | L247-L265 HydrophobicContact CD1-CD1 4.44Å; L247-L265 HydrophobicContact CD2-CD1 3.83Å; L247-L265 HydrophobicContact CG-CD1 3.92Å; R261-L265 WeakPolarHBondContact O-CB 3.34Å; R261-L265 PolarHBondContact O-N 2.91Å; K262-L265 WeakPolarHBondContact O-CB 3.46Å; K262-L265 PolarHBondContact O-N 2.95Å; R263-L265 VanDerWaalsContact C-N 3.32Å; R263-L265 PolarHBondContact O-N 3.39Å; L265-L267 PolarHBondContact O-N 3.42Å; L265-L268 PolarHBondContact O-N 3.36Å; L265-V269 HydrophobicContact CD1-CG2 4.23Å; L265-V269 HydrophobicContact CG-CG2 4.29Å; L265-V269 WeakPolarHBondContact O-CB 3.21Å; L265-V269 VanDerWaalsContact O-CG2 3.23Å; L265-V269 WeakPolarHBondContact O-CG2 3.32Å; L265-V269 PolarHBondContact O-N 3.01Å |
| 266 | Y | 82.2 | Confident | 76 | Confident | 167 Ų | 167 | 70.9 Ų | 70.9 | 66% | 0.655 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -60.3 | -46.2 | 178.3 | -75.5 | -64.4 | 0 | 0 | 0 | 112.7 | K262 R263 L268 V269 F270 | K262-Y266 HydrophobicContact CB-CE2 4.41Å; K262-Y266 WeakPolarHBondContact O-CD2 3.26Å; K262-Y266 PolarHBondContact O-N 2.78Å; R263-Y266 PolarHBondContact O-N 2.76Å; Y266-L268 VanDerWaalsContact C-N 3.35Å; Y266-L268 PolarHBondContact O-N 2.7Å; Y266-V269 PolarHBondContact O-N 2.81Å; Y266-F270 WeakPolarHBondContact O-CB 3.47Å; Y266-F270 PolarHBondContact O-N 2.81Å |
| 267 | L | 78.6 | Confident | 77.2 | Confident | 4 Ų | 4 | 74.9 Ų | 74.9 | 2% | 0.021 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59 | -46.2 | 178.5 | -179.8 | 156.3 | 0 | 0 | 0 | 111.2 | I184 T187 R188 M191 I193 R263 K264 L265 F270 I271 | I184-L267 HydrophobicContact CG2-CD2 4.14Å; T187-L267 HydrophobicContact CG2-CD1 3.74Å; T187-L267 HydrophobicContact CG2-CG 4.11Å; R188-L267 HydrophobicContact CB-CD1 4.28Å; M191-L267 HydrophobicContact SD-CB 4.22Å; M191-L267 HydrophobicContact SD-CD1 4.36Å; I193-L267 HydrophobicContact CD1-CB 4.17Å; I193-L267 HydrophobicContact CD1-CD1 3.64Å; R263-L267 PolarHBondContact O-N 2.78Å; K264-L267 PolarHBondContact O-N 2.93Å; L265-L267 PolarHBondContact O-N 3.42Å; L267-F270 WeakPolarHBondContact O-CB 3.46Å; L267-F270 PolarHBondContact O-N 2.81Å; L267-I271 HydrophobicContact CD2-CD1 3.42Å; L267-I271 VanDerWaalsContact CD2-CD1 3.42Å; L267-I271 HydrophobicContact CD2-CG1 4.43Å; L267-I271 HydrophobicContact CG-CD1 4.41Å; L267-I271 WeakPolarHBondContact O-CG1 3.22Å; L267-I271 PolarHBondContact O-N 2.89Å |
| 268 | L | 76.7 | Confident | 78.3 | Confident | 9 Ų | 9 | 66.4 Ų | 66.4 | 5% | 0.047 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -77.1 | -31.5 | -176.8 | -69.5 | 156.9 | 0 | 0 | 0 | 112.7 | L197 Y205 L247 V251 K264 L265 Y266 F270 I271 S272 | L197-L268 HydrophobicContact CD1-CD1 4.07Å; L197-L268 HydrophobicContact CD1-CD2 4.39Å; L197-L268 HydrophobicContact CD1-CG 4.46Å; Y205-L268 HydrophobicContact CD2-CD2 4.38Å; L247-L268 HydrophobicContact CD1-CB 3.23Å; L247-L268 HydrophobicContact CD1-CD1 3.04Å; L247-L268 HydrophobicContact CD1-CG 3.67Å; L247-L268 HydrophobicContact CD2-CB 3.36Å; L247-L268 HydrophobicContact CG-CB 3.86Å; L247-L268 HydrophobicContact CG-CD1 4.41Å; V251-L268 HydrophobicContact CG2-CD1 4.43Å; K264-L268 HydrophobicContact CD-CD1 4.43Å; K264-L268 HydrophobicContact CG-CD1 3.61Å; K264-L268 WeakPolarHBondContact O-CB 3.31Å; K264-L268 WeakPolarHBondContact O-CD1 3.45Å; K264-L268 WeakPolarHBondContact O-CG 3.46Å; K264-L268 PolarHBondContact O-N 3.41Å; K264-L268 VanDerWaalsContact O-N 3.09Å; L265-L268 PolarHBondContact O-N 3.36Å; Y266-L268 VanDerWaalsContact C-N 3.35Å; Y266-L268 PolarHBondContact O-N 2.7Å; L268-F270 VanDerWaalsContact C-N 3.34Å; L268-I271 HydrophobicContact CD2-CD1 4.15Å; L268-I271 PolarHBondContact O-N 3.44Å; L268-S272 VanDerWaalsContact O-CB 3.29Å; L268-S272 WeakPolarHBondContact O-CB 3.26Å; L268-S272 PolarHBondContact O-N 2.69Å |
| 269 | V | 81.8 | Confident | 79 | Confident | 54 Ų | 54 | 61.3 Ų | 61.3 | 33% | 0.327 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 169 | 168.6 | 0 | 0 | 0 | 0 | 110.1 | L247 L265 Y266 S272 L273 | L247-V269 HydrophobicContact CD2-CG2 3.74Å; L265-V269 HydrophobicContact CD1-CG2 4.23Å; L265-V269 HydrophobicContact CG-CG2 4.29Å; L265-V269 WeakPolarHBondContact O-CB 3.21Å; L265-V269 VanDerWaalsContact O-CG2 3.23Å; L265-V269 WeakPolarHBondContact O-CG2 3.32Å; L265-V269 PolarHBondContact O-N 3.01Å; Y266-V269 PolarHBondContact O-N 2.81Å; V269-S272 WeakPolarHBondContact O-CB 3.19Å; V269-S272 PolarHBondContact O-N 3.33Å; V269-L273 HydrophobicContact CG1-CD1 3.86Å; V269-L273 HydrophobicContact CG1-CG 4.29Å; V269-L273 WeakPolarHBondContact O-CB 2.97Å; V269-L273 VanDerWaalsContact O-CG 3.31Å; V269-L273 WeakPolarHBondContact O-CG 2.89Å; V269-L273 PolarHBondContact O-N 2.8Å |
| 270 | F | 81.7 | Confident | 79.7 | Confident | 124 Ų | 124 | 60.9 Ų | 60.9 | 54% | 0.544 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -58.9 | -48.5 | 175 | 177.7 | -100.1 | 0 | 0 | 0 | 111.4 | Y266 L267 L268 S272 L273 T274 | Y266-F270 WeakPolarHBondContact O-CB 3.47Å; Y266-F270 PolarHBondContact O-N 2.81Å; L267-F270 WeakPolarHBondContact O-CB 3.46Å; L267-F270 PolarHBondContact O-N 2.81Å; L268-F270 VanDerWaalsContact C-N 3.34Å; F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.4Å; F270-L273 PolarHBondContact O-N 3.43Å; F270-T274 HydrophobicContact CD1-CG2 4.42Å; F270-T274 HydrophobicContact CE1-CG2 4.04Å; F270-T274 HydrophobicContact CE2-CG2 4.18Å; F270-T274 HydrophobicContact CZ-CG2 3.92Å; F270-T274 WeakPolarHBondContact O-CG2 3.09Å; F270-T274 PolarHBondContact O-N 3.17Å; F270-T274 PolarHBondContact O-OG1 3.41Å |
| 271 | I | 78.3 | Confident | 80.1 | Confident | 14 Ų | 14 | 67.9 Ų | 67.9 | 7% | 0.072 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58 | -44 | 174.9 | -67.2 | 163 | 0 | 0 | 0 | 111.3 | I184 L267 L268 L273 T274 Q275 | I184-I271 HydrophobicContact CB-CD1 4.32Å; I184-I271 HydrophobicContact CD1-CD1 3.64Å; I184-I271 HydrophobicContact CD1-CG1 4.01Å; I184-I271 HydrophobicContact CD1-CG2 4.3Å; I184-I271 HydrophobicContact CG1-CD1 3.58Å; I184-I271 HydrophobicContact CG1-CG1 3.9Å; I184-I271 HydrophobicContact CG2-CD1 3.77Å; L267-I271 HydrophobicContact CD2-CD1 3.42Å; L267-I271 VanDerWaalsContact CD2-CD1 3.42Å; L267-I271 HydrophobicContact CD2-CG1 4.43Å; L267-I271 HydrophobicContact CG-CD1 4.41Å; L267-I271 WeakPolarHBondContact O-CG1 3.22Å; L267-I271 PolarHBondContact O-N 2.89Å; L268-I271 HydrophobicContact CD2-CD1 4.15Å; L268-I271 PolarHBondContact O-N 3.44Å; I271-L273 VanDerWaalsContact C-N 3.29Å; I271-L273 PolarHBondContact O-N 2.81Å; I271-T274 WeakPolarHBondContact CA-OG1 3.35Å; I271-T274 PolarHBondContact O-N 2.79Å; I271-T274 PolarHBondContact O-OG1 3.46Å; I271-Q275 VanDerWaalsContact O-CG 3.3Å; I271-Q275 WeakPolarHBondContact O-CG 3.19Å; I271-Q275 PolarHBondContact O-N 3.37Å; I271-Q275 PolarHBondContact O-NE2 3.45Å |
| 272 | S | 80.2 | Confident | 80.1 | Confident | 4 Ų | 4 | 63.6 Ų | 63.6 | 3% | 0.028 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.8 | -36.2 | -179.4 | -172.9 | 0 | 0 | 0 | 0 | 112.2 | S240 L268 V269 F270 | S240-S272 PolarHBondContact O-OG 3.17Å; S240-S272 PolarHBondContact OG-O 3.24Å; L268-S272 VanDerWaalsContact O-CB 3.29Å; L268-S272 WeakPolarHBondContact O-CB 3.26Å; L268-S272 PolarHBondContact O-N 2.69Å; V269-S272 WeakPolarHBondContact O-CB 3.19Å; V269-S272 PolarHBondContact O-N 3.33Å; F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.4Å |
| 273 | L | 83 | Confident | 79.8 | Confident | 117 Ų | 117 | 58 Ų | 58 | 61% | 0.613 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -79.5 | -24.7 | 178.8 | -70.5 | 174.6 | 0 | 0 | 0 | 112.8 | V269 F270 I271 Q275 P276 | V269-L273 HydrophobicContact CG1-CD1 3.86Å; V269-L273 HydrophobicContact CG1-CG 4.29Å; V269-L273 WeakPolarHBondContact O-CB 2.97Å; V269-L273 VanDerWaalsContact O-CG 3.31Å; V269-L273 WeakPolarHBondContact O-CG 2.89Å; V269-L273 PolarHBondContact O-N 2.8Å; F270-L273 PolarHBondContact O-N 3.43Å; I271-L273 VanDerWaalsContact C-N 3.29Å; I271-L273 PolarHBondContact O-N 2.81Å; L273-Q275 VanDerWaalsContact C-N 3.32Å; L273-P276 WeakPolarHBondContact O-CD 3.37Å |
| 274 | T | 82.5 | Confident | 79.6 | Confident | 33 Ų | 33 | 54.1 Ų | 54.1 | 20% | 0.202 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -77.6 | -18.8 | 173.7 | 57.2 | 0 | 0 | 0 | 0 | 112.5 | F270 I271 L277 I278 | F270-T274 HydrophobicContact CD1-CG2 4.42Å; F270-T274 HydrophobicContact CE1-CG2 4.04Å; F270-T274 HydrophobicContact CE2-CG2 4.18Å; F270-T274 HydrophobicContact CZ-CG2 3.92Å; F270-T274 WeakPolarHBondContact O-CG2 3.09Å; F270-T274 PolarHBondContact O-N 3.17Å; F270-T274 PolarHBondContact O-OG1 3.41Å; I271-T274 WeakPolarHBondContact CA-OG1 3.35Å; I271-T274 PolarHBondContact O-N 2.79Å; I271-T274 PolarHBondContact O-OG1 3.46Å; T274-L277 WeakPolarHBondContact O-CB 3.41Å; T274-L277 PolarHBondContact O-N 2.82Å; T274-L277 VanDerWaalsContact O-N 3.13Å; T274-I278 WeakPolarHBondContact O-CG1 3.23Å; T274-I278 PolarHBondContact O-N 2.84Å |
| 275 | Q | 85.5 | Confident | 79.2 | Confident | 3 Ų | 3 | 55.3 Ų | 55.3 | 1% | 0.014 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -57.2 | -46.9 | -178.4 | -64.8 | -52.8 | -67.4 | 0 | 0 | 114.4 | L243 I271 L273 L277 I278 M279 | L243-Q275 HydrophobicContact CD1-CG 3.55Å; I271-Q275 VanDerWaalsContact O-CG 3.3Å; I271-Q275 WeakPolarHBondContact O-CG 3.19Å; I271-Q275 PolarHBondContact O-N 3.37Å; I271-Q275 PolarHBondContact O-NE2 3.45Å; L273-Q275 VanDerWaalsContact C-N 3.32Å; Q275-L277 VanDerWaalsContact C-N 3.27Å; Q275-L277 PolarHBondContact O-N 3.45Å; Q275-I278 PolarHBondContact O-N 2.89Å; Q275-M279 WeakPolarHBondContact O-CB 3.4Å; Q275-M279 WeakPolarHBondContact O-CG 3.21Å; Q275-M279 PolarHBondContact O-N 2.89Å |
| 276 | P | 84.1 | Confident | 78.6 | Confident | 31 Ų | 31 | 54.2 Ų | 54.2 | 20% | 0.201 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60 | -38.2 | 176.1 | -26.4 | 37.2 | 0 | 0 | 0 | 112.9 | S240 L273 M279 W280 | S240-P276 WeakPolarHBondContact OG-CD 3.04Å; S240-P276 WeakPolarHBondContact OG-CG 3.3Å; L273-P276 WeakPolarHBondContact O-CD 3.37Å; P276-M279 PolarHBondContact O-N 3.37Å; P276-W280 VanDerWaalsContact O-CB 3.23Å; P276-W280 WeakPolarHBondContact O-CB 3.45Å; P276-W280 PolarHBondContact O-N 3.41Å |
| 277 | L | 83.3 | Confident | 77.6 | Confident | 122 Ų | 122 | 48.6 Ų | 48.6 | 64% | 0.639 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -64.2 | -43.6 | 177.5 | -61.8 | 175.2 | 0 | 0 | 0 | 110.6 | T274 Q275 W280 W281 | T274-L277 WeakPolarHBondContact O-CB 3.41Å; T274-L277 PolarHBondContact O-N 2.82Å; T274-L277 VanDerWaalsContact O-N 3.13Å; Q275-L277 VanDerWaalsContact C-N 3.27Å; Q275-L277 PolarHBondContact O-N 3.45Å; L277-W280 PolarHBondContact O-N 2.86Å; L277-W281 VanDerWaalsContact O-CB 3.27Å; L277-W281 WeakPolarHBondContact O-CB 3.17Å; L277-W281 PolarHBondContact O-N 3.45Å |
| 278 | I | 82.4 | Confident | 76.5 | Confident | 32 Ų | 32 | 51.1 Ų | 51.1 | 16% | 0.164 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -69.4 | -41.1 | 179 | -62.6 | 170.7 | 0 | 0 | 0 | 111 | E180 T274 Q275 W281 L282 | E180-I278 HydrophobicContact CG-CD1 4.25Å; E180-I278 WeakPolarHBondContact OE1-CD1 3.42Å; T274-I278 WeakPolarHBondContact O-CG1 3.23Å; T274-I278 PolarHBondContact O-N 2.84Å; Q275-I278 PolarHBondContact O-N 2.89Å; I278-W281 PolarHBondContact O-N 2.8Å; I278-L282 VanDerWaalsContact O-CB 3.27Å; I278-L282 WeakPolarHBondContact O-CB 3.19Å; I278-L282 PolarHBondContact O-N 2.89Å |
| 279 | M | 80.8 | Confident | 75.4 | Confident | 2 Ų | 2 | 56.4 Ų | 56.4 | 1% | 0.01 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.1 | -47.3 | 174 | -77.9 | -173.9 | 163.1 | 0 | 0 | 111.7 | K209 M213 I239 Q275 P276 W281 T283 | K209-M279 HydrophobicContact CB-CE 3.41Å; K209-M279 VanDerWaalsContact CB-CE 3.41Å; K209-M279 HydrophobicContact CB-CG 4.39Å; K209-M279 WeakPolarHBondContact O-CE 3.38Å; M213-M279 HydrophobicContact CG-CE 4.3Å; M213-M279 HydrophobicContact CG-CG 4.34Å; M213-M279 HydrophobicContact SD-CG 4.34Å; I239-M279 HydrophobicContact CB-CE 3.98Å; I239-M279 HydrophobicContact CG1-CE 3.69Å; I239-M279 HydrophobicContact CG2-CE 4.05Å; Q275-M279 WeakPolarHBondContact O-CB 3.4Å; Q275-M279 WeakPolarHBondContact O-CG 3.21Å; Q275-M279 PolarHBondContact O-N 2.89Å; P276-M279 PolarHBondContact O-N 3.37Å; M279-W281 VanDerWaalsContact C-N 3.34Å; M279-T283 WeakPolarHBondContact O-CB 3.21Å; M279-T283 PolarHBondContact O-N 3.44Å; M279-T283 PolarHBondContact O-OG1 2.85Å |
| 280 | W | 80.4 | Confident | 73.9 | Confident | 139 Ų | 139 | 55.5 Ų | 55.5 | 53% | 0.527 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 177.2 | -178.4 | -94.2 | 0 | 0 | 0 | 111.1 | F229 L232 P276 L277 S284 | F229-W280 HydrophobicContact CD1-CZ3 4.44Å; L232-W280 HydrophobicContact CD2-CE3 3.94Å; L232-W280 HydrophobicContact CD2-CZ3 4.48Å; P276-W280 VanDerWaalsContact O-CB 3.23Å; P276-W280 WeakPolarHBondContact O-CB 3.45Å; P276-W280 PolarHBondContact O-N 3.41Å; L277-W280 PolarHBondContact O-N 2.86Å; W280-S284 WeakPolarHBondContact O-CA 3.28Å; W280-S284 WeakPolarHBondContact O-CB 3.16Å; W280-S284 PolarHBondContact O-N 3.49Å; W280-S284 PolarHBondContact O-OG 2.78Å |
| 281 | W | 79.4 | Confident | 72.2 | Confident | 162 Ų | 162 | 52.4 Ų | 52.4 | 61% | 0.614 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -66.5 | -50.7 | 178.4 | -171.3 | -84.6 | 0 | 0 | 0 | 112.6 | W176 L277 I278 M279 T283 S284 S285 | W176-W281 AromaticContact CZ2-CD1 3.89Å; W176-W281 AromaticContact CZ2-NE1 3.95Å; L277-W281 VanDerWaalsContact O-CB 3.27Å; L277-W281 WeakPolarHBondContact O-CB 3.17Å; L277-W281 PolarHBondContact O-N 3.45Å; I278-W281 PolarHBondContact O-N 2.8Å; M279-W281 VanDerWaalsContact C-N 3.34Å; W281-T283 VanDerWaalsContact C-N 3.3Å; W281-T283 PolarHBondContact O-N 3.36Å; W281-S284 WeakPolarHBondContact CA-OG 3.43Å; W281-S284 PolarHBondContact O-N 3.14Å; W281-S284 PolarHBondContact O-OG 2.93Å; W281-S285 WeakPolarHBondContact O-CB 3.29Å; W281-S285 PolarHBondContact O-N 3.15Å |
| 282 | L | 73.3 | Confident | 70.7 | Confident | 7 Ų | 7 | 60 Ų | 60 | 4% | 0.037 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.1 | -41.9 | 179.9 | -168.4 | 143.8 | 0 | 0 | 0 | 110.5 | Y147 W176 M213 I278 S285 L286 | Y147-L282 HydrophobicContact CE1-CD2 4.17Å; Y147-L282 VanDerWaalsContact OH-CD2 3.31Å; Y147-L282 WeakPolarHBondContact OH-CD2 3.46Å; W176-L282 HydrophobicContact CG-CD1 4.34Å; M213-L282 HydrophobicContact CE-CD2 4.44Å; M213-L282 HydrophobicContact SD-CD2 4Å; I278-L282 VanDerWaalsContact O-CB 3.27Å; I278-L282 WeakPolarHBondContact O-CB 3.19Å; I278-L282 PolarHBondContact O-N 2.89Å; L282-S285 PolarHBondContact O-N 3.48Å; L282-S285 PolarHBondContact O-OG 3.01Å; L282-L286 PolarHBondContact O-N 3.31Å |
| 283 | T | 71.9 | Confident | 69.3 | Low | 3 Ų | 3 | 69.6 Ų | 69.6 | 2% | 0.018 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.3 | -51.6 | 174.1 | -68.4 | 0 | 0 | 0 | 0 | 112.7 | Y228 L232 M279 W281 S285 L286 M287 | Y228-T283 HydrophobicContact CE1-CG2 3.61Å; Y228-T283 WeakPolarHBondContact OH-CG2 3.37Å; L232-T283 HydrophobicContact CD1-CG2 3.28Å; L232-T283 VanDerWaalsContact CD1-OG1 3.27Å; L232-T283 WeakPolarHBondContact CD1-OG1 3.38Å; M279-T283 WeakPolarHBondContact O-CB 3.21Å; M279-T283 PolarHBondContact O-N 3.44Å; M279-T283 PolarHBondContact O-OG1 2.85Å; W281-T283 VanDerWaalsContact C-N 3.3Å; W281-T283 PolarHBondContact O-N 3.36Å; T283-S285 PolarHBondContact O-N 3.44Å; T283-L286 WeakPolarHBondContact O-CA 3.48Å; T283-L286 WeakPolarHBondContact O-CB 3.28Å; T283-L286 PolarHBondContact O-N 3.17Å; T283-M287 PolarHBondContact O-N 3.46Å |
| 284 | S | 71.5 | Confident | 67.8 | Low | 36 Ų | 36 | 69.5 Ų | 69.5 | 25% | 0.252 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60.8 | -34.1 | -179 | 57.6 | 0 | 0 | 0 | 0 | 110 | W280 W281 T288 | W280-S284 WeakPolarHBondContact O-CA 3.28Å; W280-S284 WeakPolarHBondContact O-CB 3.16Å; W280-S284 PolarHBondContact O-N 3.49Å; W280-S284 PolarHBondContact O-OG 2.78Å; W281-S284 WeakPolarHBondContact CA-OG 3.43Å; W281-S284 PolarHBondContact O-N 3.14Å; W281-S284 PolarHBondContact O-OG 2.93Å; S284-T288 WeakPolarHBondContact O-CA 3.38Å; S284-T288 WeakPolarHBondContact O-CB 3.47Å; S284-T288 PolarHBondContact O-N 3.48Å; S284-T288 PolarHBondContact O-OG1 3.08Å |
| 285 | S | 66.6 | Low | 65.9 | Low | 36 Ų | 36 | 73.5 Ų | 73.5 | 25% | 0.252 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.2 | -42.7 | 171.4 | 82.4 | 0 | 0 | 0 | 0 | 112.2 | W281 L282 T283 N289 | W281-S285 WeakPolarHBondContact O-CB 3.29Å; W281-S285 PolarHBondContact O-N 3.15Å; L282-S285 PolarHBondContact O-N 3.48Å; L282-S285 PolarHBondContact O-OG 3.01Å; T283-S285 PolarHBondContact O-N 3.44Å; S285-N289 VanDerWaalsContact O-CB 3.24Å; S285-N289 WeakPolarHBondContact O-CB 3.44Å; S285-N289 VanDerWaalsContact O-CG 3.28Å; S285-N289 PolarHBondContact O-N 3.43Å; S285-N289 PolarHBondContact O-ND2 3.37Å |
| 286 | L | 65.5 | Low | 64.1 | Low | 40 Ų | 40 | 77.2 Ų | 77.2 | 21% | 0.209 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62.4 | -49.3 | 176.5 | -174.6 | 60.1 | 0 | 0 | 0 | 110.8 | L169 L282 T283 N289 V290 | L169-L286 HydrophobicContact CD1-CD1 3.79Å; L169-L286 HydrophobicContact CD1-CD2 4.39Å; L282-L286 PolarHBondContact O-N 3.31Å; T283-L286 WeakPolarHBondContact O-CA 3.48Å; T283-L286 WeakPolarHBondContact O-CB 3.28Å; T283-L286 PolarHBondContact O-N 3.17Å; L286-N289 PolarHBondContact O-N 3.42Å; L286-V290 WeakPolarHBondContact O-CB 3.41Å; L286-V290 WeakPolarHBondContact O-CG2 3.44Å; L286-V290 PolarHBondContact O-N 3.42Å |
| 287 | M | 61.9 | Low | 62.3 | Low | 49 Ų | 49 | 81 Ų | 81 | 24% | 0.241 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -69.7 | -36.5 | -179 | -154.7 | 69.9 | -179.8 | 0 | 0 | 112.4 | Y220 T283 V290 A291 | Y220-M287 HydrophobicContact CE2-CE 4.27Å; T283-M287 PolarHBondContact O-N 3.46Å; M287-V290 CarbonylContact O-C 3.53Å; M287-V290 WeakPolarHBondContact O-CB 3.26Å; M287-V290 PolarHBondContact O-N 2.94Å; M287-A291 WeakPolarHBondContact O-CB 3.12Å; M287-A291 PolarHBondContact O-N 3.39Å |
| 288 | T | 56.4 | Low | 61 | Low | 56 Ų | 56 | 80.4 Ų | 80.4 | 34% | 0.344 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -70.9 | -38.3 | 176.7 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | S284 V290 A291 K292 | S284-T288 WeakPolarHBondContact O-CA 3.38Å; S284-T288 WeakPolarHBondContact O-CB 3.47Å; S284-T288 PolarHBondContact O-N 3.48Å; S284-T288 PolarHBondContact O-OG1 3.08Å; T288-V290 VanDerWaalsContact C-N 3.26Å; T288-V290 PolarHBondContact O-N 3.42Å; T288-A291 PolarHBondContact O-N 3.14Å; T288-K292 HydrophobicContact CG2-CD 3.63Å; T288-K292 VanDerWaalsContact CG2-CE 3.42Å; T288-K292 HydrophobicContact CG2-CG 3.8Å; T288-K292 VanDerWaalsContact O-CB 3.31Å; T288-K292 WeakPolarHBondContact O-CB 3.32Å; T288-K292 WeakPolarHBondContact O-CG 3.41Å; T288-K292 PolarHBondContact O-N 3.21Å |
| 289 | N | 52.9 | Low | 59.6 | Low | 121 Ų | 121 | 83 Ų | 83 | 65% | 0.647 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -67.7 | -29.5 | 171.5 | -76.6 | -59.2 | 0 | 0 | 0 | 111.6 | S285 L286 | S285-N289 VanDerWaalsContact O-CB 3.24Å; S285-N289 WeakPolarHBondContact O-CB 3.44Å; S285-N289 VanDerWaalsContact O-CG 3.28Å; S285-N289 PolarHBondContact O-N 3.43Å; S285-N289 PolarHBondContact O-ND2 3.37Å; L286-N289 PolarHBondContact O-N 3.42Å |
| 290 | V | 50.4 | Low | 58.2 | Low | 34 Ų | 34 | 90 Ų | 90 | 21% | 0.206 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -69.2 | -37.5 | 170.3 | 168.3 | 0 | 0 | 0 | 0 | 111.6 | R160 L286 M287 T288 | R160-V290 PolarHBondContact NH1-O 2.96Å; L286-V290 WeakPolarHBondContact O-CB 3.41Å; L286-V290 WeakPolarHBondContact O-CG2 3.44Å; L286-V290 PolarHBondContact O-N 3.42Å; M287-V290 CarbonylContact O-C 3.53Å; M287-V290 WeakPolarHBondContact O-CB 3.26Å; M287-V290 PolarHBondContact O-N 2.94Å; T288-V290 VanDerWaalsContact C-N 3.26Å; T288-V290 PolarHBondContact O-N 3.42Å |
| 291 | A | 45.1 | Very low | 56.6 | Low | 60 Ų | 60 | 90.7 Ų | 90.7 | 50% | 0.496 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -82 | -46.9 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114 | M287 T288 R293 F294 | M287-A291 WeakPolarHBondContact O-CB 3.12Å; M287-A291 PolarHBondContact O-N 3.39Å; T288-A291 PolarHBondContact O-N 3.14Å; A291-R293 PolarHBondContact O-N 3.41Å; A291-R293 VanDerWaalsContact O-N 3.1Å; A291-F294 PolarHBondContact O-N 2.69Å; A291-F294 VanDerWaalsContact O-O 3.12Å |
| 292 | K | 47.1 | Very low | 55.1 | Low | 172 Ų | 172 | 93.4 Ų | 93.4 | 75% | 0.748 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -11.6 | -171.5 | -79.2 | -172.8 | 179.6 | 178.7 | 0 | 115.6 | T288 | T288-K292 HydrophobicContact CG2-CD 3.63Å; T288-K292 VanDerWaalsContact CG2-CE 3.42Å; T288-K292 HydrophobicContact CG2-CG 3.8Å; T288-K292 VanDerWaalsContact O-CB 3.31Å; T288-K292 WeakPolarHBondContact O-CB 3.32Å; T288-K292 WeakPolarHBondContact O-CG 3.41Å; T288-K292 PolarHBondContact O-N 3.21Å |
| 293 | R | 51.5 | Low | 54.2 | Low | 206 Ų | 206 | 97.7 Ų | 97.7 | 78% | 0.777 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.7 | 3.7 | 173.7 | -143.5 | 164.7 | -171.2 | -143.7 | 0 | 114 | A291 | A291-R293 PolarHBondContact O-N 3.41Å; A291-R293 VanDerWaalsContact O-N 3.1Å |
| 294 | F | 50.7 | Low | 53.2 | Low | 116 Ų | 116 | 102.7 Ų | 102.7 | 51% | 0.509 | 56% | 0.562 | S | S | . | * | S | Bend | trans | -107.1 | 104.2 | 159.3 | -71.4 | -95.9 | 0 | 0 | 0 | 105.4 | A291 A296 | A291-F294 PolarHBondContact O-N 2.69Å; A291-F294 VanDerWaalsContact O-O 3.12Å; F294-A296 PolarHBondContact O-N 3.31Å |
| 295 | P | 42.4 | Very low | 52.2 | Low | 116 Ų | 116 | 106.4 Ų | 106.4 | 75% | 0.753 | 58% | 0.579 | S | S | * | * | trans | -52.3 | 133.3 | 153.9 | 24.8 | -29.7 | 0 | 0 | 0 | 106.2 | D297 | P295-D297 PolarHBondContact O-N 3.21Š| ||
| 296 | A | 49.1 | Very low | 51.4 | Low | 82 Ų | 82 | 110.5 Ų | 110.5 | 68% | 0.678 | 60% | 0.599 | S | S | * | * | trans | -45.8 | 132.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | F294 | F294-A296 PolarHBondContact O-N 3.31Š| ||
| 297 | D | 46.2 | Very low | 50.5 | Low | 109 Ų | 109 | 114.9 Ų | 114.9 | 58% | 0.583 | 62% | 0.623 | S | S | * | * | trans | -48.7 | 132.9 | 171.1 | -172.5 | 33.5 | 0 | 0 | 0 | 108 | P295 T299 | P295-D297 PolarHBondContact O-N 3.21Å; D297-T299 PolarHBondContact O-N 3.14Å; D297-T299 PolarHBondContact OD2-OG1 2.98Å | ||
| 298 | P | 56.2 | Low | 49.7 | Very low | 110 Ų | 110 | 119.3 Ų | 119.3 | 71% | 0.714 | 65% | 0.648 | S | S | * | * | G | 310 helix | trans | -68.7 | 18.1 | -173.3 | -16.3 | 30.6 | 0 | 0 | 0 | 114.6 | ||
| 299 | T | 52 | Low | 49.3 | Very low | 87 Ų | 87 | 123.9 Ų | 123.9 | 53% | 0.534 | 67% | 0.67 | S | S | . | * | G | 310 helix | trans | -87.5 | 1.4 | -174.4 | 48.3 | 0 | 0 | 0 | 0 | 114.2 | D297 D301 | D297-T299 PolarHBondContact O-N 3.14Å; D297-T299 PolarHBondContact OD2-OG1 2.98Å; T299-D301 VanDerWaalsContact C-N 3.3Å |
| 300 | D | 52.4 | Low | 49 | Very low | 148 Ų | 148 | 124.1 Ų | 124.1 | 79% | 0.791 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -83.6 | 2.3 | 171.2 | -76.9 | -24.4 | 0 | 0 | 0 | 114.1 | ||
| 301 | D | 46.2 | Very low | 48.9 | Very low | 155 Ų | 155 | 131.6 Ų | 131.6 | 83% | 0.829 | 71% | 0.711 | S | S | * | * | trans | -108.3 | 43.7 | 172.5 | -73.1 | -34.9 | 0 | 0 | 0 | 112.9 | T299 | T299-D301 VanDerWaalsContact C-N 3.3Š| ||
| 302 | I | 47.5 | Very low | 49.2 | Very low | 218 Ų | 218 | 138.1 Ų | 138.1 | 100% | 1.118 | 73% | 0.73 | S | S | * | * | trans | -123.3 | 0 | 163.4 | -53.6 | -178.7 | 0 | 0 | 0 | 110.6 |
Retrieved 302 of 302 residues in 81.1 ms
(Link to these results)